#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l2w n GLY 1 N 0.00 -0.86 0.34 -5.12 0.00 -1.26 -4.95 105.19 93.34 1l2w n GLY 1 Ca 0.00 -1.36 -0.04 0.00 0.00 0.00 0.00 46.02 44.61 1l2w n GLY 1 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1l2w h TYR 2 N 0.00 1.16 -0.50 1.61 3.20 -2.04 -1.96 116.97 118.44 1l2w h TYR 2 Ca 0.00 -0.06 0.02 0.00 3.14 0.00 0.00 58.73 61.83 1l2w h TYR 2 Cb 0.00 -0.36 -0.03 0.00 1.54 0.00 0.00 36.73 37.88 1l2w h TYR 2 CO 0.00 0.85 0.30 0.77 -1.64 0.00 0.00 178.16 178.44 1l2w h SER 3 N 1.14 0.48 -0.37 -2.11 0.02 -1.99 0.72 113.55 111.44 1l2w h SER 3 Ca 0.27 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.20 1l2w h SER 3 Cb 0.15 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 1l2w h SER 3 CO -0.03 0.34 0.14 0.15 -1.14 0.00 0.00 176.83 176.29 1l2w h PHE 4 N 0.60 0.57 -0.41 3.45 3.57 -1.87 -0.83 116.94 122.01 1l2w h PHE 4 Ca 0.20 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.71 1l2w h PHE 4 Cb 0.02 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.54 1l2w h PHE 4 CO -0.07 0.53 0.14 0.93 -2.23 0.00 0.00 178.31 177.61 1l2w h GLU 5 N 0.45 0.29 -0.45 1.11 5.08 -0.84 0.46 114.58 120.68 1l2w h GLU 5 Ca 0.12 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.41 1l2w h GLU 5 Cb 0.21 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1l2w h GLU 5 CO -0.01 0.19 0.08 1.96 -1.00 0.00 0.00 179.01 180.24 1l2w h GLN 6 N 0.30 0.74 -0.56 2.33 1.08 -0.68 -0.88 115.11 117.44 1l2w h GLN 6 Ca 0.19 -0.19 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1l2w h GLN 6 Cb 0.19 -0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 27.50 1l2w h GLN 6 CO -0.20 0.75 0.29 0.00 -0.95 0.00 0.00 178.83 178.72 1l2w h ALA 7 N 0.95 0.72 -0.29 3.87 0.00 -0.76 -0.25 119.26 123.50 1l2w h ALA 7 Ca 0.14 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1l2w h ALA 7 Cb 0.36 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1l2w h ALA 7 CO 0.01 0.27 0.07 0.82 0.00 0.00 0.00 179.25 180.41 1l2w h ILE 8 N 0.76 1.22 -0.40 0.00 1.08 -0.78 -1.39 117.51 117.99 1l2w h ILE 8 Ca 0.20 -0.72 0.05 0.00 -0.39 0.00 0.00 64.86 63.99 1l2w h ILE 8 Cb 0.09 1.15 -0.04 0.00 -3.07 0.00 0.00 36.82 34.94 1l2w h ILE 8 CO -0.03 0.24 0.15 0.74 -0.69 0.00 0.00 178.15 178.56 1l2w h THR 9 N 0.29 0.89 -0.28 -0.27 2.02 -0.91 0.10 112.91 114.76 1l2w h THR 9 Ca 0.09 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1l2w h THR 9 Cb 0.29 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 1l2w h THR 9 CO 0.00 0.06 0.18 -0.61 0.37 0.00 0.00 175.52 175.52 1l2w h GLN 10 N 0.32 0.38 -0.19 6.66 4.15 -0.93 -1.41 115.11 124.08 1l2w h GLN 10 Ca 0.18 -0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.61 1l2w h GLN 10 Cb 0.16 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.73 1l2w h GLN 10 CO -0.18 0.26 0.01 1.25 -1.93 0.00 0.00 178.83 178.24 1l2w h LEU 11 N 0.38 -0.06 -1.23 -2.39 5.85 -0.64 -1.90 115.31 115.33 1l2w h LEU 11 Ca 0.10 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.91 1l2w h LEU 11 Cb -0.03 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.02 1l2w h LEU 11 CO -0.02 -0.00 0.54 -0.26 -0.34 0.00 0.00 178.44 178.36 1l2w h PHE 12 N 0.07 0.96 -0.71 1.25 -1.00 -0.55 -1.37 116.94 115.59 1l2w h PHE 12 Ca 0.09 0.02 -0.04 0.00 2.81 0.00 0.00 57.97 60.85 1l2w h PHE 12 Cb 0.11 -0.32 -0.03 0.00 3.61 0.00 0.00 35.95 39.32 1l2w h PHE 12 CO -0.17 0.53 0.28 1.96 -1.61 0.00 0.00 178.31 179.30 1l2w h GLN 13 N 0.97 1.06 0.00 1.51 4.20 -0.63 0.15 115.11 122.37 1l2w h GLN 13 Ca 0.34 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1l2w h GLN 13 Cb 0.13 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.74 1l2w h GLN 13 CO -0.11 0.88 0.00 1.04 -0.67 0.00 0.00 178.83 179.97 1l2w n GLN 14 N -4.36 0.06 -0.10 1.46 6.02 -0.61 -2.50 117.38 117.36 1l2w n GLN 14 Ca 0.06 0.22 0.06 0.00 -0.01 0.00 0.00 57.00 57.33 1l2w n GLN 14 Cb 0.18 -1.60 0.11 0.00 1.02 0.00 0.00 30.24 29.95 1l2w n GLN 14 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1l2w n LEU 15 N -1.70 2.52 -2.92 1.08 4.77 -0.59 -4.98 117.00 115.17 1l2w n LEU 15 Ca 0.04 -1.50 -0.22 0.00 -0.03 0.00 0.00 56.01 54.30 1l2w n LEU 15 Cb 0.24 -0.13 0.04 0.00 -2.33 0.00 0.00 43.42 41.24 1l2w n LEU 15 CO 0.19 0.57 0.01 -1.20 -1.33 0.00 0.00 177.39 175.62 1l2w n SER 16 N 0.65 -6.01 -4.78 -1.43 7.64 -0.45 -4.99 113.62 104.25 1l2w n SER 16 Ca 0.10 -0.28 -0.36 0.00 1.01 0.00 0.00 58.87 59.34 1l2w n SER 16 Cb 0.37 -4.82 -0.08 0.00 -1.01 0.00 0.00 64.21 58.68 1l2w n SER 16 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1l2w s LEU 17 N -6.47 4.02 0.42 -3.43 1.43 -0.09 -5.04 118.68 109.52 1l2w s LEU 17 Ca 0.30 0.30 -0.26 0.00 -1.03 0.00 0.00 54.13 53.44 1l2w s LEU 17 Cb -0.13 -1.96 -0.09 0.00 0.03 0.00 0.00 46.19 44.04 1l2w s LEU 17 CO 0.37 0.37 1.36 -0.94 0.23 0.00 0.00 176.35 177.74 1l2w s SER 18 N -0.80 6.16 -0.39 2.29 1.04 -1.26 -4.43 113.70 116.31 1l2w s SER 18 Ca 0.13 2.78 -0.26 0.00 0.48 0.00 0.00 55.95 59.08 1l2w s SER 18 Cb -0.12 -2.65 0.02 0.00 0.10 0.00 0.00 66.02 63.37 1l2w s SER 18 CO 0.03 -0.97 0.95 -0.63 0.98 0.00 0.00 173.24 173.61 1l2w s ILE 19 N -1.23 4.53 0.71 -1.02 1.01 -1.26 -5.02 121.20 118.92 1l2w s ILE 19 Ca 0.58 1.17 -0.16 0.00 0.00 0.00 0.00 60.65 62.24 1l2w s ILE 19 Cb -0.41 -4.38 -0.01 0.00 0.01 0.00 0.00 42.46 37.68 1l2w s ILE 19 CO 0.53 -0.62 0.90 -2.65 0.00 0.00 0.00 174.94 173.10 1l2w n PRO 20 N 6.93 0.52 0.13 2.79 -0.02 -1.26 -4.89 135.00 139.20 1l2w n PRO 20 Ca 0.08 0.23 -0.02 0.00 -2.02 0.00 0.00 63.50 61.77 1l2w n PRO 20 Cb 0.48 -2.15 0.18 0.00 -0.02 0.00 0.00 33.50 31.99 1l2w n PRO 20 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1l2w h ASP 21 N -0.19 0.06 -3.42 2.55 3.32 -2.06 -3.42 116.42 113.27 1l2w h ASP 21 Ca -0.47 -0.03 -0.53 0.00 0.02 0.00 0.00 57.03 56.01 1l2w h ASP 21 Cb 1.34 -0.02 -0.33 0.00 0.22 0.00 0.00 39.33 40.54 1l2w h ASP 21 CO 0.47 0.63 -0.82 -0.89 -1.72 0.00 0.00 179.24 176.90 1l2w s THR 22 N -3.72 1.24 -0.41 0.35 2.01 -1.26 -5.11 115.64 108.74 1l2w s THR 22 Ca -0.02 -0.54 -0.14 0.00 0.31 0.00 0.00 61.69 61.30 1l2w s THR 22 Cb 0.13 -1.12 0.03 0.00 0.01 0.00 0.00 72.50 71.55 1l2w s THR 22 CO 0.77 0.38 0.29 -0.63 -0.69 0.00 0.00 174.62 174.74 1l2w s ILE 23 N 0.62 5.09 0.68 1.82 1.01 -1.26 -5.07 121.20 124.09 1l2w s ILE 23 Ca -0.15 -0.77 -0.13 0.00 0.00 0.00 0.00 60.65 59.60 1l2w s ILE 23 Cb -0.16 -3.87 0.01 0.00 0.01 0.00 0.00 42.46 38.45 1l2w s ILE 23 CO 0.04 -0.34 1.08 -1.83 0.00 0.00 0.00 174.94 173.90 1l2w s GLU 24 N 1.64 2.82 0.47 2.79 -1.05 -1.26 -4.94 118.70 119.17 1l2w s GLU 24 Ca 0.04 1.19 0.14 0.00 -0.15 0.00 0.00 54.97 56.19 1l2w s GLU 24 Cb -0.20 -1.97 1.11 0.00 -0.44 0.00 0.00 34.13 32.64 1l2w s GLU 24 CO 0.09 -1.21 2.06 -1.35 0.95 0.00 0.00 175.26 175.79 1l2w h PRO 25 N -0.35 0.25 -4.63 -4.83 0.11 -1.98 -3.35 132.00 117.22 1l2w h PRO 25 Ca -0.45 -0.02 -0.65 0.00 0.11 0.00 0.00 66.00 64.99 1l2w h PRO 25 Cb 1.23 -0.06 -0.39 0.00 0.11 0.00 0.00 31.00 31.89 1l2w h PRO 25 CO 0.55 0.17 -0.76 0.08 -0.21 0.00 0.00 178.00 177.82 1l2w s VAL 26 N -5.26 2.04 -0.02 3.15 1.01 -1.26 -4.30 120.40 115.77 1l2w s VAL 26 Ca -0.07 -1.88 -0.24 0.00 0.00 0.00 0.00 61.98 59.80 1l2w s VAL 26 Cb 0.18 -2.35 -0.05 0.00 0.00 0.00 0.00 36.38 34.16 1l2w s VAL 26 CO 0.72 -0.33 0.71 -0.63 0.00 0.00 0.00 175.10 175.57 1l2w s ILE 27 N 1.09 4.91 -0.21 2.22 -1.09 0.46 -4.87 121.20 123.70 1l2w s ILE 27 Ca 0.01 1.49 -0.08 0.00 -2.23 0.00 0.00 60.65 59.84 1l2w s ILE 27 Cb -0.19 -4.06 -0.04 0.00 -1.58 0.00 0.00 42.46 36.59 1l2w s ILE 27 CO -0.08 0.32 0.10 -0.83 -1.23 0.00 0.00 174.94 173.22 1l2w s GLY 28 N 0.35 1.91 -0.08 6.18 0.00 -1.26 -0.59 107.32 113.81 1l2w s GLY 28 Ca 0.37 -0.87 -0.01 0.00 0.00 0.00 0.00 44.72 44.22 1l2w s GLY 28 CO 0.20 0.26 -0.03 0.14 0.00 0.00 0.00 173.10 173.67 1l2w s VAL 29 N 0.84 0.60 -0.40 1.40 1.01 0.69 -4.99 120.40 119.56 1l2w s VAL 29 Ca 0.05 -0.03 -0.18 0.00 0.00 0.00 0.00 61.98 61.82 1l2w s VAL 29 Cb -0.13 -0.70 0.01 0.00 0.00 0.00 0.00 36.38 35.56 1l2w s VAL 29 CO 0.02 0.29 0.50 -0.75 0.00 0.00 0.00 175.10 175.17 