#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 -0.03 0.34 3.17 0.00 -1.26 -4.94 105.19 102.46 1l2w n GLY 1 Ca 0.00 -1.36 -0.03 0.00 0.00 0.00 0.00 46.02 44.63 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 1.13 -0.70 1.61 3.20 -2.04 -1.79 116.97 118.37 1l2w h TYR 2 Ca 0.00 0.02 0.04 0.00 3.14 0.00 0.00 58.73 61.93 1l2w h TYR 2 Cb 0.00 -0.38 -0.05 0.00 1.54 0.00 0.00 36.73 37.84 1l2w h TYR 2 CO 0.00 0.73 0.43 0.77 -1.64 0.00 0.00 178.16 178.44 1l2w h SER 3 N 1.21 0.68 -0.22 -2.11 0.02 -1.99 0.84 113.55 111.98 1l2w h SER 3 Ca 0.32 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.25 1l2w h SER 3 Cb -0.11 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 1l2w h SER 3 CO -0.07 0.46 0.02 0.15 -1.14 0.00 0.00 176.83 176.26 1l2w h PHE 4 N 0.81 0.39 -0.54 3.45 3.57 -1.85 -1.19 116.94 121.58 1l2w h PHE 4 Ca 0.29 -0.06 0.08 0.00 3.53 0.00 0.00 57.97 61.82 1l2w h PHE 4 Cb 0.08 -0.11 -0.07 0.00 2.79 0.00 0.00 35.95 38.65 1l2w h PHE 4 CO -0.05 0.52 0.17 0.93 -2.23 0.00 0.00 178.31 177.65 1l2w h GLU 5 N 0.15 0.33 -0.40 1.11 5.08 -0.70 0.38 114.58 120.52 1l2w h GLU 5 Ca 0.06 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.33 1l2w h GLU 5 Cb 0.34 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1l2w h GLU 5 CO 0.01 0.22 -0.05 1.96 -1.00 0.00 0.00 179.01 180.15 1l2w h GLN 6 N 0.34 0.74 -0.49 2.33 1.08 -0.78 -1.04 115.11 117.29 1l2w h GLN 6 Ca 0.27 -0.26 -0.02 0.00 -1.45 0.00 0.00 58.65 57.19 1l2w h GLN 6 Cb 0.32 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.68 1l2w h GLN 6 CO -0.29 0.85 0.23 0.00 -0.95 0.00 0.00 178.83 178.67 1l2w h ALA 7 N 0.86 0.64 -0.46 3.87 0.00 -0.69 -0.48 119.26 123.00 1l2w h ALA 7 Ca 0.11 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1l2w h ALA 7 Cb 0.55 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1l2w h ALA 7 CO 0.03 0.20 0.09 0.82 0.00 0.00 0.00 179.25 180.39 1l2w h ILE 8 N 0.65 1.24 -0.52 0.00 1.08 -0.87 -1.39 117.51 117.70 1l2w h ILE 8 Ca 0.17 -0.87 0.01 0.00 -0.39 0.00 0.00 64.86 63.79 1l2w h ILE 8 Cb 0.12 0.92 -0.03 0.00 -3.07 0.00 0.00 36.82 34.76 1l2w h ILE 8 CO -0.02 0.31 0.33 0.74 -0.69 0.00 0.00 178.15 178.82 1l2w h THR 9 N 0.62 1.10 -0.17 -0.27 2.02 -0.92 0.11 112.91 115.41 1l2w h THR 9 Ca 0.14 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 67.09 1l2w h THR 9 Cb 0.36 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 1l2w h THR 9 CO 0.01 0.12 0.11 -0.61 0.37 0.00 0.00 175.52 175.51 1l2w h GLN 10 N 0.67 0.22 -0.35 6.66 4.15 -0.96 -1.62 115.11 123.88 1l2w h GLN 10 Ca 0.20 -0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.63 1l2w h GLN 10 Cb -0.03 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 27.58 1l2w h GLN 10 CO -0.07 0.17 0.16 1.25 -1.93 0.00 0.00 178.83 178.41 1l2w h LEU 11 N 0.21 0.22 -1.61 -2.39 5.85 -0.72 -1.74 115.31 115.13 1l2w h LEU 11 Ca 0.06 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1l2w h LEU 11 Cb -0.00 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 1l2w h LEU 11 CO -0.01 0.17 0.08 -0.26 -0.34 0.00 0.00 178.44 178.07 1l2w h PHE 12 N 0.34 0.32 -0.50 1.25 -1.00 -0.59 -1.39 116.94 115.37 1l2w h PHE 12 Ca 0.15 -0.01 -0.13 0.00 2.81 0.00 0.00 57.97 60.80 1l2w h PHE 12 Cb 0.08 -0.10 -0.01 0.00 3.61 0.00 0.00 35.95 39.52 1l2w h PHE 12 CO -0.11 0.27 -0.19 1.96 -1.61 0.00 0.00 178.31 178.63 1l2w h GLN 13 N 0.33 1.00 0.00 1.51 4.20 -0.49 0.85 115.11 122.52 1l2w h GLN 13 Ca 0.08 -0.42 0.00 0.00 0.06 0.00 0.00 58.65 58.38 1l2w h GLN 13 Cb 0.10 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1l2w h GLN 13 CO -0.01 1.10 0.00 1.04 -0.67 0.00 0.00 178.83 180.29 1l2w n GLN 14 N -4.13 0.11 -0.12 1.46 6.02 -0.72 -2.48 117.38 117.51 1l2w n GLN 14 Ca 0.00 0.27 0.06 0.00 -0.01 0.00 0.00 57.00 57.33 1l2w n GLN 14 Cb 0.44 -1.67 0.13 0.00 1.02 0.00 0.00 30.24 30.16 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 -1.87 2.67 -2.52 1.08 4.77 -0.60 -4.98 117.00 115.55 1l2w n LEU 15 Ca 0.04 -1.61 -0.20 0.00 -0.03 0.00 0.00 56.01 54.21 1l2w n LEU 15 Cb 0.25 -0.16 0.01 