#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1geq s PHE 2 N 0.00 0.92 0.51 3.17 -0.12 -1.26 -4.89 117.98 116.31 1geq s PHE 2 Ca 0.00 -0.91 -0.21 0.00 -0.05 0.00 0.00 56.93 55.75 1geq s PHE 2 Cb 0.00 -0.53 -0.06 0.00 -0.63 0.00 0.00 43.02 41.80 1geq s PHE 2 CO 0.00 -0.14 1.21 0.15 -0.05 0.00 0.00 175.22 176.39 1geq s LYS 3 N -3.83 3.43 0.40 1.99 1.02 -1.26 -4.96 119.74 116.51 1geq s LYS 3 Ca 0.13 1.87 -0.27 0.00 0.02 0.00 0.00 55.97 57.71 1geq s LYS 3 Cb 0.05 -2.24 -0.09 0.00 -0.52 0.00 0.00 37.83 35.03 1geq s LYS 3 CO -0.04 -0.85 1.39 -0.51 -0.92 0.00 0.00 175.35 174.42 1geq s ASP 4 N -1.36 6.28 0.00 2.83 -0.00 -1.26 -2.48 116.67 120.67 1geq s ASP 4 Ca 0.69 2.85 0.00 0.00 -0.00 0.00 0.00 52.55 56.09 1geq s ASP 4 Cb -0.31 -2.65 0.00 0.00 -0.00 0.00 0.00 42.92 39.96 1geq s ASP 4 CO 0.36 -0.90 0.00 0.61 -0.00 0.00 0.00 175.17 175.25 1geq n GLY 5 N 0.61 0.61 3.78 0.21 0.00 0.29 -5.04 105.19 105.65 1geq n GLY 5 Ca 0.03 -0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1geq n GLY 5 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1geq s SER 6 N -2.04 6.65 -0.15 1.61 0.01 -1.03 -4.91 113.70 113.85 1geq s SER 6 Ca 0.00 2.03 -0.09 0.00 1.31 0.00 0.00 55.95 59.20 1geq s SER 6 Cb 0.00 -2.58 -0.05 0.00 0.21 0.00 0.00 66.02 63.60 1geq s SER 6 CO 0.00 -0.56 0.17 -0.22 0.41 0.00 0.00 173.24 173.04 1geq s LEU 7 N -2.81 4.31 -0.31 2.44 2.96 -1.26 -1.26 118.68 122.75 1geq s LEU 7 Ca 0.60 0.42 0.02 0.00 -0.22 0.00 0.00 54.13 54.95 1geq s LEU 7 Cb -0.21 -2.15 0.09 0.00 0.50 0.00 0.00 46.19 44.42 1geq s LEU 7 CO 0.26 0.29 0.04 -0.63 -1.32 0.00 0.00 176.35 174.99 1geq s ILE 8 N -0.36 1.85 0.47 6.68 1.01 0.39 -1.47 121.20 129.77 1geq s ILE 8 Ca 0.13 -1.94 -0.22 0.00 0.00 0.00 0.00 60.65 58.62 1geq s ILE 8 Cb -0.12 -2.31 -0.07 0.00 0.01 0.00 0.00 42.46 39.96 1geq s ILE 8 CO 0.02 -0.52 1.13 -2.84 0.00 0.00 0.00 174.94 172.74 1geq s PRO 9 N 1.14 3.73 -0.06 2.79 0.02 -1.23 -0.81 135.00 140.59 1geq s PRO 9 Ca 0.07 1.67 0.06 0.00 0.02 0.00 0.00 61.00 62.82 1geq s PRO 9 Cb -0.19 -2.32 -0.01 0.00 0.02 0.00 0.00 34.50 32.01 1geq s PRO 9 CO -0.12 -0.55 -0.25 -0.47 -0.33 0.00 0.00 177.00 175.29 1geq s TYR 10 N -1.64 2.43 0.00 6.54 5.04 -0.47 -0.82 117.35 128.43 1geq s TYR 10 Ca 0.65 -0.73 -0.02 0.00 -2.44 0.00 0.00 57.07 54.52 1geq s TYR 10 Cb -0.26 -1.60 -0.01 0.00 0.35 0.00 0.00 41.96 40.45 1geq s TYR 10 CO 0.31 -0.22 0.04 -0.51 -1.34 0.00 0.00 175.55 173.83 1geq s LEU 11 N -0.15 1.92 -0.11 6.97 1.43 -0.62 -4.58 118.68 123.53 1geq s LEU 11 Ca -0.04 -0.22 -0.19 0.00 -1.03 0.00 0.00 54.13 52.64 1geq s LEU 11 Cb -0.14 0.27 -0.04 0.00 0.03 0.00 0.00 46.19 46.31 1geq s LEU 11 CO 0.04 -0.22 0.52 -0.89 0.23 0.00 0.00 176.35 176.03 1geq s THR 12 N -0.94 5.16 0.21 5.49 2.01 -1.26 -0.35 115.64 125.95 1geq s THR 12 Ca -0.10 1.05 -0.31 0.00 0.31 0.00 0.00 61.69 62.64 1geq s THR 12 Cb -0.06 -3.86 -0.10 0.00 0.01 0.00 0.00 72.50 68.49 1geq s THR 12 CO -0.00 0.30 1.48 0.00 -0.69 0.00 0.00 174.62 175.71 1geq s ALA 13 N 0.72 3.67 0.00 7.40 0.00 0.12 -2.79 121.76 130.89 1geq s ALA 13 Ca 0.28 1.33 0.00 0.00 0.00 0.00 0.00 51.96 53.57 1geq s ALA 13 Cb -0.16 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.39 1geq s ALA 13 CO 0.12 -0.75 0.00 0.41 0.00 0.00 0.00 175.76 175.54 1geq n GLY 14 N 2.77 0.53 3.20 0.00 0.00 -1.26 -4.56 105.19 105.87 1geq n GLY 14 Ca 0.09 -0.30 -0.37 0.00 0.00 0.00 0.00 46.02 45.44 1geq n GLY 14 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1geq s ASP 15 N -2.27 5.29 0.34 1.61 3.68 -1.12 -2.05 116.67 122.14 1geq s ASP 15 Ca 0.00 -1.57 0.24 0.00 2.13 0.00 0.00 52.55 53.35 1geq s ASP 15 Cb 0.00 -1.85 0.49 0.00 -1.45 0.00 0.00 42.92 40.11 1geq s ASP 15 CO 0.00 -0.44 1.63 1.55 0.13 0.00 0.00 175.17 178.04 1geq h PRO 16 N 8.16 0.00 -3.16 4.34 0.13 -1.90 -3.42 132.00 136.16 1geq h PRO 16 Ca -0.19 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.92 1geq h PRO 16 Cb 1.07 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.09 1geq h PRO 16 CO 0.66 0.00 0.11 0.16 -0.23 0.00 0.00 178.00 178.70 1geq s ASP 17 N -5.50 -0.40 0.44 1.44 1.47 -0.87 -4.82 116.67 108.44 1geq s ASP 17 Ca 0.08 -0.24 0.12 0.00 1.18 0.00 0.00 52.55 53.68 1geq s ASP 17 Cb 0.08 0.58 1.01 0.00 -0.34 0.00 0.00 42.92 44.25 1geq s ASP 17 CO 0.65 -1.00 2.05 0.07 0.68 0.00 0.00 175.17 177.62 1geq h LYS 18 N 2.12 0.37 -0.26 2.11 2.10 -1.94 -2.02 116.57 119.06 1geq h LYS 18 Ca -0.31 -0.02 -0.19 0.00 -2.00 0.00 0.00 60.65 58.12 1geq h LYS 18 Cb 1.28 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 1geq h LYS 18 CO 0.38 0.25 -0.58 0.37 -2.00 0.00 0.00 179.45 177.87 1geq h GLN 19 N 0.39 0.85 -0.59 0.07 5.75 -1.97 -2.76 115.11 116.85 1geq h GLN 19 Ca 0.17 -0.57 -0.07 0.00 -0.15 0.00 0.00 58.65 58.03 1geq h GLN 19 Cb 0.18 0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 1geq h GLN 19 CO -0.04 1.20 0.10 0.77 -2.65 0.00 0.00 178.83 178.21 1geq h SER 20 N 0.62 0.93 -0.25 -0.69 0.02 -1.82 -1.65 113.55 110.71 1geq h SER 20 Ca 0.00 -0.26 0.05 0.00 -0.84 0.00 0.00 61.79 60.75 1geq h SER 20 Cb 1.19 -0.25 -0.05 0.00 0.14 0.00 0.00 62.40 63.43 1geq h SER 20 CO 0.13 0.95 -0.08 0.74 -1.14 0.00 0.00 176.83 177.43 1geq h THR 21 N 0.87 0.70 -0.47 -2.27 2.02 -1.35 0.24 112.91 112.65 1geq h THR 21 Ca 0.18 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.40 1geq h THR 21 Cb 0.42 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.48 1geq h THR 21 CO 0.01 0.00 0.23 0.25 0.37 0.00 0.00 175.52 176.39 1geq h LEU 22 N -0.03 0.34 -0.96 2.58 5.85 -1.27 -0.62 115.31 121.20 1geq h LEU 22 Ca 0.13 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.91 1geq h LEU 22 Cb 0.22 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.16 1geq h LEU 22 CO -0.28 0.24 0.63 0.78 -0.34 0.00 0.00 178.44 179.47 1geq h ASN 23 N 0.47 1.05 -0.29 1.25 2.35 -0.29 -1.42 115.58 118.69 1geq h ASN 23 Ca 0.21 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.92 1geq h ASN 23 Cb 0.12 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 1geq h ASN 23 CO -0.15 0.72 0.07 -0.26 -1.65 0.00 0.00 177.43 176.17 1geq h PHE 24 N 1.22 0.49 -0.45 1.19 0.04 0.30 -2.31 116.94 117.43 1geq h PHE 24 Ca 0.38 -0.06 0.02 0.00 2.80 0.00 0.00 57.97 61.11 1geq h PHE 24 Cb -0.01 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 37.96 1geq h PHE 24 CO -0.01 0.53 0.26 -0.07 -0.60 0.00 0.00 178.31 178.43 1geq h LEU 25 N 0.31 0.41 -1.33 1.54 3.38 -0.62 -1.45 115.31 117.55 1geq h LEU 25 Ca 0.09 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1geq h LEU 25 Cb 0.29 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1geq h LEU 25 CO 0.00 0.29 0.09 -0.07 0.09 0.00 0.00 178.44 178.84 1geq h LEU 26 N 0.52 0.50 -0.47 1.67 3.38 -1.21 -0.30 115.31 119.39 1geq h LEU 26 Ca 0.18 -0.07 -0.17 0.00 0.09 0.00 0.00 57.88 57.92 1geq h LEU 26 Cb 0.03 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1geq h LEU 26 CO -0.09 0.50 -0.76 0.00 0.09 0.00 0.00 178.44 178.18 1geq h ALA 27 N 1.57 0.71 0.00 1.53 0.00 -0.86 -3.27 119.26 118.94 1geq h ALA 27 Ca 0.12 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1geq h ALA 27 Cb 0.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1geq h ALA 27 CO -0.00 0.89 -0.76 1.28 0.00 0.00 0.00 179.25 180.66 1geq n LEU 28 N -3.69 0.64 -0.26 0.00 4.77 -0.60 -4.47 117.00 113.40 1geq n LEU 28 Ca -0.02 -0.08 0.06 0.00 -0.03 0.00 0.00 56.01 55.94 1geq n LEU 28 Cb 0.73 -0.15 0.19 0.00 -2.33 0.00 0.00 43.42 41.86 1geq n LEU 28 CO 0.45 0.11 0.98 -0.78 -1.33 0.00 0.00 177.39 176.83 1geq h ASP 29 N 0.00 0.18 0.22 -1.43 -0.00 -1.11 -1.12 116.42 113.16 1geq h ASP 29 Ca 0.00 0.13 0.00 0.00 -0.00 0.00 0.00 57.03 57.16 1geq h ASP 29 Cb 0.59 0.13 0.00 0.00 -0.00 0.00 0.00 39.33 40.05 1geq h ASP 29 CO 0.00 0.04 0.00 -1.84 -0.00 0.00 0.00 179.24 177.44 1geq n GLU 30 N -5.07 0.13 -0.00 0.28 0.28 -1.26 -1.96 120.64 113.04 1geq n GLU 30 Ca 0.15 0.54 0.06 0.00 -0.16 0.00 0.00 57.16 57.75 1geq n GLU 30 Cb 0.45 -1.84 -0.08 0.00 1.43 0.00 0.00 31.44 31.39 1geq n GLU 30 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1geq n TYR 31 N -2.10 0.00 -3.23 -1.84 4.02 -0.46 -5.02 117.16 108.53 1geq n TYR 31 Ca -0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.50 1geq n TYR 31 Cb 0.09 -0.09 -0.06 0.00 -0.02 0.00 0.00 39.34 39.26 1geq n TYR 31 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1geq s ALA 32 N -2.44 3.56 -0.14 -0.72 0.00 -0.83 -4.46 121.76 116.73 1geq s ALA 32 Ca 0.02 0.08 0.20 0.00 0.00 0.00 0.00 51.96 52.27 1geq s ALA 32 Cb 