1l2w s LYS 30 N 1.80 3.31 -0.45 2.72 2.47 -1.26 -0.17 119.74 128.17 1l2w s LYS 30 Ca 0.04 -0.49 -0.06 0.00 -1.56 0.00 0.00 55.97 53.90 1l2w s LYS 30 Cb -0.12 -3.91 0.12 0.00 -1.46 0.00 0.00 37.83 32.45 1l2w s LYS 30 CO -0.06 -0.81 0.29 0.08 0.16 0.00 0.00 175.35 175.01 1l2w s VAL 31 N 2.36 3.82 0.00 4.02 1.01 0.32 -4.94 120.40 127.00 1l2w s VAL 31 Ca 0.16 -1.92 0.00 0.00 0.00 0.00 0.00 61.98 60.23 1l2w s VAL 31 Cb -0.16 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1l2w s VAL 31 CO 0.15 -0.74 0.00 0.61 0.00 0.00 0.00 175.10 175.11 1l2w n GLY 32 N 4.76 2.67 1.31 4.51 0.00 -1.26 -2.01 105.19 115.17 1l2w n GLY 32 Ca -0.05 -0.30 0.12 0.00 0.00 0.00 0.00 46.02 45.78 1l2w n GLY 32 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1l2w n GLU 33 N 12.69 2.68 -3.75 1.61 1.02 -1.26 -4.89 120.64 128.73 1l2w n GLU 33 Ca 0.00 -2.57 -0.37 0.00 -0.02 0.00 0.00 57.16 54.20 1l2w n GLU 33 Cb 0.00 -1.56 -0.13 0.00 -0.02 0.00 0.00 31.44 29.74 1l2w n GLU 33 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1l2w s PHE 34 N -1.12 3.11 -0.27 -0.32 0.40 -0.85 -5.06 117.98 113.86 1l2w s PHE 34 Ca 0.46 -0.66 -0.24 0.00 -0.60 0.00 0.00 56.93 55.90 1l2w s PHE 34 Cb 0.25 -2.25 -0.00 0.00 0.51 0.00 0.00 43.02 41.53 1l2w s PHE 34 CO 0.33 -0.46 0.83 0.00 0.70 0.00 0.00 175.22 176.63 1l2w s ALA 35 N 1.57 3.59 0.12 5.36 0.00 -1.26 -0.52 121.76 130.62 1l2w s ALA 35 Ca 0.05 -0.24 0.10 0.00 0.00 0.00 0.00 51.96 51.87 1l2w s ALA 35 Cb -0.16 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.60 1l2w s ALA 35 CO 0.03 -1.07 -0.21 0.00 0.00 0.00 0.00 175.76 174.51 1l2w s HIS 37 N -1.13 1.88 -0.07 0.00 3.76 0.04 -0.22 115.29 119.56 1l2w s HIS 37 Ca 0.17 -0.36 0.02 0.00 -0.15 0.00 0.00 55.06 54.74 1l2w s HIS 37 Cb -0.10 -1.20 0.01 0.00 1.11 0.00 0.00 32.58 32.40 1l2w s HIS 37 CO 0.09 -0.02 -0.13 0.42 -0.85 0.00 0.00 174.74 174.25 1l2w s ILE 38 N -0.53 1.21 0.25 0.60 1.01 0.24 -1.38 121.20 122.60 1l2w s ILE 38 Ca 0.08 -0.52 -0.12 0.00 0.00 0.00 0.00 60.65 60.10 1l2w s ILE 38 Cb -0.08 -1.10 -0.01 0.00 0.01 0.00 0.00 42.46 41.28 1l2w s ILE 38 CO -0.01 0.37 0.46 0.28 0.00 0.00 0.00 174.94 176.05 1l2w s THR 39 N 0.69 0.00 -0.37 2.92 -1.32 -0.53 -0.41 115.64 116.63 1l2w s THR 39 Ca -0.14 -1.45 -0.12 0.00 -1.21 0.00 0.00 61.69 58.77 1l2w s THR 39 Cb -0.16 -2.25 0.02 0.00 -1.51 0.00 0.00 72.50 68.60 1l2w s THR 39 CO 0.04 0.00 0.22 -0.70 -2.21 0.00 0.00 174.62 171.96 1l2w s GLU 40 N -3.96 2.98 -0.30 7.08 2.12 -1.26 -0.65 118.70 124.71 1l2w s GLU 40 Ca 0.24 -0.98 -0.10 0.00 0.36 0.00 0.00 54.97 54.48 1l2w s GLU 40 Cb -0.00 -3.76 0.16 0.00 0.26 0.00 0.00 34.13 30.79 1l2w s GLU 40 CO 0.10 -0.65 0.81 -1.58 -0.54 0.00 0.00 175.26 173.40 1l2w s HIS 41 N 1.60 -1.06 0.45 5.30 2.46 -0.15 -4.36 115.29 119.53 1l2w s HIS 41 Ca 0.03 1.58 -0.08 0.00 0.47 0.00 0.00 55.06 57.07 1l2w s HIS 41 Cb -0.19 0.54 0.11 0.00 -0.13 0.00 0.00 32.58 32.91 1l2w s HIS 41 CO 0.08 -0.54 0.48 -0.35 -2.47 0.00 0.00 174.74 171.93 1l2w n PRO 42 N 5.28 -1.27 -1.63 2.88 -0.04 -1.26 -4.55 135.00 134.42 1l2w n PRO 42 Ca -0.08 -0.75 -0.45 0.00 -0.04 0.00 0.00 63.50 62.17 1l2w n PRO 42 Cb 0.51 -0.61 -0.02 0.00 -0.04 0.00 0.00 33.50 33.34 1l2w n PRO 42 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1l2w n VAL 43 N -3.13 1.43 -0.84 0.52 0.31 -1.26 -1.69 118.33 113.67 1l2w n VAL 43 Ca 0.06 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 1l2w n VAL 43 Cb 0.23 -1.21 0.00 0.00 -0.91 0.00 0.00 33.84 31.95 1l2w n VAL 43 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1l2w n GLY 44 N 1.61 0.76 3.04 2.92 0.00 -1.26 -5.03 105.19 107.22 1l2w n GLY 44 Ca 0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 1l2w n GLY 44 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1l2w s GLN 45 N -0.16 1.27 -0.31 1.61 -1.52 -0.68 -0.65 119.66 119.22 1l2w s GLN 45 Ca 0.00 -0.39 -0.12 0.00 -1.95 0.00 0.00 55.36 52.89 1l2w s GLN 45 Cb 0.00 -1.13 -0.03 0.00 -0.22 0.00 0.00 33.01 31.62 1l2w s GLN 45 CO 0.00 0.13 0.24 0.42 -0.25 0.00 0.00 175.29 175.83 1l2w