0.00 -2.33 0.00 0.00 43.42 41.19 1l2w n LEU 15 CO 0.20 0.62 -0.14 -1.20 -1.33 0.00 0.00 177.39 175.53 1l2w n SER 16 N 0.69 -5.77 -4.85 -1.43 7.64 -0.56 -4.99 113.62 104.33 1l2w n SER 16 Ca 0.11 -0.13 -0.37 0.00 1.01 0.00 0.00 58.87 59.49 1l2w n SER 16 Cb 0.40 -4.71 -0.06 0.00 -1.01 0.00 0.00 64.21 58.83 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 -5.97 4.36 0.46 -3.43 1.43 0.19 -5.04 118.68 110.68 1l2w s LEU 17 Ca 0.13 0.45 -0.24 0.00 -1.03 0.00 0.00 54.13 53.43 1l2w s LEU 17 Cb -0.06 -2.09 -0.07 0.00 0.03 0.00 0.00 46.19 44.00 1l2w s LEU 17 CO 0.16 0.37 1.36 -0.94 0.23 0.00 0.00 176.35 177.52 1l2w s SER 18 N -0.81 5.87 -0.34 2.29 1.04 -1.26 -4.47 113.70 116.02 1l2w s SER 18 Ca 0.14 2.77 -0.25 0.00 0.48 0.00 0.00 55.95 59.09 1l2w s SER 18 Cb -0.12 -2.64 0.01 0.00 0.10 0.00 0.00 66.02 63.37 1l2w s SER 18 CO 0.03 -1.16 0.86 -0.63 0.98 0.00 0.00 173.24 173.32 1l2w s ILE 19 N -1.27 4.68 0.65 -1.02 1.01 -1.26 -5.02 121.20 118.97 1l2w s ILE 19 Ca 0.63 1.18 -0.18 0.00 0.00 0.00 0.00 60.65 62.28 1l2w s ILE 19 Cb -0.40 -4.25 -0.02 0.00 0.01 0.00 0.00 42.46 37.80 1l2w s ILE 19 CO 0.51 -0.41 1.15 -2.65 0.00 0.00 0.00 174.94 173.54 1l2w n PRO 20 N 6.51 0.94 0.16 2.79 -0.02 -1.26 -4.89 135.00 139.23 1l2w n PRO 20 Ca 0.06 0.37 0.01 0.00 -2.02 0.00 0.00 63.50 61.92 1l2w n PRO 20 Cb 0.48 -2.38 0.28 0.00 -0.02 0.00 0.00 33.50 31.86 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 0.36 0.02 -3.33 2.55 3.32 -2.06 -3.41 116.42 113.87 1l2w h ASP 21 Ca -0.50 -0.01 -0.53 0.00 0.02 0.00 0.00 57.03 56.01 1l2w h ASP 21 Cb 1.35 -0.00 -0.34 0.00 0.22 0.00 0.00 39.33 40.55 1l2w h ASP 21 CO 0.51 0.48 -0.82 -0.89 -1.72 0.00 0.00 179.24 176.80 1l2w s THR 22 N -3.99 1.20 -0.41 0.35 2.01 -1.26 -5.10 115.64 108.44 1l2w s THR 22 Ca -0.02 -0.48 -0.17 0.00 0.31 0.00 0.00 61.69 61.33 1l2w s THR 22 Cb 0.14 -1.12 0.02 0.00 0.01 0.00 0.00 72.50 71.54 1l2w s THR 22 CO 0.74 0.38 0.40 -0.63 -0.69 0.00 0.00 174.62 174.82 1l2w s ILE 23 N 0.97 5.13 0.68 1.82 1.01 -1.26 -5.06 121.20 124.48 1l2w s ILE 23 Ca -0.08 -0.39 -0.13 0.00 0.00 0.00 0.00 60.65 60.05 1l2w s ILE 23 Cb -0.15 -4.00 0.00 0.00 0.01 0.00 0.00 42.46 38.32 1l2w s ILE 23 CO -0.00 -0.38 1.07 -1.83 0.00 0.00 0.00 174.94 173.80 1l2w s GLU 24 N 2.04 2.89 0.41 2.79 -1.05 -1.26 -4.95 118.70 119.57 1l2w s GLU 24 Ca 0.11 1.11 0.09 0.00 -0.15 0.00 0.00 54.97 56.13 1l2w s GLU 24 Cb -0.17 -1.98 0.90 0.00 -0.44 0.00 0.00 34.13 32.43 1l2w s GLU 24 CO 0.13 -1.14 2.02 -1.35 0.95 0.00 0.00 175.26 175.86 1l2w h PRO 25 N -0.39 0.52 -4.72 -4.83 0.11 -1.97 -3.36 132.00 117.36 1l2w h PRO 25 Ca -0.45 -0.03 -0.66 0.00 0.11 0.00 0.00 66.00 64.97 1l2w h PRO 25 Cb 1.22 -0.12 -0.39 0.00 0.11 0.00 0.00 31.00 31.82 1l2w h PRO 25 CO 0.56 0.35 -0.75 0.08 -0.21 0.00 0.00 178.00 178.02 1l2w s VAL 26 N -5.49 2.21 -0.05 3.15 1.01 -1.26 -4.30 120.40 115.67 1l2w s VAL 26 Ca -0.08 -2.09 -0.24 0.00 0.00 0.00 0.00 61.98 59.57 1l2w s VAL 26 Cb 0.18 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 1l2w s VAL 26 CO 0.74 -0.41 0.73 -0.63 0.00 0.00 0.00 175.10 175.53 1l2w s ILE 27 N 0.98 5.00 -0.24 2.22 -1.09 0.32 -4.86 121.20 123.52 1l2w s ILE 27 Ca 0.04 1.51 -0.11 0.00 -2.23 0.00 0.00 60.65 59.86 1l2w s ILE 27 Cb -0.19 -4.07 -0.05 0.00 -1.58 0.00 0.00 42.46 36.57 1l2w s ILE 27 CO -0.07 0.26 0.17 -0.83 -1.23 0.00 0.00 174.94 173.24 1l2w s GLY 28 N 0.69 1.99 -0.13 6.18 0.00 -1.26 -0.84 107.32 113.95 1l2w s GLY 28 Ca 0.39 -0.88 -0.01 0.00 0.00 0.00 0.00 44.72 44.21 1l2w s GLY 28 CO 0.19 0.42 -0.05 0.14 0.00 0.00 0.00 173.10 173.80 1l2w s VAL 29 N 1.09 0.94 -0.36 1.40 1.01 0.27 -4.99 120.40 119.76 1l2w s VAL 29 Ca 0.08 -0.37 -0.19 0.00 0.00 0.00 0.00 61.98 61.49 1l2w s VAL 29 Cb -0.14 -1.06 0.00 0.00 0.00 0.00 0.00 36.38 35.18 1l2w s VAL 29 CO 0.05 0.23 0.58 -0.75 0.00 0.00 0.00 175.10 175.21 1l2w s LYS 30 N 1.73 3.62 -0.51 2.72 2.47 -1.26 -0.52 119.74 127.98 1l2w s LYS 30 Ca 0.03 -0.07 -0.04 0.00 -1.56 0.00 0.00 55.97 54.33 1l2w s LYS 30 Cb -0.14 -3.82 0.13 0.00 -1.46 0.00 0.00 37.83 