0.10 -2.68 -0.15 0.00 0.00 0.00 0.00 23.12 20.38 1geq s ALA 32 CO 0.55 0.38 0.74 0.41 0.00 0.00 0.00 175.76 177.84 1geq n GLY 33 N 1.64 -1.22 3.61 0.00 0.00 -0.54 -4.95 105.19 103.73 1geq n GLY 33 Ca -0.09 -0.29 -0.06 0.00 0.00 0.00 0.00 46.02 45.58 1geq n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1geq s ALA 34 N -3.22 -1.78 -0.03 4.61 0.00 -1.25 -4.51 121.76 115.57 1geq s ALA 34 Ca -0.04 0.66 0.02 0.00 0.00 0.00 0.00 51.96 52.59 1geq s ALA 34 Cb 0.10 0.49 0.01 0.00 0.00 0.00 0.00 23.12 23.72 1geq s ALA 34 CO 0.83 -0.85 -0.06 0.42 0.00 0.00 0.00 175.76 176.11 1geq s ILE 35 N -3.13 0.57 -0.24 0.00 1.01 -0.51 -3.51 121.20 115.39 1geq s ILE 35 Ca 0.08 -0.21 -0.08 0.00 0.00 0.00 0.00 60.65 60.45 1geq s ILE 35 Cb -0.01 -0.54 -0.03 0.00 0.01 0.00 0.00 42.46 41.89 1geq s ILE 35 CO -0.04 0.20 0.08 -1.61 0.00 0.00 0.00 174.94 173.57 1geq s GLU 36 N 0.46 3.73 -0.26 2.79 2.02 -0.00 -0.34 118.70 127.10 1geq s GLU 36 Ca -0.06 -0.44 -0.04 0.00 0.02 0.00 0.00 54.97 54.44 1geq s GLU 36 Cb -0.10 -3.34 0.01 0.00 0.10 0.00 0.00 34.13 30.80 1geq s GLU 36 CO 0.00 -0.12 -0.00 -1.17 0.02 0.00 0.00 175.26 173.99 1geq s LEU 37 N 1.45 3.40 -0.05 1.80 2.96 -0.15 -1.59 118.68 126.49 1geq s LEU 37 Ca 0.06 -0.71 -0.20 0.00 -0.22 0.00 0.00 54.13 53.06 1geq s LEU 37 Cb -0.15 -1.77 -0.05 0.00 0.50 0.00 0.00 46.19 44.73 1geq s LEU 37 CO 0.04 -0.13 0.55 -0.83 -1.32 0.00 0.00 176.35 174.66 1geq s GLY 38 N 1.42 2.53 -0.26 7.98 0.00 0.53 -0.66 107.32 118.86 1geq s GLY 38 Ca 0.02 -0.05 -0.19 0.00 0.00 0.00 0.00 44.72 44.50 1geq s GLY 38 CO -0.01 0.75 0.57 -0.42 0.00 0.00 0.00 173.10 173.98 1geq s ILE 39 N 0.10 5.03 0.34 0.90 1.01 0.20 0.15 121.20 128.92 1geq s ILE 39 Ca 0.29 0.98 -0.27 0.00 0.00 0.00 0.00 60.65 61.65 1geq s ILE 39 Cb -0.17 -3.88 -0.13 0.00 0.01 0.00 0.00 42.46 38.30 1geq s ILE 39 CO 0.15 0.05 1.14 -2.65 0.00 0.00 0.00 174.94 173.62 1geq n PRO 40 N 5.62 1.70 -3.86 2.79 -0.02 -1.26 -4.62 135.00 135.35 1geq n PRO 40 Ca -0.03 0.60 -0.12 0.00 -2.02 0.00 0.00 63.50 61.94 1geq n PRO 40 Cb 0.49 -2.10 -0.12 0.00 -0.02 0.00 0.00 33.50 31.75 1geq n PRO 40 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1geq s PHE 41 N -1.12 -0.03 0.43 6.00 5.36 -1.26 -4.99 117.98 122.37 1geq s PHE 41 Ca 0.58 0.09 0.28 0.00 -0.96 0.00 0.00 56.93 56.92 1geq s PHE 41 Cb -0.61 -0.01 1.50 0.00 -0.34 0.00 0.00 43.02 43.55 1geq s PHE 41 CO 0.60 -0.11 2.09 0.66 -1.46 0.00 0.00 175.22 177.01 1geq h SER 42 N 5.53 0.00 -2.09 6.13 4.64 -1.95 -3.32 113.55 122.48 1geq h SER 42 Ca -0.27 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.48 1geq h SER 42 Cb 1.20 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.89 1geq h SER 42 CO 0.44 0.10 -0.88 0.47 -0.87 0.00 0.00 176.83 176.10 1geq n ASP 43 N -3.63 1.91 -3.40 4.97 8.00 -1.26 -5.00 116.55 118.14 1geq n ASP 43 Ca -0.02 -3.07 -0.33 0.00 0.71 0.00 0.00 54.79 52.08 1geq n ASP 43 Cb 0.22 -0.65 -0.03 0.00 -0.02 0.00 0.00 41.12 40.65 1geq n ASP 43 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1geq n PRO 44 N 1.04 2.31 0.02 -0.24 -0.04 -1.25 -4.70 135.00 132.15 1geq n PRO 44 Ca 0.25 -1.85 0.04 0.00 -0.04 0.00 0.00 63.50 61.91 1geq n PRO 44 Cb 0.48 -2.75 0.19 0.00 -0.04 0.00 0.00 33.50 31.38 1geq n PRO 44 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1geq n ILE 45 N 4.71 1.46 0.92 0.52 -5.35 -1.26 -2.32 119.36 118.04 1geq n ILE 45 Ca 0.53 0.39 0.11 0.00 -0.27 0.00 0.00 62.75 63.51 1geq n ILE 45 Cb 0.26 -1.28 0.06 0.00 -1.74 0.00 0.00 39.64 36.93 1geq n ILE 45 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1geq n ALA 46 N -1.53 2.81 -2.82 -1.28 0.00 -1.26 -4.98 120.51 111.44 1geq n ALA 46 Ca 0.02 -0.65 -0.20 0.00 0.00 0.00 0.00 53.44 52.60 1geq n ALA 46 Cb 0.09 -0.74 -0.02 0.00 0.00 0.00 0.00 19.45 18.78 1geq n ALA 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1geq s ASP 47 N -2.00 6.16 0.84 0.00 1.11 -0.98 -5.05 116.67 116.75 1geq s ASP 47 Ca 0.23 -0.03 -0.12 0.00 0.18 0.00 0.00 52.55 52.81 1geq s ASP 47 Cb 0.18 -1.65 0.10 0.00 1.07 0.00 0.00 42.92 42.62 1geq s ASP 47 CO 0.36 -0.17 1.15 -0.83 1.18 0.00 0.00 175.17 176.86 1geq s GLY 48 N -4.02 1.59 0.17 0.21 0.00 -1.26 -4.77 107.32 99.23 1geq s GLY 48 Ca 0.37 -0.54 -0.16 0.00 0.00 0.00 0.00 44.72 44.39 1geq s GLY 48 CO 0.29 -0.03 1.69 1.70 0.00 0.00 0.00 173.10 176.75 1geq h LYS 49 N -1.22 0.10 -0.45 2.90 3.64 -1.97 -1.31 116.57 118.26 1geq h LYS 49 Ca -0.48 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 58.97 1geq h LYS 49 Cb 1.32 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 33.06 1geq h LYS 49 CO 0.64 0.07 0.10 1.15 -2.27 0.00 0.00 179.45 179.13 1geq h THR 50 N 0.10 0.77 -0.47 1.00 2.02 -1.96 -0.95 112.91 113.42 1geq h THR 50 Ca 0.20 -0.08 -0.14 0.00 0.77 0.00 0.00 66.41 67.16 1geq h THR 50 Cb 0.29 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 1geq h THR 50 CO -0.34 0.04 -0.25 0.40 0.37 0.00 0.00 175.52 175.75 1geq h ILE 51 N 0.24 1.27 -0.65 3.11 1.08 -1.87 -2.93 117.51 117.76 1geq h ILE 51 Ca 0.22 -1.41 0.05 0.00 -0.39 0.00 0.00 64.86 63.32 1geq h ILE 51 Cb 0.27 1.16 -0.05 0.00 -3.07 0.00 0.00 36.82 35.14 1geq h ILE 51 CO -0.28 0.49 0.37 1.56 -0.69 0.00 0.00 178.15 179.59 1geq h GLN 52 N 0.85 0.67 0.00 2.37 4.20 -0.70 -0.91 115.11 121.59 1geq h GLN 52 Ca 0.10 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 1geq h GLN 52 Cb 0.83 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.46 1geq h GLN 52 CO 0.07 0.45 -0.09 0.93 -0.67 0.00 0.00 178.83 179.52 1geq h GLU 53 N 0.69 0.00 -0.02 1.46 5.08 -1.07 -1.95 114.58 118.78 1geq h GLU 53 Ca 0.28 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.40 1geq h GLU 53 Cb 0.14 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.40 1geq h GLU 53 CO -0.16 0.09 -0.95 0.66 -1.00 0.00 0.00 179.01 177.65 1geq h SER 54 N 0.00 0.68 -0.59 1.42 4.64 -1.01 -1.85 113.55 116.84 1geq h SER 54 Ca -0.00 -0.53 -0.01 0.00 -0.47 0.00 0.00 61.79 60.78 1geq h SER 54 Cb 0.19 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.05 1geq h SER 54 CO 0.01 1.33 0.32 0.45 -0.87 0.00 0.00 176.83 178.07 1geq h HIS 55 N 0.31 0.81 -0.61 4.77 3.86 -0.73 -1.54 115.15 122.02 1geq h HIS 55 Ca -0.09 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.08 1geq h HIS 55 Cb 1.59 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 29.77 1geq h HIS 55 CO 0.07 0.59 0.31 1.88 0.86 0.00 0.00 177.93 181.65 1geq h TYR 56 N 0.80 0.86 0.08 2.45 0.99 -1.31 -1.55 116.97 119.30 1geq h TYR 56 Ca 0.21 -0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.90 1geq h TYR 56 Cb 0.05 -0.27 0.00 0.00 1.00 0.00 0.00 36.73 37.51 1geq h TYR 56 CO -0.01 0.64 -0.04 0.00 -0.00 0.00 0.00 178.16 178.75 1geq h ARG 57 N 0.83 -0.11 -0.57 4.88 3.08 -1.05 -0.15 114.38 121.29 1geq h ARG 57 Ca 0.21 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.33 1geq h ARG 57 Cb 0.09 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.11 1geq h ARG 57 CO -0.03 -0.01 0.28 0.00 -1.07 0.00 0.00 179.97 179.14 1geq h ALA 58 N 0.74 0.75 -0.45 0.04 0.00 -1.14 -0.19 119.26 119.01 1geq h ALA 58 Ca -0.01 0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 1geq h ALA 58 Cb 0.14 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1geq h ALA 58 CO 0.02 -0.08 -0.22 -0.07 0.00 0.00 0.00 179.25 178.90 1geq h LEU 59 N 0.52 0.94 -1.05 0.00 3.38 -1.16 -2.20 115.31 115.73 1geq h LEU 59 Ca 0.26 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1geq h LEU 59 Cb 0.21 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1geq h LEU 59 CO -0.20 1.12 0.24 0.11 0.09 0.00 0.00 178.44 179.80 1geq h LYS 60 N 0.79 0.92 0.00 1.13 1.79 -0.32 -1.05 116.57 119.83 1geq h LYS 60 Ca 0.11 -0.15 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1geq h LYS 60 Cb 0.77 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.27 1geq h LYS 60 CO 0.06 0.76 0.00 0.09 -1.08 0.00 0.00 179.45 179.28 1geq n ASN 61 N -4.31 0.00 -0.92 0.86 5.03 -0.15 -4.89 115.26 110.88 1geq n ASN 61 Ca 0.05 -1.29 -0.00 0.00 0.87 0.00 0.00 54.58 54.22 1geq n ASN 61 Cb 0.17 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.93 1geq n ASN 61 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1geq n GLY 62 N 0.58 0.52 3.78 7.41 0.00 -0.40 -5.04 105.19 112.04 1geq n GLY 62 Ca 0.11 -0.51 -0.37 0.00 0.00 0.00 0.00 46.02 45.25 1geq n GLY 62 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1geq s PHE 63 N -3.00 3.40 -0.04 1.61 2.19 -0.85 -5.03 117.98 116.26 1geq s PHE 63 Ca 0.00 1.68 0.07 0.00 0.33 0.00 0.00 56.93 59.01 1geq