s ILE 46 N 0.24 5.28 -0.11 1.08 -1.09 0.04 -0.98 121.20 125.66 1l2w s ILE 46 Ca -0.05 0.02 -0.02 0.00 -2.23 0.00 0.00 60.65 58.37 1l2w s ILE 46 Cb -0.10 -3.65 -0.03 0.00 -1.58 0.00 0.00 42.46 37.10 1l2w s ILE 46 CO 0.01 0.10 -0.02 -0.22 -1.23 0.00 0.00 174.94 173.58 1l2w s LEU 47 N 1.79 3.39 -0.01 2.97 2.96 0.17 -2.03 118.68 127.92 1l2w s LEU 47 Ca 0.08 0.01 0.04 0.00 -0.22 0.00 0.00 54.13 54.03 1l2w s LEU 47 Cb -0.17 -1.79 -0.01 0.00 0.50 0.00 0.00 46.19 44.73 1l2w s LEU 47 CO 0.11 0.29 -0.12 -0.04 -1.32 0.00 0.00 176.35 175.27 1l2w s MET 48 N -0.34 0.97 0.14 1.98 -1.94 -0.62 -1.45 119.30 118.05 1l2w s MET 48 Ca 0.06 -0.43 -0.14 0.00 -1.71 0.00 0.00 55.69 53.46 1l2w s MET 48 Cb -0.12 -0.94 0.02 0.00 2.01 0.00 0.00 34.83 35.80 1l2w s MET 48 CO 0.02 0.26 0.39 -0.59 -0.01 0.00 0.00 175.02 175.09 1l2w s PHE 49 N -0.29 -0.05 0.13 -0.03 -0.12 -0.48 -1.38 117.98 115.76 1l2w s PHE 49 Ca 0.05 -0.29 -0.15 0.00 -0.05 0.00 0.00 56.93 56.48 1l2w s PHE 49 Cb -0.05 0.20 0.03 0.00 -0.63 0.00 0.00 43.02 42.58 1l2w s PHE 49 CO -0.00 -0.73 0.39 -0.08 -0.05 0.00 0.00 175.22 174.74 1l2w s THR 50 N -3.85 0.07 -0.45 -4.49 -1.32 -0.52 -0.78 115.64 104.31 1l2w s THR 50 Ca 0.07 -0.70 -0.15 0.00 -1.21 0.00 0.00 61.69 59.70 1l2w s THR 50 Cb 0.02 -1.27 0.06 0.00 -1.51 0.00 0.00 72.50 69.80 1l2w s THR 50 CO -0.08 -0.32 0.35 -0.76 -2.21 0.00 0.00 174.62 171.60 1l2w s LEU 51 N -2.83 5.40 0.67 9.08 1.02 -1.26 -1.37 118.68 129.39 1l2w s LEU 51 Ca 0.05 -1.22 -0.11 0.00 0.02 0.00 0.00 54.13 52.87 1l2w s LEU 51 Cb 0.02 -2.15 -0.01 0.00 0.02 0.00 0.00 46.19 44.07 1l2w s LEU 51 CO -0.10 -0.57 1.06 -2.16 0.02 0.00 0.00 176.35 174.60 1l2w s PRO 52 N 1.63 3.17 -0.36 1.29 0.04 -1.26 -4.96 135.00 134.55 1l2w s PRO 52 Ca 0.04 0.65 -0.14 0.00 0.04 0.00 0.00 61.00 61.58 1l2w s PRO 52 Cb -0.23 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.27 1l2w s PRO 52 CO 0.07 -0.85 0.31 -1.12 0.04 0.00 0.00 177.00 175.45 1l2w s SER 53 N -4.21 6.12 0.07 6.66 0.01 -1.26 -4.78 113.70 116.31 1l2w s SER 53 Ca 0.57 -0.47 -0.08 0.00 1.31 0.00 0.00 55.95 57.27 1l2w s SER 53 Cb -0.11 -2.17 -0.05 0.00 0.21 0.00 0.00 66.02 63.89 1l2w s SER 53 CO 0.53 -0.34 0.36 -0.76 0.41 0.00 0.00 173.24 173.44 1l2w s LEU 54 N 1.85 4.34 -0.17 2.44 1.43 -1.26 -4.12 118.68 123.19 1l2w s LEU 54 Ca 0.08 0.69 -0.25 0.00 -1.03 0.00 0.00 54.13 53.62 1l2w s LEU 54 Cb -0.17 -2.96 -0.02 0.00 0.03 0.00 0.00 46.19 43.07 1l2w s LEU 54 CO 0.11 0.17 0.81 -0.62 0.23 0.00 0.00 176.35 177.05 1l2w s ASP 55 N -1.87 6.92 0.58 2.29 -1.08 -1.26 -4.93 116.67 117.31 1l2w s ASP 55 Ca 0.33 1.13 0.37 0.00 -0.52 0.00 0.00 52.55 53.86 1l2w s ASP 55 Cb -0.13 -2.44 1.65 0.00 -1.46 0.00 0.00 42.92 40.54 1l2w s ASP 55 CO 0.19 -0.38 2.09 0.78 0.52 0.00 0.00 175.17 178.36 1l2w h ASN 56 N 7.35 0.00 0.38 -0.34 2.35 -1.98 -2.25 115.58 121.09 1l2w h ASN 56 Ca -0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.46 1l2w h ASN 56 Cb 1.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.50 1l2w h ASN 56 CO 0.83 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 177.20 1l2w n ASN 57 N -3.07 0.00 -4.72 5.81 5.03 -1.26 -4.74 115.26 112.30 1l2w n ASN 57 Ca -0.00 -0.32 -0.38 0.00 0.87 0.00 0.00 54.58 54.74 1l2w n ASN 57 Cb 0.24 -0.21 -0.06 0.00 -1.02 0.00 0.00 39.78 38.73 1l2w n ASN 57 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1l2w s ASP 58 N -2.42 6.80 0.72 6.41 1.01 -0.85 -5.07 116.67 123.27 1l2w s ASP 58 Ca 0.31 0.95 -0.03 0.00 0.71 0.00 0.00 52.55 54.50 1l2w s ASP 58 Cb 0.19 -2.33 0.11 0.00 1.01 0.00 0.00 42.92 41.91 1l2w s ASP 58 CO 0.40 -0.02 1.00 -1.61 0.21 0.00 0.00 175.17 175.15 1l2w s GLU 59 N 0.59 1.75 0.14 8.23 2.02 -1.26 -4.88 118.70 125.29 1l2w s GLU 59 Ca 0.30 -0.92 -0.25 0.00 0.02 0.00 0.00 54.97 54.12 1l2w s GLU 59 Cb -0.16 -2.29 -0.01 0.00 0.10 0.00 0.00 34.13 31.77 1l2w s GLU 59 CO 0.13 -1.42 1.62 1.57 0.02 0.00 0.00 175.26 177.18 1l2w h LYS 60 N -0.56 -0.33 -0.78 1.61 2.10 -1.99 -1.52 116.57 115.10 1l2w h LYS 60 Ca -0.39 0.02 0.12 0.00 -2.00 0.00 0.00 