32.55 1l2w s LYS 30 CO -0.08 -0.71 0.33 0.08 0.16 0.00 0.00 175.35 175.13 1l2w s VAL 31 N 2.57 3.60 0.00 4.02 1.01 0.40 -4.95 120.40 127.05 1l2w s VAL 31 Ca 0.22 -2.41 0.00 0.00 0.00 0.00 0.00 61.98 59.78 1l2w s VAL 31 Cb -0.15 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1l2w s VAL 31 CO 0.14 -0.78 0.00 0.61 0.00 0.00 0.00 175.10 175.07 1l2w n GLY 32 N 4.15 2.59 1.08 4.51 0.00 -1.26 -2.26 105.19 114.00 1l2w n GLY 32 Ca 0.02 -0.32 0.11 0.00 0.00 0.00 0.00 46.02 45.83 1l2w n GLY 32 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1l2w n GLU 33 N 11.33 2.41 -3.68 1.61 0.28 -1.26 -4.90 120.64 126.43 1l2w n GLU 33 Ca 0.00 -2.18 -0.37 0.00 -0.16 0.00 0.00 57.16 54.44 1l2w n GLU 33 Cb 0.00 -1.49 -0.12 0.00 1.43 0.00 0.00 31.44 31.26 1l2w n GLU 33 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1l2w s PHE 34 N -1.54 3.15 -0.38 -1.84 0.40 -0.96 -5.05 117.98 111.76 1l2w s PHE 34 Ca 0.35 -0.30 -0.24 0.00 -0.60 0.00 0.00 56.93 56.15 1l2w s PHE 34 Cb 0.21 -2.31 0.01 0.00 0.51 0.00 0.00 43.02 41.45 1l2w s PHE 34 CO 0.30 -0.33 0.81 0.00 0.70 0.00 0.00 175.22 176.71 1l2w s ALA 35 N 1.66 3.40 0.14 5.36 0.00 -1.26 -0.45 121.76 130.61 1l2w s ALA 35 Ca 0.06 -0.67 0.07 0.00 0.00 0.00 0.00 51.96 51.42 1l2w s ALA 35 Cb -0.16 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 1l2w s ALA 35 CO 0.06 -1.58 -0.03 0.00 0.00 0.00 0.00 175.76 174.21 1l2w s HIS 37 N -1.53 1.68 -0.06 0.00 3.76 0.14 -0.56 115.29 118.71 1l2w s HIS 37 Ca 0.26 -0.32 0.03 0.00 -0.15 0.00 0.00 55.06 54.87 1l2w s HIS 37 Cb -0.10 -1.07 0.01 0.00 1.11 0.00 0.00 32.58 32.53 1l2w s HIS 37 CO 0.17 -0.01 -0.14 0.42 -0.85 0.00 0.00 174.74 174.33 1l2w s ILE 38 N -0.50 1.27 0.23 0.60 1.01 -0.02 -1.33 121.20 122.47 1l2w s ILE 38 Ca 0.07 -0.57 -0.16 0.00 0.00 0.00 0.00 60.65 59.99 1l2w s ILE 38 Cb -0.07 -1.14 0.01 0.00 0.01 0.00 0.00 42.46 41.27 1l2w s ILE 38 CO -0.00 0.38 0.52 0.28 0.00 0.00 0.00 174.94 176.12 1l2w s THR 39 N 0.52 0.02 -0.40 2.92 -1.32 -0.45 -0.52 115.64 116.39 1l2w s THR 39 Ca -0.13 -1.08 -0.15 0.00 -1.21 0.00 0.00 61.69 59.12 1l2w s THR 39 Cb -0.15 -1.89 0.02 0.00 -1.51 0.00 0.00 72.50 68.97 1l2w s THR 39 CO 0.04 -0.07 0.30 -0.70 -2.21 0.00 0.00 174.62 171.98 1l2w s GLU 40 N -3.94 3.04 -0.30 7.08 2.12 -1.26 -0.76 118.70 124.69 1l2w s GLU 40 Ca 0.15 -0.96 -0.08 0.00 0.36 0.00 0.00 54.97 54.43 1l2w s GLU 40 Cb -0.01 -3.96 0.16 0.00 0.26 0.00 0.00 34.13 30.58 1l2w s GLU 40 CO 0.03 -0.72 0.73 -1.58 -0.54 0.00 0.00 175.26 173.19 1l2w s HIS 41 N 1.71 -1.23 0.58 5.30 2.46 -0.43 -4.52 115.29 119.15 1l2w s HIS 41 Ca 0.06 1.77 -0.10 0.00 0.47 0.00 0.00 55.06 57.26 1l2w s HIS 41 Cb -0.19 0.60 0.14 0.00 -0.13 0.00 0.00 32.58 33.00 1l2w s HIS 41 CO 0.10 -0.64 0.66 -0.35 -2.47 0.00 0.00 174.74 172.04 1l2w n PRO 42 N 5.36 -1.30 -1.62 2.88 -0.04 -1.26 -4.56 135.00 134.46 1l2w n PRO 42 Ca -0.08 -1.03 -0.45 0.00 -0.04 0.00 0.00 63.50 61.90 1l2w n PRO 42 Cb 0.51 -0.79 -0.02 0.00 -0.04 0.00 0.00 33.50 33.15 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 -3.30 1.41 -0.75 0.52 0.31 -1.26 -1.65 118.33 113.60 1l2w n VAL 43 Ca 0.09 -0.35 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1l2w n VAL 43 Cb 0.31 -1.17 0.00 0.00 -0.91 0.00 0.00 33.84 32.07 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 1.64 0.79 3.05 2.92 0.00 -1.26 -5.04 105.19 107.29 1l2w n GLY 44 Ca 0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.25 1.04 -0.31 1.61 -1.52 -0.66 -0.89 119.66 118.69 1l2w s GLN 45 Ca 0.00 -0.40 -0.11 0.00 -1.95 0.00 0.00 55.36 52.90 1l2w s GLN 45 Cb 0.00 -0.98 -0.03 0.00 -0.22 0.00 0.00 33.01 31.78 1l2w s GLN 45 CO 0.00 0.20 0.19 0.42 -0.25 0.00 0.00 175.29 175.86 1l2w s ILE 46 N -0.08 5.06 -0.13 1.08 -1.09 0.40 -1.31 121.20 125.12 1l2w s ILE 46 Ca 0.01 -0.14 -0.03 0.00 -2.23 0.00 0.00 60.65 58.27 1l2w s ILE 46 Cb -0.07 -3.52 -0.03 0.00 -1.58 0.00 0.00 42.46 37.27 1l2w s ILE 46 CO 0.00 0.12 -0.03 -0.22 -1.23 0.00 0.00 174.94 173.57 1l2w s LEU 47 N 1.70 3.30 0.03 2.97 2.96 0.07 -1.95 118.68 127.76 1l2w s