#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dyr n SER 2 N 0.00 2.55 -0.07 1.61 2.88 -1.26 -4.86 113.62 114.46 3dyr n SER 2 Ca 0.00 1.11 0.13 0.00 -1.33 0.00 0.00 58.87 58.78 3dyr n SER 2 Cb 0.00 -1.50 0.75 0.00 -0.75 0.00 0.00 64.21 62.71 3dyr n SER 2 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 3dyr n ASP 3 N 0.21 0.21 -0.19 -3.46 5.68 -1.26 -3.05 116.55 114.69 3dyr n ASP 3 Ca 0.07 -1.22 0.11 0.00 -0.50 0.00 0.00 54.79 53.25 3dyr n ASP 3 Cb 0.40 -0.01 0.12 0.00 -1.14 0.00 0.00 41.12 40.49 3dyr n ASP 3 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3dyr n LYS 4 N -0.76 0.52 -2.93 0.11 5.02 -1.26 -4.90 118.16 113.97 3dyr n LYS 4 Ca 0.20 -0.38 -0.40 0.00 -2.02 0.00 0.00 58.31 55.70 3dyr n LYS 4 Cb 0.13 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.60 3dyr n LYS 4 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3dyr s ILE 5 N -2.74 4.73 -0.26 -0.18 1.01 -1.17 -4.58 121.20 118.01 3dyr s ILE 5 Ca 0.15 1.71 -0.17 0.00 0.00 0.00 0.00 60.65 62.35 3dyr s ILE 5 Cb 0.18 -4.16 -0.03 0.00 0.01 0.00 0.00 42.46 38.46 3dyr s ILE 5 CO 0.67 0.33 0.46 -0.63 0.00 0.00 0.00 174.94 175.77 3dyr s ILE 6 N 0.10 5.11 -0.43 2.92 1.09 -0.63 -4.94 121.20 124.42 3dyr s ILE 6 Ca 0.41 0.77 -0.22 0.00 -1.10 0.00 0.00 60.65 60.51 3dyr s ILE 6 Cb -0.21 -3.78 0.02 0.00 -1.06 0.00 0.00 42.46 37.43 3dyr s ILE 6 CO 0.24 0.12 0.72 -1.00 -0.10 0.00 0.00 174.94 174.93 3dyr s HIS 7 N 2.16 3.03 0.38 3.97 3.76 -1.26 0.04 115.29 127.37 3dyr s HIS 7 Ca 0.19 0.12 -0.09 0.00 -0.15 0.00 0.00 55.06 55.14 3dyr s HIS 7 Cb -0.16 -3.50 -0.06 0.00 1.11 0.00 0.00 32.58 29.97 3dyr s HIS 7 CO 0.09 -0.91 0.71 -0.51 -0.85 0.00 0.00 174.74 173.28 3dyr s LEU 8 N 3.08 3.87 0.00 0.89 1.43 0.72 -4.93 118.68 123.74 3dyr s LEU 8 Ca 0.27 1.00 0.01 0.00 -1.03 0.00 0.00 54.13 54.38 3dyr s LEU 8 Cb -0.13 -3.87 0.01 0.00 0.03 0.00 0.00 46.19 42.22 3dyr s LEU 8 CO 0.21 -0.36 0.05 0.35 0.23 0.00 0.00 176.35 176.83 3dyr n THR 9 N -1.29 0.00 0.03 5.49 -2.24 -1.26 -4.47 114.28 110.53 3dyr n THR 9 Ca 0.01 -2.11 -0.05 0.00 -2.27 0.00 0.00 64.05 59.63 3dyr n THR 9 Cb 0.54 0.35 0.15 0.00 -2.10 0.00 0.00 70.33 69.27 3dyr n THR 9 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3dyr h ASP 10 N 1.01 0.47 1.63 3.42 3.45 -1.90 -2.46 116.42 122.04 3dyr h ASP 10 Ca -0.37 -0.20 0.00 0.00 0.43 0.00 0.00 57.03 56.89 3dyr h ASP 10 Cb 1.14 -0.13 0.00 0.00 -0.56 0.00 0.00 39.33 39.77 3dyr h ASP 10 CO 0.60 0.82 -0.19 0.44 -1.57 0.00 0.00 179.24 179.35 3dyr h ASP 11 N 0.37 0.00 0.00 6.45 3.32 -2.00 -3.30 116.42 121.26 3dyr h ASP 11 Ca 0.03 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3dyr h ASP 11 Cb 0.87 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.42 3dyr h ASP 11 CO 0.07 0.01 -1.00 -1.54 -1.72 0.00 0.00 179.24 175.06 3dyr n SER 12 N -2.74 0.90 -0.03 6.45 3.41 -1.19 -4.64 113.62 115.79 3dyr n SER 12 Ca 0.04 -0.63 -0.14 0.00 -0.26 0.00 0.00 58.87 57.88 3dyr n SER 12 Cb 0.50 1.20 -0.08 0.00 -0.26 0.00 0.00 64.21 65.56 3dyr n SER 12 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 3dyr h PHE 13 N 0.00 -1.49 -0.74 7.33 3.57 -1.52 0.31 116.94 124.40 3dyr h PHE 13 Ca 0.00 0.06 0.06 0.00 3.53 0.00 0.00 57.97 61.62 3dyr h PHE 13 Cb 0.46 0.67 -0.06 0.00 2.79 0.00 0.00 35.95 39.82 3dyr h PHE 13 CO 0.00 -0.52 0.44 -0.44 -2.23 0.00 0.00 178.31 175.56 3dyr h ASP 14 N -0.52 0.67 -0.14 0.41 5.19 -1.83 0.38 116.42 120.58 3dyr h ASP 14 Ca 0.06 0.02 -0.06 0.00 -0.62 0.00 0.00 57.03 56.42 3dyr h ASP 14 Cb 0.66 -0.12 -0.00 0.00 0.18 0.00 0.00 39.33 40.05 3dyr h ASP 14 CO -0.46 0.44 -0.16 0.74 -3.12 0.00 0.00 179.24 176.68 3dyr h THR 15 N 0.81 1.35 -0.25 0.35 2.02 -1.77 -2.58 112.91 