s PHE 63 Cb -0.00 -3.08 -0.01 0.00 -1.31 0.00 0.00 43.02 38.61 1geq s PHE 63 CO 0.00 -0.41 -0.24 0.15 1.83 0.00 0.00 175.22 176.55 1geq s LYS 64 N -2.32 2.28 0.22 10.12 3.01 -1.26 -4.91 119.74 126.88 1geq s LYS 64 Ca 0.55 -0.88 -0.17 0.00 -1.01 0.00 0.00 55.97 54.45 1geq s LYS 64 Cb -0.22 -2.04 0.22 0.00 -1.01 0.00 0.00 37.83 34.79 1geq s LYS 64 CO 0.27 0.44 1.57 1.25 0.51 0.00 0.00 175.35 179.39 1geq h LEU 65 N 5.85 -1.22 -2.57 3.17 5.85 -1.97 0.94 115.31 125.37 1geq h LEU 65 Ca -0.36 0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 1geq h LEU 65 Cb 1.15 0.65 -0.00 0.00 0.37 0.00 0.00 40.66 42.83 1geq h LEU 65 CO 0.47 -0.29 -0.01 0.03 -0.34 0.00 0.00 178.44 178.29 1geq h ARG 66 N -0.06 0.00 0.00 1.25 2.47 -2.02 -1.57 114.38 114.45 1geq h ARG 66 Ca 0.32 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 59.02 1geq h ARG 66 Cb 0.59 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.90 1geq h ARG 66 CO -0.86 0.01 -0.07 0.93 0.56 0.00 0.00 179.97 180.55 1geq h GLU 67 N 0.00 0.00 -0.54 0.04 5.08 -1.22 -0.94 114.58 117.00 1geq h GLU 67 Ca -0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1geq h GLU 67 Cb 0.05 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 1geq h GLU 67 CO 0.00 0.07 0.22 0.00 -1.00 0.00 0.00 179.01 178.29 1geq h ALA 68 N 1.93 0.70 0.00 3.43 0.00 -1.37 -1.44 119.26 122.51 1geq h ALA 68 Ca -0.00 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1geq h ALA 68 Cb 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1geq h ALA 68 CO 0.01 0.31 -0.30 0.74 0.00 0.00 0.00 179.25 180.00 1geq h PHE 69 N 0.73 0.00 -0.25 0.00 0.04 -1.33 -2.59 116.94 113.54 1geq h PHE 69 Ca 0.18 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.90 1geq h PHE 69 Cb 0.20 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.34 1geq h PHE 69 CO 0.01 0.30 -0.04 2.35 -0.60 0.00 0.00 178.31 180.33 1geq h TRP 70 N 0.00 0.52 -0.10 -0.55 7.01 -0.97 -1.25 115.95 120.60 1geq h TRP 70 Ca -0.00 -0.11 0.03 0.00 2.11 0.00 0.00 58.89 60.92 1geq h TRP 70 Cb 0.55 -0.13 -0.03 0.00 -2.10 0.00 0.00 29.16 27.45 1geq h TRP 70 CO 0.00 0.67 -0.09 0.82 -2.79 0.00 0.00 178.44 177.05 1geq h ILE 71 N 0.22 0.74 -0.55 2.65 2.04 -0.94 -0.37 117.51 121.30 1geq h ILE 71 Ca 0.07 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.90 1geq h ILE 71 Cb 0.49 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 1geq h ILE 71 CO 0.02 0.00 0.24 0.58 0.00 0.00 0.00 178.15 178.99 1geq h VAL 72 N -0.10 1.21 -0.11 1.67 2.07 -1.45 -0.17 116.25 119.37 1geq h VAL 72 Ca 0.07 -0.63 0.02 0.00 0.82 0.00 0.00 66.70 66.97 1geq h VAL 72 Cb 0.21 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1geq h VAL 72 CO -0.17 0.25 -0.01 0.50 0.02 0.00 0.00 177.57 178.17 1geq h LYS 73 N 0.75 0.03 -0.81 1.57 3.64 -0.88 0.14 116.57 121.00 1geq h LYS 73 Ca 0.19 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.53 1geq h LYS 73 Cb 0.16 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.94 1geq h LYS 73 CO -0.02 0.02 0.36 0.93 -2.27 0.00 0.00 179.45 178.47 1geq h GLU 74 N 0.03 1.19 -0.72 1.90 4.39 -0.89 -2.49 114.58 117.99 1geq h GLU 74 Ca 0.05 -0.20 -0.06 0.00 0.34 0.00 0.00 59.36 59.50 1geq h GLU 74 Cb 0.06 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.48 1geq h GLU 74 CO -0.09 0.94 0.23 0.35 -1.16 0.00 0.00 179.01 179.28 1geq h PHE 75 N 1.17 1.14 0.00 4.33 3.57 -0.58 -2.33 116.94 124.24 1geq h PHE 75 Ca 0.28 -0.11 -0.00 0.00 3.53 0.00 0.00 57.97 61.67 1geq h PHE 75 Cb 0.17 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 38.57 1geq h PHE 75 CO 0.02 0.90 -0.00 0.00 -2.23 0.00 0.00 178.31 177.00 1geq h ARG 76 N 1.07 0.00 0.00 1.11 2.47 -0.26 -0.09 114.38 118.67 1geq h ARG 76 Ca 0.23 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.95 1geq h ARG 76 Cb 0.29 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.61 1geq h ARG 76 CO -0.01 0.00 0.00 0.00 0.56 0.00 0.00 179.97 180.52 1geq h ARG 77 N 0.00 0.00 0.00 0.04 3.08 -1.31 -3.29 114.38 112.89 1geq h ARG 77 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1geq h ARG 77 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1geq h ARG 77 CO 0.00 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.62 1geq n HIS 78 N -3.06 0.00 -3.66 3.04 8.25 -0.15 -5.09 115.22 114.55 1geq n HIS 78 Ca 0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.36 1geq n HIS 78 Cb 0.34 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.40 1geq n HIS 78 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1geq s SER 79 N -0.71 -0.23 0.00 0.41 0.15 -0.57 -5.02 113.70 107.72 1geq s SER 79 Ca 0.00 -0.21 0.08 0.00 0.70 0.00 0.00 55.95 56.52 1geq s SER 79 Cb 0.00 0.45 0.18 0.00 -1.71 0.00 0.00 66.02 64.93 1geq s SER 79 CO 0.00 -0.77 1.06 -1.54 1.20 0.00 0.00 173.24 173.18 1geq n SER 80 N 0.07 2.38 -4.69 5.45 3.41 -1.26 -4.37 113.62 114.60 1geq n SER 80 Ca -0.17 -1.80 -0.45 0.00 -0.26 0.00 0.00 58.87 56.20 1geq n SER 80 Cb 0.62 -0.12 -0.04 0.00 -0.26 0.00 0.00 64.21 64.42 1geq n SER 80 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1geq n THR 81 N 0.32 0.01 -1.64 6.66 -1.04 -1.26 -4.87 114.28 112.46 1geq n THR 81 Ca 0.07 -0.00 -0.46 0.00 -2.04 0.00 0.00 64.05 61.63 1geq n THR 81 Cb 0.33 -1.70 -0.03 0.00 -1.82 0.00 0.00 70.33 67.11 1geq n THR 81 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1geq n PRO 82 N 3.60 1.73 -5.11 -2.82 -0.02 -1.26 -4.85 135.00 126.27 1geq n PRO 82 Ca 0.17 0.61 -0.31 0.00 -2.02 0.00 0.00 63.50 61.95 1geq n PRO 82 Cb 0.31 -2.19 -0.17 0.00 -0.02 0.00 0.00 33.50 31.43 1geq n PRO 82 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1geq s ILE 83 N -0.29 1.96 -0.19 4.25 -1.09 -1.26 -1.42 121.20 123.16 1geq s ILE 83 Ca 0.67 -0.96 -0.01 0.00 -2.23 0.00 0.00 60.65 58.12 1geq s ILE 83 Cb -0.70 -1.70 0.00 0.00 -1.58 0.00 0.00 42.46 38.48 1geq s ILE 83 CO 0.53 0.54 -0.13 -0.69 -1.23 0.00 0.00 174.94 173.95 1geq s VAL 84 N 0.41 2.70 -0.11 2.92 1.01 0.54 -1.49 120.40 126.39 1geq s VAL 84 Ca -0.18 -0.73 -0.23 0.00 0.00 0.00 0.00 61.98 60.84 1geq s VAL 84 Cb -0.18 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 1geq s VAL 84 CO 0.08 0.49 0.72 -0.22 0.00 0.00 0.00 175.10 176.16 1geq s LEU 85 N 1.26 4.26 -0.15 3.92 2.96 -0.30 -0.98 118.68 129.65 1geq s LEU 85 Ca 0.03 1.13 -0.03 0.00 -0.22 0.00 0.00 54.13 55.04 1geq s LEU 85 Cb -0.14 -3.08 -0.03 0.00 0.50 0.00 0.00 46.19 43.44 1geq s LEU 85 CO -0.07 -0.20 -0.05 -0.32 -1.32 0.00 0.00 176.35 174.40 1geq s MET 86 N 1.25 3.64 0.13 1.98 -2.45 0.17 -0.94 119.30 123.08 1geq s MET 86 Ca 0.36 -0.54 -0.18 0.00 -1.25 0.00 0.00 55.69 54.09 1geq s MET 86 Cb -0.17 -2.89 0.04 0.00 1.25 0.00 0.00 34.83 33.07 1geq s MET 86 CO 0.16 0.24 0.45 -0.08 1.05 0.00 0.00 175.02 176.83 1geq s THR 87 N 0.36 0.05 0.56 10.11 -1.32 -0.31 -0.63 115.64 124.47 1geq s THR 87 Ca -0.05 -0.44 -0.06 0.00 -1.21 0.00 0.00 61.69 59.93 1geq s THR 87 Cb -0.14 -1.13 -0.01 0.00 -1.51 0.00 0.00 72.50 69.71 1geq s THR 87 CO 0.03 -0.24 0.88 -0.31 -2.21 0.00 0.00 174.62 172.77 1geq s TYR 88 N -3.79 3.36 0.22 9.09 1.51 -1.26 -1.22 117.35 125.26 1geq s TYR 88 Ca 0.02 0.73 -0.02 0.00 -1.01 0.00 0.00 57.07 56.79 1geq s TYR 88 Cb 0.01 -2.62 0.21 0.00 -0.11 0.00 0.00 41.96 39.46 1geq s TYR 88 CO -0.12 -0.67 1.60 -0.92 -1.11 0.00 0.00 175.55 174.33 1geq h TYR 89 N -0.08 0.71 -0.72 2.71 3.20 -1.93 -3.35 116.97 117.51 1geq h TYR 89 Ca -0.46 -0.20 0.09 0.00 3.14 0.00 0.00 58.73 61.31 1geq h TYR 89 Cb 1.24 -0.16 -0.11 0.00 1.54 0.00 0.00 36.73 39.24 1geq h TYR 89 CO 0.51 0.89 -0.48 -0.97 -1.64 0.00 0.00 178.16 176.47 1geq h ASN 90 N 0.50 -1.69 0.23 -2.11 -1.24 -1.95 0.37 115.58 109.69 1geq h ASN 90 Ca 0.05 0.28 0.01 0.00 0.71 0.00 0.00 56.30 57.34 1geq h ASN 90 Cb 0.87 0.77 -0.04 0.00 0.73 0.00 0.00 38.32 40.65 1geq h ASN 90 CO 0.07 -0.31 -0.42 -0.65 -1.29 0.00 0.00 177.43 174.83 1geq h PRO 91 N -0.16 -0.70 -0.52 6.67 0.11 -1.98 0.18 132.00 135.59 1geq h PRO 91 Ca 0.19 0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.34 1geq h PRO 91 Cb 0.54 0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.78 1geq h PRO 91 CO -0.78 -0.47 0.31 0.97 -0.21 0.00 0.00 178.00 177.82 1geq h ILE 92 N -0.73 1.16 -0.26 4.15 2.10 -1.65 -1.86 117.51 120.42 1geq h ILE 92 Ca -0.00 -0.38 -0.00 0.00 1.08 0.00 0.00 64.86 65.56 1geq h ILE 92 Cb 0.71 0.47 -0.01 0.00 -1.09 0.00 0.00 36.82 36.89 1geq h ILE 92 CO -0.17 0.17 0.15 0.22 -1.08 0.00 0.00 178.15 177.43 1geq h TYR 93 N 0.70 0.35 0.00 2.19 3.20 -0.11 0.10 116.97 123.41 1geq h TYR 93 Ca 0.19 