#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2lhb s ILE 2 N 0.00 5.20 0.23 0.52 1.01 -1.26 -4.91 121.20 121.99 2lhb s ILE 2 Ca 0.00 0.76 0.10 0.00 0.00 0.00 0.00 60.65 61.51 2lhb s ILE 2 Cb 0.00 -3.71 -0.05 0.00 0.01 0.00 0.00 42.46 38.71 2lhb s ILE 2 CO 0.00 0.41 -0.19 0.68 0.00 0.00 0.00 174.94 175.84 2lhb s VAL 3 N 0.14 2.19 -0.10 2.92 -7.23 -1.26 -5.01 120.40 112.05 2lhb s VAL 3 Ca 0.22 -2.20 0.15 0.00 -1.81 0.00 0.00 61.98 58.33 2lhb s VAL 3 Cb -0.15 -2.13 0.23 0.00 0.56 0.00 0.00 36.38 34.89 2lhb s VAL 3 CO 0.08 -0.36 1.11 -0.90 -0.31 0.00 0.00 175.10 174.72 2lhb n ASP 4 N -0.22 2.02 -4.01 4.85 5.68 -1.26 -4.51 116.55 119.10 2lhb n ASP 4 Ca -0.09 -2.84 -0.09 0.00 -0.50 0.00 0.00 54.79 51.27 2lhb n ASP 4 Cb 0.59 -0.36 -0.08 0.00 -1.14 0.00 0.00 41.12 40.13 2lhb n ASP 4 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 2lhb s THR 5 N -2.35 0.09 0.00 2.12 -4.23 -1.26 -4.33 115.64 105.68 2lhb s THR 5 Ca 0.25 -1.54 0.00 0.00 -1.18 0.00 0.00 61.69 59.23 2lhb s THR 5 Cb 0.22 -1.83 0.00 0.00 1.34 0.00 0.00 72.50 72.23 2lhb s THR 5 CO 0.02 -0.41 0.00 0.61 -0.54 0.00 0.00 174.62 174.30 2lhb n GLY 6 N -0.15 -0.79 3.15 3.99 0.00 -1.26 -4.92 105.19 105.21 2lhb n GLY 6 Ca -0.08 -1.42 -0.15 0.00 0.00 0.00 0.00 46.02 44.37 2lhb n GLY 6 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2lhb s SER 7 N -4.00 1.36 -0.04 1.61 1.04 -1.26 -5.05 113.70 107.36 2lhb s SER 7 Ca 0.00 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 55.74 2lhb s SER 7 Cb 0.00 -0.00 -0.03 0.00 0.10 0.00 0.00 66.02 66.09 2lhb s SER 7 CO 0.00 -0.20 -0.01 -0.69 0.98 0.00 0.00 173.24 173.32 2lhb s VAL 8 N -1.85 4.11 0.41 5.02 1.01 -1.26 -5.10 120.40 122.74 2lhb s VAL 8 Ca -0.01 -0.48 -0.23 0.00 0.00 0.00 0.00 61.98 61.27 2lhb s VAL 8 Cb -0.07 -2.78 -0.10 0.00 0.00 0.00 0.00 36.38 33.44 2lhb s VAL 8 CO 0.01 0.48 0.97 0.00 0.00 0.00 0.00 175.10 176.56 2lhb s ALA 9 N -0.98 3.07 0.74 5.51 0.00 -1.26 -5.01 121.76 123.83 2lhb s ALA 9 Ca 0.16 0.50 -0.15 0.00 0.00 0.00 0.00 51.96 52.47 2lhb s ALA 9 Cb -0.11 -3.19 0.03 0.00 0.00 0.00 0.00 23.12 19.85 2lhb s ALA 9 CO 0.06 0.04 1.10 -0.35 0.00 0.00 0.00 175.76 176.61 2lhb n PRO 10 N -0.29 0.51 -2.88 0.00 -0.04 -1.26 -4.97 135.00 126.07 2lhb n PRO 10 Ca 0.06 0.24 -0.37 0.00 -0.04 0.00 0.00 63.50 63.39 2lhb n PRO 10 Cb 0.52 -2.35 -0.06 0.00 -0.04 0.00 0.00 33.50 31.57 2lhb n PRO 10 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2lhb s LEU 11 N -4.19 4.35 0.29 1.53 2.01 -1.26 -5.06 118.68 116.36 2lhb s LEU 11 Ca 0.75 1.71 -0.01 0.00 0.01 0.00 0.00 54.13 56.59 2lhb s LEU 11 Cb -0.33 -3.86 -0.04 0.00 0.01 0.00 0.00 46.19 41.97 2lhb s LEU 11 CO 0.49 -0.03 0.51 -0.94 1.01 0.00 0.00 176.35 177.39 2lhb s SER 12 N -1.60 6.36 0.49 2.29 1.04 -1.26 -4.95 113.70 116.07 2lhb s SER 12 Ca 0.47 0.50 0.16 0.00 0.48 0.00 0.00 55.95 57.56 2lhb s SER 12 Cb -0.18 -2.05 1.20 0.00 0.10 0.00 0.00 66.02 65.09 2lhb s SER 12 CO 0.23 -0.20 2.08 0.00 0.98 0.00 0.00 173.24 176.33 2lhb h ALA 13 N 1.33 2.06 -0.57 5.32 0.00 -1.99 -0.64 119.26 124.76 2lhb h ALA 13 Ca -0.49 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.34 2lhb h ALA 13 Cb 1.20 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2lhb h ALA 13 CO 0.64 -0.11 0.09 0.00 0.00 0.00 0.00 179.25 179.87 2lhb h ALA 14 N 1.87 0.76 -0.06 0.00 0.00 -1.99 -1.37 119.26 118.46 2lhb h ALA 14 Ca 0.11 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2lhb h ALA 14 Cb 0.27 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2lhb h ALA 14 CO -0.02 0.51 0.02 0.93 0.00 0.00 0.00 179.25 180.70 2lhb h GLU 15 N 0.85 0.09 -0.23 0.00 5.08 -1.53 -1.17 114.58 117.66 2lhb h GLU 15 Ca 0.17 -0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.57 2lhb h GLU 15 Cb 0.42 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.60 2lhb h GLU 15 CO 0.01 0.23 -0.13 0.87 -1.00 0.00 0.00 179.01 178.99 2lhb h LYS 16 N -0.07 -0.11 -0.28 2.33 1.57 -1.33 0.46 116.57 119.14 2lhb h LYS 16 Ca 0.02 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.87 2lhb h LYS 16 Cb 0.18 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.45 2lhb h LYS 16 CO -0.00 -0.07 -0.11 1.15 -0.57 0.00 0.00 179.45 179.85 2lhb h THR 17 N -0.11 0.64 -0.15 -0.16 2.02 -1.08 -1.37 112.91 112.69 2lhb h THR 17 Ca 0.13 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.16 2lhb h THR 17 Cb 0.31 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 2lhb h THR 17 CO -0.31 0.00 -0.55 0.07 0.37 0.00 0.00 175.52 175.10 2lhb h LYS 18 N -0.05 0.46 -0.42 6.66 2.10 -0.32 -2.64 116.57 122.35 2lhb h LYS 18 Ca 0.14 -0.29 0.04 0.00 -2.00 0.00 0.00 60.65 58.55 2lhb h LYS 18 Cb 0.27 0.03 -0.04 0.00 -0.90 0.00 0.00 32.23 31.59 2lhb h LYS 18 CO -0.32 0.89 0.18 0.82 -2.00 0.00 0.00 179.45 179.02 2lhb h ILE 19 N 0.35 0.92 -0.80 0.07 2.04 0.27 -1.57 117.51 118.79 2lhb h ILE 19 Ca 0.01 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 2lhb h ILE 19 Cb 1.08 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 2lhb h ILE 19 CO 0.10 0.07 0.40 0.03 0.00 0.00 0.00 178.15 178.74 2lhb h ARG 20 N 0.36 1.13 0.01 2.37 3.08 -1.13 -0.56 114.38 119.64 2lhb h ARG 20 Ca 0.19 -0.15 -0.23 0.00 0.07 0.00 0.00 59.98 59.86 2lhb h ARG 20 Cb 0.14 