LEU 47 Ca 0.06 -0.06 0.05 0.00 -0.22 0.00 0.00 54.13 53.96 1l2w s LEU 47 Cb -0.17 -1.78 -0.02 0.00 0.50 0.00 0.00 46.19 44.73 1l2w s LEU 47 CO 0.09 0.23 -0.16 -0.04 -1.32 0.00 0.00 176.35 175.16 1l2w s MET 48 N -0.03 1.10 0.15 1.98 -1.94 -0.67 -1.35 119.30 118.55 1l2w s MET 48 Ca 0.01 -0.75 -0.18 0.00 -1.71 0.00 0.00 55.69 53.07 1l2w s MET 48 Cb -0.13 -1.13 0.04 0.00 2.01 0.00 0.00 34.83 35.62 1l2w s MET 48 CO 0.03 0.29 0.46 -0.59 -0.01 0.00 0.00 175.02 175.20 1l2w s PHE 49 N -0.73 -0.24 0.12 -0.03 -0.12 -0.44 -1.40 117.98 115.14 1l2w s PHE 49 Ca 0.04 -0.06 -0.15 0.00 -0.05 0.00 0.00 56.93 56.71 1l2w s PHE 49 Cb -0.08 0.34 0.03 0.00 -0.63 0.00 0.00 43.02 42.69 1l2w s PHE 49 CO 0.01 -0.78 0.38 -0.08 -0.05 0.00 0.00 175.22 174.70 1l2w s THR 50 N -3.81 0.08 -0.48 -4.49 -1.32 -0.44 -0.68 115.64 104.50 1l2w s THR 50 Ca 0.04 -0.64 -0.16 0.00 -1.21 0.00 0.00 61.69 59.72 1l2w s THR 50 Cb 0.01 -1.18 0.08 0.00 -1.51 0.00 0.00 72.50 69.90 1l2w s THR 50 CO -0.10 -0.35 0.43 -0.76 -2.21 0.00 0.00 174.62 171.62 1l2w s LEU 51 N -2.79 5.62 0.67 9.08 1.02 -1.26 -1.23 118.68 129.79 1l2w s LEU 51 Ca 0.03 -1.34 -0.11 0.00 0.02 0.00 0.00 54.13 52.73 1l2w s LEU 51 Cb 0.02 -2.21 -0.01 0.00 0.02 0.00 0.00 46.19 44.01 1l2w s LEU 51 CO -0.12 -0.69 1.06 -2.16 0.02 0.00 0.00 176.35 174.47 1l2w s PRO 52 N 1.73 3.18 -0.35 1.29 0.04 -1.26 -4.96 135.00 134.67 1l2w s PRO 52 Ca 0.05 0.64 -0.14 0.00 0.04 0.00 0.00 61.00 61.58 1l2w s PRO 52 Cb -0.24 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.24 1l2w s PRO 52 CO 0.07 -0.85 0.32 -1.12 0.04 0.00 0.00 177.00 175.46 1l2w s SER 53 N -4.22 6.13 0.08 6.66 0.01 -1.26 -4.78 113.70 116.33 1l2w s SER 53 Ca 0.57 -0.36 -0.08 0.00 1.31 0.00 0.00 55.95 57.38 1l2w s SER 53 Cb -0.11 -2.17 -0.06 0.00 0.21 0.00 0.00 66.02 63.89 1l2w s SER 53 CO 0.53 -0.32 0.38 -0.76 0.41 0.00 0.00 173.24 173.48 1l2w s LEU 54 N 1.89 4.33 -0.23 2.44 1.43 -1.26 -3.75 118.68 123.53 1l2w s LEU 54 Ca 0.09 0.72 -0.25 0.00 -1.03 0.00 0.00 54.13 53.66 1l2w s LEU 54 Cb -0.17 -3.01 -0.00 0.00 0.03 0.00 0.00 46.19 43.03 1l2w s LEU 54 CO 0.11 0.16 0.85 -0.62 0.23 0.00 0.00 176.35 177.08 1l2w s ASP 55 N -1.89 6.87 0.51 2.29 -1.08 -1.26 -4.93 116.67 117.18 1l2w s ASP 55 Ca 0.34 1.09 0.34 0.00 -0.52 0.00 0.00 52.55 53.80 1l2w s ASP 55 Cb -0.13 -2.45 1.68 0.00 -1.46 0.00 0.00 42.92 40.56 1l2w s ASP 55 CO 0.19 -0.52 2.04 0.78 0.52 0.00 0.00 175.17 178.18 1l2w h ASN 56 N 7.62 0.00 -0.00 -0.34 2.35 -1.98 -1.55 115.58 121.67 1l2w h ASN 56 Ca -0.23 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.52 1l2w h ASN 56 Cb 1.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.46 1l2w h ASN 56 CO 0.88 0.00 0.00 -3.20 -1.65 0.00 0.00 177.43 173.46 1l2w n ASN 57 N -2.82 0.26 -4.70 5.81 5.15 -1.26 -4.76 115.26 112.94 1l2w n ASN 57 Ca -0.01 -1.11 -0.37 0.00 -0.60 0.00 0.00 54.58 52.49 1l2w n ASN 57 Cb 0.16 -0.00 -0.07 0.00 -0.53 0.00 0.00 39.78 39.34 1l2w n ASN 57 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 1l2w s ASP 58 N -1.98 6.47 0.77 1.20 1.01 -0.59 -5.08 116.67 118.48 1l2w s ASP 58 Ca 0.45 0.55 -0.06 0.00 0.71 0.00 0.00 52.55 54.21 1l2w s ASP 58 Cb 0.21 -2.22 0.12 0.00 1.01 0.00 0.00 42.92 42.05 1l2w s ASP 58 CO 0.36 0.01 1.07 -1.61 0.21 0.00 0.00 175.17 175.20 1l2w s GLU 59 N 0.86 1.60 0.13 8.23 2.02 -1.26 -4.86 118.70 125.41 1l2w s GLU 59 Ca 0.19 -0.69 -0.27 0.00 0.02 0.00 0.00 54.97 54.22 1l2w s GLU 59 Cb -0.14 -2.18 -0.04 0.00 0.10 0.00 0.00 34.13 31.88 1l2w s GLU 59 CO 0.07 -1.60 1.61 1.57 0.02 0.00 0.00 175.26 176.93 1l2w h LYS 60 N -0.79 -0.42 -0.86 1.61 2.10 -1.99 -1.62 116.57 114.61 1l2w h LYS 60 Ca -0.41 0.03 0.15 0.00 -2.00 0.00 0.00 60.65 58.42 1l2w h LYS 60 Cb 1.27 0.09 -0.09 0.00 -0.90 0.00 0.00 32.23 32.60 1l2w h LYS 60 CO 0.46 -0.28 0.45 0.93 -2.00 0.00 0.00 179.45 179.00 1l2w h GLU 61 N -0.43 0.61 -0.49 0.07 3.07 -1.98 0.68 114.58 116.11 1l2w h GLU 61 Ca 0.08 -0.04 -0.07 0.00 -0.50 0.00 0.00 59.36 58.84 1l2w h GLU 61 Cb 0.55 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 28.31 