112.84 3dyr h THR 15 Ca 0.32 -1.35 -0.19 0.00 0.77 0.00 0.00 66.41 65.96 3dyr h THR 15 Cb 0.16 1.91 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 3dyr h THR 15 CO -0.17 0.40 -0.59 0.44 0.37 0.00 0.00 175.52 175.97 3dyr h ASP 16 N -0.02 0.93 0.00 4.18 3.45 0.04 -3.28 116.42 121.72 3dyr h ASP 16 Ca 0.02 -0.52 -0.35 0.00 0.43 0.00 0.00 57.03 56.61 3dyr h ASP 16 Cb 0.71 -0.27 -0.05 0.00 -0.56 0.00 0.00 39.33 39.16 3dyr h ASP 16 CO 0.04 1.31 -2.16 0.52 -1.57 0.00 0.00 179.24 177.37 3dyr n VAL 17 N -3.99 1.46 0.37 -1.35 0.31 0.13 -3.87 118.33 111.39 3dyr n VAL 17 Ca -0.05 -0.26 0.13 0.00 -0.01 0.00 0.00 64.34 64.16 3dyr n VAL 17 Cb 0.65 -1.96 0.39 0.00 -0.91 0.00 0.00 33.84 32.01 3dyr n VAL 17 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3dyr h LEU 18 N -0.95 0.00 -2.04 7.52 3.38 -1.53 -2.83 115.31 118.86 3dyr h LEU 18 Ca -0.53 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.44 3dyr h LEU 18 Cb 1.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.21 3dyr h LEU 18 CO -0.32 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.50 3dyr n LYS 19 N -2.75 1.97 -1.74 1.13 5.02 -1.06 -3.86 118.16 116.86 3dyr n LYS 19 Ca 0.03 -1.86 -0.40 0.00 -2.02 0.00 0.00 58.31 54.06 3dyr n LYS 19 Cb 0.41 -1.39 0.02 0.00 -0.02 0.00 0.00 35.03 34.05 3dyr n LYS 19 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dyr n ALA 20 N 1.12 1.73 -0.03 7.82 0.00 -1.07 -4.93 120.51 125.15 3dyr n ALA 20 Ca 0.14 0.23 -0.14 0.00 0.00 0.00 0.00 53.44 53.66 3dyr n ALA 20 Cb 0.50 -2.35 -0.03 0.00 0.00 0.00 0.00 19.45 17.57 3dyr n ALA 20 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3dyr h ASP 21 N 2.05 0.86 -2.59 0.00 5.19 -1.92 -3.42 116.42 116.59 3dyr h ASP 21 Ca -0.50 -0.51 0.00 0.00 -0.62 0.00 0.00 57.03 55.40 3dyr h ASP 21 Cb 1.28 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 40.54 3dyr h ASP 21 CO 0.60 1.29 0.00 0.61 -3.12 0.00 0.00 179.24 178.62 3dyr n GLY 22 N 0.49 4.77 3.75 2.75 0.00 -1.26 -4.81 105.19 110.89 3dyr n GLY 22 Ca -0.05 -2.14 -0.41 0.00 0.00 0.00 0.00 46.02 43.42 3dyr n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dyr s ALA 23 N -2.00 3.56 -0.10 4.61 0.00 -1.26 -4.67 121.76 121.90 3dyr s ALA 23 Ca 0.00 1.26 0.01 0.00 0.00 0.00 0.00 51.96 53.23 3dyr s ALA 23 Cb 0.00 -3.51 0.02 0.00 0.00 0.00 0.00 23.12 19.63 3dyr s ALA 23 CO 0.00 -0.66 -0.11 -1.50 0.00 0.00 0.00 175.76 173.48 3dyr s ILE 24 N -0.42 1.19 -0.30 0.00 2.07 -0.92 -1.52 121.20 121.30 3dyr s ILE 24 Ca 0.55 -0.45 -0.14 0.00 -1.41 0.00 0.00 60.65 59.20 3dyr s ILE 24 Cb -0.40 -1.13 -0.03 0.00 0.13 0.00 0.00 42.46 41.03 3dyr s ILE 24 CO 0.46 0.38 0.32 -0.22 -1.91 0.00 0.00 174.94 173.97 3dyr s LEU 25 N 1.16 4.18 -0.22 8.50 2.96 0.03 -0.19 118.68 135.11 3dyr s LEU 25 Ca -0.05 0.01 -0.07 0.00 -0.22 0.00 0.00 54.13 53.81 3dyr s LEU 25 Cb -0.14 -2.31 -0.03 0.00 0.50 0.00 0.00 46.19 44.21 3dyr s LEU 25 CO -0.03 -0.20 0.04 -0.69 -1.32 0.00 0.00 176.35 174.16 3dyr s VAL 26 N 1.96 4.30 -0.43 1.68 1.01 0.63 -0.35 120.40 129.20 3dyr s VAL 26 Ca 0.12 -0.19 -0.17 0.00 0.00 0.00 0.00 61.98 61.74 3dyr s VAL 26 Cb -0.16 -2.97 0.03 0.00 0.00 0.00 0.00 36.38 33.27 3dyr s VAL 26 CO 0.11 0.40 0.40 -0.62 0.00 0.00 0.00 175.10 175.38 3dyr s ASP 27 N 1.12 6.17 -0.28 3.32 3.68 0.50 -1.26 116.67 129.91 3dyr s ASP 27 Ca 0.04 -0.82 -0.25 0.00 2.13 0.00 0.00 52.55 53.64 3dyr s ASP 27 Cb -0.14 -2.20 0.00 0.00 -1.45 0.00 0.00 42.92 39.13 3dyr s ASP 27 CO 0.03 -0.56 0.88 -0.36 0.13 0.00 0.00 175.17 175.28 3dyr s PHE 28 N 1.98 3.25 0.23 -5.34 0.08 -0.51 -0.82 117.98 116.84 3dyr s PHE 28 Ca 0.09 1.07 -0.00 0.00 0.12 0.00 0.00 56.93 58.21 3dyr s PHE 28 Cb -0.18 -3.25 -0.03 0.00 -0.57 