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2lhb h ARG 20 CO -0.17 0.86 -0.95 0.66 -1.07 0.00 0.00 179.97 179.30 2lhb h SER 21 N 1.13 0.50 0.62 7.04 4.64 -1.23 -2.94 113.55 123.31 2lhb h SER 21 Ca 0.28 -0.41 -0.18 0.00 -0.47 0.00 0.00 61.79 61.01 2lhb h SER 21 Cb 0.09 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.01 2lhb h SER 21 CO -0.04 1.21 -0.79 0.00 -0.87 0.00 0.00 176.83 176.34 2lhb h ALA 22 N 0.75 0.66 -0.14 5.18 0.00 -1.11 -3.31 119.26 121.28 2lhb h ALA 22 Ca -0.08 -0.68 -0.22 0.00 0.00 0.00 0.00 54.91 53.93 2lhb h ALA 22 Cb 1.59 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.30 2lhb h ALA 22 CO 0.16 0.90 -0.76 2.35 0.00 0.00 0.00 179.25 181.91 2lhb h TRP 23 N 0.08 1.04 -0.57 0.00 2.91 -1.15 -3.38 115.95 114.88 2lhb h TRP 23 Ca -0.02 -0.46 0.05 0.00 1.13 0.00 0.00 58.89 59.58 2lhb h TRP 23 Cb 1.38 -0.16 -0.07 0.00 -0.51 0.00 0.00 29.16 29.81 2lhb h TRP 23 CO 0.02 1.29 -0.33 0.00 -1.03 0.00 0.00 178.44 178.38 2lhb n ALA 24 N -2.60 -0.36 0.05 2.65 0.00 -1.11 -1.01 120.51 118.12 2lhb n ALA 24 Ca -0.08 0.48 0.04 0.00 0.00 0.00 0.00 53.44 53.89 2lhb n ALA 24 Cb 0.74 0.10 0.45 0.00 0.00 0.00 0.00 19.45 20.74 2lhb n ALA 24 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2lhb h PRO 25 N 0.00 0.43 -0.26 0.00 0.13 -1.76 -1.37 132.00 129.17 2lhb h PRO 25 Ca 0.09 -0.04 -0.07 0.00 -0.87 0.00 0.00 66.00 65.12 2lhb h PRO 25 Cb 0.23 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.26 2lhb h PRO 25 CO -0.53 0.32 -0.10 0.28 -0.23 0.00 0.00 178.00 177.73 2lhb h VAL 26 N 0.43 1.29 -0.44 1.56 2.07 -1.25 -1.83 116.25 118.09 2lhb h VAL 26 Ca 0.11 -1.16 -0.03 0.00 0.82 0.00 0.00 66.70 66.45 2lhb h VAL 26 Cb 0.01 1.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 2lhb h VAL 26 CO -0.02 0.36 0.16 0.22 0.02 0.00 0.00 177.57 178.31 2lhb h TYR 27 N 0.26 0.69 0.00 1.57 3.20 -0.85 -2.78 116.97 119.06 2lhb h TYR 27 Ca 0.06 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 2lhb h TYR 27 Cb 0.59 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.65 2lhb h TYR 27 CO 0.06 0.62 -0.13 0.66 -1.64 0.00 0.00 178.16 177.72 2lhb h SER 28 N 0.57 0.00 -0.01 -2.11 4.64 -1.24 -2.77 113.55 112.64 2lhb h SER 28 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2lhb h SER 28 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2lhb h SER 28 CO -0.01 0.13 -0.08 0.35 -0.87 0.00 0.00 176.83 176.35 2lhb n THR 29 N -3.30 0.00 0.00 2.95 -2.24 -0.90 -3.54 114.28 107.24 2lhb n THR 29 Ca 0.00 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 2lhb n THR 29 Cb 0.37 1.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.71 2lhb n THR 29 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2lhb n ASP 29 N 0.02 0.00 -0.37 3.42 9.92 -0.74 -0.35 116.55 128.45 2lhb n ASP 29 Ca 0.04 0.00 0.02 0.00 -0.53 0.00 0.00 54.79 54.32 2lhb n ASP 29 Cb 0.17 0.00 0.17 0.00 -0.64 0.00 0.00 41.12 40.82 2lhb n ASP 29 CO 0.00 0.00 0.00 0.10 0.13 0.00 0.00 177.20 177.43 2lhb h TYR 30 N 0.00 1.19 -0.06 1.24 -0.00 -1.22 0.16 116.97 118.28 2lhb h TYR 30 Ca 0.00 0.03 0.02 0.00 -0.00 0.00 0.00 58.73 58.78 2lhb h TYR 30 Cb 0.00 -0.39 -0.00 0.00 -0.00 0.00 0.00 36.73 36.34 2lhb h TYR 30 CO 0.00 0.62 0.06 0.93 -0.00 0.00 0.00 178.16 179.78 2lhb h GLU 31 N 1.17 0.00 0.00 0.10 5.08 -1.81 0.43 114.58 119.56 2lhb h GLU 31 Ca 0.43 0.00 -0.42 0.00 -1.00 0.00 0.00 59.36 58.37 2lhb h GLU 31 Cb 0.15 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.34 2lhb h GLU 31 CO -0.17 0.00 -2.33 2.41 -1.00 0.00 0.00 179.01 177.93 2lhb n THR 32 N -3.94 1.53 -0.19 1.13 -1.04 -0.50 -4.27 114.28 107.00 2lhb n THR 32 Ca -0.02 -0.32 -0.07 0.00 -2.04 0.00 0.00 64.05 61.60 2lhb n THR 32 Cb 0.16 -1.92 0.07 0.00 -1.82 0.00 0.00 70.33 66.82 2lhb n THR 32 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2lhb h SER 33 N -1.00 0.98 -0.51 8.00 4.64 0.21 -2.46 113.55 123.41 2lhb h SER 33 Ca -0.63 -0.25 0.04 0.00 -0.47 0.00 0.00 61.79 60.47 2lhb h SER 33 Cb 1.55 -0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 63.34 2lhb h SER 33 CO -0.38 1.01 0.28 1.23 -0.87 0.00 0.00 176.83 178.10 2lhb h GLY 34 N 1.01 0.72 0.83 -0.77 0.00 -1.11 -0.80 103.07 102.96 2lhb h GLY 34 Ca 0.18 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 2lhb h GLY 34 CO 0.02 0.15 0.03 -2.08 0.00 0.00 0.00 176.54 174.66 2lhb h VAL 35 N 0.55 1.21 -0.66 4.60 2.07 -1.70 -2.92 116.25 119.41 2lhb h VAL 35 Ca 0.22 -0.69 0.10 0.00 0.82 0.00 0.00 66.70 67.15 2lhb h VAL 35 Cb 0.08 1.34 -0.08 0.00 -1.52 0.00 0.00 31.29 31.11 2lhb h VAL 35 CO -0.13 0.21 0.27 -0.78 0.02 0.00 0.00 177.57 177.16 2lhb h ASP 36 N 0.09 0.28 -0.47 0.57 3.58 -1.10 -0.94 116.42 118.43 2lhb h ASP 36 Ca 0.05 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.59 2lhb h ASP 36 Cb 0.29 0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.37 2lhb h ASP 36 CO 0.00 0.15 0.29 0.40 -2.88 0.00 0.00 179.24 177.21 2lhb h ILE 37 N 0.45 1.14 -0.62 2.25 2.04 -1.02 -0.99 117.51 120.76 2lhb h ILE 37 Ca 0.34 -0.29 -0.07 0.00 1.00 0.00 0.00 64.86 65.84 2lhb h ILE 37 Cb 0.43 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 2lhb h ILE 37 CO -0.32 0.14 0.11 0.25 0.00 0.00 0.00 178.15 178.33 2lhb h LEU 38 N 0.63 0.96 0.17 1.44 5.85 -1.17 0.05 115.31 123.24 2lhb h LEU 38 Ca 0.17 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 2lhb h LEU 38 Cb -0.03 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 40.75 2lhb h LEU 38 CO -0.03 0.97 -0.08 0.58 -0.34 0.00 0.00 178.44 179.54 2lhb h VAL 39 N 0.92 0.88 -0.56 1.05 2.07 -1.07 -0.72 116.25 118.82 2lhb h VAL 39 Ca 0.19 -0.20 0.04 0.00 0.82 0.00 0.00 66.70 67.55 2lhb h VAL 39 Cb 0.41 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 2lhb h VAL 39 CO 0.01 0.05 0.32 0.11 0.02 0.00 0.00 177.57 178.07 2lhb h LYS 40 N -0.32 0.59 0.74 1.57 1.57 -1.08 -0.08 116.57 119.56 2lhb h LYS 40 Ca -0.02 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 2lhb h LYS 40 Cb 0.25 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 2lhb h LYS 40 CO 0.04 0.39 -0.46 0.35 -0.57 0.00 0.00 179.45 179.20 2lhb h PHE 41 N 0.61 -1.23 0.00 -1.35 3.57 -0.67 -2.77 116.94 115.10 2lhb h PHE 41 Ca 0.24 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.66 2lhb h PHE 41 Cb 0.10 0.44 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 2lhb h PHE 41 CO -0.08 -0.69 -0.31 0.74 -2.23 0.00 0.00 178.31 175.74 2lhb h PHE 42 N -1.13 0.00 0.08 0.41 0.04 -1.05 0.22 116.94 115.51 2lhb h PHE 42 Ca -0.10 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.42 2lhb h PHE 42 Cb 0.91 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.06 2lhb h PHE 42 CO -0.11 0.31 -1.14 1.79 -0.60 0.00 0.00 178.31 178.56 2lhb h THR 43 N 0.00 1.53 0.00 -1.55 1.35 -0.97 -3.07 112.91 110.21 2lhb h THR 43 Ca -0.00 -3.04 -0.04 0.00 -0.55 0.00 0.00 66.41 62.77 2lhb h THR 43 Cb 0.59 2.85 -0.01 0.00 -1.73 0.00 0.00 68.15 69.85 2lhb h THR 43 CO 0.04 0.89 -0.63 0.77 -0.25 0.00 0.00 175.52 176.33 2lhb h SER 44 N 0.08 0.00 -2.15 5.36 4.64 -1.34 -3.38 113.55 116.75 2lhb h SER 44 Ca -0.10 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.64 2lhb h SER 44 Cb 1.86 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 63.55 2lhb h SER 44 CO 0.18 0.16 -0.85 0.41 -0.87 0.00 0.00 176.83 175.86 2lhb n THR 45 N -2.94 0.73 0.25 2.95 -1.04 0.75 -4.95 114.28 110.03 2lhb n THR 45 Ca 0.00 -4.56 0.09 0.00 -2.04 0.00 0.00 64.05 57.55 2lhb n THR 45 Cb 0.61 -2.02 0.65 0.00 -1.82 0.00 0.00 70.33 67.75 2lhb n THR 45 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2lhb h PRO 46 N 4.22 0.00 -0.76 -2.82 0.13 -1.73 -2.03 132.00 129.00 2lhb h PRO 46 Ca 0.14 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.32 2lhb h PRO 46 Cb 0.78 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.86 2lhb h PRO 46 CO 0.63 0.11 0.50 0.00 -0.23 0.00 0.00 178.00 179.02 2lhb h ALA 47 N 1.89 1.62 -0.10 -0.56 0.00 -1.92 -2.81 119.26 117.39 2lhb h ALA 47 Ca -0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2lhb h ALA 47 Cb 0.23 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2lhb h ALA 47 CO 0.01 0.27 -0.13 0.00 0.00 0.00 0.00 179.25 179.41 2lhb h ALA 48 N 1.58 1.61 0.00 0.00 0.00 -1.74 -2.90 119.26 117.81 2lhb h ALA 48 Ca 0.32 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 2lhb h ALA 48 Cb 0.18 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2lhb h ALA 48 CO -0.10 0.29 -0.13 0.37 0.00 0.00 0.00 179.25 179.67 2lhb h GLN 49 N 0.14 0.00 0.00 0.00 4.15 -1.61 -2.72 115.11 115.07 2lhb h GLN 49 Ca 0.03 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.45 2lhb h GLN 49 Cb 0.32 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.01 2lhb h GLN 49 CO 0.02 0.13 0.00 0.93 -1.93 0.00 0.00 178.83 177.98 2lhb h GLU 50 N 0.00 0.00 -0.00 1.69 4.39 -1.66 -2.30 114.58 116.69 2lhb h GLU 50 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2lhb h GLU 50 Cb 0.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2lhb h GLU 50 CO 0.02 0.00 -0.02 1.19 -1.16 0.00 0.00 179.01 179.04 2lhb n PHE 51 N -3.03 0.00 -3.89 4.33 3.01 -1.03 -4.58 117.46 112.27 2lhb n PHE 51 Ca -0.02 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.11 2lhb n PHE 51 Cb 0.15 -0.07 -0.13 0.00 -0.01 0.00 0.00 39.48 39.42 2lhb n PHE 51 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 2lhb s PHE 52 N -2.16 3.52 0.23 1.38 0.40 -0.87 -4.99 117.98 115.48 2lhb s PHE 52 Ca 0.40 -2.86 -0.06 0.00 -0.60 0.00 0.00 56.93 53.81 2lhb s PHE 52 Cb 0.21 -3.02 0.21 0.00 0.51 0.00 0.00 43.02 40.93 2lhb s PHE 52 CO 0.40 -0.88 1.79 -1.00 0.70 0.00 0.00 175.22 176.23 2lhb h PRO 53 N 7.33 1.14 0.00 0.24 0.13 -1.82 -2.85 132.00 136.17 2lhb h PRO 53 Ca -0.07 -0.21 -0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2lhb h PRO 53 Cb 0.98 -0.19 -0.00 0.00 0.13 0.00 0.00 31.00 31.93 2lhb h PRO 53 CO 0.64 0.93 -0.01 0.87 -0.23 0.00 0.00 178.00 180.19 2lhb h LYS 54 N 1.11 0.00 -0.50 0.86 1.57 -1.94 -2.56 116.57 115.11 2lhb h LYS 54 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2lhb h LYS 54 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2lhb h LYS 54 CO -0.02 0.01 0.00 1.19 -0.57 0.00 0.00 179.45 180.06 2lhb n PHE 55 N -3.18 1.36 -2.31 -1.35 3.72 -1.07 -4.97 117.46 109.66 2lhb n PHE 55 Ca -0.02 -0.69 -0.41 0.00 -0.05 0.00 0.00 57.45 56.28 2lhb n PHE 55 Cb 0.17 -0.29 -0.03 0.00 -0.94 0.00 0.00 39.48 38.38 2lhb n PHE 55 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2lhb s LYS 56 N -2.19 4.49 0.00 -1.08 