#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oma n SER 3 N 0.00 1.48 -4.75 0.00 3.41 -1.26 -4.94 113.62 107.57 2oma n SER 3 Ca 0.00 0.81 -0.40 0.00 -0.26 0.00 0.00 58.87 59.02 2oma n SER 3 Cb 0.00 -1.48 -0.06 0.00 -0.26 0.00 0.00 64.21 62.41 2oma n SER 3 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2oma s LYS 4 N -3.12 4.83 1.12 4.33 1.02 -1.26 -4.94 119.74 121.72 2oma s LYS 4 Ca 0.80 1.52 -0.19 0.00 0.02 0.00 0.00 55.97 58.12 2oma s LYS 4 Cb -0.39 -3.28 0.28 0.00 -0.52 0.00 0.00 37.83 33.92 2oma s LYS 4 CO 0.43 0.48 1.02 -0.35 -0.92 0.00 0.00 175.35 176.01 2oma n PRO 5 N 1.53 -2.89 -1.69 -1.68 -0.04 -1.26 -4.92 135.00 124.04 2oma n PRO 5 Ca -0.02 -1.63 -0.44 0.00 -0.04 0.00 0.00 63.50 61.38 2oma n PRO 5 Cb 0.47 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.40 2oma n PRO 5 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2oma n GLN 6 N -4.53 2.58 -1.45 0.54 7.27 -1.26 -4.97 117.38 115.56 2oma n GLN 6 Ca 0.14 0.94 -0.30 0.00 0.07 0.00 0.00 57.00 57.85 2oma n GLN 6 Cb 0.54 -2.78 0.11 0.00 2.41 0.00 0.00 30.24 30.52 2oma n GLN 6 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 2oma s PRO 7 N 1.87 1.80 -0.02 3.69 0.04 -1.26 -4.87 135.00 136.24 2oma s PRO 7 Ca 0.80 0.67 0.02 0.00 0.04 0.00 0.00 61.00 62.53 2oma s PRO 7 Cb -0.55 -1.88 0.01 0.00 0.04 0.00 0.00 34.50 32.11 2oma s PRO 7 CO 0.37 -1.83 -0.07 0.42 0.04 0.00 0.00 177.00 175.93 2oma s ILE 8 N -3.10 0.60 -0.30 0.56 1.01 -0.98 -0.99 121.20 118.00 2oma s ILE 8 Ca 0.62 -0.25 0.01 0.00 0.00 0.00 0.00 60.65 61.03 2oma s ILE 8 Cb -0.15 -0.56 0.07 0.00 0.01 0.00 0.00 42.46 41.83 2oma s ILE 8 CO 0.55 0.20 -0.02 0.00 0.00 0.00 0.00 174.94 175.67 2oma s ALA 9 N 0.33 2.75 -0.16 9.38 0.00 -0.12 -1.51 121.76 132.43 2oma s ALA 9 Ca -0.04 -1.97 -0.03 0.00 0.00 0.00 0.00 51.96 49.92 2oma s ALA 9 Cb -0.09 -1.83 -0.02 0.00 0.00 0.00 0.00 23.12 21.18 2oma s ALA 9 CO 0.00 -1.36 -0.06 0.00 0.00 0.00 0.00 175.76 174.35 2oma s ALA 10 N 1.12 2.89 -0.24 0.00 0.00 -0.19 -1.04 121.76 124.29 2oma s ALA 10 Ca -0.03 -0.88 -0.12 0.00 0.00 0.00 0.00 51.96 50.93 2oma s ALA 10 Cb -0.20 -1.50 -0.05 0.00 0.00 0.00 0.00 23.12 21.37 2oma s ALA 10 CO -0.04 0.13 0.25 0.00 0.00 0.00 0.00 175.76 176.10 2oma s ALA 11 N 0.51 3.58 -0.44 0.00 0.00 0.96 -0.41 121.76 125.96 2oma s ALA 11 Ca -0.04 -0.83 -0.10 0.00 0.00 0.00 0.00 51.96 50.99 2oma s ALA 11 Cb -0.15 -2.47 0.09 0.00 0.00 0.00 0.00 23.12 20.59 2oma s ALA 11 CO 0.03 -0.34 0.31 1.21 0.00 0.00 0.00 175.76 176.97 2oma s ASN 12 N 1.24 5.73 0.11 0.00 2.47 0.77 -0.75 114.94 124.52 2oma s ASN 12 Ca 0.11 -1.61 0.17 0.00 0.42 0.00 0.00 52.86 51.95 2oma s ASN 12 Cb -0.14 -2.02 0.73 0.00 -1.45 0.00 0.00 41.25 38.36 2oma s ASN 12 CO 0.07 -0.61 1.52 0.79 -3.72 0.00 0.00 177.10 175.16 2oma n TRP 13 N 4.96 0.33 -1.19 0.43 8.01 -1.05 -4.43 117.44 124.50 2oma n TRP 13 Ca -0.10 0.14 0.00 0.00 -1.31 0.00 0.00 57.50 56.23 2oma n TRP 13 Cb 0.42 -0.72 0.00 0.00 -2.01 0.00 0.00 31.31 29.00 2oma n TRP 13 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 2oma n LYS 14 N -1.81 0.00 -1.43 -0.99 5.02 -1.26 -2.75 118.16 114.94 2oma n LYS 14 Ca 0.02 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.92 2oma n LYS 14 Cb 0.17 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 35.16 2oma n LYS 14 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2oma s ASN 16 N 2.78 0.15 0.00 0.00 0.01 -1.11 -5.16 114.94 111.60 2oma s ASN 16 Ca 0.59 -0.32 0.00 0.00 -0.71 0.00 0.00 52.86 52.41 2oma s ASN 16 Cb 0.16 0.10 0.00 0.00 0.41 0.00 0.00 41.25 41.92 2oma s ASN 16 CO -0.06 -0.23 0.00 0.61 -1.51 0.00 0.00 177.10 175.91 2oma n GLY 17 N 1.96 2.35 3.59 0.66 0.00 -1.26 -4.71 105.19 107.78 2oma n GLY 17 Ca -0.21 -1.46 -0.08 0.00 0.00 0.00 0.00 46.02 44.27 2oma n GLY 17 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oma s SER 18 N 0.00 -0.28 0.31 1.61 1.04 -1.26 -4.98 113.70 110.13 2oma s SER 18 Ca 0.00 0.27 0.05 0.00 0.48 0.00 0.00 55.95 56.75 2oma s SER 18 Cb 0.00 0.24 0.50 0.00 0.10 0.00 0.00 66.02 66.86 2oma s SER 18 CO 0.00 -0.29 1.75 -0.33 0.98 0.00 0.00 173.24 175.35 2oma h GLU 19 N 2.37 0.37 -0.27 4.02 5.08 -2.00 -2.65 114.58 121.49 2oma h GLU 19 Ca -0.16 -0.14 0.08 0.00 -1.00 0.00 0.00 59.36 58.15 2oma h GLU 19 Cb 1.17 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 2oma h GLU 19 CO 0.29 0.61 0.27 1.03 -1.00 0.00 0.00 179.01 180.21 2oma h SER 20 N 0.33 0.00 0.02 1.42 0.87 -2.03 -2.88 113.55 111.28 2oma h SER 20 Ca 0.05 0.00 -0.39 0.00 -1.23 0.00 0.00 61.79 60.21 2oma h SER 20 Cb 0.65 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.55 2oma h SER 20 CO 0.05 0.00 -2.31 -0.11 -0.53 0.00 0.00 176.83 173.93 2oma n LEU 21 N -3.87 2.51 0.17 2.23 0.00 -1.06 -4.61 117.00 112.36 2oma n LEU 21 Ca 0.04 0.12 0.06 0.00 0.00 0.00 0.00 56.01 56.22 2oma n LEU 21 Cb 0.42 -0.92 0.17 0.00 0.00 0.00 0.00 43.42 43.09 2oma n LEU 21 CO 0.29 0.75 0.61 -0.07 0.00 0.00 0.00 177.39 178.96 2oma h LEU 22 N -0.39 0.00 0.85 -1.96 3.38 -1.42 -3.21 115.31 112.57 2oma h LEU 22 Ca -0.57 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.36 2oma h LEU 22 Cb 1.78 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.53 2oma h LEU 22 CO -0.18 0.37 -0.41 0.58 0.09 0.00 0.00 178.44 178.90 2oma h VAL 23 N 0.00 0.16 -0.99 1.22 2.07 -1.76 -0.90 116.25 116.04 2oma h VAL 23 Ca -0.00 -0.01 0.06 0.00 0.82 0.00 0.00 66.70 67.56 2oma h VAL 23 Cb 1.15 0.16 -0.06 0.00 -1.52 0.00 0.00 31.29 31.01 2oma h VAL 23 CO 0.05 0.00 0.64 1.55 0.02 0.00 0.00 177.57 179.83 2oma h PRO 24 N -1.15 1.15 0.06 1.57 0.13 -1.85 -1.82 132.00 130.09 2oma h PRO 24 Ca -0.12 -0.07 0.02 0.00 -0.87 0.00 0.00 66.00 64.97 2oma h PRO 24 Cb 0.88 -0.26 -0.03 0.00 0.13 0.00 0.00 31.00 31.72 2oma h PRO 24 CO 0.19 0.76 -0.22 1.25 -0.23 0.00 0.00 178.00 179.75 2oma h LEU 25 N 1.18 -0.64 -1.25 1.56 5.85 -1.54 -1.86 115.31 118.61 2oma h LEU 25 Ca 0.42 0.08 0.03 0.00 0.84 0.00 0.00 57.88 59.25 2oma h LEU 25 Cb 0.13 0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 2oma h LEU 25 CO -0.16 -0.30 0.52 0.40 -0.34 0.00 0.00 178.44 178.56 2oma h ILE 26 N -0.39 1.14 -0.22 4.05 2.04 -0.97 -1.53 117.51 121.62 2oma h ILE 26 Ca 0.04 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.59 2oma h ILE 26 Cb 0.44 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 2oma h ILE 26 CO -0.16 0.18 0.07 -0.33 0.00 0.00 0.00 178.15 177.91 2oma h GLU 27 N 0.99 0.17 -0.04 2.37 5.08 -1.06 -0.23 114.58 121.87 2oma h GLU 27 Ca 0.31 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.70 2oma h GLU 27 Cb 0.02 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.18 2oma h GLU 27 CO -0.09 0.11 -0.27 1.15 -1.00 0.00 0.00 179.01 178.92 2oma h THR 28 N 0.17 0.39 -0.84 1.13 2.02 -1.03 -2.40 112.91 112.36 2oma h THR 28 Ca 0.10 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.35 2oma h THR 28 Cb 0.07 0.39 -0.07 0.00 -1.74 0.00 0.00 68.15 66.80 2oma h THR 28 CO -0.10 0.00 0.50 -0.07 0.37 0.00 0.00 175.52 176.22 2oma h LEU 29 N -0.39 0.76 -1.28 2.58 -0.00 -1.10 -0.76 115.31 115.13 2oma h LEU 29 Ca 0.07 0.03 0.02 0.00 -0.00 0.00 0.00 57.88 58.01 2oma h LEU 29 Cb 0.49 -0.13 -0.04 0.00 -0.00 0.00 0.00 40.66 40.99 2oma h LEU 29 CO -0.26 0.47 0.50 0.78 -0.00 0.00 0.00 178.44 179.93 2oma h ASN 30 N 0.89 0.82 1.53 -0.43 2.35 -0.86 -2.82 115.58 117.06 2oma h ASN 30 Ca 0.38 -0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 56.05 2oma h ASN 30 Cb 0.25 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 2oma h ASN 30 CO -0.20 0.58 -0.48 0.00 -1.65 0.00 0.00 177.43 175.68 2oma h ALA 31 N 1.55 0.76 -2.57 -0.83 0.00 -0.88 -3.42 119.26 113.87 2oma h ALA 31 Ca 0.29 -0.29 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 2oma h ALA 31 Cb -0.02 -0.01 0.04 0.00 0.00 0.00 0.00 17.79 17.80 2oma h ALA 31 CO -0.08 0.37 0.93 0.00 0.00 0.00 0.00 179.25 180.48 2oma s ALA 32 N -3.09 3.77 -0.03 0.00 0.00 -0.35 -5.01 121.76 117.05 2oma s ALA 32 Ca 0.04 1.36 0.06 0.00 0.00 0.00 0.00 51.96 53.42 2oma s ALA 32 Cb 0.07 -3.65 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 2oma s ALA 32 CO 0.73 -0.88 -0.22 0.99 0.00 0.00 0.00 175.76 176.38 2oma s THR 33 N 1.55 1.75 0.05 0.00 2.01 -1.26 -5.00 115.64 114.73 2oma s THR 33 Ca 0.72 -0.92 0.07 0.00 0.31 0.00 0.00 61.69 61.86 2oma s THR 33 Cb -0.43 -1.47 -0.02 0.00 0.01 0.00 0.00 72.50 70.59 2oma s THR 33 CO 0.32 0.49 -0.19 -0.36 -0.69 0.00 0.00 174.62 174.19 2oma s PHE 34 N -0.33 1.66 -2.11 4.92 0.08 -1.26 -5.04 117.98 115.90 2oma s PHE 34 Ca 0.03 -0.37 0.16 0.00 0.12 0.00 0.00 56.93 56.87 2oma s PHE 34 Cb -0.10 -0.98 0.49 0.00 -0.57 0.00 0.00 43.02 41.85 2oma s PHE 34 CO 0.01 0.08 1.39 -0.25 -0.10 0.00 0.00 175.22 176.35 2oma n ASP 35 N 1.81 2.24 -4.12 1.36 8.00 -1.26 -4.94 116.55 119.65 2oma n ASP 35 Ca -0.18 -1.92 -0.08 0.00 0.71 0.00 0.00 54.79 53.32 2oma n ASP 35 Cb 0.54 -0.24 -0.10 0.00 -0.02 0.00 0.00 41.12 41.30 2oma n ASP 35 CO 0.00 0.00 0.00 -1.38 -0.39 0.00 0.00 177.20 175.43 2oma s HIS 36 N -1.53 0.68 -0.44 1.24 -3.43 -1.26 -5.11 115.29 105.44 2oma s HIS 36 Ca 0.31 -1.14 -0.28 0.00 -0.80 0.00 0.00 55.06 53.14 2oma s HIS 36 Cb 0.16 -0.43 -0.00 0.00 -1.43 0.00 0.00 32.58 30.88 2oma s HIS 36 CO 0.22 -0.44 1.62 0.34 -2.00 0.00 0.00 174.74 174.48 2oma s ASP 37 N -2.98 5.98 -0.02 7.38 2.15 -1.26 -4.98 116.67 122.94 2oma s ASP 37 Ca 0.15 0.82 -0.01 0.00 0.43 0.00 0.00 52.55 53.94 2oma s ASP 37 Cb 0.08 -2.53 0.01 0.00 -0.30 0.00 0.00 42.92 40.18 2oma s ASP 37 CO -0.05 -1.72 0.04 0.54 -0.17 0.00 0.00 175.17 173.80 2oma s VAL 38 N 6.62 -0.02 -0.39 1.11 0.11 -1.26 -4.16 120.40 122.39 2oma s VAL 38 Ca 0.67 0.09 -0.21 0.00 -2.93 0.00 0.00 61.98 59.61 2oma s VAL 38 Cb -0.16 -0.07 0.01 0.00 -1.53 0.00 0.00 36.38 34.63 2oma s VAL 38 CO 0.30 0.04 0.64 -1.58 -3.33 0.00 0.00 175.10 171.17 2oma s GLN 39 N 0.48 3.51 0.04 1.54 2.00 -0.16 -4.86 119.66 122.20 2oma s GLN 39 Ca -0.04 -0.13 -0.09 0.00 -2.00 0.00 0.00 55.36 53.10 2oma s GLN 39 Cb -0.06 -3.87 -0.05 0.00 0.80 0.00 0.00 33.01 29.83 2oma s GLN 39 CO -0.02 -0.86 0.34 0.00 -0.50 0.00 0.00 175.29 174.26 2oma s VAL 41 N -1.33 0.33 -0.10 0.00 1.01 -0.21 -0.10 120.40 120.00 2oma s VAL 41 Ca 0.30 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.27 2oma s VAL 41 Cb -0.14 -0.37 -0.00 0.00 0.00 0.00 0.00 36.38 35.87 2oma s VAL 41 CO 0.17 0.16 -0.23 0.68 0.00 0.00 0.00 175.10 175.88 2oma s VAL 42 N 0.71 2.20 -0.69 2.92 -7.23 0.71 -0.03 120.40 118.99 2oma s VAL 42 Ca -0.08 -0.97 0.01 0.00 -1.81 0.00 0.00 61.98 59.12 2oma s VAL 42 Cb -0.11 -1.85 0.17 0.00 0.56 0.00 0.00 36.38 35.15 2oma s VAL 42 CO -0.01 0.56 0.50 0.00 -0.31 0.00 0.00 175.10 175.83 2oma s ALA 43 N 0.31 3.74 1.05 1.32 0.00 0.07 -0.95 121.76 127.30 2oma s ALA 43 Ca -0.17 -3.54 -0.14 0.00 0.00 0.00 0.00 51.96 48.11 2oma s ALA 43 Cb -0.17 -2.49 0.21 0.00 0.00 0.00 0.00 23.12 20.67 2oma s ALA 43 CO 0.08 -2.10 1.10 -2.14 0.00 0.00 0.00 175.76 172.71 2oma s PRO 44 N -0.75 0.05 0.72 0.00 0.02 -1.25 -2.53 135.00 131.26 2oma s PRO 44 Ca 0.21 0.33 -0.15 0.00 0.02 0.00 0.00 61.00 61.41 2oma s PRO 44 Cb -0.15 -1.71 0.03 0.00 0.02 0.00 0.00 34.50 32.70 2oma s PRO 44 CO -0.08 -2.95 1.19 0.95 -0.33 0.00 0.00 177.00 175.78 2oma s THR 45 N -3.02 2.49 0.31 0.99 -4.23 -1.26 -4.30 115.64 106.62 2oma s THR 45 Ca 0.67 0.24 0.08 0.00 -1.18 0.00 0.00 61.69 61.49 2oma s THR 45 Cb -0.16 -2.78 0.30 0.00 1.34 0.00 0.00 72.50 71.20 2oma s THR 45 CO 0.57 -0.13 1.73 -0.26 -0.54 0.00 0.00 174.62 175.99 2oma h PHE 46 N -0.27 0.97 -0.04 3.99 0.04 -1.96 -0.22 116.94 119.45 2oma h PHE 46 Ca -0.47 0.04 -0.08 0.00 2.80 0.00 0.00 57.97 60.25 2oma h PHE 46 Cb 1.28 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 