0.00 0.00 43.02 38.98 3dyr s PHE 28 CO 0.12 -0.53 0.19 1.67 -0.10 0.00 0.00 175.22 176.56 3dyr s TRP 29 N 3.07 1.21 0.20 0.36 1.48 -0.73 -2.74 118.94 121.78 3dyr s TRP 29 Ca 0.37 -1.38 -0.16 0.00 -1.06 0.00 0.00 56.10 53.86 3dyr s TRP 29 Cb -0.14 -0.52 0.02 0.00 -1.16 0.00 0.00 33.47 31.66 3dyr s TRP 29 CO 0.10 -0.72 0.49 0.00 -4.06 0.00 0.00 176.95 172.77 3dyr s ALA 30 N -4.00 -0.75 0.02 2.67 0.00 -1.26 -0.90 121.76 117.54 3dyr s ALA 30 Ca 0.38 -0.38 -0.26 0.00 0.00 0.00 0.00 51.96 51.70 3dyr s ALA 30 Cb 0.06 0.87 -0.17 0.00 0.00 0.00 0.00 23.12 23.88 3dyr s ALA 30 CO 0.15 -0.80 1.35 1.49 0.00 0.00 0.00 175.76 177.95 3dyr h GLU 31 N 2.24 -0.39 -4.79 0.00 4.57 -2.00 -3.34 114.58 110.87 3dyr h GLU 31 Ca -0.28 0.03 -0.72 0.00 -1.18 0.00 0.00 59.36 57.20 3dyr h GLU 31 Cb 1.26 0.09 -0.18 0.00 -0.16 0.00 0.00 28.75 29.75 3dyr h GLU 31 CO 0.38 -0.10 1.13 -1.58 -1.18 0.00 0.00 179.01 177.66 3dyr s TRP 32 N -5.01 3.40 -0.31 0.92 0.52 -1.26 -4.84 118.94 112.36 3dyr s TRP 32 Ca -0.15 -1.90 0.06 0.00 0.02 0.00 0.00 56.10 54.13 3dyr s TRP 32 Cb 0.03 -4.28 0.19 0.00 -1.15 0.00 0.00 33.47 28.26 3dyr s TRP 32 CO 0.58 -1.41 0.56 0.00 0.02 0.00 0.00 176.95 176.70 3dyr h GLY 34 N 7.83 -0.80 0.58 0.00 0.00 -1.93 -1.84 103.07 106.92 3dyr h GLY 34 Ca -0.01 0.56 0.09 0.00 0.00 0.00 0.00 47.33 47.97 3dyr h GLY 34 CO 0.16 -0.22 0.52 -2.55 0.00 0.00 0.00 176.54 174.45 3dyr h PRO 35 N -0.52 0.87 -0.99 4.80 0.11 -1.97 -1.58 132.00 132.71 3dyr h PRO 35 Ca 0.06 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 66.15 3dyr h PRO 35 Cb 0.65 -0.20 -0.05 0.00 0.11 0.00 0.00 31.00 31.51 3dyr h PRO 35 CO -0.40 0.57 0.65 0.00 -0.21 0.00 0.00 178.00 178.61 3dyr h LYS 37 N 1.28 0.64 0.03 0.00 1.63 -0.47 -2.87 116.57 116.81 3dyr h LYS 37 Ca 0.38 -0.12 -0.22 0.00 -0.85 0.00 0.00 60.65 59.84 3dyr h LYS 37 Cb -0.05 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.47 3dyr h LYS 37 CO -0.11 0.61 -1.00 0.52 -3.45 0.00 0.00 179.45 176.02 3dyr h MET 38 N 0.62 0.11 -0.00 1.90 2.86 -0.44 -3.18 114.93 116.80 3dyr h MET 38 Ca 0.14 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3dyr h MET 38 Cb 0.28 0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.99 3dyr h MET 38 CO 0.00 1.02 -0.34 0.44 1.06 0.00 0.00 176.91 179.09 3dyr n ILE 39 N -3.50 0.00 0.46 -1.22 -5.35 -0.92 -4.46 119.36 104.37 3dyr n ILE 39 Ca -0.03 -0.07 -0.20 0.00 -0.27 0.00 0.00 62.75 62.19 3dyr n ILE 39 Cb 0.91 0.28 -0.10 0.00 -1.74 0.00 0.00 39.64 38.99 3dyr n ILE 39 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3dyr h ALA 40 N 3.37 -1.17 -0.08 -1.28 0.00 -1.49 0.19 119.26 118.82 3dyr h ALA 40 Ca 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3dyr h ALA 40 Cb 0.49 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3dyr h ALA 40 CO 0.00 -1.16 -0.01 -1.00 0.00 0.00 0.00 179.25 177.08 3dyr h PRO 41 N -1.16 0.11 0.05 0.00 0.13 -1.78 -1.34 132.00 128.00 3dyr h PRO 41 Ca -0.12 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.00 3dyr h PRO 41 Cb 0.89 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.00 3dyr h PRO 41 CO 0.19 0.13 -0.03 0.82 -0.23 0.00 0.00 178.00 178.89 3dyr h ILE 42 N 0.11 0.99 -0.99 -3.56 2.04 -1.64 -2.51 117.51 111.95 3dyr h ILE 42 Ca 0.03 -0.14 0.09 0.00 1.00 0.00 0.00 64.86 65.84 3dyr h ILE 42 Cb 0.10 1.08 -0.07 0.00 -0.74 0.00 0.00 36.82 37.19 3dyr h ILE 42 CO 0.00 0.04 0.63 -0.07 0.00 0.00 0.00 178.15 178.75 3dyr h LEU 43 N -0.13 0.97 -0.79 1.44 3.38 0.11 -1.56 115.31 118.73 3dyr h LEU 43 Ca -0.01 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.07 3dyr h LEU 43 Cb 0.11 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.62 3dyr h LEU 43 CO 0.01 0.58 