60.65 58.41 1l2w h LYS 60 Cb 1.27 0.08 -0.08 0.00 -0.90 0.00 0.00 32.23 32.59 1l2w h LYS 60 CO 0.44 -0.22 0.38 0.93 -2.00 0.00 0.00 179.45 178.98 1l2w h GLU 61 N -0.34 0.58 -0.58 0.07 3.07 -1.98 0.60 114.58 116.00 1l2w h GLU 61 Ca 0.10 -0.03 -0.08 0.00 -0.50 0.00 0.00 59.36 58.85 1l2w h GLU 61 Cb 0.50 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.26 1l2w h GLU 61 CO -0.33 0.38 0.06 1.15 -1.40 0.00 0.00 179.01 178.87 1l2w h THR 62 N 0.59 1.26 -0.16 1.13 2.02 -1.82 -0.95 112.91 114.99 1l2w h THR 62 Ca 0.41 -1.03 -0.10 0.00 0.77 0.00 0.00 66.41 66.46 1l2w h THR 62 Cb 0.52 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1l2w h THR 62 CO -0.33 0.38 -0.28 -0.07 0.37 0.00 0.00 175.52 175.59 1l2w h LEU 63 N 0.87 0.52 -1.56 2.58 3.38 -0.61 -3.14 115.31 117.35 1l2w h LEU 63 Ca 0.17 -0.54 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 1l2w h LEU 63 Cb 0.46 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1l2w h LEU 63 CO 0.02 0.96 -0.19 -0.07 0.09 0.00 0.00 178.44 179.25 1l2w h LEU 64 N 0.09 0.03 -1.95 1.67 3.38 -0.87 -2.60 115.31 115.06 1l2w h LEU 64 Ca 0.01 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.04 1l2w h LEU 64 Cb 0.86 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1l2w h LEU 64 CO 0.06 0.23 0.20 0.28 0.09 0.00 0.00 178.44 179.30 1l2w h SER 65 N 0.04 0.05 0.42 -0.43 0.02 -1.11 -0.43 113.55 112.10 1l2w h SER 65 Ca 0.01 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1l2w h SER 65 Cb 0.36 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.89 1l2w h SER 65 CO 0.03 0.03 -0.08 0.45 -1.14 0.00 0.00 176.83 176.11 1l2w h HIS 66 N 0.06 0.00 -0.36 3.45 3.86 -1.55 -2.98 115.15 117.63 1l2w h HIS 66 Ca 0.13 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 1l2w h HIS 66 Cb 0.45 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.92 1l2w h HIS 66 CO -0.00 0.08 0.00 0.09 0.86 0.00 0.00 177.93 178.96 1l2w n ASN 67 N -3.47 1.98 -4.77 2.45 3.02 -0.17 -4.88 115.26 109.43 1l2w n ASN 67 Ca -0.02 -1.97 -0.40 0.00 -0.03 0.00 0.00 54.58 52.16 1l2w n ASN 67 Cb 0.22 -0.24 -0.03 0.00 -0.61 0.00 0.00 39.78 39.13 1l2w n ASN 67 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1l2w s ILE 68 N -1.53 2.98 0.79 2.41 1.10 -1.13 -4.98 121.20 120.85 1l2w s ILE 68 Ca 0.26 0.95 -0.12 0.00 -0.51 0.00 0.00 60.65 61.23 1l2w s ILE 68 Cb 0.14 -3.59 0.07 0.00 0.15 0.00 0.00 42.46 39.23 1l2w s ILE 68 CO 0.18 0.20 1.15 0.72 -2.11 0.00 0.00 174.94 175.08 1l2w s PHE 69 N -1.20 2.09 0.00 3.50 -0.12 -1.26 -5.04 117.98 115.94 1l2w s PHE 69 Ca 0.50 1.65 0.00 0.00 -0.05 0.00 0.00 56.93 59.03 1l2w s PHE 69 Cb -0.36 -3.31 0.00 0.00 -0.63 0.00 0.00 43.02 38.72 1l2w s PHE 69 CO 0.47 -2.39 0.00 -1.13 -0.05 0.00 0.00 175.22 172.12 1l2w n SER 70 N -3.34 0.00 0.01 1.98 3.41 -1.26 -5.04 113.62 109.37 1l2w n SER 70 Ca 0.12 -0.62 0.13 0.00 -0.26 0.00 0.00 58.87 58.24 1l2w n SER 70 Cb 0.52 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 64.90 1l2w n SER 70 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1l2w n GLN 71 N 0.00 0.02 -3.70 4.33 10.64 -1.26 -4.70 117.38 122.71 1l2w n GLN 71 Ca 0.00 0.01 -0.38 0.00 -1.83 0.00 0.00 57.00 54.80 1l2w n GLN 71 Cb 0.00 -1.52 -0.12 0.00 -0.86 0.00 0.00 30.24 27.74 1l2w n GLN 71 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1l2w s ASP 72 N -3.09 5.37 0.00 2.61 -1.08 -1.26 -4.97 116.67 114.25 1l2w s ASP 72 Ca 0.12 -0.66 0.16 0.00 -0.52 0.00 0.00 52.55 51.66 1l2w s ASP 72 Cb 0.18 -1.95 0.70 0.00 -1.46 0.00 0.00 42.92 40.40 1l2w s ASP 72 CO 0.61 -0.21 1.51 2.30 0.52 0.00 0.00 175.17 179.90 1l2w n ILE 73 N 4.93 0.85 1.11 4.11 -5.35 -1.26 -2.32 119.36 121.43 1l2w n ILE 73 Ca -0.14 0.21 0.12 0.00 -0.27 0.00 0.00 62.75 62.67 1l2w n ILE 73 Cb 0.48 -0.94 0.34 0.00 -1.74 0.00 0.00 39.64 37.78 1l2w n ILE 73 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1l2w n LEU 74 N -1.47 2.19 -4.68 7.28 4.77 -1.26 -4.70 117.00 119.13 1l2w n LEU 74 Ca 0.04 -0.83 -0.42 0.00 -0.03 0.00 0.00 56.01 54.77 1l2w n LEU 74 Cb 0.18 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.17 1l2w n LEU 74 CO 0.15 0.42 1.46 -0.75 -1.33 0.00 0.00 177.39 177.33 1l2w s LYS 75 N -1.85 4.16 0.53 3.23 2.20 -0.98 -4.72 119.74 122.31 1l2w s LYS 75 Ca 0.34 2.50 -0.21 0.00 -0.36 0.00 0.00 55.97 58.24 1l2w s LYS 75 Cb 0.20 -3.75 -0.06 0.00 -1.51 0.00 0.00 37.83 32.71 1l2w s LYS 75 CO 0.30 -0.84 1.18 -1.25 -0.36 0.00 0.00 175.35 174.39 1l2w s PRO 76 N 3.19 3.38 -0.15 4.03 0.04 -1.26 -4.87 135.00 139.36 1l2w s PRO 76 Ca 0.80 1.78 -0.07 0.00 0.04 0.00 0.00 61.00 63.56 1l2w s PRO 76 Cb -0.43 -2.