39.15 2oma h PHE 46 CO 0.49 0.08 -0.36 1.25 -0.60 0.00 0.00 178.31 179.17 2oma h LEU 47 N 0.59 0.09 -0.70 1.54 5.85 -2.03 -2.76 115.31 117.89 2oma h LEU 47 Ca 0.62 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.31 2oma h LEU 47 Cb 1.12 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.13 2oma h LEU 47 CO -0.46 0.45 -0.41 1.41 -0.34 0.00 0.00 178.44 179.08 2oma n HIS 48 N -4.09 0.00 -0.29 1.25 8.25 -0.57 -4.46 115.22 115.32 2oma n HIS 48 Ca -0.02 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.38 2oma n HIS 48 Cb 0.42 -0.06 0.06 0.00 1.12 0.00 0.00 29.99 31.53 2oma n HIS 48 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2oma h ILE 49 N 1.72 1.26 -0.50 1.59 2.04 -0.77 -2.52 117.51 120.33 2oma h ILE 49 Ca 0.00 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.00 2oma h ILE 49 Cb 0.63 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 2oma h ILE 49 CO 0.00 0.34 0.26 -0.65 0.00 0.00 0.00 178.15 178.10 2oma h PRO 50 N 1.15 0.71 -0.72 2.37 0.11 -1.78 -0.55 132.00 133.29 2oma h PRO 50 Ca 0.26 -0.09 0.02 0.00 0.11 0.00 0.00 66.00 66.30 2oma h PRO 50 Cb 0.24 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 31.17 2oma h PRO 50 CO -0.02 0.58 0.46 1.98 -0.21 0.00 0.00 178.00 180.79 2oma h MET 51 N 0.67 0.89 -0.34 1.05 1.85 -1.83 -1.09 114.93 116.13 2oma h MET 51 Ca 0.17 -0.05 -0.06 0.00 -0.61 0.00 0.00 59.70 59.15 2oma h MET 51 Cb 0.09 -0.20 -0.01 0.00 0.43 0.00 0.00 31.60 31.90 2oma h MET 51 CO -0.02 0.59 -0.02 1.15 -0.40 0.00 0.00 176.91 178.20 2oma h THR 52 N 0.92 1.27 -0.49 -0.77 2.02 -1.39 -1.32 112.91 113.14 2oma h THR 52 Ca 0.28 -1.02 -0.02 0.00 0.77 0.00 0.00 66.41 66.41 2oma h THR 52 Cb -0.03 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 2oma h THR 52 CO -0.09 0.34 0.21 0.50 0.37 0.00 0.00 175.52 176.84 2oma h LYS 53 N 0.42 0.70 -0.33 6.66 3.64 -0.94 -0.81 116.57 125.91 2oma h LYS 53 Ca 0.09 -0.09 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 2oma h LYS 53 Cb 0.49 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 2oma h LYS 53 CO 0.02 0.57 -0.32 0.00 -2.27 0.00 0.00 179.45 177.45 2oma h ALA 54 N 1.53 0.82 0.00 5.00 0.00 -1.08 -3.38 119.26 122.14 2oma h ALA 54 Ca 0.17 -0.41 -0.18 0.00 0.00 0.00 0.00 54.91 54.49 2oma h ALA 54 Cb 0.12 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2oma h ALA 54 CO -0.02 0.64 -2.04 0.54 0.00 0.00 0.00 179.25 178.37 2oma n ARG 55 N -4.07 0.92 -2.61 0.00 1.74 -0.51 -4.96 116.66 107.16 2oma n ARG 55 Ca -0.01 -0.08 -0.42 0.00 -0.77 0.00 0.00 57.85 56.57 2oma n ARG 55 Cb 0.48 -1.44 -0.03 0.00 -1.02 0.00 0.00 32.46 30.46 2oma n ARG 55 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2oma s LEU 56 N -4.85 4.28 0.00 0.55 2.96 -0.33 -4.91 118.68 116.37 2oma s LEU 56 Ca -0.08 1.65 0.00 0.00 -0.22 0.00 0.00 54.13 55.48 2oma s LEU 56 Cb 0.08 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.21 2oma s LEU 56 CO 0.74 -0.46 0.00 0.35 -1.32 0.00 0.00 176.35 175.65 2oma n THR 57 N 4.46 0.00 -1.66 3.68 -2.24 -1.26 -4.93 114.28 112.33 2oma n THR 57 Ca 0.09 -0.34 -0.44 0.00 -2.27 0.00 0.00 64.05 61.08 2oma n THR 57 Cb 0.48 0.99 -0.04 0.00 -2.10 0.00 0.00 70.33 69.66 2oma n THR 57 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2oma n ASN 58 N -0.71 3.83 0.00 3.42 2.85 -1.26 -4.84 115.26 118.54 2oma n ASN 58 Ca 0.00 0.86 0.13 0.00 -0.11 0.00 0.00 54.58 55.46 2oma n ASN 58 Cb 0.00 -1.47 0.80 0.00 1.24 0.00 0.00 39.78 40.35 2oma n ASN 58 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2oma n PRO 59 N 7.38 0.86 0.00 1.20 -0.04 -1.26 -2.83 135.00 140.31 2oma n PRO 59 Ca 0.22 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.82 2oma n PRO 59 Cb 0.37 -1.49 0.62 0.00 -0.04 0.00 0.00 33.50 32.96 2oma n PRO 59 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2oma n LYS 60 N -0.99 0.89 -4.53 0.54 5.02 -1.26 -4.92 118.16 112.91 2oma n LYS 60 Ca 0.20 -0.34 -0.34 0.00 -2.02 0.00 0.00 58.31 55.81 2oma n LYS 60 Cb 0.09 -1.49 -0.11 0.00 -0.02 0.00 0.00 35.03 33.50 2oma n LYS 60 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2oma s PHE 61 N -2.34 3.01 0.15 2.13 0.40 -1.13 -0.34 117.98 119.85 2oma s PHE 61 Ca 0.32 0.07 0.09 0.00 -0.60 0.00 0.00 56.93 56.81 2oma s PHE 61 Cb 0.20 -1.72 -0.04 0.00 0.51 0.00 0.00 43.02 41.97 2oma s PHE 61 CO 0.44 0.38 -0.20 -0.65 0.70 0.00 0.00 175.22 175.90 2oma s GLN 62 N -0.91 1.25 -0.20 0.44 -1.52 0.86 -4.95 119.66 114.64 2oma s GLN 62 Ca 0.13 -1.34 -0.10 0.00 -1.95 0.00 0.00 55.36 52.11 2oma s GLN 62 Cb -0.11 -1.42 -0.05 0.00 -0.22 0.00 0.00 33.01 31.21 2oma s GLN 62 CO 0.03 0.31 0.13 0.42 -0.25 0.00 0.00 175.29 175.92 2oma s ILE 63 N -1.69 5.38 0.22 1.08 1.01 -1.26 -0.21 121.20 125.74 2oma s ILE 63 Ca 0.13 0.18 0.11 0.00 0.00 0.00 0.00 60.65 61.07 2oma s ILE 63 Cb -0.07 -3.45 -0.04 0.00 0.01 0.00 0.00 42.46 38.90 2oma s ILE 63 CO 0.06 0.44 -0.16 0.00 0.00 0.00 0.00 174.94 175.28 2oma s ALA 64 N 0.34 2.78 0.26 9.38 0.00 -0.12 -3.53 121.76 130.87 2oma s ALA 64 Ca 0.08 -1.65 -0.01 0.00 0.00 0.00 0.00 51.96 50.38 2oma s ALA 64 Cb -0.11 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 2oma s ALA 64 CO -0.02 0.38 0.46 0.00 0.00 0.00 0.00 175.76 176.59 2oma s ALA 65 N -1.97 3.76 -0.92 0.00 0.00 -0.93 -3.87 121.76 117.83 2oma s ALA 65 Ca 0.25 -0.82 0.28 0.00 0.00 0.00 0.00 51.96 51.67 2oma s ALA 65 Cb -0.07 -2.07 1.03 0.00 0.00 0.00 0.00 23.12 22.01 2oma s ALA 65 CO 0.14 0.27 1.83 1.04 0.00 0.00 0.00 175.76 179.03 2oma n GLN 66 N -1.06 0.08 -3.64 0.00 6.02 -1.26 -1.54 117.38 115.98 2oma n GLN 66 Ca -0.04 0.06 0.01 0.00 -0.01 0.00 0.00 57.00 57.01 2oma n GLN 66 Cb 0.55 -1.59 -0.01 0.00 1.02 0.00 0.00 30.24 30.21 2oma n GLN 66 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2oma s ASN 67 N -3.45 -0.07 0.02 1.08 2.47 -1.23 -4.56 114.94 109.19 2oma s ASN 67 Ca 0.13 -0.18 -0.28 0.00 0.42 0.00 0.00 52.86 52.95 2oma s ASN 67 Cb 0.17 0.21 0.10 0.00 -1.45 0.00 0.00 41.25 40.28 2oma s ASN 67 CO 0.57 -0.39 0.83 0.00 -3.72 0.00 0.00 177.10 174.39 2oma s ALA 68 N -2.55 -1.78 0.28 1.71 0.00 -1.26 -4.91 121.76 113.24 2oma s ALA 68 Ca 0.14 0.94 0.07 0.00 0.00 0.00 0.00 51.96 53.10 2oma s ALA 68 Cb 0.04 0.46 -0.03 0.00 0.00 0.00 0.00 23.12 23.59 2oma s ALA 68 CO -0.03 -0.68 0.30 0.96 0.00 0.00 0.00 175.76 176.31 2oma s ILE 69 N -3.13 4.36 0.92 0.00 -4.36 -0.39 -4.92 121.20 113.68 2oma s ILE 69 Ca 0.04 -1.23 -0.13 0.00 -0.26 0.00 0.00 60.65 59.06 2oma s ILE 69 Cb -0.01 -3.46 0.19 0.00 1.25 0.00 0.00 42.46 40.42 2oma s ILE 69 CO -0.09 -0.27 1.26 0.42 0.24 0.00 0.00 174.94 176.50 2oma s THR 70 N -2.14 2.02 -0.39 8.37 -4.23 -1.26 -1.23 115.64 116.78 2oma s THR 70 Ca 0.37 -0.11 0.18 0.00 -1.18 0.00 0.00 61.69 60.95 2oma s THR 70 Cb -0.08 -2.91 0.18 0.00 1.34 0.00 0.00 72.50 71.03 2oma s THR 70 CO 0.27 0.00 1.56 0.54 -0.54 0.00 0.00 174.62 176.45 2oma n ARG 71 N -3.59 0.12 -0.38 3.99 1.74 -1.26 -3.27 116.66 114.01 2oma n ARG 71 Ca 0.15 0.58 0.09 0.00 -0.77 0.00 0.00 57.85 57.89 2oma n ARG 71 Cb 0.60 -1.86 0.24 0.00 -1.02 0.00 0.00 32.46 30.41 2oma n ARG 71 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2oma n SER 72 N -2.11 3.65 -4.98 0.55 3.41 -1.26 -4.98 113.62 107.89 2oma n SER 72 Ca -0.01 -2.95 -0.20 0.00 -0.26 0.00 0.00 58.87 55.45 2oma n SER 72 Cb 0.06 -0.51 0.01 0.00 -0.26 0.00 0.00 64.21 63.51 2oma n SER 72 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2oma s GLY 73 N -1.97 1.67 -0.10 5.00 0.00 -1.20 -5.07 107.32 105.65 2oma s GLY 73 Ca 0.40 -1.39 -0.30 0.00 0.00 0.00 0.00 44.72 43.43 2oma s GLY 73 CO 0.09 -1.25 1.36 0.00 0.00 0.00 0.00 173.10 173.30 2oma s ALA 74 N -2.35 3.62 -0.27 3.20 0.00 -1.26 -4.95 121.76 119.75 2oma s ALA 74 Ca 0.48 0.66 0.26 0.00 0.00 0.00 0.00 51.96 53.36 2oma s ALA 74 Cb -0.10 -3.63 0.66 0.00 0.00 0.00 0.00 23.12 20.06 2oma s ALA 74 CO 0.34 -1.11 1.73 0.74 0.00 0.00 0.00 175.76 177.45 2oma h PHE 75 N 8.30 0.00 -2.87 0.00 -1.00 -1.96 -3.43 116.94 115.98 2oma h PHE 75 Ca -0.32 0.00 -0.55 0.00 2.81 0.00 0.00 57.97 59.91 2oma h PHE 75 Cb 1.14 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.69 2oma h PHE 75 CO 0.80 0.00 0.88 0.99 -1.61 0.00 0.00 178.31 179.37 2oma s THR 76 N -3.35 3.84 0.00 -1.55 2.01 -1.26 -0.88 115.64 114.45 2oma s THR 76 Ca 0.05 1.15 0.00 0.00 0.31 0.00 0.00 61.69 63.20 2oma s THR 76 Cb 0.06 -3.74 0.00 0.00 0.01 0.00 0.00 72.50 68.83 2oma s THR 76 CO 0.63 -0.04 0.00 0.61 -0.69 0.00 0.00 174.62 175.13 2oma n GLY 77 N 3.70 1.63 3.66 4.40 0.00 -1.26 -5.03 105.19 112.28 2oma n GLY 77 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 2oma n GLY 77 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oma s GLU 78 N -0.32 2.24 -0.09 1.61 0.41 -0.06 -5.12 118.70 117.37 2oma s GLU 78 Ca 0.00 -1.54 0.01 0.00 -0.41 0.00 0.00 54.97 53.03 2oma s GLU 78 Cb 0.00 -2.09 0.02 0.00 -1.78 0.00 0.00 34.13 30.27 2oma s GLU 78 CO 0.00 0.25 -0.11 0.08 -0.49 0.00 0.00 175.26 174.98 2oma s VAL 79 N -2.40 1.17 0.51 2.63 1.01 -1.26 -4.94 120.40 117.12 2oma s VAL 79 Ca 0.34 -0.45 -0.07 0.00 0.00 0.00 0.00 61.98 61.80 2oma s VAL 79 Cb -0.04 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 2oma s VAL 79 CO 0.20 0.38 0.85 -0.94 0.00 0.00 0.00 175.10 175.58 2oma s SER 80 N 1.08 6.27 0.38 3.32 1.04 -1.26 -1.26 113.70 123.27 2oma s SER 80 Ca -0.06 1.06 0.08 0.00 0.48 0.00 0.00 55.95 57.51 2oma s SER 80 Cb -0.14 -2.31 0.82 0.00 0.10 0.00 0.00 66.02 64.49 2oma s SER 80 CO -0.02 -0.64 1.94 -0.07 0.98 0.00 0.00 173.24 175.44 2oma h LEU 81 N 0.16 0.60 -0.13 2.42 3.38 -1.50 -1.38 115.31 118.85 2oma h LEU 81 Ca -0.46 0.01 -0.21 0.00 0.09 0.00 0.00 57.88 57.31 2oma h LEU 81 Cb 1.20 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.85 2oma h LEU 81 CO 0.62 0.36 -0.75 1.56 0.09 0.00 0.00 178.44 180.32 2oma h GLN 82 N 0.67 0.75 -0.25 1.13 1.08 -1.94 -1.97 115.11 114.57 2oma h GLN 82 Ca 0.34 -0.62 -0.01 0.00 -1.45 0.00 0.00 58.65 56.90 2oma h GLN 82 Cb 0.43 0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.99 2oma h GLN 82 CO -0.12 1.23 0.11 0.82 -0.95 0.00 0.00 178.83 179.92 2oma h ILE 83 N 0.46 1.16 -0.38 2.54 2.04 -1.89 -0.81 117.51 120.63 2oma h ILE 83 Ca -0.06 -0.48 0.04 0.00 1.00 0.00 0.00 64.86 65.37 2oma h ILE 83 Cb 1.39 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 38.44 2oma h ILE 83 CO 0.15 0.16 0.15 -0.07 0.00 0.00 0.00 178.15 178.54 2oma h LEU 84 N 0.27 0.17 -0.51 1.44 3.38 -1.24 -1.86 115.31 116.97 2oma h LEU 84 Ca 0.09 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.11 2oma h LEU 84 Cb 0.16 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2oma h LEU 84 CO -0.01 0.14 0.31 0.50 0.09 0.00 0.00 178.44 179.47 2oma h LYS 85 N 0.31 0.61 0.00 1.13 3.64 -1.21 -1.52 116.57 119.54 2oma h LYS 85 Ca 0.17 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 2oma h LYS 85 Cb 0.14 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 2oma h LYS 85 CO -0.16 0.40 -0.15 0.22 -2.27 0.00 0.00 179.45 177.49 2oma h ASP 86 N 0.63 0.00 0.74 4.20 1.82 -0.90 0.33 116.42 123.25 2oma h ASP 86 Ca 0.20 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.84 2oma h ASP 86 Cb -0.01 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.00 2oma h ASP 86 CO -0.07 0.15 0.00 0.00 -1.61 0.00 0.00 179.24 177.71 2oma n TYR 87 N -4.32 0.60 -0.35 0.28 4.19 -0.67 -4.91 117.16 111.97 2oma n TYR 87 Ca -0.03 0.23 0.00 0.00 3.31 0.00 0.00 57.90 61.41 2oma n TYR 87 Cb 0.22 -0.87 0.00 0.00 0.49 0.00 0.00 39.34 39.18 2oma n TYR 87 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 2oma n GLY 88 N 0.15 0.82 3.69 2.98 0.00 0.12 -5.07 105.19 107.88 2oma n GLY 88 Ca 0.03 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 2oma n GLY 88 