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.05 1geq h TYR 93 Cb 0.00 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.16 1geq h TYR 93 CO -0.02 0.29 0.00 -0.09 -1.64 0.00 0.00 178.16 176.69 1geq h ARG 94 N 0.32 0.00 0.00 1.82 2.43 -0.48 -2.69 114.38 115.78 1geq h ARG 94 Ca 0.09 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1geq h ARG 94 Cb 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1geq h ARG 94 CO -0.02 0.00 -1.08 0.00 -1.51 0.00 0.00 179.97 177.36 1geq n ALA 95 N -1.87 3.74 -0.11 2.80 0.00 -0.71 -5.07 120.51 119.29 1geq n ALA 95 Ca 0.01 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1geq n ALA 95 Cb 0.22 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1geq n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1geq n GLY 96 N 1.43 0.42 0.41 0.00 0.00 0.31 -4.56 105.19 103.20 1geq n GLY 96 Ca 0.01 -1.01 -0.10 0.00 0.00 0.00 0.00 46.02 44.92 1geq n GLY 96 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1geq h VAL 97 N 0.00 0.08 -0.15 1.61 2.07 -1.79 0.93 116.25 118.99 1geq h VAL 97 Ca 0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 1geq h VAL 97 Cb 0.00 0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 29.80 1geq h VAL 97 CO 0.00 0.00 -0.12 -0.09 0.02 0.00 0.00 177.57 177.38 1geq h ARG 98 N -0.31 -0.13 -0.43 1.57 2.43 -1.92 0.29 114.38 115.88 1geq h ARG 98 Ca 0.13 0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.38 1geq h ARG 98 Cb 0.58 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 30.10 1geq h ARG 98 CO -0.62 -0.09 0.10 -0.91 -1.51 0.00 0.00 179.97 176.95 1geq h ASN 99 N -0.13 0.03 0.77 -3.80 2.35 -1.66 -0.92 115.58 112.22 1geq h ASN 99 Ca 0.10 0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 55.88 1geq h ASN 99 Cb 0.27 0.09 0.01 0.00 0.05 0.00 0.00 38.32 38.74 1geq h ASN 99 CO -0.23 0.05 -0.38 0.15 -1.65 0.00 0.00 177.43 175.37 1geq h PHE 100 N 0.23 -0.98 -0.92 1.19 3.57 -0.28 -2.08 116.94 117.68 1geq h PHE 100 Ca 0.21 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.79 1geq h PHE 100 Cb 0.25 0.33 -0.07 0.00 2.79 0.00 0.00 35.95 39.25 1geq h PHE 100 CO -0.20 -0.60 0.59 -0.07 -2.23 0.00 0.00 178.31 175.80 1geq h LEU 101 N -1.04 0.82 0.05 0.59 3.38 -0.81 -0.27 115.31 118.03 1geq h LEU 101 Ca -0.10 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1geq h LEU 101 Cb 0.80 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1geq h LEU 101 CO 0.17 0.47 -0.02 0.00 0.09 0.00 0.00 178.44 179.15 1geq h ALA 102 N 1.55 -0.07 -0.17 1.53 0.00 -1.02 -0.56 119.26 120.52 1geq h ALA 102 Ca 0.43 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 1geq h ALA 102 Cb 0.44 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1geq h ALA 102 CO -0.19 -0.46 -0.25 1.49 0.00 0.00 0.00 179.25 179.83 1geq h GLU 103 N -0.23 0.31 -0.07 0.00 4.81 -0.97 -0.09 114.58 118.33 1geq h GLU 103 Ca -0.01 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1geq h GLU 103 Cb 0.20 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.56 1geq h GLU 103 CO 0.01 0.54 0.03 0.00 -0.73 0.00 0.00 179.01 178.86 1geq h ALA 104 N 1.46 0.09 -0.87 2.92 0.00 -0.84 -1.18 119.26 120.85 1geq h ALA 104 Ca 0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1geq h ALA 104 Cb 0.60 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1geq h ALA 104 CO 0.04 -0.31 0.49 -0.22 0.00 0.00 0.00 179.25 179.25 1geq h LYS 105 N -0.06 1.21 -0.59 0.00 1.63 -0.86 -1.77 116.57 116.14 1geq h LYS 105 Ca 0.02 -0.13 -0.00 0.00 -0.85 0.00 0.00 60.65 59.69 1geq h LYS 105 Cb 0.19 -0.24 -0.03 0.00 -0.60 0.00 0.00 32.23 31.55 1geq h LYS 105 CO -0.00 0.88 0.36 0.00 -3.45 0.00 0.00 179.45 177.23 1geq h ALA 106 N 1.26 1.52 0.00 5.00 0.00 -0.66 -2.22 119.26 124.16 1geq h ALA 106 Ca 0.31 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1geq h ALA 106 Cb 0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1geq h ALA 106 CO -0.05 0.42 -0.08 0.77 0.00 0.00 0.00 179.25 180.30 1geq h SER 107 N 0.81 0.00 0.00 0.00 0.02 -0.66 -3.47 113.55 110.25 1geq h SER 107 Ca 0.21 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 1geq h SER 107 Cb -0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1geq h SER 107 CO -0.04 0.08 0.00 0.61 -1.14 0.00 0.00 176.83 176.34 1geq n GLY 108 N 0.69 1.53 3.73 -3.77 0.00 -0.84 -3.72 105.19 102.81 1geq n GLY 108 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1geq n GLY 108 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1geq s VAL 109 N -2.00 3.67 -0.19 1.61 1.01 -0.72 -4.76 120.40 119.03 1geq s VAL 109 Ca 0.00 1.39 -0.09 0.00 0.00 0.00 0.00 61.98 63.28 1geq s VAL 109 Cb 0.00 -3.89 -0.21 0.00 0.00 0.00 0.00 36.38 32.29 1geq s VAL 109 CO 0.00 0.21 0.09 0.47 0.00 0.00 0.00 175.10 175.88 1geq n ASP 110 N 2.64 2.01 -4.24 3.32 9.92 -0.55 -4.47 116.55 125.18 1geq n ASP 110 Ca 0.05 0.19 -0.13 0.00 -0.53 0.00 0.00 54.79 54.36 1geq n ASP 110 Cb 0.45 -0.78 -0.10 0.00 -0.64 0.00 0.00 41.12 40.05 1geq n ASP 110 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1geq s GLY 111 N -5.63 1.30 0.01 0.44 0.00 -0.80 -1.31 107.32 101.32 1geq s GLY 111 Ca -0.29 -1.63 0.01 0.00 0.00 0.00 0.00 44.72 42.81 1geq s GLY 111 CO 0.65 -1.51 -0.04 -1.50 0.00 0.00 0.00 173.10 170.70 1geq s ILE 112 N -3.75 0.30 -0.16 0.90 2.07 0.01 -1.15 121.20 119.41 1geq s ILE 112 Ca 0.27 -0.42 -0.00 0.00 -1.41 0.00 0.00 60.65 59.10 1geq s ILE 112 Cb 0.07 -0.30 0.04 0.00 0.13 0.00 0.00 42.46 42.39 1geq s ILE 112 CO 0.06 -0.08 -0.08 -0.22 -1.91 0.00 0.00 174.94 172.71 1geq s LEU 113 N -0.53 1.70 -0.43 8.50 2.96 -0.11 -1.23 118.68 129.54 1geq s LEU 113 Ca -0.03 -0.63 -0.11 0.00 -0.22 0.00 0.00 54.13 53.14 1geq s LEU 113 Cb -0.04 -1.00 0.07 0.00 0.50 0.00 0.00 46.19 45.72 1geq s LEU 113 CO -0.00 -0.15 0.30 -0.69 -1.32 0.00 0.00 176.35 174.49 1geq s VAL 114 N 1.58 4.56 0.18 1.68 1.01 -1.26 -1.16 120.40 126.99 1geq s VAL 114 Ca 0.02 -1.25 -0.16 0.00 0.00 0.00 0.00 61.98 60.59 1geq s VAL 114 Cb -0.15 -3.75 0.13 0.00 0.00 0.00 0.00 36.38 32.62 1geq s VAL 114 CO -0.08 -0.51 1.66 0.58 0.00 0.00 0.00 175.10 176.75 1geq h VAL 115 N 5.96 0.55 -1.26 2.92 2.07 -1.51 -3.17 116.25 121.82 1geq h VAL 115 Ca -0.25 -0.01 -0.60 0.00 0.82 0.00 0.00 66.70 66.67 1geq h VAL 115 Cb 1.09 0.53 -0.40 0.00 -1.52 0.00 0.00 31.29 30.99 1geq h VAL 115 CO 0.79 0.00 -0.48 -0.90 0.02 0.00 0.00 177.57 177.00 1geq n ASP 116 N -5.32 5.26 -4.66 0.57 5.75 -1.26 -4.99 116.55 111.89 1geq n ASP 116 Ca 0.04 -3.75 -0.42 0.00 -0.01 0.00 0.00 54.79 50.65 1geq n ASP 116 Cb 0.25 -0.51 -0.03 0.00 -1.03 0.00 0.00 41.12 39.81 1geq n ASP 116 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1geq s LEU 117 N -3.63 4.28 0.19 -2.12 2.96 -1.20 -4.64 118.68 114.51 1geq s LEU 117 Ca 0.51 2.06 -0.33 0.00 -0.22 0.00 0.00 54.13 56.14 1geq s LEU 117 Cb 0.41 -3.54 -0.14 0.00 0.50 0.00 0.00 46.19 43.43 1geq s LEU 117 CO -0.12 -0.85 1.55 -2.65 -1.32 0.00 0.00 176.35 172.96 1geq n PRO 118 N 6.73 2.18 -0.24 0.98 -0.02 -1.26 -4.85 135.00 138.52 1geq n PRO 118 Ca 0.16 0.78 0.16 0.00 -2.02 0.00 0.00 63.50 62.58 1geq n PRO 118 Cb 0.43 -2.53 0.45 0.00 -0.02 0.00 0.00 33.50 31.84 1geq n PRO 118 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1geq h VAL 119 N 3.48 0.75 -0.10 -1.45 3.04 -2.02 -0.70 116.25 119.26 1geq h VAL 119 Ca -0.45 -0.18 -0.04 0.00 -1.01 0.00 0.00 66.70 65.02 1geq h VAL 119 Cb 1.25 0.18 -0.02 0.00 -2.01 0.00 0.00 31.29 30.69 1geq h VAL 119 CO 0.86 0.10 0.05 0.49 -1.01 0.00 0.00 177.57 178.05 1geq n PHE 120 N -4.54 0.30 0.00 3.17 3.72 -1.26 -2.64 117.46 116.21 1geq n PHE 120 Ca 0.18 -0.46 0.00 0.00 -0.05 0.00 0.00 57.45 57.12 1geq n PHE 120 Cb 0.58 -0.27 0.00 0.00 -0.94 0.00 0.00 39.48 38.85 1geq n PHE 120 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1geq n HIS 121 N 0.24 0.00 -0.15 1.38 8.25 -0.28 -4.87 115.22 119.78 1geq n HIS 121 Ca 0.05 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.49 1geq n HIS 121 Cb 0.54 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.71 1geq n HIS 121 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1geq h ALA 122 N 0.00 0.54 0.05 -1.41 0.00 -1.38 0.48 119.26 117.54 1geq h ALA 122 Ca 0.00 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1geq h ALA 122 Cb 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1geq h ALA 122 CO 0.00 -0.32 -0.07 0.87 0.00 0.00 0.00 179.25 179.73 1geq h LYS 123 N 0.22 -0.14 -0.19 0.00 1.79 -1.90 0.13 116.57 116.49 1geq h LYS 123 Ca 0.24 0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.74 1geq h LYS 123 Cb 0.33 