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 1l2w s PRO 76 CO 0.36 -0.87 0.09 0.42 0.04 0.00 0.00 177.00 177.04 1l2w s ILE 77 N -1.60 5.03 -0.18 0.56 -1.09 0.90 -4.81 121.20 120.01 1l2w s ILE 77 Ca 0.71 0.04 -0.15 0.00 -2.23 0.00 0.00 60.65 59.02 1l2w s ILE 77 Cb -0.29 -3.23 -0.04 0.00 -1.58 0.00 0.00 42.46 37.32 1l2w s ILE 77 CO 0.33 0.52 0.35 -0.22 -1.23 0.00 0.00 174.94 174.69 1l2w s LEU 78 N -0.21 4.19 0.00 2.97 2.96 -1.26 -1.47 118.68 125.86 1l2w s LEU 78 Ca 0.09 0.50 0.03 0.00 -0.22 0.00 0.00 54.13 54.53 1l2w s LEU 78 Cb -0.12 -2.44 -0.01 0.00 0.50 0.00 0.00 46.19 44.12 1l2w s LEU 78 CO 0.01 0.00 0.18 -1.54 -1.32 0.00 0.00 176.35 173.69 1l2w n SER 79 N 4.08 -0.47 -3.87 3.68 3.41 0.72 -4.96 113.62 116.20 1l2w n SER 79 Ca -0.10 -2.14 -0.15 0.00 -0.26 0.00 0.00 58.87 56.22 1l2w n SER 79 Cb 0.51 1.02 -0.15 0.00 -0.26 0.00 0.00 64.21 65.34 1l2w n SER 79 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 1l2w s TRP 80 N -3.02 0.25 -0.49 7.33 -0.11 -1.26 -0.10 118.94 121.53 1l2w s TRP 80 Ca 0.20 -0.01 -0.16 0.00 1.22 0.00 0.00 56.10 57.35 1l2w s TRP 80 Cb 0.01 -0.26 0.09 0.00 -1.50 0.00 0.00 33.47 31.81 1l2w s TRP 80 CO 0.14 -0.06 0.43 0.34 -4.62 0.00 0.00 176.95 173.18 1l2w s ASP 81 N 0.45 6.16 0.36 5.86 2.15 0.15 -4.90 116.67 126.90 1l2w s ASP 81 Ca -0.04 -1.46 0.07 0.00 0.43 0.00 0.00 52.55 51.55 1l2w s ASP 81 Cb -0.07 -2.19 0.70 0.00 -0.30 0.00 0.00 42.92 41.06 1l2w s ASP 81 CO -0.01 -0.71 1.89 -0.33 -0.17 0.00 0.00 175.17 175.84 1l2w h GLU 82 N 8.80 0.36 -0.32 4.34 4.39 -1.97 0.70 114.58 130.88 1l2w h GLU 82 Ca -0.29 -0.08 -0.05 0.00 0.34 0.00 0.00 59.36 59.28 1l2w h GLU 82 Cb 1.11 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.70 1l2w h GLU 82 CO 0.93 0.46 0.01 0.28 -1.16 0.00 0.00 179.01 179.53 1l2w h VAL 83 N 0.35 1.25 -0.01 3.13 2.07 -1.97 -3.23 116.25 117.84 1l2w h VAL 83 Ca 0.07 -0.92 0.00 0.00 0.82 0.00 0.00 66.70 66.67 1l2w h VAL 83 Cb 0.37 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1l2w h VAL 83 CO 0.02 0.30 -0.43 0.61 0.02 0.00 0.00 177.57 178.09 1l2w n GLY 84 N -0.37 -0.09 3.13 2.17 0.00 -1.19 -5.00 105.19 103.84 1l2w n GLY 84 Ca -0.02 -0.60 -0.15 0.00 0.00 0.00 0.00 46.02 45.25 1l2w n GLY 84 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l2w n GLY 85 N 1.40 -0.26 2.99 -0.02 0.00 0.22 -5.04 105.19 104.48 1l2w n GLY 85 Ca 0.10 0.03 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 1l2w n GLY 85 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1l2w s HIS 86 N -3.31 0.39 0.38 1.61 3.76 -1.07 -5.01 115.29 112.04 1l2w s HIS 86 Ca 0.06 -0.35 -0.22 0.00 -0.15 0.00 0.00 55.06 54.40 1l2w s HIS 86 Cb -0.02 -0.25 -0.10 0.00 1.11 0.00 0.00 32.58 33.31 1l2w s HIS 86 CO 0.63 -0.09 0.91 -1.25 -0.85 0.00 0.00 174.74 174.09 1l2w s PRO 87 N -1.02 4.31 -0.06 8.40 0.04 -1.26 -0.68 135.00 144.73 1l2w s PRO 87 Ca -0.08 1.12 0.01 0.00 0.04 0.00 0.00 61.00 62.08 1l2w s PRO 87 Cb -0.07 -2.42 0.02 0.00 0.04 0.00 0.00 34.50 32.07 1l2w s PRO 87 CO -0.00 0.10 -0.05 0.08 0.04 0.00 0.00 177.00 177.17 1l2w s VAL 88 N -1.96 0.63 -0.18 -0.36 1.01 0.86 -4.12 120.40 116.27 1l2w s VAL 88 Ca 0.57 -0.14 -0.04 0.00 0.00 0.00 0.00 61.98 62.36 1l2w s VAL 88 Cb -0.12 -0.66 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 1l2w s VAL 88 CO 0.17 0.26 -0.02 -0.22 0.00 0.00 0.00 175.10 175.29 1l2w s LEU 89 N 1.11 3.25 0.06 3.92 2.96 -0.47 -0.20 118.68 129.31 1l2w s LEU 89 Ca -0.08 -0.17 -0.12 0.00 -0.22 0.00 0.00 54.13 53.55 1l2w s