1l2w h GLU 61 CO -0.32 0.41 0.05 1.15 -1.40 0.00 0.00 179.01 178.90 1l2w h THR 62 N 0.63 1.26 -0.28 1.13 2.02 -1.80 -1.55 112.91 114.31 1l2w h THR 62 Ca 0.47 -0.98 -0.11 0.00 0.77 0.00 0.00 66.41 66.55 1l2w h THR 62 Cb 0.66 0.94 -0.00 0.00 -1.74 0.00 0.00 68.15 68.00 1l2w h THR 62 CO -0.36 0.35 -0.26 -0.07 0.37 0.00 0.00 175.52 175.54 1l2w h LEU 63 N 0.70 0.72 -1.46 2.58 3.38 -0.42 -3.06 115.31 117.74 1l2w h LEU 63 Ca 0.14 -0.47 -0.06 0.00 0.09 0.00 0.00 57.88 57.59 1l2w h LEU 63 Cb 0.44 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1l2w h LEU 63 CO 0.02 1.03 -0.27 -0.07 0.09 0.00 0.00 178.44 179.24 1l2w h LEU 64 N 0.41 0.00 -2.14 1.67 3.38 -0.87 -2.76 115.31 115.01 1l2w h LEU 64 Ca 0.05 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1l2w h LEU 64 Cb 0.82 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 1l2w h LEU 64 CO 0.07 0.27 0.02 0.28 0.09 0.00 0.00 178.44 179.17 1l2w h SER 65 N 0.00 0.00 0.58 -0.43 0.02 -1.17 -1.02 113.55 111.53 1l2w h SER 65 Ca -0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1l2w h SER 65 Cb 0.52 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.06 1l2w h SER 65 CO 0.04 0.00 -0.07 0.45 -1.14 0.00 0.00 176.83 176.10 1l2w h HIS 66 N 0.00 0.00 -0.25 3.45 3.86 -1.56 -3.01 115.15 117.64 1l2w h HIS 66 Ca 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1l2w h HIS 66 Cb 0.05 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.52 1l2w h HIS 66 CO 0.00 0.07 0.00 0.09 0.86 0.00 0.00 177.93 178.95 1l2w n ASN 67 N -3.33 1.95 -4.77 2.45 3.02 -0.39 -4.88 115.26 109.32 1l2w n ASN 67 Ca -0.01 -1.82 -0.40 0.00 -0.03 0.00 0.00 54.58 52.32 1l2w n ASN 67 Cb 0.25 -0.16 -0.01 0.00 -0.61 0.00 0.00 39.78 39.25 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 -1.67 2.73 0.77 2.41 1.10 -1.14 -4.96 121.20 120.44 1l2w s ILE 68 Ca 0.31 0.68 -0.13 0.00 -0.51 0.00 0.00 60.65 61.00 1l2w s ILE 68 Cb 0.17 -3.41 0.06 0.00 0.15 0.00 0.00 42.46 39.43 1l2w s ILE 68 CO 0.24 0.12 1.15 0.72 -2.11 0.00 0.00 174.94 175.06 1l2w s PHE 69 N -1.24 2.15 0.00 3.50 -0.12 -1.26 -5.04 117.98 115.97 1l2w s PHE 69 Ca 0.54 1.63 0.00 0.00 -0.05 0.00 0.00 56.93 59.05 1l2w s PHE 69 Cb -0.38 -3.31 0.00 0.00 -0.63 0.00 0.00 43.02 38.71 1l2w s PHE 69 CO 0.49 -2.33 0.00 -1.13 -0.05 0.00 0.00 175.22 172.19 1l2w n SER 70 N -3.15 0.00 0.00 1.98 3.41 -1.26 -5.04 113.62 109.56 1l2w n SER 70 Ca 0.12 -0.64 0.13 0.00 -0.26 0.00 0.00 58.87 58.22 1l2w n SER 70 Cb 0.51 0.00 0.50 0.00 -0.26 0.00 0.00 64.21 64.96 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 0.01 -3.66 4.33 10.64 -1.26 -4.69 117.38 122.75 1l2w n GLN 71 Ca 0.00 0.01 -0.39 0.00 -1.83 0.00 0.00 57.00 54.78 1l2w n GLN 71 Cb 0.00 -1.51 -0.12 0.00 -0.86 0.00 0.00 30.24 27.75 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 -3.05 5.53 0.00 2.61 -1.08 -1.26 -4.97 116.67 114.46 1l2w s ASP 72 Ca 0.13 -0.96 0.13 0.00 -0.52 0.00 0.00 52.55 51.32 1l2w s ASP 72 Cb 0.18 -1.96 0.58 0.00 -1.46 0.00 0.00 42.92 40.26 1l2w s ASP 72 CO 0.58 -0.33 1.37 2.30 0.52 0.00 0.00 175.17 179.62 1l2w n ILE 73 N 4.93 0.94 0.74 4.11 -5.35 -1.26 -1.96 119.36 121.51 1l2w n ILE 73 Ca -0.12 0.24 0.11 0.00 -0.27 0.00 0.00 62.75 62.70 1l2w n ILE 73 Cb 0.46 -1.02 0.28 0.00 -1.74 0.00 0.00 39.64 37.62 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 -1.41 2.63 -4.69 7.28 4.77 -1.26 -4.69 117.00 119.62 1l2w n LEU 74 Ca 0.04 -1.12 -0.42 0.00 -0.03 0.00 0.00 56.01 54.48 1l2w n LEU 74 Cb 0.13 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 1l2w n LEU 74 CO 0.11 0.56 1.36 -0.75 -1.33 0.00 0.00 177.39 177.34 1l2w s LYS 75 N -1.63 4.18 0.56 3.23 2.20 -0.83 -4.73 119.74 122.72 1l2w s LYS 75 Ca 0.35 2.41 -0.19 0.00 -0.36 0.00 0.00 55.97 58.18 1l2w s LYS 75 Cb 0.20 -3.57 -0.05 0.00 -1.51 0.00 0.00 37.83 32.90 1l2w s LYS 75 CO 0.29 -0.76 1.13 -1.25 -0.36 0.00 0.00 175.35 174.40 1l2w s PRO 76 N 2.59 3.28 -0.14 4.03 0.04 -1.26 -4.86 135.00 138.68 1l2w s PRO 76 Ca 0.76 1.60 -0.04 0.00 0.04 0.00 0.00 61.00 63.36 1l2w s PRO 76 Cb -0.42 