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oma s ILE 89 N -2.00 4.92 -0.05 -0.61 -1.09 -0.66 -4.96 121.20 116.75 2oma s ILE 89 Ca 0.00 1.68 0.07 0.00 -2.23 0.00 0.00 60.65 60.17 2oma s ILE 89 Cb 0.00 -4.15 0.11 0.00 -1.58 0.00 0.00 42.46 36.83 2oma s ILE 89 CO 0.00 0.12 0.99 -1.54 -1.23 0.00 0.00 174.94 173.28 2oma n SER 90 N 4.53 1.12 -4.22 3.58 3.41 -1.26 -3.83 113.62 116.95 2oma n SER 90 Ca 0.03 -2.27 -0.23 0.00 -0.26 0.00 0.00 58.87 56.14 2oma n SER 90 Cb 0.50 -0.23 -0.14 0.00 -0.26 0.00 0.00 64.21 64.08 2oma n SER 90 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 2oma s TRP 91 N -1.18 1.61 -0.16 7.33 0.52 -1.23 -1.17 118.94 124.65 2oma s TRP 91 Ca 0.12 -0.38 -0.12 0.00 0.02 0.00 0.00 56.10 55.74 2oma s TRP 91 Cb 0.10 -0.94 0.05 0.00 -1.15 0.00 0.00 33.47 31.53 2oma s TRP 91 CO 0.01 0.09 0.42 0.54 0.02 0.00 0.00 176.95 178.03 2oma s VAL 92 N -0.89 -0.01 -0.16 4.03 0.11 -0.86 -2.20 120.40 120.42 2oma s VAL 92 Ca 0.05 0.04 -0.14 0.00 -2.93 0.00 0.00 61.98 59.01 2oma s VAL 92 Cb -0.09 -0.60 -0.05 0.00 -1.53 0.00 0.00 36.38 34.11 2oma s VAL 92 CO 0.02 0.02 0.31 -0.69 -3.33 0.00 0.00 175.10 171.42 2oma s VAL 93 N 0.80 5.29 -0.00 2.04 1.01 -0.59 -0.81 120.40 128.15 2oma s VAL 93 Ca -0.05 0.57 0.02 0.00 0.00 0.00 0.00 61.98 62.52 2oma s VAL 93 Cb -0.06 -3.65 -0.00 0.00 0.00 0.00 0.00 36.38 32.67 2oma s VAL 93 CO -0.06 0.37 -0.05 -0.76 0.00 0.00 0.00 175.10 174.60 2oma s LEU 94 N 0.56 2.02 0.00 3.92 1.43 0.64 -3.55 118.68 123.70 2oma s LEU 94 Ca 0.17 -0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 2oma s LEU 94 Cb -0.13 -0.28 0.00 0.00 0.03 0.00 0.00 46.19 45.81 2oma s LEU 94 CO 0.04 0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.30 2oma n GLY 95 N 2.92 0.51 3.73 -3.19 0.00 -1.26 -0.49 105.19 107.39 2oma n GLY 95 Ca -0.13 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.61 2oma n GLY 95 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2oma n HIS 96 N -3.46 2.52 -0.33 1.61 -0.00 -1.26 -4.28 115.22 110.01 2oma n HIS 96 Ca 0.00 0.51 0.01 0.00 0.46 0.00 0.00 57.72 58.70 2oma n HIS 96 Cb 0.32 -2.45 0.06 0.00 -0.12 0.00 0.00 29.99 27.80 2oma n HIS 96 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2oma n SER 97 N 0.57 -0.50 -0.07 0.26 2.88 -1.26 -0.67 113.62 114.83 2oma n SER 97 Ca 0.04 1.53 0.09 0.00 -1.33 0.00 0.00 58.87 59.20 2oma n SER 97 Cb 0.38 -0.39 0.46 0.00 -0.75 0.00 0.00 64.21 63.91 2oma n SER 97 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2oma h GLU 98 N 0.00 0.48 0.17 -1.46 5.08 -1.98 0.23 114.58 117.10 2oma h GLU 98 Ca 0.34 -0.03 -0.23 0.00 -1.00 0.00 0.00 59.36 58.44 2oma h GLU 98 Cb 0.56 -0.11 0.03 0.00 0.50 0.00 0.00 28.75 29.73 2oma h GLU 98 CO -0.89 0.31 -1.01 0.00 -1.00 0.00 0.00 179.01 176.43 2oma h ARG 99 N 0.49 0.38 -0.88 2.33 3.08 -1.24 0.09 114.38 118.63 2oma h ARG 99 Ca 0.24 -0.64 0.12 0.00 0.07 0.00 0.00 59.98 59.77 2oma h ARG 99 Cb 0.33 0.24 -0.07 0.00 0.08 0.00 0.00 29.97 30.55 2oma h ARG 99 CO -0.07 1.30 0.57 0.00 -1.07 0.00 0.00 179.97 180.70 2oma h ARG 100 N -0.20 0.76 0.07 0.04 3.08 -0.62 -2.04 114.38 115.47 2oma h ARG 100 Ca -0.17 -0.05 -0.24 0.00 0.07 0.00 0.00 59.98 59.59 2oma h ARG 100 Cb 1.79 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.66 2oma h ARG 100 CO 0.19 0.50 -1.28 -0.07 -1.07 0.00 0.00 179.97 178.24 2oma h LEU 101 N 0.78 0.24 0.00 3.04 4.07 -0.59 -3.33 115.31 119.52 2oma h LEU 101 Ca 0.42 -0.78 -0.19 0.00 0.08 0.00 0.00 57.88 57.41 2oma h LEU 101 Cb 0.55 -0.08 -0.04 0.00 1.08 0.00 0.00 40.66 42.18 2oma h LEU 101 CO -0.19 1.54 -2.15 -1.22 -1.08 0.00 0.00 178.44 175.34 2oma n TYR 102 N -4.10 0.06 -1.32 1.13 4.01 0.02 -4.58 117.16 112.38 2oma n TYR 102 Ca -0.26 0.02 0.06 0.00 -0.16 0.00 0.00 57.90 57.55 2oma n TYR 102 Cb 0.81 -0.78 0.19 0.00 -0.31 0.00 0.00 39.34 39.25 2oma n TYR 102 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2oma n TYR 103 N -2.54 0.34 -4.13 -0.72 4.01 -0.79 -5.01 117.16 108.32 2oma n TYR 103 Ca -0.19 -1.27 -0.28 0.00 -0.16 0.00 0.00 57.90 56.00 2oma n TYR 103 Cb 0.88 -0.27 -0.09 0.00 -0.31 0.00 0.00 39.34 39.54 2oma n TYR 103 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2oma n GLY 104 N -1.15 -0.11 3.59 2.72 0.00 -1.19 -4.91 105.19 104.14 2oma n GLY 104 Ca 0.21 0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.99 2oma n GLY 104 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oma s GLU 105 N -6.93 3.88 0.84 1.61 2.02 -1.06 -5.00 118.70 114.07 2oma s GLU 105 Ca 0.00 0.11 -0.08 0.00 0.02 0.00 0.00 54.97 55.02 2oma s GLU 105 Cb -0.00 -3.72 0.17 0.00 0.10 0.00 0.00 34.13 30.67 2oma s GLU 105 CO 0.89 -0.48 1.16 0.95 0.02 0.00 0.00 175.26 177.80 2oma s THR 106 N 2.36 2.05 0.20 3.63 -4.23 -1.26 -4.34 115.64 114.06 2oma s THR 106 Ca 0.20 -0.31 -0.10 0.00 -1.18 0.00 0.00 61.69 60.30 2oma s THR 106 Cb -0.15 -2.74 0.15 0.00 1.34 0.00 0.00 72.50 71.09 2oma s THR 106 CO 0.11 0.00 1.84 0.78 -0.54 0.00 0.00 174.62 176.81 2oma h ASN 107 N -1.09 0.91 -0.34 3.99 2.35 -1.95 -1.91 115.58 117.53 2oma h ASN 107 Ca -0.40 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.26 2oma h ASN 107 Cb 1.25 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 39.37 2oma h ASN 107 CO 0.38 0.72 0.16 -0.33 -1.65 0.00 0.00 177.43 176.71 2oma h GLU 108 N 1.02 0.50 -0.27 0.81 3.07 -1.93 -2.12 114.58 115.66 2oma h GLU 108 Ca 0.26 -0.08 -0.01 0.00 -0.50 0.00 0.00 59.36 59.04 2oma h GLU 108 Cb -0.01 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 27.80 2oma h GLU 108 CO -0.05 0.46 0.13 0.82 -1.40 0.00 0.00 179.01 178.98 2oma h ILE 109 N 0.42 1.15 -0.14 3.13 2.04 -1.87 -0.93 117.51 121.31 2oma h ILE 109 Ca 0.12 -0.43 0.03 0.00 1.00 0.00 0.00 64.86 65.58 2oma h ILE 109 Cb 0.13 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 2oma h ILE 109 CO -0.01 0.15 -0.05 0.58 0.00 0.00 0.00 178.15 