LEU 89 Cb -0.14 -1.80 0.01 0.00 0.50 0.00 0.00 46.19 44.76 1l2w s LEU 89 CO -0.01 0.11 0.27 -1.66 -1.32 0.00 0.00 176.35 173.74 1l2w s TRP 90 N 0.70 -0.02 0.14 5.38 1.48 -0.54 -1.44 118.94 124.64 1l2w s TRP 90 Ca -0.01 -0.23 -0.01 0.00 -1.06 0.00 0.00 56.10 54.78 1l2w s TRP 90 Cb -0.14 0.05 -0.04 0.00 -1.16 0.00 0.00 33.47 32.18 1l2w s TRP 90 CO 0.02 -0.53 0.07 0.54 -4.06 0.00 0.00 176.95 173.00 1l2w s ASN 91 N -2.37 0.28 -0.05 -2.66 2.20 -0.48 -0.07 114.94 111.79 1l2w s ASN 91 Ca -0.01 -1.21 -0.22 0.00 -0.94 0.00 0.00 52.86 50.48 1l2w s ASN 91 Cb 0.01 0.31 0.05 0.00 -2.00 0.00 0.00 41.25 39.62 1l2w s ASN 91 CO -0.07 -0.75 0.48 -0.60 -2.94 0.00 0.00 177.10 173.23 1l2w s ARG 92 N -4.05 0.82 0.01 3.55 3.52 -1.26 -1.59 118.95 119.95 1l2w s ARG 92 Ca 0.25 0.11 -0.19 0.00 -0.13 0.00 0.00 55.73 55.76 1l2w s ARG 92 Cb 0.07 0.38 0.04 0.00 -1.56 0.00 0.00 34.95 33.88 1l2w s ARG 92 CO 0.03 -0.23 0.43 1.14 -0.81 0.00 0.00 175.30 175.85 1l2w s GLN 93 N -1.07 0.88 0.42 5.12 -2.07 -0.86 -4.79 119.66 117.29 1l2w s GLN 93 Ca -0.11 -0.22 -0.26 0.00 -1.82 0.00 0.00 55.36 52.95 1l2w s GLN 93 Cb -0.03 0.39 -0.10 0.00 -1.09 0.00 0.00 33.01 32.19 1l2w s GLN 93 CO 0.06 -0.28 1.36 -2.30 -1.32 0.00 0.00 175.29 172.80 1l2w n PRO 94 N 0.77 2.15 0.10 9.60 -0.02 -1.26 -0.78 135.00 145.57 1l2w n PRO 94 Ca -0.19 0.76 -0.03 0.00 -2.02 0.00 0.00 63.50 62.02 1l2w n PRO 94 Cb 0.58 -2.50 0.03 0.00 -0.02 0.00 0.00 33.50 31.59 1l2w n PRO 94 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1l2w h LEU 95 N 2.29 0.00 -0.16 2.45 5.85 -1.22 -3.06 115.31 121.46 1l2w h LEU 95 Ca -0.49 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.23 1l2w h LEU 95 Cb 1.28 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.31 1l2w h LEU 95 CO 0.61 0.77 -0.11 -0.46 -0.34 0.00 0.00 178.44 178.91 1l2w n ASN 96 N -3.49 0.35 -3.24 1.25 6.94 -1.26 -4.21 115.26 111.60 1l2w n ASN 96 Ca -0.00 -0.40 -0.25 0.00 -0.02 0.00 0.00 54.58 53.92 1l2w n ASN 96 Cb 0.78 -0.12 -0.07 0.00 -2.36 0.00 0.00 39.78 38.00 1l2w n ASN 96 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 1l2w n SER 97 N -1.09 0.85 -4.69 0.53 2.88 -1.16 -5.11 113.62 105.83 1l2w n SER 97 Ca 0.13 -2.83 -0.40 0.00 -1.33 0.00 0.00 58.87 54.44 1l2w n SER 97 Cb 0.28 -0.64 -0.05 0.00 -0.75 0.00 0.00 64.21 63.05 1l2w n SER 97 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1l2w s LEU 98 N -1.40 4.24 -0.03 2.46 1.43 -1.23 -4.32 118.68 119.82 1l2w s LEU 98 Ca 0.36 1.06 -0.35 0.00 -1.03 0.00 0.00 54.13 54.18 1l2w s LEU 98 Cb 0.16 -3.04 -0.13 0.00 0.03 0.00 0.00 46.19 43.22 1l2w s LEU 98 CO -0.09 -0.21 1.76 -0.67 0.23 0.00 0.00 176.35 177.37 1l2w n ASP 99 N 4.43 3.17 -2.55 2.29 -0.08 -1.25 -0.03 116.55 122.54 1l2w n ASP 99 Ca -0.00 1.02 -0.20 0.00 -1.51 0.00 0.00 54.79 54.10 1l2w n ASP 99 Cb 0.50 -1.36 -0.00 0.00 2.34 0.00 0.00 41.12 42.61 1l2w n ASP 99 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1l2w n ASN 100 N 5.48 -5.58 -4.11 1.67 3.02 -1.26 -2.25 115.26 112.23 1l2w n ASN 100 Ca 0.21 -0.04 -0.31 0.00 -0.03 0.00 0.00 54.58 54.41 1l2w n ASN 100 Cb 0.27 -4.63 -0.04 0.00 -0.61 0.00 0.00 39.78 34.77 1l2w n ASN 100 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1l2w n ASN 101 N -2.08 -0.72 -3.62 6.41 3.02 0.96 -4.90 115.26 114.33 1l2w n ASN 101 Ca -0.20 -1.17 0.00 0.00 -0.03 0.00 0.00 54.58 53.18 1l2w n ASN 101 Cb 0.66 -2.25 -0.01 0.00 -0.61 0.00 0.00 39.78 37.57 1l2w n ASN 101 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1l2w s SER 102 N -4.19 -0.08 0.00 6.41 0.15 -0.96 -5.02 113.70 110.01 1l2w s SER 102 Ca 0.11 -0.12 0.21 0.00 0.70 0.00 0.00 55.95 56.84 1l2w s SER 102 Cb -0.05 0.18 -0.15 0.00 -1.71 0.00 0.00 66.02 64.28 1l2w s SER 102 CO 0.95 -0.32 0.92 0.18 1.20 0.00 0.00 173.24 176.17 1l2w n LEU 103 N -0.41 1.29 -0.16 3.45 4.77 -1.26 -3.95 117.00 120.73 1l2w n LEU 103 Ca -0.07 -0.59 -0.04 0.00 -0.03 0.00 0.00 56.01 55.29 1l2w n LEU 103 Cb 0.62 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.74 1l2w n LEU 103 CO 0.11 0.28 0.73 0.22 -1.33 0.00 