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.09 1l2w s PRO 76 CO 0.33 -0.90 0.01 0.42 0.04 0.00 0.00 177.00 176.90 1l2w s ILE 77 N -1.81 4.37 -0.20 0.56 -1.09 0.89 -4.80 121.20 119.12 1l2w s ILE 77 Ca 0.73 -0.20 -0.15 0.00 -2.23 0.00 0.00 60.65 58.80 1l2w s ILE 77 Cb -0.24 -2.90 -0.04 0.00 -1.58 0.00 0.00 42.46 37.69 1l2w s ILE 77 CO 0.29 0.53 0.34 -0.22 -1.23 0.00 0.00 174.94 174.65 1l2w s LEU 78 N -0.17 4.17 0.00 2.97 2.96 -1.26 -1.15 118.68 126.20 1l2w s LEU 78 Ca 0.05 0.47 0.03 0.00 -0.22 0.00 0.00 54.13 54.46 1l2w s LEU 78 Cb -0.12 -2.43 -0.01 0.00 0.50 0.00 0.00 46.19 44.12 1l2w s LEU 78 CO 0.02 -0.02 0.17 -1.54 -1.32 0.00 0.00 176.35 173.66 1l2w n SER 79 N 4.23 -0.44 -3.94 3.68 3.41 0.10 -4.96 113.62 115.71 1l2w n SER 79 Ca -0.10 -2.16 -0.16 0.00 -0.26 0.00 0.00 58.87 56.19 1l2w n SER 79 Cb 0.51 0.98 -0.15 0.00 -0.26 0.00 0.00 64.21 65.29 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 -2.90 0.45 -0.48 7.33 -0.11 -1.26 -0.08 118.94 121.88 1l2w s TRP 80 Ca 0.21 -0.08 -0.13 0.00 1.22 0.00 0.00 56.10 57.31 1l2w s TRP 80 Cb 0.01 -0.32 0.10 0.00 -1.50 0.00 0.00 33.47 31.76 1l2w s TRP 80 CO 0.15 -0.03 0.39 0.34 -4.62 0.00 0.00 176.95 173.18 1l2w s ASP 81 N 0.04 5.97 0.24 5.86 2.15 -0.09 -4.89 116.67 125.95 1l2w s ASP 81 Ca 0.00 -1.62 -0.05 0.00 0.43 0.00 0.00 52.55 51.30 1l2w s ASP 81 Cb -0.04 -2.12 0.26 0.00 -0.30 0.00 0.00 42.92 40.72 1l2w s ASP 81 CO -0.00 -0.70 1.81 -0.33 -0.17 0.00 0.00 175.17 175.77 1l2w h GLU 82 N 8.67 1.07 -0.08 4.34 4.39 -1.97 0.24 114.58 131.25 1l2w h GLU 82 Ca -0.26 -0.19 0.01 0.00 0.34 0.00 0.00 59.36 59.25 1l2w h GLU 82 Cb 1.09 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.56 1l2w h GLU 82 CO 0.90 0.88 0.02 0.28 -1.16 0.00 0.00 179.01 179.93 1l2w h VAL 83 N 1.04 0.97 -0.01 3.13 2.07 -1.97 -3.10 116.25 118.39 1l2w h VAL 83 Ca 0.24 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.74 1l2w h VAL 83 Cb 0.23 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1l2w h VAL 83 CO -0.02 0.01 -0.55 0.61 0.02 0.00 0.00 177.57 177.64 1l2w n GLY 84 N -1.12 -0.70 3.10 2.17 0.00 -1.21 -5.00 105.19 102.43 1l2w n GLY 84 Ca -0.05 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.33 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 1.44 -0.47 3.00 -0.02 0.00 0.84 -5.04 105.19 104.93 1l2w n GLY 85 Ca 0.08 0.17 -0.10 0.00 0.00 0.00 0.00 46.02 46.17 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 -3.32 0.11 0.45 1.61 3.76 -1.06 -5.00 115.29 111.83 1l2w s HIS 86 Ca 0.13 -0.24 -0.20 0.00 -0.15 0.00 0.00 55.06 54.60 1l2w s HIS 86 Cb -0.02 -0.09 -0.10 0.00 1.11 0.00 0.00 32.58 33.48 1l2w s HIS 86 CO 0.64 -0.17 0.96 -1.25 -0.85 0.00 0.00 174.74 174.08 1l2w s PRO 87 N -1.01 4.14 -0.04 8.40 0.04 -1.26 -0.91 135.00 144.35 1l2w s PRO 87 Ca -0.11 1.11 0.01 0.00 0.04 0.00 0.00 61.00 62.05 1l2w s PRO 87 Cb -0.07 -2.16 0.02 0.00 0.04 0.00 0.00 34.50 32.33 1l2w s PRO 87 CO -0.00 -0.11 -0.04 0.08 0.04 0.00 0.00 177.00 176.97 1l2w s VAL 88 N -2.25 0.51 -0.16 -0.36 1.01 0.88 -4.18 120.40 115.85 1l2w s VAL 88 Ca 0.62 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.47 1l2w s VAL 88 Cb -0.10 -0.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.73 1l2w s VAL 88 CO 0.17 0.22 -0.08 -0.22 0.00 0.00 0.00 175.10 175.19 1l2w s LEU 89 N 0.91 2.90 0.04 3.92 2.96 -0.37 0.02 118.68 129.07 1l2w s LEU 89 Ca -0.11 -0.29 -0.11 0.00 -0.22 0.00 0.00 54.13 53.39 1l2w s LEU 89 Cb -0.14 -1.69 0.01 0.00 0.50 0.00 0.00 46.19 44.87 1l2w s LEU 89 CO 0.00 0.12 0.24 -1.66 -1.32 0.00 0.00 176.35 173.73 1l2w s TRP 90 N 0.66 -0.01 0.17 5.38 1.48 -0.30 -1.32 118.94 125.00 1l2w s TRP 90 Ca -0.05 -0.19 0.00 0.00 -1.06 0.00 0.00 56.10 54.81 1l2w s TRP 90 Cb -0.15 0.02 -0.04 0.00 -1.16 0.00 0.00 33.47 32.14 1l2w s TRP 90 CO 0.02 -0.47 0.05 0.54 -4.06 0.00 0.00 176.95 173.03 1l2w s ASN 91 N -2.13 0.75 -0.04 -2.66 2.20 -0.49 -0.08 114.94 112.49 1l2w s ASN 91 Ca -0.04 -1.23 -0.21 0.00 -0.94 0.00 0.00 52.86 50.44 1l2w s ASN 91 Cb -0.01 0.22 0.04 0.00 -2.00 0.00 0.00 41.25 39.50 1l2w s