0.45 0.44 0.09 0.00 0.00 178.44 180.01 3dyr h ASP 44 N 1.08 0.65 0.15 -0.43 3.45 -0.90 0.61 116.42 121.03 3dyr h ASP 44 Ca 0.45 0.04 -0.15 0.00 0.43 0.00 0.00 57.03 57.80 3dyr h ASP 44 Cb 0.30 -0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 38.98 3dyr h ASP 44 CO -0.20 0.39 -0.55 -0.33 -1.57 0.00 0.00 179.24 176.97 3dyr h GLU 45 N 0.77 0.43 -0.53 3.56 5.08 -0.90 -2.65 114.58 120.35 3dyr h GLU 45 Ca 0.37 -0.27 -0.09 0.00 -1.00 0.00 0.00 59.36 58.37 3dyr h GLU 45 Cb 0.31 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 3dyr h GLU 45 CO -0.23 0.87 -0.01 0.82 -1.00 0.00 0.00 179.01 179.46 3dyr h ILE 46 N 0.33 1.26 -0.66 3.13 5.03 -0.79 0.63 117.51 126.44 3dyr h ILE 46 Ca 0.01 -1.12 0.07 0.00 -0.12 0.00 0.00 64.86 63.69 3dyr h ILE 46 Cb 1.07 0.93 -0.06 0.00 -3.03 0.00 0.00 36.82 35.73 3dyr h ILE 46 CO 0.10 0.40 0.35 0.00 -0.68 0.00 0.00 178.15 178.31 3dyr h ALA 47 N 0.95 0.89 -0.02 1.87 0.00 -0.73 0.49 119.26 122.72 3dyr h ALA 47 Ca 0.15 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3dyr h ALA 47 Cb 0.55 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3dyr h ALA 47 CO 0.03 -0.01 -0.00 -0.44 0.00 0.00 0.00 179.25 178.83 3dyr h ASP 48 N 0.63 0.03 0.97 0.00 3.32 -1.31 -2.99 116.42 117.06 3dyr h ASP 48 Ca 0.31 -0.31 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 3dyr h ASP 48 Cb 0.25 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 3dyr h ASP 48 CO -0.21 0.33 -0.52 -0.33 -1.72 0.00 0.00 179.24 176.79 3dyr h GLU 49 N -0.28 0.00 -0.53 3.56 5.08 -0.46 -3.21 114.58 118.74 3dyr h GLU 49 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3dyr h GLU 49 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3dyr h GLU 49 CO 0.00 0.52 0.00 0.66 -1.00 0.00 0.00 179.01 179.19 3dyr n TYR 50 N -3.48 1.15 -1.75 4.33 4.02 0.17 -5.00 117.16 116.59 3dyr n TYR 50 Ca 0.00 -0.62 -0.42 0.00 -0.01 0.00 0.00 57.90 56.86 3dyr n TYR 50 Cb 0.63 -0.19 -0.01 0.00 -0.02 0.00 0.00 39.34 39.75 3dyr n TYR 50 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 3dyr n GLN 51 N 0.79 2.72 0.00 -0.72 7.27 -1.13 -0.74 117.38 125.58 3dyr n GLN 51 Ca 0.22 0.97 0.00 0.00 0.07 0.00 0.00 57.00 58.26 3dyr n GLN 51 Cb 0.77 -2.75 0.00 0.00 2.41 0.00 0.00 30.24 30.68 3dyr n GLN 51 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3dyr n GLY 52 N 1.90 2.40 0.00 1.69 0.00 -1.26 -4.75 105.19 105.17 3dyr n GLY 52 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3dyr n GLY 52 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3dyr n LYS 53 N -2.00 2.79 -3.56 1.61 0.00 0.08 -5.08 118.16 112.01 3dyr n LYS 53 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.17 3dyr n LYS 53 Cb 0.00 -0.75 -0.06 0.00 -0.00 0.00 0.00 35.03 34.22 3dyr n LYS 53 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 3dyr s LEU 54 N -2.31 -0.53 -0.15 -5.58 2.96 -0.13 -4.52 118.68 108.42 3dyr s LEU 54 Ca 0.00 0.63 0.01 0.00 -0.22 0.00 0.00 54.13 54.55 3dyr s LEU 54 Cb 0.00 2.21 0.00 0.00 0.50 0.00 0.00 46.19 48.90 3dyr s LEU 54 CO 0.00 -0.45 -0.18 -0.89 -1.32 0.00 0.00 176.35 173.51 3dyr s THR 55 N -0.99 2.47 -0.03 3.68 2.01 -0.57 -4.32 115.64 117.90 3dyr s THR 55 Ca -0.06 -0.84 -0.20 0.00 0.31 0.00 0.00 61.69 60.91 3dyr s THR 55 Cb -0.01 -2.02 -0.05 0.00 0.01 0.00 0.00 72.50 70.43 3dyr s THR 55 CO 0.05 0.53 0.56 -0.69 -0.69 0.00 0.00 174.62 174.38 3dyr s VAL 56 N 0.77 4.97 0.08 3.82 1.01 -1.26 -0.79 120.40 129.01 3dyr s VAL 56 Ca -0.07 1.17 0.05 0.00 0.00 0.00 0.00 61.98 63.13 3dyr s VAL 56 Cb -0.16 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.30 3dyr s VAL 56 CO 0.00 0.41 -0.14 0.00 0.00 0.00 0.00 175.10 175.37 3dyr s ALA 57 N -0.07 1.21 -0.07 5.51 0.00 0.52 -1.60 121.76 127.26 3dyr s ALA 57 Ca 0.30 -1.06 0.05 0.00 0.00 0.00 0.00 51.96 51.25 3dyr s ALA 57 Cb -0.17 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.86 3dyr s ALA 57 CO 0.16 0.14 -0.23 0.15 0.00 0.00 0.00 175.76 175.97 3dyr s LYS 58 N -1.96 2.58 -0.35 0.00 1.02 0.11 -0.37 119.74 120.76 3dyr s LYS 58 Ca 0.00 -0.84 -0.03 0.00 0.02 0.00 0.00 55.97 55.12 3dyr s LYS 58 Cb -0.09 -2.10 0.07 0.00 -0.52 0.00 0.00 37.83 35.19 3dyr s LYS 58 CO 0.02 0.28 0.10 -1.17 -0.92 0.00 0.00 175.35 173.67 3dyr s LEU 59 N 0.06 4.53 -0.50 3.17 2.96 -0.00 -0.20 118.68 128.69 3dyr s LEU 59 Ca -0.09 -1.54 -0.29 0.00 -0.22 0.00 0.00 54.13 51.99 3dyr s LEU 59 Cb -0.15 -1.79 0.02 0.00 0.50 0.00 0.00 46.19 44.77 3dyr s LEU 59 CO 0.05 -0.39 1.25 0.21 -1.32 0.00 0.00 176.35 176.15 3dyr s ASN 60 N 1.52 6.45 0.38 3.68 3.84 -1.26 -1.77 114.94 127.79 3dyr s ASN 60 Ca 0.01 0.42 0.27 0.00 0.21 0.00 0.00 52.86 53.77 3dyr s ASN 60 Cb -0.21 -2.55 0.98 0.00 -0.55 0.00 0.00 41.25 38.92 3dyr s ASN 60 CO -0.01 -1.41 1.80 0.16 -2.79 0.00 0.00 177.10 174.84 3dyr h ILE 61 N 6.28 0.00 -0.28 -5.21 3.07 -1.22 0.10 117.51 120.25 3dyr h ILE 61 Ca -0.25 -0.49 -0.03 0.00 1.55 0.00 0.00 64.86 65.64 3dyr h ILE 61 Cb 1.07 1.40 -0.01 0.00 -0.27 0.00 0.00 36.82 39.01 3dyr h ILE 61 CO 1.14 0.00 0.06 0.44 -1.05 0.00 0.00 178.15 178.74 3dyr h ASP 62 N 0.00 0.44 0.72 2.16 3.32 -1.92 -3.29 116.42 117.85 3dyr h ASP 62 Ca 0.00 -0.24 0.00 0.00 0.02 0.00 0.00 57.03 56.81 3dyr h ASP 62 Cb 0.58 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.01 3dyr h ASP 62 CO 0.00 0.57 -0.50 0.00 -1.72 0.00 0.00 179.24 177.59 3dyr n GLN 63 N -4.67 0.13 -3.33 3.56 6.02 -0.86 -4.60 117.38 113.63 3dyr n GLN 63 Ca -0.03 0.04 -0.21 0.00 -0.01 0.00 0.00 57.00 56.79 3dyr n GLN 63 Cb 0.20 -1.58 -0.08 0.00 1.02 0.00 0.00 30.24 29.79 3dyr n GLN 63 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 3dyr s ASN 64 N -3.54 1.35 0.00 1.08 0.01 0.29 -4.86 114.94 109.27 3dyr s ASN 64 Ca 0.09 -2.14 0.28 0.00 -0.71 0.00 0.00 52.86 50.39 3dyr s ASN 64 Cb 0.16 0.22 1.13 0.00 0.41 0.00 0.00 41.25 43.17 3dyr s ASN 64 CO 0.69 -0.22 1.85 -0.81 -1.51 0.00 0.00 177.10 177.10 3dyr n PRO 65 N 3.68 0.00 0.04 -0.60 -0.04 -1.24 -4.26 135.00 132.58 3dyr n PRO 65 Ca 0.17 -0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.42 3dyr n PRO 65 Cb 0.45 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.27 3dyr n PRO 65 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3dyr h GLY 66 N 5.00 0.35 0.98 0.55 0.00 -1.95 -3.41 103.07 104.59 3dyr h GLY 66 Ca 0.00 -0.90 -0.08 0.00 0.00 0.00 0.00 47.33 46.35 3dyr h GLY 66 CO 0.00 0.79 -0.03 -0.84 0.00 0.00 0.00 176.54 176.47 3dyr h THR 67 N 0.08 1.27 -0.63 4.70 2.02 -1.92 -3.34 112.91 115.09 3dyr h THR 67 Ca -0.36 -1.08 0.03 0.00 0.77 0.00 0.00 66.41 65.76 3dyr h THR 67 Cb 2.06 1.09 -0.04 0.00 -1.74 0.00 0.00 68.15 69.52 3dyr h THR 67 CO 0.14 0.37 0.39 0.00 0.37 0.00 0.00 175.52 176.78 3dyr h ALA 68 N 0.89 0.81 -0.33 6.16 0.00 -1.83 -1.62 119.26 123.35 3dyr h ALA 68 Ca 0.12 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3dyr h ALA 68 Cb 0.53 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3dyr h ALA 68 CO 0.03 0.13 0.20 -1.35 0.00 0.00 0.00 179.25 178.26 3dyr h PRO 69 N 0.76 0.44 0.00 0.00 0.11 -1.81 -2.22 132.00 129.28 3dyr h PRO 69 Ca 0.25 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.32 3dyr h PRO 69 Cb 0.02 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.03 3dyr h PRO 69 CO -0.10 0.31 -0.04 0.87 -0.21 0.00 0.00 178.00 178.82 3dyr h LYS 70 N 0.45 0.00 -0.23 1.05 1.57 -1.43 -2.72 116.57 115.26 3dyr h LYS 70 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3dyr