178.82 2oma h VAL 110 N 0.30 0.82 -0.60 1.67 2.07 -1.34 -1.70 116.25 117.48 2oma h VAL 110 Ca 0.09 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.73 2oma h VAL 110 Cb 0.12 0.82 -0.11 0.00 -1.52 0.00 0.00 31.29 30.60 2oma h VAL 110 CO -0.01 0.00 -0.13 0.00 0.02 0.00 0.00 177.57 177.44 2oma h ALA 111 N 1.11 0.41 0.13 1.67 0.00 -1.23 0.25 119.26 121.60 2oma h ALA 111 Ca 0.07 0.23 0.01 0.00 0.00 0.00 0.00 54.91 55.22 2oma h ALA 111 Cb 0.13 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2oma h ALA 111 CO -0.16 -0.43 -0.21 0.93 0.00 0.00 0.00 179.25 179.38 2oma h GLU 112 N 0.01 -0.40 -0.54 0.00 5.08 -0.96 0.38 114.58 118.16 2oma h GLU 112 Ca 0.29 0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.75 2oma h GLU 112 Cb 0.44 0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.72 2oma h GLU 112 CO -0.60 -0.26 0.20 0.87 -1.00 0.00 0.00 179.01 178.21 2oma h LYS 113 N -0.41 0.38 0.14 2.33 1.57 -0.88 -0.91 116.57 118.78 2oma h LYS 113 Ca 0.02 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2oma h LYS 113 Cb 0.42 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2oma h LYS 113 CO -0.11 0.25 -0.12 0.28 -0.57 0.00 0.00 179.45 179.19 2oma h VAL 114 N 0.39 0.74 -0.49 0.50 2.07 -0.30 0.13 116.25 119.28 2oma h VAL 114 Ca 0.26 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.78 2oma h VAL 114 Cb 0.29 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 2oma h VAL 114 CO -0.26 0.00 0.30 0.00 0.02 0.00 0.00 177.57 177.63 2oma h ALA 115 N 0.58 0.63 -0.48 1.67 0.00 -0.71 -2.58 119.26 118.37 2oma h ALA 115 Ca -0.00 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.87 2oma h ALA 115 Cb 0.25 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 2oma h ALA 115 CO -0.02 0.12 0.26 1.96 0.00 0.00 0.00 179.25 181.57 2oma h GLN 116 N 0.66 0.51 -1.08 0.00 1.08 -1.08 -0.80 115.11 114.40 2oma h GLN 116 Ca 0.18 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2oma h GLN 116 Cb -0.01 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.31 2oma h GLN 116 CO -0.03 0.34 0.00 0.00 -0.95 0.00 0.00 178.83 178.18 2oma n ALA 117 N -2.29 1.50 0.00 3.87 0.00 0.43 -2.15 120.51 121.87 2oma n ALA 117 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2oma n ALA 117 Cb 0.09 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.54 2oma n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2oma n ALA 119 N 0.68 0.00 1.49 0.00 0.00 -0.31 -1.81 120.51 120.57 2oma n ALA 119 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 2oma n ALA 119 Cb 0.07 0.00 0.40 0.00 0.00 0.00 0.00 19.45 19.92 2oma n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2oma n ALA 120 N 0.00 2.54 -0.60 0.00 0.00 -0.91 -4.94 120.51 116.60 2oma n ALA 120 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2oma n ALA 120 Cb 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.31 2oma n ALA 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oma n GLY 121 N 0.98 0.73 3.80 0.00 0.00 -1.14 -5.04 105.19 104.52 2oma n GLY 121 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 2oma n GLY 121 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oma s PHE 122 N -2.31 2.97 -0.14 1.61 0.40 -0.75 -4.94 117.98 114.83 2oma s PHE 122 Ca 0.00 1.56 -0.16 0.00 -0.60 0.00 0.00 56.93 57.73 2oma s PHE 122 Cb 0.00 -3.07 -0.04 0.00 0.51 0.00 0.00 43.02 40.42 2oma s PHE 122 CO 0.00 -0.96 0.39 -1.01 0.70 0.00 0.00 175.22 174.34 2oma s HIS 123 N -2.08 3.49 -0.15 0.36 3.76 -0.32 -4.84 115.29 115.51 2oma s HIS 123 Ca 0.67 0.75 -0.00 0.00 -0.15 0.00 0.00 55.06 56.32 2oma s HIS 123 Cb -0.17 -2.45 -0.01 0.00 1.11 0.00 0.00 32.58 31.07 2oma s HIS 123 CO 0.25 0.21 -0.13 0.08 -0.85 0.00 0.00 174.74 174.29 2oma s VAL 124 N 0.52 2.90 -0.56 -0.90 1.01 0.94 -2.03 120.40 122.27 2oma s VAL 124 Ca 0.21 -0.70 -0.18 0.00 0.00 0.00 0.00 61.98 61.32 2oma s VAL 124 Cb -0.14 -2.23 0.11 0.00 0.00 0.00 0.00 36.38 34.12 2oma s VAL 124 CO 0.07 0.51 0.60 -0.63 0.00 0.00 0.00 175.10 175.66 2oma s ILE 125 N 0.63 4.99 -0.34 2.22 1.01 0.01 -0.50 121.20 129.23 2oma s ILE 125 Ca -0.07 -1.15 -0.22 0.00 0.00 0.00 0.00 60.65 59.20 2oma s ILE 125 Cb -0.16 -4.40 0.00 0.00 0.01 0.00 0.00 42.46 37.92 2oma s ILE 125 CO 0.03 -0.98 0.73 -0.69 0.00 0.00 0.00 174.94 174.03 2oma s VAL 126 N 2.22 4.81 0.11 2.92 1.01 0.21 -0.26 120.40 131.42 2oma s VAL 126 Ca 0.08 0.86 -0.08 0.00 0.00 0.00 0.00 61.98 62.84 2oma s VAL 126 Cb -0.26 -4.14 -0.06 0.00 0.00 0.00 0.00 36.38 31.93 2oma s VAL 126 CO 0.05 -0.33 0.39 0.00 0.00 0.00 0.00 175.10 175.22 2oma s VAL 128 N -1.52 0.12 0.00 0.00 -7.23 -0.69 -4.71 120.40 106.37 2oma s VAL 128 Ca 0.37 -0.99 0.00 0.00 -1.81 0.00 0.00 61.98 59.55 2oma s VAL 128 Cb -0.13 -1.30 0.00 0.00 0.56 0.00 0.00 36.38 35.51 2oma s VAL 128 CO 0.21 -0.53 0.00 0.61 -0.31 0.00 0.00 175.10 175.08 2oma n GLY 129 N -0.12 3.95 3.92 2.32 0.00 -1.26 -1.21 105.19 112.79 2oma n GLY 129 Ca -0.15 -0.45 -0.28 0.00 0.00 0.00 0.00 46.02 45.13 2oma n GLY 129 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2oma s GLU 130 N -1.84 3.52 0.68 1.61 1.03 -1.26 -4.72 118.70 117.72 2oma s GLU 130 Ca 0.00 -0.33 -0.09 0.00 0.03 0.00 0.00 54.97 54.59 2oma s GLU 130 Cb 0.00 -2.88 0.03 0.00 -0.80 0.00 0.00 34.13 30.48 2oma s GLU 130 CO 0.00 0.45 1.02 0.95 -1.33 0.00 0.00 175.26 176.35 2oma s THR 131 N -1.78 3.13 0.24 1.83 -4.23 -1.26 -2.04 115.64 111.54 2oma s THR 131 Ca 0.38 0.10 -0.06 0.00 -1.18 0.00 0.00 61.69 60.93 2oma s THR 131 Cb -0.11 -3.32 0.21 0.00 1.34 0.00 0.00 72.50 70.62 2oma s THR 131 CO 0.28 -0.37 1.70 -1.13 -0.54 0.00 0.00 174.62 174.56 2oma h ASN 132 N -0.51 0.09 -0.62 3.99 -1.24 -1.97 0.38 115.58 115.69 2oma h ASN 132 Ca -0.45 0.13 -0.07 0.00 0.71 0.00 0.00 56.30 56.62 2oma h ASN 132 Cb 1.28 0.16 -0.02 0.00 0.73 0.00 0.00 38.32 40.46 2oma h ASN 132 CO 0.62 0.01 0.12 -0.33 -1.29 0.00 