0.00 177.39 177.41 1l2w h TYR 104 N 0.77 -0.41 -0.64 -1.77 5.03 -1.94 -1.80 116.97 116.21 1l2w h TYR 104 Ca 0.00 0.05 -0.06 0.00 2.58 0.00 0.00 58.73 61.30 1l2w h TYR 104 Cb 0.56 0.26 -0.03 0.00 1.55 0.00 0.00 36.73 39.07 1l2w h TYR 104 CO 0.00 -0.26 0.15 1.15 -1.32 0.00 0.00 178.16 177.88 1l2w h THR 105 N -0.06 1.25 -0.63 1.81 2.02 -1.85 -1.13 112.91 114.31 1l2w h THR 105 Ca 0.24 -0.93 -0.01 0.00 0.77 0.00 0.00 66.41 66.48 1l2w h THR 105 Cb 0.42 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 1l2w h THR 105 CO -0.54 0.35 0.35 -0.61 0.37 0.00 0.00 175.52 175.44 1l2w h GLN 106 N 0.97 0.88 -0.40 6.66 4.15 -1.66 -0.15 115.11 125.57 1l2w h GLN 106 Ca 0.20 -0.10 -0.09 0.00 0.77 0.00 0.00 58.65 59.43 1l2w h GLN 106 Cb 0.35 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 1l2w h GLN 106 CO 0.00 0.67 -0.09 1.25 -1.93 0.00 0.00 178.83 178.73 1l2w h LEU 107 N 0.86 0.77 -0.94 -2.39 5.85 -1.11 -1.81 115.31 116.54 1l2w h LEU 107 Ca 0.22 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 58.54 1l2w h LEU 107 Cb 0.04 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 1l2w h LEU 107 CO -0.04 0.95 0.29 -0.08 -0.34 0.00 0.00 178.44 179.23 1l2w h GLU 108 N 0.58 1.06 -0.20 1.25 4.81 -0.99 -1.54 114.58 119.55 1l2w h GLU 108 Ca 0.10 -0.18 -0.09 0.00 -0.13 0.00 0.00 59.36 59.06 1l2w h GLU 108 Cb 0.62 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 1l2w h GLU 108 CO 0.04 0.85 -0.28 0.52 -0.73 0.00 0.00 179.01 179.42 1l2w h MET 109 N 1.04 0.38 -0.05 1.92 2.86 -0.83 -1.53 114.93 118.73 1l2w h MET 109 Ca 0.24 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.72 1l2w h MET 109 Cb 0.19 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 31.82 1l2w h MET 109 CO -0.02 0.63 -0.02 1.25 1.06 0.00 0.00 176.91 179.80 1l2w h LEU 110 N 0.34 0.10 -1.12 1.22 5.85 -0.71 -1.86 115.31 119.13 1l2w h LEU 110 Ca 0.05 -0.42 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 1l2w h LEU 110 Cb 0.67 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 1l2w h LEU 110 CO 0.05 0.50 0.15 -0.37 -0.34 0.00 0.00 178.44 178.43 1l2w h VAL 111 N -0.30 1.21 -0.38 1.05 -1.51 -1.24 -1.01 116.25 114.07 1l2w h VAL 111 Ca 0.01 -0.73 -0.09 0.00 -1.23 0.00 0.00 66.70 64.66 1l2w h VAL 111 Cb 0.46 0.66 -0.02 0.00 -2.13 0.00 0.00 31.29 30.26 1l2w h VAL 111 CO 0.01 0.28 -0.12 1.56 -1.23 0.00 0.00 177.57 178.07 1l2w h GLN 112 N 0.75 0.67 -0.27 5.19 4.20 -1.23 0.17 115.11 124.59 1l2w h GLN 112 Ca 0.17 -0.21 -0.09 0.00 0.06 0.00 0.00 58.65 58.57 1l2w h GLN 112 Cb 0.24 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 1l2w h GLN 112 CO -0.01 0.77 -0.23 0.78 -0.67 0.00 0.00 178.83 179.47 1l2w h GLY 113 N 0.97 0.55 0.92 3.46 0.00 -0.49 -2.07 103.07 106.40 1l2w h GLY 113 Ca 0.11 -0.44 -0.12 0.00 0.00 0.00 0.00 47.33 46.88 1l2w h GLY 113 CO 0.03 0.40 -0.34 0.00 0.00 0.00 0.00 176.54 176.64 1l2w h ALA 114 N 1.30 0.33 -1.01 3.60 0.00 -0.54 -2.90 119.26 120.06 1l2w h ALA 114 Ca 0.07 -0.42 0.02 0.00 0.00 0.00 0.00 54.91 54.58 1l2w h ALA 114 Cb 0.65 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 1l2w h ALA 114 CO 0.05 0.38 0.66 0.93 0.00 0.00 0.00 179.25 181.27 1l2w h GLU 115 N 0.30 1.29 -0.50 0.00 5.08 -0.83 -2.19 114.58 117.73 1l2w h GLU 115 Ca 0.02 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1l2w h GLU 115 Cb 0.92 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 1l2w h GLU 115 CO 0.08 0.85 0.27 -0.09 -1.00 0.00 0.00 179.01 179.12 1l2w h ARG 116 N 1.33 0.69 0.00 2.33 2.43 -1.33 -2.07 114.38 117.77 1l2w h ARG 116 Ca 0.38 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.46 1l2w h ARG 116 Cb -0.10 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.31 1l2w h ARG 116 CO -0.10 0.54 -0.06 -0.07 -1.51 0.00 0.00 179.97 178.77 1l2w h LEU 117 N 0.66 0.00 0.00 3.80 3.38 -1.21 -3.52 115.31 118.43 1l2w h LEU 117 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1l2w h LEU 117 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1l2w h LEU 117 CO -0.03 0.06 0.00 0.00 0.09 0.00 0.00 178.44 178.56