ASN 91 CO -0.04 -0.68 0.46 -0.60 -2.94 0.00 0.00 177.10 173.30 1l2w s ARG 92 N -4.00 0.80 0.04 3.55 3.52 -1.26 -1.66 118.95 119.93 1l2w s ARG 92 Ca 0.27 0.04 -0.21 0.00 -0.13 0.00 0.00 55.73 55.70 1l2w s ARG 92 Cb 0.07 0.37 0.05 0.00 -1.56 0.00 0.00 34.95 33.87 1l2w s ARG 92 CO 0.05 -0.23 0.48 1.14 -0.81 0.00 0.00 175.30 175.93 1l2w s GLN 93 N -1.15 0.98 0.42 5.12 -2.07 -0.82 -4.77 119.66 117.36 1l2w s GLN 93 Ca -0.12 -0.25 -0.26 0.00 -1.82 0.00 0.00 55.36 52.91 1l2w s GLN 93 Cb -0.03 0.44 -0.10 0.00 -1.09 0.00 0.00 33.01 32.24 1l2w s GLN 93 CO 0.06 -0.34 1.45 -2.30 -1.32 0.00 0.00 175.29 172.83 1l2w n PRO 94 N 0.51 2.40 0.14 9.60 -0.02 -1.26 -0.46 135.00 145.91 1l2w n PRO 94 Ca -0.19 0.85 0.01 0.00 -2.02 0.00 0.00 63.50 62.16 1l2w n PRO 94 Cb 0.60 -2.63 0.11 0.00 -0.02 0.00 0.00 33.50 31.56 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 2.54 0.00 -0.43 2.45 5.85 -1.34 -3.00 115.31 121.37 1l2w h LEU 95 Ca -0.51 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1l2w h LEU 95 Cb 1.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1l2w h LEU 95 CO 0.62 0.57 -0.10 -0.46 -0.34 0.00 0.00 178.44 178.73 1l2w n ASN 96 N -3.39 0.78 -3.23 1.25 6.94 -1.26 -4.25 115.26 112.10 1l2w n ASN 96 Ca 0.01 -0.91 -0.24 0.00 -0.02 0.00 0.00 54.58 53.41 1l2w n ASN 96 Cb 0.69 -0.00 -0.07 0.00 -2.36 0.00 0.00 39.78 38.04 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 -0.63 0.51 -4.70 0.53 2.88 -1.13 -5.11 113.62 105.96 1l2w n SER 97 Ca 0.16 -2.75 -0.40 0.00 -1.33 0.00 0.00 58.87 54.55 1l2w n SER 97 Cb 0.29 -0.64 -0.05 0.00 -0.75 0.00 0.00 64.21 63.06 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 -1.24 4.26 0.02 2.46 1.43 -1.24 -4.31 118.68 120.06 1l2w s LEU 98 Ca 0.35 1.08 -0.34 0.00 -1.03 0.00 0.00 54.13 54.20 1l2w s LEU 98 Cb 0.16 -3.03 -0.13 0.00 0.03 0.00 0.00 46.19 43.22 1l2w s LEU 98 CO -0.11 -0.18 1.76 -0.67 0.23 0.00 0.00 176.35 177.38 1l2w n ASP 99 N 4.25 3.31 -2.72 2.29 -0.08 -1.25 -0.18 116.55 122.17 1l2w n ASP 99 Ca -0.01 1.02 -0.20 0.00 -1.51 0.00 0.00 54.79 54.09 1l2w n ASP 99 Cb 0.51 -1.40 0.01 0.00 2.34 0.00 0.00 41.12 42.57 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 5.31 -5.27 -4.13 1.67 3.02 -1.26 -2.06 115.26 112.54 1l2w n ASN 100 Ca 0.20 -0.10 -0.32 0.00 -0.03 0.00 0.00 54.58 54.34 1l2w n ASN 100 Cb 0.29 -4.36 -0.05 0.00 -0.61 0.00 0.00 39.78 35.06 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 -2.16 -0.52 -3.62 6.41 3.02 0.75 -4.90 115.26 114.25 1l2w n ASN 101 Ca -0.16 -1.18 0.00 0.00 -0.03 0.00 0.00 54.58 53.21 1l2w n ASN 101 Cb 0.63 -2.16 -0.01 0.00 -0.61 0.00 0.00 39.78 37.63 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 -4.21 -0.08 0.00 6.41 0.15 -0.88 -5.02 113.70 110.07 1l2w s SER 102 Ca 0.10 -0.11 0.21 0.00 0.70 0.00 0.00 55.95 56.86 1l2w s SER 102 Cb -0.05 0.16 -0.15 0.00 -1.71 0.00 0.00 66.02 64.27 1l2w s SER 102 CO 0.95 -0.29 0.96 0.18 1.20 0.00 0.00 173.24 176.24 1l2w n LEU 103 N -0.39 1.03 -0.19 3.45 4.77 -1.26 -3.95 117.00 120.45 1l2w n LEU 103 Ca -0.06 -0.48 -0.00 0.00 -0.03 0.00 0.00 56.01 55.44 1l2w n LEU 103 Cb 0.62 -0.02 0.08 0.00 -2.33 0.00 0.00 43.42 41.77 1l2w n LEU 103 CO 0.11 0.25 0.82 0.22 -1.33 0.00 0.00 177.39 177.46 1l2w h TYR 104 N 0.17 -0.09 -0.20 -1.77 5.03 -1.94 -1.41 116.97 116.76 1l2w h TYR 104 Ca 0.00 0.05 -0.10 0.00 2.58 0.00 0.00 58.73 61.25 1l2w h TYR 104 Cb 0.52 0.13 -0.01 0.00 1.55 0.00 0.00 36.73 38.92 1l2w h TYR 104 CO 0.00 -0.18 -0.32 1.15 -1.32 0.00 0.00 178.16 177.49 1l2w h THR 105 N 0.09 1.28 -0.35 1.81 2.02 -1.85 -1.59 112.91 114.32 1l2w h THR 105 Ca 0.30 -1.37 -0.05 0.00 0.77 0.00 0.00 66.41 66.06 1l2w h THR 105 Cb 0.48 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 1l2w h THR 105 CO -0.53 0.43 0.03 -0.61 0.37 0.00 0.00 175.52 175.21 1l2w h GLN 106 N 0.35 0.60 -0.54 6.66 4.15 -1.57 -0.75 115.11 124.00 1l2w h GLN 106 Ca 0.04 -0.17 -0.06 0.00 0.77 0.00 0.00 58.65 59.23 1l2w h GLN 106 Cb 0.74 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.34 1l2w h GLN 106 CO 0.06 0.69 