0.00 177.43 176.56 2oma h GLU 133 N 0.32 1.01 -0.13 6.67 5.08 -1.99 -0.53 114.58 125.02 2oma h GLU 133 Ca 0.40 -0.26 0.01 0.00 -1.00 0.00 0.00 59.36 58.50 2oma h GLU 133 Cb 0.64 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2oma h GLU 133 CO -0.46 0.94 0.04 0.93 -1.00 0.00 0.00 179.01 179.46 2oma h GLU 134 N 0.93 0.10 -0.95 2.33 5.08 -1.85 -2.60 114.58 117.62 2oma h GLU 134 Ca 0.19 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.56 2oma h GLU 134 Cb 0.41 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 2oma h GLU 134 CO 0.01 0.07 0.63 -0.09 -1.00 0.00 0.00 179.01 178.62 2oma h ARG 135 N 0.10 1.24 0.00 2.33 2.43 -0.67 -1.15 114.38 118.67 2oma h ARG 135 Ca 0.05 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 2oma h ARG 135 Cb 0.03 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 29.29 2oma h ARG 135 CO -0.06 0.82 -0.28 0.93 -1.51 0.00 0.00 179.97 179.87 2oma h GLU 136 N 1.28 0.00 -0.46 0.20 5.08 -0.98 -2.39 114.58 117.31 2oma h GLU 136 Ca 0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 2oma h GLU 136 Cb -0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.11 2oma h GLU 136 CO -0.08 0.28 0.00 0.00 -1.00 0.00 0.00 179.01 178.21 2oma n ALA 137 N -2.31 2.43 -1.26 3.43 0.00 -0.99 -4.91 120.51 116.89 2oma n ALA 137 Ca -0.01 -0.84 -0.04 0.00 0.00 0.00 0.00 53.44 52.55 2oma n ALA 137 Cb 0.40 -0.97 -0.02 0.00 0.00 0.00 0.00 19.45 18.87 2oma n ALA 137 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oma n GLY 138 N 1.28 0.64 1.24 0.00 0.00 -0.90 -4.95 105.19 102.50 2oma n GLY 138 Ca 0.17 -0.85 0.12 0.00 0.00 0.00 0.00 46.02 45.45 2oma n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oma n ARG 139 N -2.67 2.61 0.12 1.61 5.12 -0.47 -4.75 116.66 118.24 2oma n ARG 139 Ca -0.04 -2.46 -0.15 0.00 -1.93 0.00 0.00 57.85 53.26 2oma n ARG 139 Cb 0.20 -1.54 -0.09 0.00 -1.16 0.00 0.00 32.46 29.87 2oma n ARG 139 CO 0.00 0.00 0.00 1.15 -1.93 0.00 0.00 177.63 176.85 2oma h THR 140 N 4.36 0.00 -0.58 0.55 2.02 -1.85 -0.63 112.91 116.78 2oma h THR 140 Ca 0.00 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.30 2oma h THR 140 Cb 0.99 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 67.28 2oma h THR 140 CO 0.00 0.00 -0.19 0.00 0.37 0.00 0.00 175.52 175.70 2oma h ALA 141 N -0.66 0.30 -0.44 6.16 0.00 -1.97 -0.59 119.26 122.06 2oma h ALA 141 Ca -0.01 0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 2oma h ALA 141 Cb 0.72 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 2oma h ALA 141 CO -0.24 -0.48 0.26 0.00 0.00 0.00 0.00 179.25 178.78 2oma h ALA 142 N 1.46 0.56 0.34 0.00 0.00 -1.79 0.16 119.26 119.99 2oma h ALA 142 Ca 0.27 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2oma h ALA 142 Cb 0.47 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2oma h ALA 142 CO -0.62 0.06 -0.17 0.28 0.00 0.00 0.00 179.25 178.80 2oma h VAL 143 N 0.58 0.68 -0.10 0.00 2.07 -0.97 -2.38 116.25 116.13 2oma h VAL 143 Ca 0.16 -0.27 -0.12 0.00 0.82 0.00 0.00 66.70 67.28 2oma h VAL 143 Cb 0.01 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2oma h VAL 143 CO -0.03 0.06 -0.49 -0.37 0.02 0.00 0.00 177.57 176.76 2oma h VAL 144 N -0.61 1.34 -0.00 2.57 -1.51 -0.94 -1.10 116.25 116.00 2oma h VAL 144 Ca -0.05 -1.71 -0.16 0.00 -1.23 0.00 0.00 66.70 63.56 2oma h VAL 144 Cb 0.44 1.81 -0.02 0.00 -2.13 0.00 0.00 31.29 31.39 2oma h VAL 144 CO 0.08 0.51 -0.74 -0.07 -1.23 0.00 0.00 177.57 176.12 2oma h LEU 145 N 0.20 0.05 -0.20 4.19 3.38 -0.77 -1.22 115.31 120.94 2oma h LEU 145 Ca 0.01 -0.04 -0.18 0.00 0.09 0.00 0.00 57.88 57.76 2oma h LEU 145 Cb 0.94 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.67 2oma h LEU 145 CO 0.08 0.77 -0.58 0.74 0.09 0.00 0.00 178.44 179.53 2oma h THR 146 N 0.03 1.30 -0.46 0.22 2.02 -1.20 0.40 112.91 115.21 2oma h THR 146 Ca -0.01 -1.79 -0.01 0.00 0.77 0.00 0.00 66.41 65.36 2oma h THR 146 Cb 1.30 1.87 -0.02 0.00 -1.74 0.00 0.00 68.15 69.56 2oma h THR 146 CO 0.10 0.57 0.24 1.56 0.37 0.00 0.00 175.52 178.35 2oma h GLN 147 N 0.47 0.66 -0.03 6.66 4.20 -1.16 -1.96 115.11 123.95 2oma h GLN 147 Ca -0.02 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 2oma h GLN 147 Cb 1.20 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.86 2oma h GLN 147 CO 0.12 0.55 0.00 1.25 -0.67 0.00 0.00 178.83 180.08 2oma h LEU 148 N 0.61 0.04 -0.70 1.46 5.85 -1.19 -3.12 115.31 118.26 2oma h LEU 148 Ca 0.16 -0.27 0.04 0.00 0.84 0.00 0.00 57.88 58.65 2oma h LEU 148 Cb 0.09 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.06 2oma h LEU 148 CO -0.02 0.30 0.43 0.00 -0.34 0.00 0.00 178.44 178.81 2oma h ALA 149 N 0.74 0.93 -0.55 1.25 0.00 -0.14 0.79 119.26 122.28 2oma h ALA 149 Ca 0.01 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.99 2oma h ALA 149 Cb 0.28 -0.20 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 2oma h ALA 149 CO 0.00 0.17 0.18 0.00 0.00 0.00 0.00 179.25 179.60 2oma h ALA 150 N 1.32 0.68 -0.32 0.00 0.00 -1.41 -1.47 119.26 118.05 2oma h ALA 150 Ca 0.29 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.28 2oma h ALA 150 Cb 0.08 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2oma h ALA 150 CO -0.13 -0.23 0.15 0.28 0.00 0.00 0.00 179.25 179.32 2oma h VAL 151 N 0.34 1.16 0.00 0.00 2.07 -1.26 -3.28 116.25 115.28 2oma h VAL 151 Ca 0.27 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 2oma h VAL 151 Cb 0.33 0.87 -0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2oma h VAL 151 CO -0.30 0.17 -0.07 0.00 0.02 0.00 0.00 177.57 177.40 2oma h ALA 152 N 1.01 1.87 0.00 1.67 0.00 0.13 -2.10 119.26 121.84 2oma h ALA 152 Ca 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2oma h ALA 152 Cb 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2oma h ALA 152 CO -0.01 0.08 -0.10 -0.56 0.00 0.00 0.00 179.25 178.66 2oma h GLN 153 N 0.00 0.00 -0.12 