1.02 -0.97 -2.52 119.74 118.49 2lhb s LYS 56 Ca 0.46 1.98 0.00 0.00 0.02 0.00 0.00 55.97 58.43 2lhb s LYS 56 Cb 0.33 -3.17 0.00 0.00 -0.52 0.00 0.00 37.83 34.47 2lhb s LYS 56 CO 0.18 -0.04 0.00 0.41 -0.92 0.00 0.00 175.35 174.98 2lhb n GLY 57 N 1.50 0.88 3.35 -3.33 0.00 -1.26 -5.00 105.19 101.32 2lhb n GLY 57 Ca 0.02 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.58 2lhb n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2lhb s LEU 58 N 0.00 5.90 -0.01 0.99 1.43 -1.05 -4.88 118.68 121.06 2lhb s LEU 58 Ca 0.00 -1.56 0.21 0.00 -1.03 0.00 0.00 54.13 51.75 2lhb s LEU 58 Cb 0.00 -2.21 -0.27 0.00 0.03 0.00 0.00 46.19 43.75 2lhb s LEU 58 CO 0.00 -0.78 0.75 0.35 0.23 0.00 0.00 176.35 176.90 2lhb n THR 59 N 5.25 0.00 -4.33 5.49 -2.24 -1.26 -4.92 114.28 112.27 2lhb n THR 59 Ca -0.13 -0.17 -0.21 0.00 -2.27 0.00 0.00 64.05 61.26 2lhb n THR 59 Cb 0.42 0.66 -0.11 0.00 -2.10 0.00 0.00 70.33 69.19 2lhb n THR 59 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2lhb s THR 60 N -3.17 1.80 0.20 4.28 -4.23 -1.26 -5.03 115.64 108.23 2lhb s THR 60 Ca 0.02 -1.93 -0.10 0.00 -1.18 0.00 0.00 61.69 58.51 2lhb s THR 60 Cb 0.15 -1.84 0.13 0.00 1.34 0.00 0.00 72.50 72.28 2lhb s THR 60 CO 0.88 -0.33 1.76 0.00 -0.54 0.00 0.00 174.62 176.38 2lhb h ALA 61 N 3.22 0.76 -0.63 3.99 0.00 -1.95 0.03 119.26 124.69 2lhb h ALA 61 Ca -0.42 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 2lhb h ALA 61 Cb 1.21 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 2lhb h ALA 61 CO 0.52 -0.16 0.26 -0.44 0.00 0.00 0.00 179.25 179.42 2lhb h ASP 62 N 0.44 0.83 -0.35 0.00 3.45 -1.98 0.21 116.42 119.02 2lhb h ASP 62 Ca 0.29 -0.11 -0.13 0.00 0.43 0.00 0.00 57.03 57.51 2lhb h ASP 62 Cb 0.32 -0.21 -0.01 0.00 -0.56 0.00 0.00 39.33 38.87 2lhb h ASP 62 CO -0.27 0.74 -0.29 -0.33 -1.57 0.00 0.00 179.24 177.52 2lhb h GLU 63 N 0.90 0.81 0.02 3.56 5.08 -1.66 -2.81 114.58 120.47 2lhb h GLU 63 Ca 0.21 -0.41 -0.00 0.00 -1.00 0.00 0.00 59.36 58.17 2lhb h GLU 63 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2lhb h GLU 63 CO -0.02 1.04 -0.01 -0.07 -1.00 0.00 0.00 179.01 178.95 2lhb h LEU 64 N 0.60 -0.02 -1.45 1.33 3.38 -0.68 -1.55 115.31 116.92 2lhb h LEU 64 Ca 0.06 -0.18 0.19 0.00 0.09 0.00 0.00 57.88 58.04 2lhb h LEU 64 Cb 0.86 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.55 2lhb h LEU 64 CO 0.07 0.17 0.59 0.50 0.09 0.00 0.00 178.44 179.87 2lhb h LYS 65 N -0.21 0.46 -0.15 1.13 3.64 -0.57 -2.55 116.57 118.32 2lhb h LYS 65 Ca -0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2lhb h LYS 65 Cb 0.20 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2lhb h LYS 65 CO 0.00 0.30 0.00 1.63 -2.27 0.00 0.00 179.45 179.12 2lhb n LYS 66 N -4.53 2.01 -2.84 1.90 5.02 -1.07 -4.95 118.16 113.70 2lhb n LYS 66 Ca 0.19 -1.87 -0.41 0.00 -2.02 0.00 0.00 58.31 54.20 2lhb n LYS 66 Cb 0.65 -1.41 -0.04 0.00 -0.02 0.00 0.00 35.03 34.21 2lhb n LYS 66 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2lhb s SER 67 N -1.55 7.21 0.45 4.39 0.15 -0.60 -4.92 113.70 118.83 2lhb s SER 67 Ca 0.27 1.47 0.22 0.00 0.70 0.00 0.00 55.95 58.61 2lhb s SER 67 Cb 0.18 -2.51 1.06 0.00 -1.71 0.00 0.00 66.02 63.04 2lhb s SER 67 CO 0.26 -0.22 1.92 0.00 1.20 0.00 0.00 173.24 176.40 2lhb h ALA 68 N 6.81 1.22 -0.14 5.45 0.00 -1.91 -2.50 119.26 128.20 2lhb h ALA 68 Ca -0.40 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.29 2lhb h ALA 68 Cb 1.21 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2lhb h ALA 68 CO 0.76 0.30 0.09 -0.44 0.00 0.00 0.00 179.25 179.95 2lhb h ASP 69 N 0.00 0.16 -0.26 0.00 5.19 -1.95 -0.48 116.42 119.09 2lhb h ASP 69 Ca -0.00 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.38 2lhb h ASP 69 Cb 0.57 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.02 2lhb h ASP 69 CO 0.03 0.14 0.14 0.58 -3.12 0.00 0.00 179.24 177.01 2lhb h VAL 70 N 0.18 1.13 -0.44 -1.35 2.07 -1.81 -1.79 116.25 114.23 2lhb h VAL 70 Ca 0.05 -0.34 0.03 0.00 0.82 0.00 0.00 66.70 67.26 2lhb h VAL 70 Cb -0.00 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2lhb h VAL 70 CO -0.01 0.12 0.25 -0.09 0.02 0.00 0.00 177.57 177.86 2lhb h ARG 71 N 0.31 0.48 -0.63 1.57 1.12 -0.98 0.43 114.38 116.68 2lhb h ARG 71 Ca 0.09 -0.03 -0.08 0.00 -1.11 0.00 0.00 59.98 58.85 2lhb h ARG 71 Cb 0.07 -0.11 -0.02 0.00 -0.01 0.00 0.00 29.97 29.90 2lhb h ARG 71 CO -0.01 0.32 0.06 -1.49 -3.11 0.00 0.00 179.97 175.73 2lhb h TRP 72 N 0.49 1.13 -0.06 2.20 4.06 -1.01 -2.72 115.95 120.04 2lhb h TRP 72 Ca 0.18 -0.17 -0.01 0.00 2.06 0.00 0.00 58.89 60.96 2lhb h TRP 72 Cb 0.05 -0.31 -0.00 0.00 -1.00 0.00 0.00 29.16 27.90 2lhb h TRP 72 CO -0.08 0.97 0.01 1.25 -3.56 0.00 0.00 178.44 177.03 2lhb h HIS 73 N 0.98 0.11 -0.87 0.49 2.76 -1.11 -3.11 115.15 114.41 2lhb h HIS 73 Ca 0.19 -0.02 0.17 0.00 -2.20 0.00 0.00 60.37 58.51 2lhb h HIS 73 Cb 0.48 -0.03 -0.07 0.00 1.55 0.00 0.00 27.41 29.34 2lhb h HIS 73 CO 0.03 0.33 0.57 0.00 -1.30 0.00 0.00 177.93 177.56 2lhb h ALA 74 N 0.77 2.02 -0.24 5.26 0.00 -0.73 -0.62 119.26 125.70 2lhb h ALA 74 Ca 0.02 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2lhb h ALA 74 Cb 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2lhb h ALA 74 CO 0.00 -0.27 -0.13 1.49 0.00 