0.09 1.25 -1.93 0.00 0.00 178.83 178.99 1l2w h LEU 107 N 0.42 0.85 -0.94 -2.39 5.85 -1.24 -1.56 115.31 116.30 1l2w h LEU 107 Ca 0.10 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.51 1l2w h LEU 107 Cb 0.40 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 1l2w h LEU 107 CO 0.01 0.89 0.16 -0.08 -0.34 0.00 0.00 178.44 179.08 1l2w h GLU 108 N 0.78 0.93 -0.05 1.25 4.81 -1.15 -1.32 114.58 119.84 1l2w h GLU 108 Ca 0.16 -0.19 -0.09 0.00 -0.13 0.00 0.00 59.36 59.11 1l2w h GLU 108 Cb 0.40 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1l2w h GLU 108 CO 0.01 0.82 -0.41 0.52 -0.73 0.00 0.00 179.01 179.22 1l2w h MET 109 N 0.90 0.10 -0.03 1.92 2.86 -0.85 -1.73 114.93 118.10 1l2w h MET 109 Ca 0.20 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.78 1l2w h MET 109 Cb 0.30 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.96 1l2w h MET 109 CO -0.00 0.49 -0.03 1.25 1.06 0.00 0.00 176.91 179.68 1l2w h LEU 110 N 0.08 0.08 -1.13 1.22 5.85 -0.52 -1.87 115.31 119.03 1l2w h LEU 110 Ca 0.01 -0.50 -0.04 0.00 0.84 0.00 0.00 57.88 58.19 1l2w h LEU 110 Cb 0.76 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 1l2w h LEU 110 CO 0.06 0.56 0.14 -0.37 -0.34 0.00 0.00 178.44 178.49 1l2w h VAL 111 N -0.40 1.21 -0.35 1.05 -1.51 -1.23 -0.92 116.25 114.09 1l2w h VAL 111 Ca 0.00 -0.73 -0.09 0.00 -1.23 0.00 0.00 66.70 64.66 1l2w h VAL 111 Cb 0.54 0.67 -0.02 0.00 -2.13 0.00 0.00 31.29 30.35 1l2w h VAL 111 CO 0.01 0.27 -0.14 1.56 -1.23 0.00 0.00 177.57 178.04 1l2w h GLN 112 N 0.74 0.63 -0.38 5.19 4.20 -1.30 0.09 115.11 124.28 1l2w h GLN 112 Ca 0.17 -0.20 -0.09 0.00 0.06 0.00 0.00 58.65 58.59 1l2w h GLN 112 Cb 0.24 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 1l2w h GLN 112 CO -0.01 0.75 -0.12 0.78 -0.67 0.00 0.00 178.83 179.56 1l2w h GLY 113 N 0.97 0.73 0.93 3.46 0.00 -0.46 -2.02 103.07 106.69 1l2w h GLY 113 Ca 0.10 -0.54 -0.11 0.00 0.00 0.00 0.00 47.33 46.78 1l2w h GLY 113 CO 0.04 0.50 -0.24 0.00 0.00 0.00 0.00 176.54 176.83 1l2w h ALA 114 N 1.25 0.39 -0.99 3.60 0.00 -0.58 -2.83 119.26 120.11 1l2w h ALA 114 Ca 0.11 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.68 1l2w h ALA 114 Cb 0.57 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 1l2w h ALA 114 CO 0.04 0.37 0.65 0.93 0.00 0.00 0.00 179.25 181.23 1l2w h GLU 115 N 0.37 1.21 -0.44 0.00 5.08 -0.85 -0.91 114.58 119.04 1l2w h GLU 115 Ca 0.05 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1l2w h GLU 115 Cb 0.80 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 1l2w h GLU 115 CO 0.06 0.80 0.22 -0.09 -1.00 0.00 0.00 179.01 179.00 1l2w h ARG 116 N 1.24 0.63 -0.25 2.33 2.43 -1.26 -2.79 114.38 116.72 1l2w h ARG 116 Ca 0.39 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 59.40 1l2w h ARG 116 Cb 0.01 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1l2w h ARG 116 CO -0.12 0.53 -0.19 -0.07 -1.51 0.00 0.00 179.97 178.61 1l2w h LEU 117 N 0.57 0.44 -1.75 3.80 3.38 -1.18 -2.57 115.31 117.99 1l2w h LEU 117 Ca 0.15 -0.13 0.05 0.00 0.09 0.00 0.00 57.88 58.04 1l2w h LEU 117 Cb 0.11 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1l2w h LEU 117 CO -0.02 0.64 0.25 1.56 0.09 0.00 0.00 178.44 180.97 1l2w h GLN 118 N 0.41 0.31 -6.83 1.13 4.20 -0.90 -3.38 115.11 110.04 1l2w h GLN 118 Ca 0.07 -0.02 -0.56 0.00 0.06 0.00 0.00 58.65 58.20 1l2w h GLN 118 Cb 0.56 -0.07 0.12 0.00 0.30 0.00 0.00 27.48 28.40 1l2w h GLN 118 CO 0.04 0.20 0.48 2.41 -0.67 0.00 0.00 178.83 181.29 1l2w n THR 119 N -4.48 2.59 -2.36 -0.54 -1.04 -0.97 -4.90 114.28 102.57 1l2w n THR 119 Ca 0.04 -0.50 -0.25 0.00 -2.04 0.00 0.00 64.05 61.30 1l2w n THR 119 Cb 0.21 -1.55 0.01 0.00 -1.82 0.00 0.00 70.33 67.18 1l2w n THR 119 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1l2w n SER 120 N 0.18 4.65 0.00 8.00 3.41 -1.26 -4.74 113.62 123.86 1l2w n SER 120 Ca 0.07 -3.68 0.00 0.00 -0.26 0.00 0.00 58.87 55.00 1l2w n SER 120 Cb 0.40 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 1l2w n SER 120 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34