h LYS 70 Cb -0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.30 3dyr h LYS 70 CO -0.02 0.04 0.00 0.66 -0.57 0.00 0.00 179.45 179.56 3dyr n TYR 71 N -3.48 0.39 -0.99 -1.35 4.02 -0.86 -4.97 117.16 109.93 3dyr n TYR 71 Ca -0.02 -0.59 0.00 0.00 -0.01 0.00 0.00 57.90 57.28 3dyr n TYR 71 Cb 0.16 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.39 3dyr n TYR 71 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dyr n GLY 72 N -0.02 0.72 3.67 2.72 0.00 -1.03 -4.97 105.19 106.28 3dyr n GLY 72 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3dyr n GLY 72 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3dyr n ILE 73 N -2.45 0.66 0.10 -0.61 2.08 -1.04 -4.86 119.36 113.25 3dyr n ILE 73 Ca 0.00 -0.12 0.04 0.00 0.56 0.00 0.00 62.75 63.23 3dyr n ILE 73 Cb 0.01 -2.27 0.07 0.00 -0.75 0.00 0.00 39.64 36.71 3dyr n ILE 73 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 3dyr n ARG 74 N 7.02 1.50 -3.81 0.38 1.74 -1.26 -4.60 116.66 117.63 3dyr n ARG 74 Ca 0.20 -1.43 -0.04 0.00 -0.77 0.00 0.00 57.85 55.81 3dyr n ARG 74 Cb 0.40 -1.17 0.00 0.00 -1.02 0.00 0.00 32.46 30.67 3dyr n ARG 74 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3dyr s GLY 75 N -0.83 -0.06 -0.00 -0.13 0.00 -1.26 -5.17 107.32 99.87 3dyr s GLY 75 Ca 0.13 -0.12 0.03 0.00 0.00 0.00 0.00 44.72 44.76 3dyr s GLY 75 CO 0.11 0.83 -0.09 -0.51 0.00 0.00 0.00 173.10 173.43 3dyr s THR 76 N -2.81 0.71 0.41 0.90 -4.23 -1.26 -3.76 115.64 105.60 3dyr s THR 76 Ca 0.16 -0.44 -0.20 0.00 -1.18 0.00 0.00 61.69 60.02 3dyr s THR 76 Cb -0.02 -0.61 -0.11 0.00 1.34 0.00 0.00 72.50 73.10 3dyr s THR 76 CO 0.04 0.16 0.92 -2.16 -0.54 0.00 0.00 174.62 173.04 3dyr s PRO 77 N -0.32 4.21 -0.05 3.99 0.04 -1.26 -4.66 135.00 136.94 3dyr s PRO 77 Ca 0.03 1.07 0.04 0.00 0.04 0.00 0.00 61.00 62.17 3dyr s PRO 77 Cb -0.04 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.28 3dyr s PRO 77 CO -0.00 0.00 -0.16 0.99 0.04 0.00 0.00 177.00 177.87 3dyr s THR 78 N -2.14 1.33 -0.18 1.26 2.01 -1.11 -0.58 115.64 116.23 3dyr s THR 78 Ca 0.61 -0.64 -0.06 0.00 0.31 0.00 0.00 61.69 61.91 3dyr s THR 78 Cb -0.09 -1.17 -0.03 0.00 0.01 0.00 0.00 72.50 71.22 3dyr s THR 78 CO 0.14 0.39 0.02 -0.76 -0.69 0.00 0.00 174.62 173.72 3dyr s LEU 79 N 0.23 3.51 -0.19 4.42 1.43 0.13 -1.42 118.68 126.79 3dyr s LEU 79 Ca -0.08 -0.06 -0.02 0.00 -1.03 0.00 0.00 54.13 52.95 3dyr s LEU 79 Cb -0.13 -1.88 -0.00 0.00 0.03 0.00 0.00 46.19 44.21 3dyr s LEU 79 CO 0.03 0.13 -0.11 -0.76 0.23 0.00 0.00 176.35 175.88 3dyr s LEU 80 N 0.60 2.64 -0.28 1.79 1.43 -0.39 -0.57 118.68 123.91 3dyr s LEU 80 Ca 0.01 -0.45 -0.21 0.00 -1.03 0.00 0.00 54.13 52.45 3dyr s LEU 80 Cb -0.14 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.43 3dyr s LEU 80 CO 0.02 0.02 0.65 -0.22 0.23 0.00 0.00 176.35 177.06 3dyr s LEU 81 N 1.19 4.09 0.07 1.79 2.96 -0.35 -0.27 118.68 128.16 3dyr s LEU 81 Ca 0.02 0.62 -0.01 0.00 -0.22 0.00 0.00 54.13 54.54 3dyr s LEU 81 Cb -0.14 -2.87 -0.04 0.00 0.50 0.00 0.00 46.19 43.63 3dyr s LEU 81 CO -0.04 -0.44 0.23 -0.36 -1.32 0.00 0.00 176.35 174.43 3dyr s PHE 82 N 2.60 3.51 -0.11 5.38 0.40 0.73 0.32 117.98 130.81 3dyr s PHE 82 Ca 0.27 0.30 -0.04 0.00 -0.60 0.00 0.00 56.93 56.85 3dyr s PHE 82 Cb -0.15 -1.80 0.06 0.00 0.51 0.00 0.00 43.02 41.64 3dyr s PHE 82 CO 0.10 0.57 0.23 0.15 0.70 0.00 0.00 175.22 176.97 3dyr s LYS 83 N -2.52 0.12 -1.78 0.44 1.02 0.63 -2.16 119.74 115.50 3dyr s LYS 83 Ca 0.36 0.68 -0.19 0.00 0.02 0.00 0.00 55.97 56.83 3dyr s LYS 83 Cb -0.13 -0.10 0.18 0.00 -0.52 0.00 0.00 37.83 37.26 3dyr s LYS 83 CO 0.27 -0.28 0.61 0.09 -0.92 0.00 0.00 175.35 175.13 3dyr n ASN 84 N 5.23 -2.09 0.00 2.83 3.02 -1.26 -0.44 115.26 122.56 3dyr n ASN 84 Ca -0.08 -1.16 0.00 0.00 -0.03 0.00 0.00 54.58 53.32 3dyr n ASN 84 Cb 0.50 -2.08 0.00 0.00 -0.61 0.00 0.00 39.78 37.59 3dyr n ASN 84 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dyr n GLY 85 N -1.34 0.76 3.46 7.41 0.00 -1.25 -5.03 105.19 109.20 3dyr n GLY 85 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 3dyr n GLY 85 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3dyr s GLU 86 N -0.46 3.08 0.07 1.61 -1.05 0.42 -4.93 118.70 117.44 3dyr s GLU 86 Ca 0.00 -0.63 -0.31 0.00 -0.15 0.00 0.00 54.97 53.88 3dyr s GLU 86 Cb 0.00 -2.61 -0.08 0.00 -0.44 0.00 0.00 34.13 31.00 3dyr s GLU 86 CO 0.00 0.42 1.61 0.08 0.95 0.00 0.00 175.26 178.32 3dyr s VAL 87 N -0.16 3.10 -0.04 1.83 1.01 -1.26 -0.27 120.40 124.61 3dyr s VAL 87 Ca 0.01 0.57 0.09 0.00 0.00 0.00 0.00 61.98 62.64 3dyr s VAL 87 Cb -0.13 -3.36 -0.13 0.00 0.00 0.00 0.00 36.38 32.75 3dyr s VAL 87 CO 0.03 0.00 0.20 0.00 0.00 0.00 0.00 175.10 175.34 3dyr n ALA 88 N 5.44 2.38 -3.53 5.51 0.00 0.15 -4.92 120.51 125.54 3dyr n ALA 88 Ca 0.15 -0.21 -0.08 0.00 0.00 0.00 0.00 53.44 53.30 3dyr n ALA 88 Cb 0.41 -0.30 -0.02 0.00 0.00 0.00 0.00 19.45 19.53 3dyr n ALA 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dyr s ALA 89 N -2.56 -1.89 -0.00 0.00 0.00 -1.19 -5.00 121.76 111.11 3dyr s ALA 89 Ca -0.03 1.22 0.01 0.00 0.00 0.00 0.00 51.96 53.16 3dyr s ALA 89 Cb 0.06 0.15 -0.00 0.00 0.00 0.00 0.00 23.12 23.33 3dyr s ALA 89 CO 0.37 -0.62 -0.02 0.99 0.00 0.00 0.00 175.76 176.47 3dyr s THR 90 N -2.71 0.20 -0.08 0.00 2.01 -1.26 -1.21 115.64 112.59 3dyr s THR 90 Ca 0.05 -0.10 -0.02 0.00 0.31 0.00 0.00 61.69 61.93 3dyr s THR 90 Cb -0.01 -0.18 0.04 0.00 0.01 0.00 0.00 72.50 72.36 3dyr s THR 90 CO -0.07 0.06 0.04 -0.54 -0.69 0.00 0.00 174.62 173.43 3dyr s LYS 91 N 0.01 0.24 -0.04 4.92 -0.14 0.26 -4.99 119.74 120.00 3dyr s LYS 91 Ca 0.00 0.14 -0.10 0.00 -1.36 0.00 0.00 55.97 54.66 3dyr s LYS 91 Cb -0.02 -1.02 -0.05 0.00 -1.68 0.00 0.00 37.83 35.07 3dyr s LYS 91 CO -0.00 -0.40 0.28 0.08 -0.76 0.00 0.00 175.35 174.54 3dyr s VAL 92 N 2.07 5.27 0.00 3.17 1.01 -1.26 0.17 120.40 130.83 3dyr s VAL 92 Ca 0.04 0.45 0.00 0.00 0.00 0.00 0.00 61.98 62.47 3dyr s VAL 92 Cb -0.13 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.69 3dyr s VAL 92 CO -0.05 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.20 3dyr n GLY 93 N 1.70 -0.45 3.76 4.51 0.00 0.26 -4.94 105.19 110.02 3dyr n GLY 93 Ca -0.15 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 43.76 3dyr n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dyr s ALA 94 N -1.70 2.61 0.25 4.61 0.00 -1.26 -4.82 121.76 121.45 3dyr s ALA 94 Ca 0.00 0.92 -0.10 0.00 0.00 0.00 0.00 51.96 52.77 3dyr s ALA 94 Cb 0.00 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.70 3dyr s ALA 94 CO 0.00 -1.00 0.44 -0.48 0.00 0.00 0.00 175.76 174.73 3dyr s LEU 95 N -3.98 0.48 0.64 0.00 2.34 -1.26 -5.12 118.68 111.78 3dyr s LEU 95 Ca 0.75 -1.04 -0.06 0.00 0.06 0.00 0.00 54.13 53.84 3dyr s LEU 95 Cb -0.27 1.60 0.03 0.00 -0.56 0.00 0.00 46.19 46.99 3dyr s LEU 95 CO 0.31 -1.13 0.95 -0.94 -1.06 0.00 0.00 176.35 174.48 3dyr s SER 96 N -3.06 5.25 0.30 1.48 1.04 -1.26 -4.83 113.70 112.62 3dyr s SER 96 Ca 0.25 0.60 -0.01 0.00 0.48 0.00 0.00 55.95 57.27 3dyr s SER 96 Cb 0.00 -1.44 0.46 0.00 0.10 0.00 0.00 66.02 65.14 3dyr s SER 96 CO 0.11 -1.30 1.93 0.07 0.98 0.00 0.00 173.24 175.03 3dyr h LYS 97 N -0.37 0.98 -0.44 4.02 -0.00 -1.98 -0.93 116.57 117.86 3dyr h LYS 97 Ca -0.45 -0.10 -0.06 0.00 -0.00 0.00 0.00 60.65 60.04 3dyr h LYS 97 Cb 1.28 -0.20 -0.02 0.00 -0.00 0.00 0.00 32.23 33.29 3dyr h LYS 97 CO 0.60 0.71 0.03 0.78 -0.00 0.00 0.00 