0.00 0.00 179.25 180.34 2lhb h GLU 75 N 0.53 0.40 -0.08 0.00 4.81 -1.42 -1.72 114.58 117.11 2lhb h GLU 75 Ca 0.44 -0.11 -0.09 0.00 -0.13 0.00 0.00 59.36 59.47 2lhb h GLU 75 Cb 0.91 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.23 2lhb h GLU 75 CO -0.18 0.54 -0.37 0.00 -0.73 0.00 0.00 179.01 178.27 2lhb h ARG 76 N 0.38 0.17 -0.13 1.92 3.08 -1.11 0.29 114.38 118.98 2lhb h ARG 76 Ca 0.07 -0.07 -0.16 0.00 0.07 0.00 0.00 59.98 59.90 2lhb h ARG 76 Cb 0.46 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.51 2lhb h ARG 76 CO 0.03 0.52 -0.52 0.82 -1.07 0.00 0.00 179.97 179.74 2lhb h ILE 77 N 0.14 1.34 -0.51 2.04 2.04 -1.20 -2.44 117.51 118.93 2lhb h ILE 77 Ca 0.02 -1.81 -0.06 0.00 1.00 0.00 0.00 64.86 64.00 2lhb h ILE 77 Cb 0.72 2.09 -0.02 0.00 -0.74 0.00 0.00 36.82 38.88 2lhb h ILE 77 CO 0.05 0.55 0.07 0.40 0.00 0.00 0.00 178.15 179.22 2lhb h ILE 78 N 0.22 1.25 -0.21 -0.67 1.08 -1.20 -2.29 117.51 115.70 2lhb h ILE 78 Ca -0.03 -0.97 -0.03 0.00 -0.39 0.00 0.00 64.86 63.45 2lhb h ILE 78 Cb 1.16 0.89 -0.01 0.00 -3.07 0.00 0.00 36.82 35.79 2lhb h ILE 78 CO 0.11 0.34 -0.00 0.78 -0.69 0.00 0.00 178.15 178.69 2lhb h ASN 79 N 0.73 0.28 -0.10 1.72 -0.26 -0.93 -0.19 115.58 116.83 2lhb h ASN 79 Ca 0.15 -0.04 -0.21 0.00 -0.56 0.00 0.00 56.30 55.64 2lhb h ASN 79 Cb 0.42 -0.07 0.01 0.00 -1.06 0.00 0.00 38.32 37.62 2lhb h ASN 79 CO 0.01 0.34 -0.74 0.00 -1.06 0.00 0.00 177.43 175.98 2lhb h ALA 80 N 1.70 0.38 -0.54 -0.83 0.00 -0.92 -1.78 119.26 117.27 2lhb h ALA 80 Ca 0.07 -0.59 -0.07 0.00 0.00 0.00 0.00 54.91 54.32 2lhb h ALA 80 Cb 0.21 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2lhb h ALA 80 CO 0.00 0.70 0.06 0.28 0.00 0.00 0.00 179.25 180.29 2lhb h VAL 81 N 0.51 1.26 -0.81 0.00 2.07 -1.22 -2.21 116.25 115.84 2lhb h VAL 81 Ca -0.04 -1.01 0.04 0.00 0.82 0.00 0.00 66.70 66.52 2lhb h VAL 81 Cb 1.36 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 31.93 2lhb h VAL 81 CO 0.15 0.36 0.53 -0.78 0.02 0.00 0.00 177.57 177.86 2lhb h ASP 82 N 0.80 0.84 -0.81 0.57 3.58 -0.88 0.14 116.42 120.66 2lhb h ASP 82 Ca 0.16 -0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.58 2lhb h ASP 82 Cb 0.45 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 41.27 2lhb h ASP 82 CO 0.02 0.56 0.39 0.44 -2.88 0.00 0.00 179.24 177.77 2lhb h ASP 83 N 0.96 1.06 -0.13 2.28 3.45 -0.70 -1.97 116.42 121.38 2lhb h ASP 83 Ca 0.33 -0.14 -0.02 0.00 0.43 0.00 0.00 57.03 57.64 2lhb h ASP 83 Cb 0.10 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.60 2lhb h ASP 83 CO -0.11 0.90 0.02 0.00 -1.57 0.00 0.00 179.24 178.48 2lhb h ALA 84 N 1.20 0.17 0.58 3.45 0.00 -1.04 -2.68 119.26 120.94 2lhb h ALA 84 Ca 0.28 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2lhb h ALA 84 Cb 0.12 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2lhb h ALA 84 CO -0.03 -0.16 -0.48 0.28 0.00 0.00 0.00 179.25 178.86 2lhb h VAL 85 N -0.01 0.05 -1.12 0.00 2.07 -0.56 -2.47 116.25 114.22 2lhb h VAL 85 Ca 0.04 0.00 0.32 0.00 0.82 0.00 0.00 66.70 67.88 2lhb h VAL 85 Cb 0.31 0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 30.09 2lhb h VAL 85 CO 0.00 0.00 0.80 0.00 0.02 0.00 0.00 177.57 178.40 2lhb h ALA 86 N -0.86 3.05 -0.45 1.67 0.00 -1.39 -2.41 119.26 118.87 2lhb h ALA 86 Ca -0.07 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2lhb h ALA 86 Cb 0.88 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2lhb h ALA 86 CO -0.01 -1.37 0.00 0.43 0.00 0.00 0.00 179.25 178.30 2lhb n SER 87 N -4.20 4.41 0.01 0.00 7.64 -1.01 -4.69 113.62 115.78 2lhb n SER 87 Ca 0.24 -2.71 0.08 0.00 1.01 0.00 0.00 58.87 57.49 2lhb n SER 87 Cb 1.18 -0.54 0.49 0.00 -1.01 0.00 0.00 64.21 64.33 2lhb n SER 87 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2lhb h MET 88 N 2.93 0.40 -0.00 1.43 2.86 -0.97 -2.44 114.93 119.14 2lhb h MET 88 Ca 0.00 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2lhb h MET 88 Cb 1.47 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 33.04 2lhb h MET 88 CO 0.26 0.26 -0.19 -0.25 1.06 0.00 0.00 176.91 178.05 2lhb n ASP 89 N -4.48 0.34 -3.74 1.22 10.43 -1.26 -4.50 116.55 114.55 2lhb n ASP 89 Ca 0.05 -0.15 -0.28 0.00 2.57 0.00 0.00 54.79 56.98 2lhb n ASP 89 Cb 0.19 -0.11 -0.11 0.00 1.84 0.00 0.00 41.12 42.93 2lhb n ASP 89 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2lhb s ASP 90 N -2.79 3.77 0.39 -2.24 3.68 -0.92 -4.96 116.67 113.61 2lhb s ASP 90 Ca 0.19 -3.61 0.17 0.00 2.13 0.00 0.00 52.55 51.43 2lhb s ASP 90 Cb 0.19 -1.26 1.05 0.00 -1.45 0.00 0.00 42.92 41.45 2lhb s ASP 90 CO 0.56 -0.11 1.79 0.74 0.13 0.00 0.00 175.17 178.28 2lhb h THR 91 N 4.47 0.59 -0.41 1.71 2.02 -1.79 0.22 112.91 119.72 2lhb h THR 91 Ca 0.18 -0.15 -0.10 0.00 0.77 0.00 0.00 66.41 67.11 2lhb h THR 91 Cb 0.80 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 2lhb h THR 91 CO 0.61 0.08 -0.14 -0.08 0.37 0.00 0.00 175.52 176.36 2lhb h GLU 92 N 0.45 0.81 0.14 6.66 4.81 -1.93 -1.41 114.58 124.11 2lhb h GLU 92 Ca 0.56 -0.33 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 2lhb h GLU 92 Cb 1.34 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.68 2lhb h GLU 92 CO -0.27 0.95 -0.07 -0.22 -0.73 0.00 0.00 179.01 178.67 2lhb h LYS 93 N 0.63 -0.19 -0.58 