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.99 1geq h LYS 123 CO -0.33 -0.09 0.07 1.49 -1.08 0.00 0.00 179.45 179.51 1geq h GLU 124 N -0.14 0.16 -0.15 3.15 4.81 -1.83 -2.15 114.58 118.44 1geq h GLU 124 Ca 0.01 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.27 1geq h GLU 124 Cb 0.15 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 1geq h GLU 124 CO -0.03 0.11 -0.10 0.35 -0.73 0.00 0.00 179.01 178.60 1geq h PHE 125 N 0.17 -0.25 -0.25 0.92 3.57 -0.66 -1.91 116.94 118.53 1geq h PHE 125 Ca 0.08 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.61 1geq h PHE 125 Cb 0.04 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 1geq h PHE 125 CO -0.11 -0.16 0.17 1.79 -2.23 0.00 0.00 178.31 177.77 1geq h THR 126 N -0.11 1.04 0.21 4.41 1.35 -0.78 -0.46 112.91 118.56 1geq h THR 126 Ca 0.09 -0.10 -0.01 0.00 -0.55 0.00 0.00 66.41 65.84 1geq h THR 126 Cb 0.24 0.72 0.00 0.00 -1.73 0.00 0.00 68.15 67.38 1geq h THR 126 CO -0.21 0.05 -0.10 -0.08 -0.25 0.00 0.00 175.52 174.93 1geq h GLU 127 N 0.29 -0.27 -0.59 4.72 4.81 -0.69 -2.36 114.58 120.48 1geq h GLU 127 Ca 0.10 0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.25 1geq h GLU 127 Cb 0.04 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1geq h GLU 127 CO -0.02 -0.02 -0.02 0.82 -0.73 0.00 0.00 179.01 179.03 1geq h ILE 128 N -0.49 1.27 -0.32 2.32 2.04 -1.05 -2.05 117.51 119.22 1geq h ILE 128 Ca -0.03 -1.17 0.04 0.00 1.00 0.00 0.00 64.86 64.70 1geq h ILE 128 Cb 0.37 0.83 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 1geq h ILE 128 CO 0.05 0.42 0.09 0.00 0.00 0.00 0.00 178.15 178.71 1geq h ALA 129 N 1.00 0.36 -0.41 1.87 0.00 -1.09 0.22 119.26 121.21 1geq h ALA 129 Ca 0.17 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1geq h ALA 129 Cb 0.58 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1geq h ALA 129 CO 0.03 -0.31 0.26 -0.09 0.00 0.00 0.00 179.25 179.14 1geq h ARG 130 N 0.22 0.51 -0.62 0.00 2.43 -1.27 0.26 114.38 115.90 1geq h ARG 130 Ca 0.15 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.27 1geq h ARG 130 Cb 0.14 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.54 1geq h ARG 130 CO -0.17 0.34 0.31 0.93 -1.51 0.00 0.00 179.97 179.87 1geq h GLU 131 N 0.52 0.87 -0.01 0.20 5.08 -0.63 -1.48 114.58 119.14 1geq h GLU 131 Ca 0.16 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1geq h GLU 131 Cb -0.03 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.05 1geq h GLU 131 CO -0.05 0.67 -0.01 0.39 -1.00 0.00 0.00 179.01 179.00 1geq n GLU 132 N -4.36 1.31 -2.03 2.33 -0.58 0.70 -4.92 120.64 113.08 1geq n GLU 132 Ca 0.06 -0.50 -0.05 0.00 -0.42 0.00 0.00 57.16 56.24 1geq n GLU 132 Cb 0.12 -1.49 -0.00 0.00 -0.57 0.00 0.00 31.44 29.50 1geq n GLU 132 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1geq n GLY 133 N 1.11 0.19 3.51 0.62 0.00 -0.22 -4.90 105.19 105.51 1geq n GLY 133 Ca 0.21 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 45.22 1geq n GLY 133 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1geq s ILE 134 N -2.26 3.79 0.31 -0.61 -1.09 0.74 -5.00 121.20 117.08 1geq s ILE 134 Ca 0.00 -0.41 -0.27 0.00 -2.23 0.00 0.00 60.65 57.74 1geq s ILE 134 Cb 0.00 -2.63 -0.10 0.00 -1.58 0.00 0.00 42.46 38.15 1geq s ILE 134 CO 0.00 0.52 0.96 -0.54 -1.23 0.00 0.00 174.94 174.65 1geq s LYS 135 N 0.06 4.61 -0.05 2.79 1.02 -0.43 -4.02 119.74 123.72 1geq s LYS 135 Ca -0.01 1.39 -0.08 0.00 0.02 0.00 0.00 55.97 57.29 1geq s LYS 135 Cb -0.14 -2.88 -0.05 0.00 -0.52 0.00 0.00 37.83 34.24 1geq s LYS 135 CO 0.03 0.29 0.24 0.95 -0.92 0.00 0.00 175.35 175.94 1geq s THR 136 N -1.52 5.35 -0.09 2.17 -4.23 -1.26 -0.81 115.64 115.24 1geq s THR 136 Ca 0.49 0.31 0.02 0.00 -1.18 0.00 0.00 61.69 61.32 1geq s THR 136 Cb -0.21 -3.52 0.01 0.00 1.34 0.00 0.00 72.50 70.13 1geq s THR 136 CO 0.26 0.52 -0.14 -0.69 -0.54 0.00 0.00 174.62 174.03 1geq s VAL 137 N -1.14 1.32 0.11 2.29 1.01 -0.36 -0.27 120.40 123.36 1geq s VAL 137 Ca 0.21 -0.55 0.10 0.00 0.00 0.00 0.00 61.98 61.74 1geq s VAL 137 Cb -0.13 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 1geq s VAL 137 CO 0.10 0.40 -0.25 -0.36 0.00 0.00 0.00 175.10 174.99 1geq s PHE 138 N 0.89 2.18 0.21 5.22 0.40 -1.23 -4.28 117.98 121.36 1geq s PHE 138 Ca -0.09 -0.39 0.06 0.00 -0.60 0.00 0.00 56.93 55.90 1geq s PHE 138 Cb -0.15 -1.20 -0.04 0.00 0.51 0.00 0.00 43.02 42.14 1geq s PHE 138 CO 0.01 0.28 0.17 -0.48 0.70 0.00 0.00 175.22 175.89 1geq s LEU 139 N -1.91 3.81 -0.01 -0.37 0.05 -1.26 -0.78 118.68 118.21 1geq s LEU 139 Ca 0.12 -0.19 -0.01 0.00 0.05 0.00 0.00 54.13 54.10 1geq s LEU 139 Cb -0.10 -2.38 0.01 0.00 -2.05 0.00 0.00 46.19 41.67 1geq s LEU 139 CO 0.05 0.01 0.03 0.00 -0.55 0.00 0.00 176.35 175.90 1geq s ALA 140 N -1.94 -0.04 0.47 1.48 0.00 -0.32 -4.92 121.76 116.49 1geq s ALA 140 Ca 0.32 0.15 0.07 0.00 0.00 0.00 0.00 51.96 52.50 1geq s ALA 140 Cb -0.09 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 22.93 1geq s ALA 140 CO 0.24 -0.04 0.37 0.00 0.00 0.00 0.00 175.76 176.33 1geq s ALA 141 N 0.30 4.15 0.46 0.00 0.00 -1.26 -1.19 121.76 124.22 1geq s ALA 141 Ca -0.02 -1.69 0.37 0.00 0.00 0.00 0.00 51.96 50.62 1geq s ALA 141 Cb -0.04 -0.81 2.04 0.00 0.00 0.00 0.00 23.12 24.32 1geq s ALA 141 CO -0.01 -0.33 2.15 -1.35 0.00 0.00 0.00 175.76 176.22 1geq h PRO 142 N 0.95 0.00 -0.58 0.00 0.11 -1.89 -1.68 132.00 128.91 1geq h PRO 142 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1geq h PRO 142 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1geq h PRO 142 CO 0.59 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.65 1geq n ASN 143 N -2.85 3.20 -4.67 -2.05 6.94 -1.26 -4.87 115.26 109.70 1geq n ASN 143 Ca -0.02 -2.07 -0.42 0.00 -0.02 0.00 0.00 54.58 52.04 1geq n ASN 143 Cb 0.10 -0.41 -0.03 0.00 -2.36 0.00 0.00 39.78 37.09 1geq n ASN 143 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1geq s THR 144 N -1.36 4.76 0.64 5.53 2.01 -0.63 -5.03 115.64 121.56 1geq s THR 144 Ca 0.38 1.91 -0.12 0.00 0.31 0.00 0.00 61.69 64.17 1geq s THR 144 Cb 0.21 -4.26 -0.02 0.00 0.01 0.00 0.00 72.50 68.44 1geq s THR 144 CO 0.24 -0.09 1.05 -2.16 -0.69 0.00 0.00 174.62 172.97 1geq s PRO 145 N 2.69 3.24 0.24 4.92 0.04 -1.26 -4.85 135.00 140.01 1geq s PRO 145 Ca 0.43 0.97 -0.06 0.00 0.04 0.00 0.00 61.00 62.38 1geq s PRO 145 Cb -0.16 -2.03 0.42 0.00 0.04 0.00 0.00 34.50 32.77 1geq s PRO 145 CO 0.10 -0.86 1.70 -0.44 0.04 0.00 0.00 177.00 177.54 1geq h ASP 146 N -0.24 0.09 -0.90 6.66 3.32 -1.99 -1.04 116.42 122.32 1geq h ASP 146 Ca -0.45 0.13 0.06 0.00 0.02 0.00 0.00 57.03 56.79 1geq h ASP 146 Cb 1.21 0.15 -0.06 0.00 0.22 0.00 0.00 39.33 40.85 1geq h ASP 146 CO 0.58 0.01 0.57 -0.33 -1.72 0.00 0.00 179.24 178.36 1geq h GLU 147 N 0.32 1.02 -0.06 3.56 3.07 -2.01 -1.74 114.58 118.74 1geq h GLU 147 Ca 0.39 -0.06 -0.16 0.00 -0.50 0.00 0.00 59.36 59.03 1geq h GLU 147 Cb 0.63 -0.23 -0.01 0.00 -0.84 0.00 0.00 28.75 28.30 1geq h GLU 147 CO -0.45 0.67 -0.66 -0.09 -1.40 0.00 0.00 179.01 177.08 1geq h ARG 148 N 1.05 0.25 -0.72 2.33 2.43 -1.61 -2.90 114.38 115.21 1geq h ARG 148 Ca 0.38 -0.19 -0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1geq h ARG 148 Cb 0.13 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.68 1geq h ARG 148 CO -0.16 0.82 0.43 -0.07 -1.51 0.00 0.00 179.97 179.48 1geq h LEU 149 N 0.18 0.86 -0.40 3.80 3.38 -0.42 -0.89 115.31 121.82 1geq h LEU 149 Ca -0.01 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 1geq h LEU 149 Cb 1.19 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 1geq h LEU 149 CO 0.10 0.66 0.08 0.11 0.09 0.00 0.00 178.44 179.48 1geq h LYS 150 N 0.99 0.65 -0.32 1.13 1.57 -1.21 0.01 116.57 119.39 1geq h LYS 150 Ca 0.26 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1geq h LYS 150 Cb -0.03 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 1geq h LYS 150 CO -0.05 0.69 0.15 0.28 -0.57 0.00 0.00 179.45 179.95 1geq h VAL 151 N 0.51 1.17 -0.45 0.50 2.07 -1.26 -1.47 116.25 117.32 1geq h VAL 151 Ca 0.12 -0.50 0.02 0.00 0.82 0.00 0.00 66.70 67.16 1geq h VAL 151 Cb 0.35 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 1geq h VAL 151 CO 0.01 0.18 0.27 0.40 0.02 0.00 0.00 177.57 178.44 1geq h ILE 152 N 0.38 1.06 -0.77 4.57 2.04 -1.04 -2.11 117.51 121.64 1geq h ILE 152 Ca 0.11 -0.19 0.03 0.00 1.00 0.00 0.00 64.86 65.81 1geq h ILE 152 Cb 0.15 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 36.65 1geq h ILE 152 CO -0.01 0.10 0.51 -0.78 0.00 0.00 0.00 178.15 177.97 1geq h ASP 153 N 0.55 0.84 0.63 1.72 -0.00 -0.68 -1.52 116.42 117.95 1geq h ASP 153 Ca 0.18 -0.01 -0.06 0.00 -0.00 0.00 0.00 57.03 57.13 1geq h ASP 153 Cb -0.01 -0.20 -0.01 0.00 -0.00 0.00 0.00 39.33 39.12 1geq h ASP 153 CO -0.07 0.58 -0.29 0.44 -0.00 0.00 0.00 179.24 179.91 1geq h ASP 154 N 0.97 0.00 0.38 2.28 3.32 -0.62 -2.79 116.42 119.96 1geq h ASP 154 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 1geq h ASP 154 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1geq h ASP 154 CO -0.08 0.29 -0.74 0.23 -1.72 0.00 0.00 179.24 177.22 1geq n MET 155 N -3.66 0.07 -2.85 3.56 2.81 -0.80 -4.91 117.12 111.34 1geq n MET 155 Ca -0.01 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.47 1geq n MET 155 Cb 0.40 -1.53 -0.04 0.00 -0.71 0.00 0.00 33.22 31.35 1geq n MET 155 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1geq s THR 156 N -3.05 4.94 -0.22 2.03 2.01 -0.64 -4.85 115.64 115.86 1geq s THR 156 Ca 0.09 1.79 0.06 0.00 0.31 0.00 0.00 61.69 63.93 1geq s THR 156 Cb 0.16 -4.20 -0.06 0.00 0.01 0.00 0.00 72.50 68.41 1geq s THR 156 CO 0.76 0.18 0.22 0.35 -0.69 0.00 0.00 174.62 175.44 1geq n THR 157 N 3.93 0.00 0.00 -0.82 -2.24 -1.15 -4.87 114.28 109.13 1geq n THR 157 Ca 0.03 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1geq n THR 157 Cb 0.51 0.90 0.00 0.00 -2.10 0.00 0.00 70.33 69.64 1geq n THR 157 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1geq n GLY 158 N 1.30 -0.43 3.54 3.38 0.00 0.63 -4.71 105.19 108.90 1geq n GLY 158 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 1geq n GLY 158 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1geq s PHE 159 N -0.24 -0.32 -0.18 1.61 -0.12 -1.23 -3.45 117.98 114.05 1geq s PHE 159 Ca 0.00 0.15 -0.15 0.00 -0.05 0.00 0.00 56.93 56.88 1geq s PHE 159 Cb 0.00 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 42.90 1geq s PHE 159 CO 0.00 -0.61 0.36 0.08 -0.05 0.00 0.00 175.22 175.00 1geq s VAL 160 N -3.18 5.24 -0.35 -2.49 1.01 -0.56 -3.56 120.40 116.51 1geq s VAL 160 Ca 0.06 0.66 -0.11 0.00 0.00 0.00 0.00 61.98 62.60 1geq s VAL 160 Cb -0.01 -3.70 0.01 0.00 0.00 0.00 0.00 36.38 32.68 1geq s VAL 160 CO -0.07 0.32 0.19 -0.47 0.00 0.00 0.00 175.10 175.06 1geq s TYR 161 N 0.88 3.21 -0.16 5.22 5.04 0.04 -1.35 117.35 130.24 1geq s TYR 161 Ca 0.19 -0.70 -0.17 0.00 -2.44 0.00 0.00 57.07 53.95 1geq s TYR 161 Cb -0.14 -2.41 -0.04 0.00 0.35 0.00 0.00 41.96 39.71 1geq s TYR 161 CO 0.07 -0.53 0.44 -0.51 -1.34 0.00 0.00 175.55 173.67 1geq s LEU 162 N 1.60 4.22 0.25 6.97 1.43 -0.03 -1.18 118.68 131.95 1geq s LEU 162 Ca 0.04 0.68 0.06 0.00 -1.03 0.00 0.00 54.13 53.88 1geq s LEU 162 Cb -0.18 -2.61 -0.05 0.00 0.03 0.00 0.00 46.19 43.38 1geq s LEU 162 CO 0.07 -0.03 -0.06 0.68 0.23 0.00 0.00 176.35 177.24 1geq s VAL 163 N 0.91 1.53 0.00 -1.59 -7.23 -0.34 -0.38 120.40 113.31 1geq s VAL 163 Ca 0.23 -2.12 0.00 0.00 -1.81 0.00 0.00 61.98 58.28 1geq s VAL 163 Cb -0.15 -2.34 0.00 0.00 0.56 0.00 0.00 36.38 34.45 1geq s VAL 163 CO 0.09 -0.37 0.00 -0.24 -0.31 0.00 0.00 175.10 174.27 1geq n SER 164 N -0.51 0.00 0.00 4.85 2.88 -1.14 -3.96 113.62 115.75 1geq n SER 164 Ca -0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 1geq n SER 164 Cb 0.63 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.09 1geq n SER 164 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1geq n LEU 165 N 0.00 0.00 0.07 2.46 7.94 -1.26 -4.89 117.00 121.32 1geq n LEU 165 Ca 0.00 0.00 -0.08 0.00 -1.11 0.00 0.00 56.01 54.82 1geq n LEU 165 Cb 0.00 0.00 -0.11 0.00 0.53 0.00 0.00 43.42 43.84 1geq n LEU 165 CO 0.00 0.00 0.13 1.88 -1.11 0.00 0.00 177.39 178.29 1geq h TYR 166 N 0.00 0.08 -0.70 1.96 0.05 -1.96 -3.49 116.97 112.91 1geq h TYR 166 Ca 0.00 -0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.72 1geq h TYR 166 Cb 0.00 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 1geq h TYR 166 CO 0.00 1.02 0.00 0.41 -1.05 0.00 0.00 178.16 178.54 1geq n GLY 167 N 1.32 0.63 3.79 3.88 0.00 -1.26 -4.73 105.19 108.82 1geq n GLY 167 Ca -0.01 -0.86 -0.29 0.00 0.00 0.00 0.00 46.02 44.85 1geq n GLY 167 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1geq s THR 168 N 0.00 2.59 0.00 2.61 -1.32 -1.26 -4.29 115.64 113.97 1geq s THR 168 Ca 0.00 0.19 0.00 0.00 -1.21 0.00 0.00 61.69 60.67 1geq s THR 168 Cb 0.00 -2.93 0.00 0.00 -1.51 0.00 0.00 72.50 68.06 1geq s THR 168 CO 0.00 -0.25 0.26 1.07 -2.21 0.00 0.00 174.62 173.49 1geq n THR 169 N -3.59 0.00 -2.90 5.08 5.66 -1.26 -4.86 114.28 112.40 1geq n THR 169 Ca 0.07 0.00 -0.40 0.00 -3.05 0.00 0.00 64.05 60.67 1geq n THR 169 Cb 0.58 1.19 -0.05 0.00 -1.55 0.00 0.00 70.33 70.50 1geq n THR 169 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1geq s GLU 173 N 0.00 4.56 -0.30 1.09 0.41 -1.26 -4.94 118.70 118.26 1geq s GLU 173 Ca 0.00 1.19 -0.19 0.00 -0.41 0.00 0.00 54.97 55.56 1geq s GLU 173 Cb 0.00 -3.37 0.20 0.00 -1.78 0.00 0.00 34.13 29.18 1geq s GLU 173 CO 0.00 0.26 1.32 -2.00 -0.49 0.00 0.00 175.26 174.35 1geq s GLU 174 N -0.04 0.01 0.22 1.61 2.12 -1.26 -5.14 118.70 116.22 1geq s GLU 174 Ca 0.41 0.02 -0.32 0.00 0.36 0.00 0.00 54.97 55.44 1geq s GLU 174 Cb -0.21 0.01 -0.12 0.00 0.26 0.00 0.00 34.13 34.06 1geq s GLU 174 CO 0.25 -0.00 1.65 -0.89 -0.54 0.00 0.00 175.26 175.73 1geq n ILE 175 N 4.33 0.30 -1.76 -3.70 2.08 -1.26 -4.62 119.36 114.72 1geq n ILE 175 Ca -0.07 -0.07 -0.38 0.00 0.56 0.00 0.00 62.75 62.78 1geq n ILE 175 Cb 0.56 -1.87 0.04 0.00 -0.75 0.00 0.00 39.64 37.62 1geq n ILE 175 CO 0.00 0.00 0.00 -2.84 0.56 0.00 0.00 176.55 174.27 1geq s PRO 176 N 0.64 3.14 0.54 0.38 0.02 -1.26 -4.87 135.00 133.59 1geq s PRO 176 Ca 0.73 2.27 0.26 0.00 0.02 0.00 0.00 61.00 64.27 1geq s PRO 176 Cb -0.54 -2.27 1.53 0.00 0.02 0.00 0.00 34.50 33.24 1geq s PRO 176 CO 0.38 -1.20 2.14 0.87 -0.33 0.00 0.00 177.00 178.86 1geq h LYS 177 N 1.48 0.00 0.00 5.54 1.57 -1.99 -1.02 116.57 122.14 1geq h LYS 177 Ca -0.51 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.22 1geq h LYS 177 Cb 1.30 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.60 1geq h LYS 177 CO 0.57 0.07 -0.26 0.00 -0.57 0.00 0.00 179.45 179.27 1geq h THR 178 N 0.00 0.97 -0.03 -0.16 1.03 -1.99 -0.11 112.91 112.62 1geq h THR 178 Ca -0.00 -0.97 -0.24 0.00 -0.01 0.00 0.00 66.41 65.19 1geq h THR 178 Cb 0.18 1.56 0.02 0.00 -1.07 0.00 0.00 68.15 68.84 1geq h THR 178 CO 0.01 0.26 -0.92 0.00 -0.01 0.00 0.00 175.52 174.86 1geq h ALA 179 N 1.74 0.15 -0.36 0.00 0.00 -1.54 -2.28 119.26 116.96 1geq h ALA 179 Ca -0.00 -0.66 -0.08 0.00 0.00 0.00 0.00 54.91 54.17 1geq h ALA 179 Cb 0.54 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1geq h ALA 179 CO 0.03 0.63 -0.09 1.88 0.00 0.00 0.00 179.25 181.70 1geq h TYR 180 N 0.34 0.66 -0.59 0.00 -1.99 -1.28 -2.09 116.97 112.03 1geq h TYR 180 Ca -0.11 -0.10 -0.06 0.00 2.00 0.00 0.00 58.73 60.46 1geq h TYR 180 Cb 1.58 -0.18 -0.02 0.00 2.00 0.00 0.00 36.73 40.11 1geq h TYR 180 CO 0.11 0.69 0.15 0.22 -0.00 0.00 0.00 178.16 179.33 1geq h ASP 181 N 0.57 0.88 -0.65 3.88 1.82 -0.98 -0.61 116.42 121.33 1geq h ASP 181 Ca 0.11 -0.23 -0.01 0.00 -0.39 0.00 0.00 57.03 56.51 1geq h ASP 181 Cb 0.50 -0.23 -0.03 0.00 0.68 0.00 0.00 39.33 40.25 1geq h ASP 181 CO 0.03 0.88 0.38 0.25 -1.61 0.00 0.00 179.24 179.17 1geq h LEU 182 N 0.84 0.79 -0.25 2.28 6.46 -1.08 -1.31 115.31 123.04 1geq h LEU 182 Ca 0.18 -0.07 -0.02 0.00 -0.12 0.00 0.00 57.88 57.85 1geq h LEU 182 Cb 0.34 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.06 1geq h LEU 182 CO 0.00 0.63 0.07 0.25 -0.62 0.00 0.00 178.44 178.78 1geq h LEU 183 N 0.88 0.37 -0.20 2.25 5.85 -1.07 -0.52 115.31 122.87 1geq h LEU 183 Ca 0.23 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.78 1geq h LEU 183 Cb 0.00 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 1geq h LEU 183 CO -0.04 0.48 -0.05 -0.09 -0.34 0.00 0.00 178.44 178.40 1geq h ARG 184 N 0.23 -0.00 -0.55 1.25 2.43 -0.89 -0.90 114.38 115.95 1geq h ARG 184 Ca 0.08 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1geq h ARG 184 Cb 0.25 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.78 1geq h ARG 184 CO -0.00 -0.00 0.34 0.00 -1.51 0.00 0.00 179.97 178.80 1geq h ARG 185 N -0.00 0.74 -0.45 0.20 3.08 -1.18 -2.89 114.38 113.89 1geq h ARG 185 Ca 0.10 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1geq h ARG 185 Cb 0.15 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 1geq h ARG 185 CO -0.21 0.52 0.28 0.00 -1.07 0.00 0.00 179.97 179.49 1geq h ALA 186 N 1.18 0.57 0.00 0.04 0.00 -0.57 -1.95 119.26 118.52 1geq h ALA 186 Ca 