179.45 181.57 3dyr h GLY 98 N 1.03 0.81 1.11 0.07 0.00 -1.99 -0.26 103.07 103.84 3dyr h GLY 98 Ca 0.26 -0.57 -0.07 0.00 0.00 0.00 0.00 47.33 46.95 3dyr h GLY 98 CO -0.04 0.53 0.18 1.46 0.00 0.00 0.00 176.54 178.66 3dyr h GLN 99 N 0.60 1.11 -0.12 4.80 4.20 -1.85 -2.02 115.11 121.83 3dyr h GLN 99 Ca 0.13 -0.26 -0.16 0.00 0.06 0.00 0.00 58.65 58.42 3dyr h GLN 99 Cb 0.44 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 3dyr h GLN 99 CO 0.02 0.97 -0.60 1.25 -0.67 0.00 0.00 178.83 179.80 3dyr h LEU 100 N 1.06 0.47 -0.41 1.46 5.85 -0.88 -1.75 115.31 121.10 3dyr h LEU 100 Ca 0.22 -0.26 -0.04 0.00 0.84 0.00 0.00 57.88 58.64 3dyr h LEU 100 Cb 0.35 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 3dyr h LEU 100 CO 0.00 0.96 0.10 0.11 -0.34 0.00 0.00 178.44 179.27 3dyr h LYS 101 N 0.31 0.66 -0.47 1.25 6.56 -0.95 -1.01 116.57 122.91 3dyr h LYS 101 Ca -0.00 -0.16 -0.12 0.00 -1.06 0.00 0.00 60.65 59.31 3dyr h LYS 101 Cb 1.13 -0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 32.69 3dyr h LYS 101 CO 0.10 0.67 -0.18 1.05 -2.06 0.00 0.00 179.45 179.04 3dyr h GLU 102 N 0.52 0.95 -0.75 3.15 -0.00 -1.25 0.26 114.58 117.45 3dyr h GLU 102 Ca 0.13 -0.39 -0.01 0.00 -0.00 0.00 0.00 59.36 59.09 3dyr h GLU 102 Cb 0.31 -0.04 -0.04 0.00 -0.00 0.00 0.00 28.75 28.99 3dyr h GLU 102 CO 0.00 1.06 0.44 0.35 -0.00 0.00 0.00 179.01 180.86 3dyr h PHE 103 N 0.79 1.01 -0.05 2.06 3.04 -1.24 -1.53 116.94 121.03 3dyr h PHE 103 Ca 0.11 -0.01 -0.08 0.00 3.98 0.00 0.00 57.97 61.97 3dyr h PHE 103 Cb 0.74 -0.33 0.00 0.00 2.56 0.00 0.00 35.95 38.93 3dyr h PHE 103 CO 0.05 0.69 -0.28 -0.07 -2.02 0.00 0.00 178.31 176.68 3dyr h LEU 104 N 1.04 0.33 -0.63 0.59 3.38 -0.96 -1.66 115.31 117.40 3dyr h LEU 104 Ca 0.27 -0.67 0.03 0.00 0.09 0.00 0.00 57.88 57.59 3dyr h LEU 104 Cb -0.01 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 3dyr h LEU 104 CO -0.05 0.95 0.39 0.44 0.09 0.00 0.00 178.44 180.26 3dyr h ASP 105 N -0.27 0.63 -0.38 -0.43 3.32 -0.94 0.58 116.42 118.93 3dyr h ASP 105 Ca -0.02 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 3dyr h ASP 105 Cb 0.95 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.35 3dyr h ASP 105 CO 0.06 0.44 0.20 0.00 -1.72 0.00 0.00 179.24 178.22 3dyr h ALA 106 N 1.27 0.49 0.00 3.45 0.00 -1.33 -3.27 119.26 119.87 3dyr h ALA 106 Ca 0.25 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 3dyr h ALA 106 Cb 0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3dyr h ALA 106 CO -0.10 0.03 -1.17 -0.91 0.00 0.00 0.00 179.25 177.10 3dyr h ASN 107 N 0.48 0.00 -0.01 0.00 2.35 -0.40 -3.15 115.58 114.85 3dyr h ASN 107 Ca 0.13 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.72 3dyr h ASN 107 Cb 0.09 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 3dyr h ASN 107 CO -0.02 0.49 -0.54 -0.07 -1.65 0.00 0.00 177.43 175.64 3dyr h LEU 108 N 0.00 0.65 -0.71 1.61 3.38 0.01 -3.18 115.31 117.07 3dyr h LEU 108 Ca -0.11 -0.34 -0.13 0.00 0.09 0.00 0.00 57.88 57.38 3dyr h LEU 108 Cb 1.47 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 3dyr h LEU 108 CO 0.04 1.06 -0.64 0.00 0.09 0.00 0.00 178.44 179.00 3dyr h ALA 109 N 0.95 0.93 -2.37 1.53 0.00 -1.65 -3.44 119.26 115.21 3dyr h ALA 109 Ca 0.01 -0.58 -0.54 0.00 0.00 0.00 0.00 54.91 53.79 3dyr h ALA 109 Cb 1.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3dyr h ALA 109 CO 0.10 0.80 0.72 0.00 0.00 0.00 0.00 179.25 180.87 3dyr s ALA 110 N -3.54 3.51 -1.03 0.00 0.00 -1.19 -5.14 121.76 114.36 3dyr s ALA 110 Ca -0.01 0.77 0.08 0.00 0.00 0.00 0.00 51.96 52.80 3dyr s ALA 110 Cb 0.12 -3.53 0.07 0.00 0.00 0.00 0.00 23.12 19.78 3dyr s ALA 110 CO 0.76 -0.74 0.76 0.00 0.00 0.00 0.00 175.76 176.55