1.92 3.64 -1.00 -2.91 116.57 118.07 2lhb h LYS 93 Ca 0.10 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.55 2lhb h LYS 93 Cb 0.68 0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 32.46 2lhb h LYS 93 CO 0.05 0.22 -0.49 1.98 -2.27 0.00 0.00 179.45 178.94 2lhb h MET 94 N -0.67 -0.18 -0.68 1.90 4.05 -1.04 -2.56 114.93 115.75 2lhb h MET 94 Ca -0.02 0.01 0.13 0.00 -0.28 0.00 0.00 59.70 59.54 2lhb h MET 94 Cb 0.49 0.04 -0.09 0.00 -0.80 0.00 0.00 31.60 31.24 2lhb h MET 94 CO 0.03 -0.12 0.22 0.77 0.23 0.00 0.00 176.91 178.05 2lhb h SER 95 N -0.18 0.16 -0.08 1.39 0.02 -1.32 -2.92 113.55 110.61 2lhb h SER 95 Ca 0.10 0.11 0.04 0.00 -0.84 0.00 0.00 61.79 61.20 2lhb h SER 95 Cb 0.43 0.11 -0.05 0.00 0.14 0.00 0.00 62.40 63.04 2lhb h SER 95 CO -0.64 0.07 -0.24 -0.03 -1.14 0.00 0.00 176.83 174.85 2lhb h MET 96 N 0.37 -0.31 -0.20 3.45 -1.53 -1.25 0.15 114.93 115.60 2lhb h MET 96 Ca 0.37 0.02 -0.15 0.00 -3.44 0.00 0.00 59.70 56.50 2lhb h MET 96 Cb 0.55 0.07 -0.01 0.00 -0.55 0.00 0.00 31.60 31.66 2lhb h MET 96 CO -0.40 -0.21 -0.49 0.87 0.14 0.00 0.00 176.91 176.82 2lhb h LYS 97 N -0.33 0.56 -0.18 0.39 1.57 -1.47 -2.72 116.57 114.39 2lhb h LYS 97 Ca 0.09 -0.32 -0.16 0.00 -1.87 0.00 0.00 60.65 58.39 2lhb h LYS 97 Cb 0.45 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 2lhb h LYS 97 CO -0.27 0.92 -0.54 -0.07 -0.57 0.00 0.00 179.45 178.92 2lhb h LEU 98 N 0.44 0.59 -0.99 2.94 3.38 -1.32 -2.14 115.31 118.21 2lhb h LEU 98 Ca 0.02 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 2lhb h LEU 98 Cb 1.02 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 2lhb h LEU 98 CO 0.09 1.02 0.34 0.03 0.09 0.00 0.00 178.44 180.01 2lhb h ARG 99 N 0.41 1.06 -0.53 1.13 3.08 -0.64 -1.46 114.38 117.44 2lhb h ARG 99 Ca 0.01 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 2lhb h ARG 99 Cb 1.08 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.91 2lhb h ARG 99 CO 0.10 0.83 0.26 -0.97 -1.07 0.00 0.00 179.97 179.12 2lhb h ASN 100 N 1.05 0.68 -0.29 7.04 -1.24 -1.24 -2.71 115.58 118.87 2lhb h ASN 100 Ca 0.25 -0.12 -0.08 0.00 0.71 0.00 0.00 56.30 57.06 2lhb h ASN 100 Cb 0.13 -0.17 -0.02 0.00 0.73 0.00 0.00 38.32 38.98 2lhb h ASN 100 CO -0.03 0.61 -0.09 0.25 -1.29 0.00 0.00 177.43 176.87 2lhb h LEU 101 N 0.70 0.68 -0.17 0.34 5.85 -1.10 -2.02 115.31 119.58 2lhb h LEU 101 Ca 0.18 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2lhb h LEU 101 Cb 0.10 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 2lhb h LEU 101 CO -0.02 0.81 0.07 -1.28 -0.34 0.00 0.00 178.44 177.67 2lhb h SER 102 N 0.63 0.09 -0.49 1.25 0.87 -1.15 -1.36 113.55 113.39 2lhb h SER 102 Ca 0.11 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.65 2lhb h SER 102 Cb 0.54 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 2lhb h SER 102 CO 0.03 0.08 0.18 1.23 -0.53 0.00 0.00 176.83 177.82 2lhb h GLY 103 N 0.16 0.81 0.95 5.77 0.00 -1.25 -0.77 103.07 108.74 2lhb h GLY 103 Ca 0.07 -0.46 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 2lhb h GLY 103 CO -0.07 0.43 0.17 0.50 0.00 0.00 0.00 176.54 177.58 2lhb h LYS 104 N 0.66 0.50 -0.60 4.80 1.57 -1.22 -0.53 116.57 121.76 2lhb h LYS 104 Ca 0.16 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 2lhb h LYS 104 Cb 0.23 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 2lhb h LYS 104 CO -0.01 0.45 0.19 0.45 -0.57 0.00 0.00 179.45 179.96 2lhb h HIS 105 N 0.43 0.91 0.11 -1.35 3.86 -1.03 0.11 115.15 118.20 2lhb h HIS 105 Ca 0.12 -0.07 -0.24 0.00 -1.16 0.00 0.00 60.37 59.03 2lhb h HIS 105 Cb 0.10 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 28.30 2lhb h HIS 105 CO -0.02 0.73 -1.17 0.00 0.86 0.00 0.00 177.93 178.33 2lhb h ALA 106 N 1.34 0.10 0.00 2.45 0.00 -0.94 -1.14 119.26 121.08 2lhb h ALA 106 Ca 0.20 -0.96 -0.12 0.00 0.00 0.00 0.00 54.91 54.03 2lhb h ALA 106 Cb 0.24 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2lhb h ALA 106 CO -0.01 0.66 -1.60 1.63 0.00 0.00 0.00 179.25 179.92 2lhb n LYS 107 N -4.04 0.64 -0.11 0.00 4.01 -0.22 -3.50 118.16 114.93 2lhb n LYS 107 Ca -0.21 0.07 -0.20 0.00 -0.51 0.00 0.00 58.31 57.46 2lhb n LYS 107 Cb 0.85 -1.71 -0.07 0.00 -0.51 0.00 0.00 35.03 33.59 2lhb n LYS 107 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 2lhb n SER 108 N -2.68 1.92 0.04 4.39 7.64 0.29 -4.60 113.62 120.62 2lhb n SER 108 Ca -0.10 0.38 0.11 0.00 1.01 0.00 0.00 58.87 60.28 2lhb n SER 108 Cb 0.76 -0.83 -0.03 0.00 -1.01 0.00 0.00 64.21 63.11 2lhb n SER 108 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2lhb n PHE 109 N -4.38 0.39 -3.80 1.43 3.01 -0.63 -5.01 117.46 108.47 2lhb n PHE 109 Ca -0.34 0.11 -0.32 0.00 1.01 0.00 0.00 57.45 57.90 2lhb n PHE 109 Cb 0.68 -0.58 0.03 0.00 -0.01 0.00 0.00 39.48 39.60 2lhb n PHE 109 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 2lhb n GLN 110 N -2.21 -1.54 -2.88 -1.08 6.02 -0.54 -4.94 117.38 110.21 2lhb n GLN 110 Ca 0.00 0.39 -0.30 0.00 -0.01 0.00 0.00 57.00 57.08 2lhb n GLN 110 Cb 0.49 -3.97 -0.03 0.00 1.02 0.00 0.00 30.24 27.75 2lhb n GLN 110 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 2lhb s VAL 111 N -3.59 4.82 -0.09 5.09 -7.23 -0.58 -5.00 120.40 113.82 2lhb s VAL 111 Ca 0.37 0.53 -0.30 0.00 -1.81 0.00 0.00 61.98 