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1geq h ALA 186 Cb -0.04 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1geq h ALA 186 CO -0.04 0.04 0.00 0.87 0.00 0.00 0.00 179.25 180.12 1geq h LYS 187 N 0.60 0.00 0.00 0.00 1.79 -1.03 0.21 116.57 118.13 1geq h LYS 187 Ca 0.16 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.61 1geq h LYS 187 Cb -0.03 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.62 1geq h LYS 187 CO -0.03 0.00 -0.57 -0.09 -1.08 0.00 0.00 179.45 177.68 1geq h ARG 188 N 0.00 0.00 0.00 3.15 2.43 -1.16 -3.40 114.38 115.40 1geq h ARG 188 Ca 0.00 0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 58.97 1geq h ARG 188 Cb 0.21 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 1geq h ARG 188 CO 0.00 0.07 -1.71 -0.89 -1.51 0.00 0.00 179.97 175.94 1geq n ILE 189 N -2.93 0.70 -2.47 1.20 5.41 -0.52 -5.05 119.36 115.71 1geq n ILE 189 Ca 0.01 -0.23 -0.41 0.00 1.00 0.00 0.00 62.75 63.12 1geq n ILE 189 Cb 0.58 -1.22 -0.04 0.00 -0.71 0.00 0.00 39.64 38.26 1geq n ILE 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1geq h ARG 191 N 5.25 0.00 -7.28 0.00 3.08 -1.91 -3.47 114.38 110.05 1geq h ARG 191 Ca -0.44 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.10 1geq h ARG 191 Cb 1.21 0.00 0.09 0.00 0.08 0.00 0.00 29.97 31.36 1geq h ARG 191 CO 0.73 0.49 0.36 -0.80 -1.07 0.00 0.00 179.97 179.69 1geq s ASN 192 N -6.09 5.31 0.68 7.04 -0.87 -1.26 -5.01 114.94 114.74 1geq s ASN 192 Ca -0.04 1.75 -0.14 0.00 -1.57 0.00 0.00 52.86 52.85 1geq s ASN 192 Cb 0.08 -2.52 0.01 0.00 -0.02 0.00 0.00 41.25 38.81 1geq s ASN 192 CO 0.82 -1.49 1.10 -0.54 -2.57 0.00 0.00 177.10 174.43 1geq s LYS 193 N -4.66 2.70 -0.03 -0.60 1.02 -1.26 -4.81 119.74 112.11 1geq s LYS 193 Ca 0.61 1.32 0.06 0.00 0.02 0.00 0.00 55.97 57.99 1geq s LYS 193 Cb -0.16 -1.94 -0.01 0.00 -0.52 0.00 0.00 37.83 35.20 1geq s LYS 193 CO 0.49 -1.32 -0.22 0.08 -0.92 0.00 0.00 175.35 173.46 1geq s VAL 194 N -2.48 1.79 0.07 3.17 1.01 -1.26 -1.50 120.40 121.20 1geq s VAL 194 Ca 0.65 -0.95 0.09 0.00 0.00 0.00 0.00 61.98 61.78 1geq s VAL 194 Cb -0.19 -1.50 -0.03 0.00 0.00 0.00 0.00 36.38 34.66 1geq s VAL 194 CO 0.45 0.51 -0.25 0.00 0.00 0.00 0.00 175.10 175.80 1geq s ALA 195 N -0.37 2.18 -0.00 5.51 0.00 -0.46 -1.51 121.76 127.11 1geq s ALA 195 Ca 0.04 -1.29 0.08 0.00 0.00 0.00 0.00 51.96 50.80 1geq s ALA 195 Cb -0.10 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.58 1geq s ALA 195 CO 0.01 0.50 -0.26 0.14 0.00 0.00 0.00 175.76 176.15 1geq s VAL 196 N -0.89 2.06 -0.56 0.00 -7.23 -0.53 -0.85 120.40 112.39 1geq s VAL 196 Ca 0.11 -1.17 0.04 0.00 -1.81 0.00 0.00 61.98 59.15 1geq s VAL 196 Cb -0.10 -1.72 0.16 0.00 0.56 0.00 0.00 36.38 35.28 1geq s VAL 196 CO 0.03 0.52 0.39 -0.83 -0.31 0.00 0.00 175.10 174.90 1geq s GLY 197 N -0.76 2.17 -0.10 2.32 0.00 0.49 -0.66 107.32 110.77 1geq s GLY 197 Ca 0.10 -3.17 0.15 0.00 0.00 0.00 0.00 44.72 41.81 1geq s GLY 197 CO -0.00 1.46 1.43 0.69 0.00 0.00 0.00 173.10 176.68 1geq n PHE 198 N 2.60 0.96 -2.28 1.90 0.99 -1.26 -2.87 117.46 117.49 1geq n PHE 198 Ca 0.19 -0.68 -0.00 0.00 -0.00 0.00 0.00 57.45 56.96 1geq n PHE 198 Cb 0.38 -0.20 0.00 0.00 -1.00 0.00 0.00 39.48 38.66 1geq n PHE 198 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1geq n GLY 199 N 0.30 0.69 3.77 1.37 0.00 -1.26 -4.48 105.19 105.58 1geq n GLY 199 Ca 0.19 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.24 1geq n GLY 199 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1geq s VAL 200 N -3.01 2.30 0.00 1.61 1.01 -1.26 -4.50 120.40 116.55 1geq s VAL 200 Ca 0.01 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.28 1geq s VAL 200 Cb -0.00 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1geq s VAL 200 CO 0.01 0.07 0.00 -1.54 0.00 0.00 0.00 175.10 173.64 1geq n SER 201 N 0.49 0.00 -3.98 3.32 3.41 -1.26 -4.37 113.62 111.22 1geq n SER 201 Ca 0.01 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.54 1geq n SER 201 Cb 0.40 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.26 1geq n SER 201 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1geq s LYS 202 N 0.00 0.57 0.26 4.33 -2.85 -1.26 -5.02 119.74 115.77 1geq s LYS 202 Ca 0.00 -0.89 -0.03 0.00 -1.00 0.00 0.00 55.97 54.04 1geq s LYS 202 Cb 0.00 0.21 0.54 0.00 -2.06 0.00 0.00 37.83 36.53 1geq s LYS 202 CO 0.00 -0.13 1.65 -0.09 0.10 0.00 0.00 175.35 176.88 1geq h ARG 203 N 3.59 0.18 0.00 1.78 9.65 -1.84 0.24 114.38 127.98 1geq h ARG 203 Ca -0.33 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.53 1geq h ARG 203 Cb 1.18 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 29.71 1geq h ARG 203 CO 0.54 0.12 -0.02 1.05 2.80 0.00 0.00 179.97 184.46 1geq h GLU 204 N 0.19 0.00 -0.14 0.20 4.11 -1.94 -1.88 114.58 115.11 1geq h GLU 204 Ca 0.47 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.87 1geq h GLU 204 Cb 0.86 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 1geq h GLU 204 CO -0.62 0.02 -0.01 0.45 0.07 0.00 0.00 179.01 178.92 1geq h HIS 205 N 0.00 0.28 -0.14 2.06 3.86 -1.36 -0.86 115.15 118.99 1geq h HIS 205 Ca -0.00 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 1geq h HIS 205 Cb 0.06 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.45 1geq h HIS 205 CO 0.00 0.50 0.07 0.28 0.86 0.00 0.00 177.93 179.64 1geq h VAL 206 N -0.02 1.12 -0.35 2.45 2.07 -1.39 -0.84 116.25 119.30 1geq h VAL 206 Ca 0.04 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 67.24 1geq h VAL 206 Cb 0.40 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 1geq h VAL 206 CO 0.01 0.11 0.15 0.58 0.02 0.00 0.00 177.57 178.44 1geq h VAL 207 N 0.10 0.95 -0.17 2.57 2.07 -1.35 -1.20 116.25 119.22 1geq h VAL 207 Ca 0.05 -0.11 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 1geq h VAL 207 Cb 0.12 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1geq h VAL 207 CO -0.01 0.06 0.09 -1.28 0.02 0.00 0.00 177.57 176.45 1geq h SER 208 N 0.32 0.21 -0.71 0.57 0.87 -1.02 -1.43 113.55 112.36 1geq h SER 208 Ca 0.15 -0.09 -0.06 0.00 -1.23 0.00 0.00 61.79 60.56 1geq h SER 208 Cb 0.09 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 61.97 1geq h SER 208 CO -0.13 0.25 0.22 -0.07 -0.53 0.00 0.00 176.83 176.57 1geq h LEU 209 N 0.16 1.03 -0.49 2.23 3.38 -0.95 -1.22 115.31 119.44 1geq h LEU 209 Ca 0.06 -0.21 -0.11 0.00 0.09 0.00 0.00 57.88 57.71 1geq h LEU 209 Cb 0.08 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1geq h LEU 209 CO -0.01 0.96 -0.12 -0.07 0.09 0.00 0.00 178.44 179.29 1geq h LEU 210 N 1.04 0.96 -1.78 1.67 3.38 -1.17 -2.15 115.31 117.26 1geq h LEU 210 Ca 0.23 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1geq h LEU 210 Cb 0.30 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1geq h LEU 210 CO -0.01 1.10 0.04 0.50 0.09 0.00 0.00 178.44 180.16 1geq h LYS 211 N 0.81 0.18 -0.09 1.13 3.64 -0.92 -1.17 116.57 120.15 1geq h LYS 211 Ca 0.12 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1geq h LYS 211 Cb 0.68 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1geq h LYS 211 CO 0.05 0.16 0.00 0.39 -2.27 0.00 0.00 179.45 177.78 1geq n GLU 212 N -4.47 1.35 0.00 1.90 -0.58 -0.49 -4.91 120.64 113.43 1geq n GLU 212 Ca -0.01 -0.53 0.00 0.00 -0.42 0.00 0.00 57.16 56.20 1geq n GLU 212 Cb 0.12 -1.32 0.00 0.00 -0.57 0.00 0.00 31.44 29.67 1geq n GLU 212 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1geq n GLY 213 N 0.93 0.66 3.70 0.62 0.00 -0.44 -4.79 105.19 105.87 1geq n GLY 213 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1geq n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1geq s ALA 214 N -2.00 3.68 0.23 4.61 0.00 -0.84 -4.87 121.76 122.57 1geq s ALA 214 Ca 0.00 1.20 0.10 0.00 0.00 0.00 0.00 51.96 53.26 1geq s ALA 214 Cb 0.00 -3.63 0.26 0.00 0.00 0.00 0.00 23.12 19.74 1geq s ALA 214 CO 0.00 -0.90 1.55 -0.91 0.00 0.00 0.00 175.76 175.50 1geq h ASN 215 N 7.55 0.00 -4.92 0.00 4.21 -1.62 -3.42 115.58 117.38 1geq h ASN 215 Ca -0.42 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 56.96 1geq h ASN 215 Cb 1.20 0.00 -0.21 0.00 -1.12 0.00 0.00 38.32 38.19 1geq h ASN 215 CO 0.91 0.68 -0.38 -0.83 -1.29 0.00 0.00 177.43 176.52 1geq s GLY 216 N -4.51 -0.06 -0.18 2.83 0.00 -0.87 -0.55 107.32 103.98 1geq s GLY 216 Ca -0.01 0.14 0.01 0.00 0.00 0.00 0.00 44.72 44.86 1geq s GLY 216 CO 0.77 -0.03 -0.19 0.14 0.00 0.00 0.00 173.10 173.79 1geq s VAL 217 N -1.27 1.99 0.19 1.40 1.01 -0.39 -1.46 120.40 121.87 1geq s VAL 217 Ca -0.13 -0.91 -0.25 0.00 0.00 0.00 0.00 61.98 60.69 1geq s VAL 217 Cb -0.06 -1.81 -0.08 0.00 0.00 0.00 0.00 36.38 34.43 1geq s VAL 217 CO 0.03 0.52 0.79 -0.69 0.00 0.00 0.00 175.10 175.74 1geq s VAL 218 N 1.32 4.37 -0.27 2.92 1.01 0.16 -0.46 120.40 129.44 1geq s VAL 218 Ca 0.05 1.67 0.01 0.00 0.00 0.00 0.00 61.98 63.71 1geq s VAL 218 Cb -0.13 -4.10 0.08 0.00 0.00 0.00 0.00 36.38 32.22 1geq s VAL 218 CO -0.13 0.45 -0.00 -0.69 0.00 0.00 0.00 175.10 174.73 1geq s VAL 219 N -1.24 1.49 0.00 2.92 1.01 0.01 -4.66 120.40 119.93 1geq s VAL 219 Ca 0.38 -1.44 0.00 0.00 0.00 0.00 0.00 61.98 60.92 1geq s VAL 219 Cb -0.22 -1.90 0.00 0.00 0.00 0.00 0.00 36.38 34.26 1geq s VAL 219 CO 0.26 -0.31 0.00 0.61 0.00 0.00 0.00 175.10 175.65 1geq n GLY 220 N 4.64 0.12 0.37 4.51 0.00 -1.26 -1.37 105.19 112.20 1geq n GLY 220 Ca -0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.08 1geq n GLY 220 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1geq h SER 221 N 0.00 0.65 0.26 1.61 4.64 -1.89 0.53 113.55 119.36 1geq h SER 221 Ca 0.00 0.05 -0.04 0.00 -0.47 0.00 0.00 61.79 61.33 1geq h SER 221 Cb 0.00 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 1geq h SER 221 CO 0.00 0.31 -0.17 0.00 -0.87 0.00 0.00 176.83 176.09 1geq h ALA 222 N 1.60 1.51 0.06 5.18 0.00 -1.89 -1.34 119.26 124.37 1geq h ALA 222 Ca 0.48 -0.16 -0.27 0.00 0.00 0.00 0.00 54.91 54.95 1geq h ALA 222 Cb 0.81 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1geq h ALA 222 CO -0.23 0.22 -1.48 -0.07 0.00 0.00 0.00 179.25 177.69 1geq h LEU 223 N 0.00 0.18 -1.90 0.00 3.38 -1.26 -3.34 115.31 112.37 1geq h LEU 223 Ca -0.00 -0.70 -0.02 0.00 0.09 0.00 0.00 57.88 57.24 1geq h LEU 223 Cb 0.35 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1geq h LEU 223 CO 0.02 1.61 -0.09 -0.37 0.09 0.00 0.00 178.44 179.71 1geq h VAL 224 N -0.57 0.95 -0.60 1.22 -1.51 -1.00 -1.09 116.25 113.65 1geq h VAL 224 Ca -0.36 -0.32 -0.06 0.00 -1.23 0.00 0.00 66.70 64.74 1geq h VAL 224 Cb 1.59 1.18 -0.03 0.00 -2.13 0.00 0.00 31.29 31.90 1geq h VAL 224 CO -0.08 0.09 0.14 0.50 -1.23 0.00 0.00 177.57 176.99 1geq h LYS 225 N 0.00 0.93 -0.38 5.19 3.64 -1.40 -0.48 116.57 124.07 1geq h LYS 225 Ca -0.00 -0.21 -0.11 0.00 -1.27 0.00 0.00 60.65 59.06 1geq h LYS 225 Cb 0.17 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1geq h LYS 225 CO 0.01 0.84 -0.19 0.82 -2.27 0.00 0.00 179.45 178.66 1geq h ILE 226 N 0.89 1.28 -0.62 2.00 2.04 -1.35 -2.69 117.51 119.06 1geq h ILE 226 Ca 0.19 -1.32 -0.02 0.00 1.00 0.00 0.00 64.86 64.71 1geq h ILE 226 Cb 0.33 1.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 1geq h ILE 226 CO 0.00 0.44 0.31 0.40 0.00 0.00 0.00 178.15 179.30 1geq h ILE 227 N 0.60 1.21 0.00 -0.67 2.04 -0.98 0.30 117.51 120.02 1geq h ILE 227 Ca 0.08 -0.59 -0.01 0.00 1.00 0.00 0.00 64.86 65.35 1geq h ILE 227 Cb 0.74 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 37.28 1geq h ILE 227 CO 0.06 0.24 -0.04 1.23 0.00 0.00 0.00 178.15 179.63 1geq h GLY 228 N 0.85 0.00 0.42 5.37 0.00 -1.01 0.58 103.07 109.28 1geq h GLY 228 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 47.18 1geq h GLY 228 CO -0.03 0.00 -2.09 -2.21 0.00 0.00 0.00 176.54 172.21 1geq n GLU 229 N -3.32 0.72 -0.00 4.80 2.13 -0.60 -4.53 120.64 119.83 1geq n GLU 229 Ca -0.02 0.25 0.09 0.00 0.66 0.00 0.00 57.16 58.14 1geq n GLU 229 Cb 0.19 -1.66 -0.11 0.00 0.27 0.00 0.00 31.44 30.13 1geq n GLU 229 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1geq n LYS 230 N -3.49 0.83 0.00 5.31 4.76 0.95 -5.06 118.16 121.45 1geq n LYS 230 Ca -0.36 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.05 1geq n LYS 230 Cb 1.01 -1.39 0.00 0.00 -1.84 0.00 0.00 35.03 32.81 1geq n LYS 230 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1geq n GLY 231 N 1.43 2.93 0.34 0.72 0.00 0.20 -1.78 105.19 109.04 1geq n GLY 231 Ca 0.02 -0.24 0.18 0.00 0.00 0.00 0.00 46.02 45.99 1geq n GLY 231 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1geq h ARG 232 N 0.00 0.00 -0.68 1.61 3.08 -1.95 -1.39 114.38 115.05 1geq h ARG 232 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1geq h ARG 232 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1geq h ARG 232 CO 0.00 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.29 1geq n GLU 233 N -3.20 3.56 0.17 0.04 -0.58 -0.73 -4.42 120.64 115.47 1geq n GLU 233 Ca -0.01 -2.20 0.05 0.00 -0.42 0.00 0.00 57.16 54.58 1geq n GLU 233 Cb 0.29 -1.95 0.19 0.00 -0.57 0.00 0.00 31.44 29.39 1geq n GLU 233 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1geq h ALA 234 N 3.52 0.83 -0.41 0.62 0.00 -1.35 -3.40 119.26 119.07 1geq h ALA 234 Ca 0.00 -0.37 0.04 0.00 0.00 0.00 0.00 54.91 54.58 1geq h ALA 234 Cb 1.43 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 19.11 1geq h ALA 234 CO 0.30 0.51 -0.24 2.41 0.00 0.00 0.00 179.25 182.22 1geq n THR 235 N -3.33 -0.28 -0.15 0.00 -1.04 -1.26 -0.75 114.28 107.47 1geq n THR 235 Ca 0.01 1.43 0.01 0.00 -2.04 0.00 0.00 64.05 63.46 1geq n THR 235 Cb 0.62 -1.81 0.29 0.00 -1.82 0.00 0.00 70.33 67.61 1geq n THR 235 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1geq h GLU 236 N 0.00 0.85 0.00 -2.82 3.07 -1.96 -1.78 114.58 111.94 1geq h GLU 236 Ca 0.07 -0.06 -0.11 0.00 -0.50 0.00 0.00 59.36 58.76 1geq h GLU 236 Cb 0.17 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 27.88 1geq h GLU 236 CO -0.39 0.58 -0.51 0.74 -1.40 0.00 0.00 179.01 178.03 1geq h PHE 237 N 0.87 0.00 -0.21 4.33 -1.00 -1.20 -2.39 116.94 117.34 1geq h PHE 237 Ca 0.23 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.96 1geq h PHE 237 Cb -0.07 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.48 1geq h PHE 237 CO 0.00 0.51 -0.08 -0.07 -1.61 0.00 0.00 178.31 177.07 1geq h LEU 238 N 0.00 0.43 -0.65 1.54 3.38 -0.21 -1.52 115.31 118.28 1geq h LEU 238 Ca -0.01 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.57 1geq h LEU 238 Cb 1.06 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.66 1geq h LEU 238 CO 0.07 0.72 0.40 0.11 0.09 0.00 0.00 178.44 179.84 1geq h LYS 239 N 0.14 0.88 -0.62 1.13 1.57 -1.37 -1.11 116.57 117.18 1geq h LYS 239 Ca 0.05 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 1geq h LYS 239 Cb 0.55 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.64 1geq h LYS 239 CO 0.03 0.61 0.23 0.87 -0.57 0.00 0.00 179.45 180.62 1geq h LYS 240 N 0.89 0.91 -0.26 3.15 1.79 -1.33 0.91 116.57 122.63 1geq h LYS 240 Ca 0.24 -0.15 -0.13 0.00 -2.18 0.00 0.00 60.65 58.43 1geq h LYS 240 Cb -0.05 -0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 30.44 1geq h LYS 240 CO -0.05 0.76 -0.33 -0.22 -1.08 0.00 0.00 179.45 178.53 1geq h LYS 241 N 0.90 0.68 -0.66 3.15 1.63 -0.81 -1.26 116.57 120.19 1geq h LYS 241 Ca 0.21 -0.38 -0.08 0.00 -0.85 0.00 0.00 60.65 59.55 1geq h LYS 241 Cb 0.19 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 31.83 1geq h LYS 241 CO -0.02 1.00 0.10 0.28 -3.45 0.00 0.00 179.45 177.36 1geq h VAL 242 N 0.40 1.26 -0.55 2.00 2.07 -0.98 -1.63 116.25 118.82 1geq h VAL 242 Ca 0.03 -1.03 0.02 0.00 0.82 0.00 0.00 66.70 66.54 1geq h VAL 242 Cb 0.91 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 1geq h VAL 242 CO 0.08 0.39 0.33 -0.33 0.02 0.00 0.00 177.57 178.06 1geq h GLU 243 N 1.02 0.64 -0.72 1.57 5.08 -0.70 0.38 114.58 121.85 1geq h GLU 243 Ca 0.20 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1geq h GLU 243 Cb 0.44 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 1geq h GLU 243 CO 0.01 0.43 0.44 1.49 -1.00 0.00 0.00 179.01 180.37 1geq h GLU 244 N 0.66 0.97 0.00 2.33 4.81 -0.87 -1.03 114.58 121.45 1geq h GLU 244 Ca 0.22 -0.09 -0.06 0.00 -0.13 0.00 0.00 59.36 59.30 1geq h GLU 244 Cb 0.01 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 1geq h GLU 244 CO -0.09 0.69 -0.29 -0.07 -0.73 0.00 0.00 179.01 178.52 1geq h LEU 245 N 0.98 0.00 -0.17 1.64 3.38 -0.67 -1.81 115.31 118.66 1geq h LEU 245 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1geq h LEU 245 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1geq h LEU 245 CO -0.05 0.29 -0.22 0.18 0.09 0.00 0.00 178.44 178.73 1geq n LEU 246 N -3.71 0.48 -1.39 1.67 4.77 0.06 -4.71 117.00 114.17 1geq n LEU 246 Ca -0.01 0.05 -0.14 0.00 -0.03 0.00 0.00 56.01 55.88 1geq n LEU 246 Cb 0.40 -0.25 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1geq n LEU 246 CO 0.35 0.10 -0.16 0.61 -1.33 0.00 0.00 177.39 176.96 1geq n GLY 247 N 1.39 0.42 0.00 -0.72 0.00 -0.46 -5.07 105.19 100.75 1geq n GLY 247 Ca 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1geq n GLY 247 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61