60.77 2lhb s VAL 111 Cb -0.15 -3.74 -0.03 0.00 0.56 0.00 0.00 36.38 33.02 2lhb s VAL 111 CO 0.88 -0.53 1.29 -0.62 -0.31 0.00 0.00 175.10 175.82 2lhb s ASP 112 N -3.24 6.95 0.13 4.85 -1.08 -1.26 -4.82 116.67 118.19 2lhb s ASP 112 Ca 0.50 1.84 0.24 0.00 -0.52 0.00 0.00 52.55 54.62 2lhb s ASP 112 Cb -0.10 -2.55 0.92 0.00 -1.46 0.00 0.00 42.92 39.73 2lhb s ASP 112 CO 0.32 -0.70 1.74 -0.81 0.52 0.00 0.00 175.17 176.24 2lhb n PRO 113 N 5.94 0.14 0.31 4.34 -0.04 -1.26 -3.49 135.00 140.93 2lhb n PRO 113 Ca 0.13 0.22 0.19 0.00 -0.04 0.00 0.00 63.50 64.00 2lhb n PRO 113 Cb 0.45 -1.70 0.99 0.00 -0.04 0.00 0.00 33.50 33.21 2lhb n PRO 113 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2lhb h GLU 114 N 0.00 0.00 0.00 0.54 4.81 -2.04 -2.70 114.58 115.19 2lhb h GLU 114 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2lhb h GLU 114 Cb 0.50 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.88 2lhb h GLU 114 CO 0.00 0.00 -0.35 0.66 -0.73 0.00 0.00 179.01 178.59 2lhb n TYR 115 N -3.18 0.71 -0.19 0.92 4.02 -1.23 -4.09 117.16 114.14 2lhb n TYR 115 Ca -0.02 0.21 -0.01 0.00 -0.01 0.00 0.00 57.90 58.08 2lhb n TYR 115 Cb 0.23 -0.78 0.09 0.00 -0.02 0.00 0.00 39.34 38.87 2lhb n TYR 115 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 176.86 176.59 2lhb h PHE 116 N 0.00 0.24 0.00 -0.72 0.05 -1.74 -1.59 116.94 113.19 2lhb h PHE 116 Ca 0.00 0.03 -0.03 0.00 3.82 0.00 0.00 57.97 61.80 2lhb h PHE 116 Cb 0.74 -0.02 -0.00 0.00 2.00 0.00 0.00 35.95 38.66 2lhb h PHE 116 CO 0.00 0.01 -0.13 1.57 -0.18 0.00 0.00 178.31 179.59 2lhb h LYS 117 N 0.29 0.00 0.00 1.51 2.10 -1.80 -1.81 116.57 116.87 2lhb h LYS 117 Ca 0.29 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.84 2lhb h LYS 117 Cb 0.40 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.73 2lhb h LYS 117 CO -0.35 0.13 -0.41 0.28 -2.00 0.00 0.00 179.45 177.10 2lhb h VAL 118 N 0.00 1.50 0.04 0.07 2.07 -1.53 -1.86 116.25 116.54 2lhb h VAL 118 Ca -0.00 -2.03 -0.00 0.00 0.82 0.00 0.00 66.70 65.48 2lhb h VAL 118 Cb 0.61 2.73 0.00 0.00 -1.52 0.00 0.00 31.29 33.11 2lhb h VAL 118 CO 0.02 0.57 -0.02 0.25 0.02 0.00 0.00 177.57 178.41 2lhb h LEU 119 N -0.35 -0.05 -1.55 2.57 5.85 -1.32 -2.32 115.31 118.14 2lhb h LEU 119 Ca -0.05 -0.14 0.16 0.00 0.84 0.00 0.00 57.88 58.69 2lhb h LEU 119 Cb 1.16 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 2lhb h LEU 119 CO 0.08 0.11 0.53 0.00 -0.34 0.00 0.00 178.44 178.82 2lhb h ALA 120 N 0.75 2.11 -0.15 1.25 0.00 -1.41 0.11 119.26 121.92 2lhb h ALA 120 Ca -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 2lhb h ALA 120 Cb 0.18 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2lhb h ALA 120 CO 0.01 -0.33 -0.57 0.00 0.00 0.00 0.00 179.25 178.36 2lhb h ALA 121 N 1.63 0.74 -0.36 0.00 0.00 -0.80 -2.02 119.26 118.45 2lhb h ALA 121 Ca 0.39 -0.52 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 2lhb h ALA 121 Cb 0.90 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2lhb h ALA 121 CO -0.13 0.70 -0.16 0.28 0.00 0.00 0.00 179.25 179.93 2lhb h VAL 122 N 0.35 1.26 0.09 0.00 2.07 -0.43 -0.64 116.25 118.95 2lhb h VAL 122 Ca 0.00 -1.19 -0.00 0.00 0.82 0.00 0.00 66.70 66.33 2lhb h VAL 122 Cb 1.10 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 2lhb h VAL 122 CO 0.10 0.40 -0.04 0.40 0.02 0.00 0.00 177.57 178.44 2lhb h ILE 123 N 0.59 1.06 -0.79 4.57 2.04 -1.08 -1.93 117.51 121.97 2lhb h ILE 123 Ca 0.10 -0.54 0.02 0.00 1.00 0.00 0.00 64.86 65.44 2lhb h ILE 123 Cb 0.61 1.40 -0.04 0.00 -0.74 0.00 0.00 36.82 38.05 2lhb h ILE 123 CO 0.04 0.13 0.51 0.00 0.00 0.00 0.00 178.15 178.83 2lhb h ALA 124 N 0.52 1.02 -0.54 1.87 0.00 -1.25 0.73 119.26 121.61 2lhb h ALA 124 Ca -0.01 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2lhb h ALA 124 Cb 0.31 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2lhb h ALA 124 CO 0.02 0.35 0.21 0.22 0.00 0.00 0.00 179.25 180.04 2lhb h ASP 125 N 1.01 0.71 -0.14 0.00 3.58 -1.06 0.14 116.42 120.65 2lhb h ASP 125 Ca 0.30 -0.09 -0.16 0.00 0.42 0.00 0.00 57.03 57.51 2lhb h ASP 125 Cb -0.04 -0.18 0.01 0.00 1.72 0.00 0.00 39.33 40.83 2lhb h ASP 125 CO -0.09 0.64 -0.52 0.74 -2.88 0.00 0.00 179.24 177.13 2lhb h THR 126 N 0.77 1.34 0.08 2.25 2.02 -0.47 -3.25 112.91 115.65 2lhb h THR 126 Ca 0.18 -1.79 -0.00 0.00 0.77 0.00 0.00 66.41 65.57 2lhb h THR 126 Cb 0.17 2.05 0.00 0.00 -1.74 0.00 0.00 68.15 68.63 2lhb h THR 126 CO -0.02 0.55 -0.04 0.58 0.37 0.00 0.00 175.52 176.97 2lhb h VAL 127 N 0.25 1.06 -0.51 3.16 2.07 -0.76 -3.46 116.25 118.07 2lhb h VAL 127 Ca -0.02 -1.46 0.02 0.00 0.82 0.00 0.00 66.70 66.06 2lhb h VAL 127 Cb 1.15 1.87 -0.17 0.00 -1.52 0.00 0.00 31.29 32.62 2lhb h VAL 127 CO 0.11 0.31 -0.25 0.00 0.02 0.00 0.00 177.57 177.76 2lhb s ALA 128 N -3.19 -3.64 -0.26 1.67 0.00 0.45 -4.88 121.76 111.91 2lhb s ALA 128 Ca -0.13 0.66 -0.38 0.00 0.00 0.00 0.00 51.96 52.12 2lhb s ALA 128 Cb -0.00 -2.90 -0.14 0.00 0.00 0.00 0.00 23.12 20.08 2lhb s ALA 128 CO 0.49 -2.40 1.91 0.00 0.00 0.00 0.00 175.76 175.77 2lhb n ALA 129 N 3.56 0.42 -0.92 0.00 0.00 -1.01 -1.22 120.51 121.34 2lhb n ALA 129 Ca 0.10 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.77 2lhb n ALA 129 Cb 0.61 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.69 2lhb n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2lhb n GLY 130 N 5.00 1.15 3.69 0.00 0.00 -1.26 -5.00 105.19 108.76 2lhb n GLY 130 Ca 0.31 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.90 2lhb n GLY 130 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2lhb s ASP 131 N -3.08 6.61 0.29 1.61 2.15 -0.36 -4.87 116.67 119.02 2lhb s ASP 131 Ca 0.00 2.47 0.05 0.00 0.43 0.00 0.00 52.55 55.51 2lhb s ASP 131 Cb 0.00 -2.56 0.43 0.00 -0.30 0.00 0.00 42.92 40.48 2lhb s ASP 131 CO 0.00 -0.88 1.69 0.00 -0.17 0.00 0.00 175.17 175.81 2lhb h ALA 132 N 8.30 1.08 -0.25 3.66 0.00 -1.95 -2.56 119.26 127.55 2lhb h ALA 132 Ca -0.42 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.06 2lhb h ALA 132 Cb 1.20 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2lhb h ALA 132 CO 0.93 0.59 0.09 0.78 0.00 0.00 0.00 179.25 181.63 2lhb h GLY 133 N 1.17 0.41 1.02 0.00 0.00 -1.92 -2.05 103.07 101.70 2lhb h GLY 133 Ca 0.03 -0.24 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 2lhb h GLY 133 CO 0.06 0.22 0.19 -2.75 0.00 0.00 0.00 176.54 174.27 2lhb h PHE 134 N 0.24 1.02 -0.08 5.60 3.57 -1.88 -2.62 116.94 122.80 2lhb h PHE 134 Ca 0.08 -0.11 -0.05 0.00 3.53 0.00 0.00 57.97 61.43 2lhb h PHE 134 Cb 0.22 -0.29 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 2lhb h PHE 134 CO -0.00 0.84 -0.16 0.93 -2.23 0.00 0.00 178.31 177.69 2lhb h GLU 135 N 0.91 0.13 -0.30 1.11 5.08 -1.37 -1.36 114.58 118.78 2lhb h GLU 135 Ca 0.20 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.45 2lhb h GLU 135 Cb 0.30 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 2lhb h GLU 135 CO -0.00 0.30 -0.15 0.87 -1.00 0.00 0.00 179.01 179.03 2lhb h LYS 136 N 0.12 0.63 -0.43 2.33 1.57 -1.01 0.67 116.57 120.47 2lhb h LYS 136 Ca 0.02 -0.28 -0.00 0.00 -1.87 0.00 0.00 60.65 58.52 2lhb h LYS 136 Cb 0.37 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 2lhb h LYS 136 CO 0.02 0.86 0.25 1.25 -0.57 0.00 0.00 179.45 181.26 2lhb h LEU 137 N 0.39 0.52 -1.07 2.94 6.46 -1.24 0.03 115.31 123.34 2lhb h LEU 137 Ca 0.07 -0.07 -0.04 0.00 -0.12 0.00 0.00 57.88 57.72 2lhb h LEU 137 Cb 0.67 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.44 2lhb h LEU 137 CO 0.04 0.44 0.23 0.24 -0.62 0.00 0.00 178.44 178.78 2lhb h MET 138 N 0.56 0.90 -0.34 1.25 2.86 -1.14 -1.44 114.93 117.59 2lhb h MET 138 Ca 0.15 -0.15 -0.12 0.00 -2.06 0.00 0.00 59.70 57.53 2lhb h MET 138 Cb 0.02 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.51 2lhb h MET 138 CO -0.03 0.74 -0.27 0.77 1.06 0.00 0.00 176.91 179.19 2lhb h SER 139 N 0.88 0.70 -0.51 1.22 0.02 -0.25 -1.60 113.55 114.02 2lhb h SER 139 Ca 0.21 -0.26 -0.06 0.00 -0.84 0.00 0.00 61.79 60.83 2lhb h SER 139 Cb 0.19 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 2lhb h SER 139 CO -0.02 0.94 0.10 0.24 -1.14 0.00 0.00 176.83 176.95 2lhb h MET 140 N 0.59 0.88 -0.12 3.45 2.86 -0.51 -1.01 114.93 121.07 2lhb h MET 140 Ca 0.08 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 2lhb h MET 140 Cb 0.76 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.29 2lhb h MET 140 CO 0.06 0.82 0.08 0.82 1.06 0.00 0.00 176.91 179.75 2lhb h ILE 141 N 0.84 1.04 -0.71 -1.22 2.04 -0.92 -2.39 117.51 116.19 2lhb h ILE 141 Ca 0.18 -0.07 -0.07 0.00 1.00 0.00 0.00 64.86 65.90 2lhb h ILE 141 Cb 0.36 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 2lhb h ILE 141 CO 0.01 0.04 0.19 0.00 0.00 0.00 0.00 178.15 178.38 2lhb h ILE 143 N 1.07 1.12 -0.81 0.00 2.04 -0.99 -2.62 117.51 117.33 2lhb h ILE 143 Ca 0.23 -0.30 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 2lhb h ILE 143 Cb 0.35 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 37.20 2lhb h ILE 143 CO -0.00 0.12 0.34 -0.07 0.00 0.00 0.00 178.15 178.54 2lhb h LEU 144 N 0.34 1.10 -1.88 1.44 3.38 -1.33 -2.65 115.31 115.71 2lhb h LEU 144 Ca 0.10 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 2lhb h LEU 144 Cb 0.05 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 2lhb h LEU 144 CO -0.02 0.96 -0.12 -0.07 0.09 0.00 0.00 178.44 179.28 2lhb h LEU 145 N 1.17 0.00 0.00 1.67 3.38 -0.79 -1.94 115.31 118.80 2lhb h LEU 145 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2lhb h LEU 145 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2lhb h LEU 145 CO -0.03 0.12 -0.33 0.03 0.09 0.00 0.00 178.44 178.32 2lhb h ARG 146 N 0.00 0.00 -0.96 1.13 3.08 -1.13 -3.39 114.38 113.11 2lhb h ARG 146 Ca -0.00 0.00 0.17 0.00 0.07 0.00 0.00 59.98 60.22 2lhb h ARG 146 Cb 0.25 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 30.22 2lhb h ARG 146 CO 0.02 0.00 0.60 0.66 -1.07 0.00 0.00 179.97 180.18 2lhb h SER 147 N 0.00 0.70 0.01 7.04 4.64 -1.10 -2.18 113.55 122.67 2lhb h SER 147 Ca 0.00 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2lhb h SER 147 Cb 0.76 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2lhb h SER 147 CO 0.00 0.31 -0.01 0.00 -0.87 0.00 0.00 176.83 176.26 2lhb n ALA 148 N -2.40 2.64 1.68 5.18 0.00 -1.26 -5.06 120.51 121.29 2lhb n ALA 148 Ca 0.20 -0.32 0.15 0.00 0.00 0.00 0.00 53.44 53.47 2lhb n ALA 148 Cb 0.54 -1.34 0.68 0.00 0.00 0.00 0.00 19.45 19.33 2lhb n ALA 148 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16