0.00 3.07 -1.43 -2.83 115.11 113.80 2oma h GLN 153 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2oma h GLN 153 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.68 2oma h GLN 153 CO 0.01 0.00 0.00 1.63 0.09 0.00 0.00 178.83 180.56 2oma n LYS 154 N -2.63 1.84 -4.32 0.06 5.02 -0.79 -4.92 118.16 112.43 2oma n LYS 154 Ca 0.04 -1.25 -0.28 0.00 -2.02 0.00 0.00 58.31 54.81 2oma n LYS 154 Cb 0.48 -1.44 -0.06 0.00 -0.02 0.00 0.00 35.03 33.98 2oma n LYS 154 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2oma s LEU 155 N -1.76 2.75 0.23 -0.35 1.43 -1.07 -4.83 118.68 115.07 2oma s LEU 155 Ca 0.35 -1.32 0.06 0.00 -1.03 0.00 0.00 54.13 52.18 2oma s LEU 155 Cb 0.20 -1.11 -0.05 0.00 0.03 0.00 0.00 46.19 45.26 2oma s LEU 155 CO 0.30 -0.75 -0.07 -0.94 0.23 0.00 0.00 176.35 175.12 2oma s SER 156 N -3.96 2.27 0.35 2.29 1.04 -1.26 -5.02 113.70 109.41 2oma s SER 156 Ca 0.28 -1.13 0.14 0.00 0.48 0.00 0.00 55.95 55.72 2oma s SER 156 Cb 0.03 -0.08 1.13 0.00 0.10 0.00 0.00 66.02 67.20 2oma s SER 156 CO 0.16 -0.36 1.57 0.29 0.98 0.00 0.00 173.24 175.89 2oma n LYS 157 N -0.42 -0.07 0.02 4.02 5.02 -1.26 -1.50 118.16 123.97 2oma n LYS 157 Ca -0.07 1.42 0.14 0.00 -2.02 0.00 0.00 58.31 57.78 2oma n LYS 157 Cb 0.62 -2.44 0.57 0.00 -0.02 0.00 0.00 35.03 33.77 2oma n LYS 157 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 2oma n GLU 158 N -5.35 0.05 -0.18 1.97 0.00 -1.26 -2.90 120.64 112.97 2oma n GLU 158 Ca 0.33 0.05 -0.04 0.00 0.00 0.00 0.00 57.16 57.49 2oma n GLU 158 Cb 1.10 -1.56 0.14 0.00 0.00 0.00 0.00 31.44 31.12 2oma n GLU 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2oma h ALA 159 N 2.90 1.14 0.00 -1.84 0.00 -1.67 -3.34 119.26 116.45 2oma h ALA 159 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2oma h ALA 159 Cb 0.54 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2oma h ALA 159 CO 0.00 0.59 0.15 -1.49 0.00 0.00 0.00 179.25 178.49 2oma h TRP 160 N 0.92 0.00 0.00 0.00 4.06 -1.64 0.86 115.95 120.14 2oma h TRP 160 Ca 0.20 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.13 2oma h TRP 160 Cb 0.29 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.45 2oma h TRP 160 CO 0.02 0.00 -0.09 0.66 -3.56 0.00 0.00 178.44 175.46 2oma h SER 161 N 0.00 0.00 -0.03 -3.49 4.64 -1.81 -2.93 113.55 109.92 2oma h SER 161 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2oma h SER 161 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 2oma h SER 161 CO 0.00 0.09 -0.00 0.54 -0.87 0.00 0.00 176.83 176.59 2oma n ARG 162 N -3.25 2.29 -3.96 4.77 5.12 0.29 -4.97 116.66 116.95 2oma n ARG 162 Ca 0.00 -1.91 -0.36 0.00 -1.93 0.00 0.00 57.85 53.65 2oma n ARG 162 Cb 0.34 -1.46 -0.06 0.00 -1.16 0.00 0.00 32.46 30.12 2oma n ARG 162 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2oma s VAL 163 N -1.98 5.29 -0.04 1.55 1.01 -1.11 -0.04 120.40 125.07 2oma s VAL 163 Ca 0.28 0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.32 2oma s VAL 163 Cb 0.20 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 33.28 2oma s VAL 163 CO 0.30 0.56 -0.02 -0.69 0.00 0.00 0.00 175.10 175.25 2oma s VAL 164 N -1.06 0.40 -0.03 2.92 1.01 0.35 -4.52 120.40 119.47 2oma s VAL 164 Ca 0.17 -0.03 -0.21 0.00 0.00 0.00 0.00 61.98 61.91 2oma s VAL 164 Cb -0.12 -0.46 -0.05 0.00 0.00 0.00 0.00 36.38 35.75 2oma s VAL 164 CO 0.06 0.20 0.61 -0.63 0.00 0.00 0.00 175.10 175.35 2oma s ILE 165 N 1.06 4.98 -0.20 2.22 -1.09 -0.83 0.68 121.20 128.01 2oma s ILE 165 Ca -0.09 1.27 -0.02 0.00 -2.23 0.00 0.00 60.65 59.58 2oma s ILE 165 Cb -0.14 -3.95 -0.00 0.00 -1.58 0.00 0.00 42.46 36.79 2oma s ILE 165 CO -0.01 0.36 -0.10 0.00 -1.23 0.00 0.00 174.94 173.96 2oma s ALA 166 N 0.18 2.65 -0.36 9.38 0.00 0.31 -0.45 121.76 133.47 2oma s ALA 166 Ca 0.32 -1.15 -0.21 0.00 0.00 0.00 0.00 51.96 50.91 2oma s ALA 166 Cb -0.18 -1.50 0.00 0.00 0.00 0.00 0.00 23.12 21.45 2oma s ALA 166 CO 0.17 -0.34 0.68 -0.47 0.00 0.00 0.00 175.76 175.80 2oma s TYR 167 N 1.31 3.14 -0.28 0.00 5.04 0.79 -1.69 117.35 125.66 2oma s TYR 167 Ca 0.04 0.42 0.02 0.00 -2.44 0.00 0.00 57.07 55.12 2oma s TYR 167 Cb -0.14 -3.22 0.07 0.00 0.35 0.00 0.00 41.96 39.03 2oma s TYR 167 CO -0.05 -0.66 -0.04 -1.21 -1.34 0.00 0.00 175.55 172.25 2oma s GLU 168 N 2.83 1.78 -0.08 4.97 2.02 -0.35 -0.63 118.70 129.25 2oma s GLU 168 Ca 0.27 -1.39 -0.30 0.00 0.02 0.00 0.00 54.97 53.57 2oma s GLU 168 Cb -0.14 -2.85 -0.04 0.00 0.10 0.00 0.00 34.13 31.20 2oma s GLU 168 CO 0.15 -0.71 1.49 -1.25 0.02 0.00 0.00 175.26 174.97 2oma s PRO 169 N 1.15 4.21 0.30 0.39 0.04 -1.25 -4.13 135.00 135.71 2oma s PRO 169 Ca -0.01 1.99 0.06 0.00 0.04 0.00 0.00 61.00 63.07 2oma s PRO 169 Cb -0.19 -3.84 0.75 0.00 0.04 0.00 0.00 34.50 31.26 2oma s PRO 169 CO -0.07 -0.75 1.76 0.28 0.04 0.00 0.00 177.00 178.25 2oma h VAL 170 N 5.42 0.66 0.00 -0.36 2.07 -1.69 0.54 116.25 122.88 2oma h VAL 170 Ca -0.35 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 66.93 2oma h VAL 170 Cb 1.16 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2oma h VAL 170 CO 0.95 0.13 0.13 4.11 0.02 0.00 0.00 177.57 182.91 2oma h TRP 171 N 0.69 0.00 -0.12 1.57 5.08 -1.90 -1.85 115.95 119.41 2oma h TRP 171 Ca 0.58 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.55 2oma h TRP 171 Cb 0.95 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.11 2oma h TRP 171 CO -0.02 0.00 0.00 0.00 -1.28 0.00 0.00 178.44 177.14 2oma n ALA 172 N -1.94 2.46 -2.59 0.11 0.00 0.19 -4.67 120.51 114.08 2oma n ALA 172 Ca -0.02 -0.73 -0.41 0.00 0.00 0.00 0.00 53.44 52.28 2oma n ALA 172 Cb 0.19 -0.87 -0.07 0.00 0.00 0.00 0.00 19.45 18.69 2oma n ALA 172 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2oma s ILE 173 N -1.87 5.02 -1.87 0.00 1.01 -0.70 -2.12 121.20 120.66 2oma s ILE 173 Ca 0.32 0.65 0.00 0.00 0.00 0.00 0.00 60.65 61.62 2oma s ILE 173 Cb 0.21 -3.92 0.00 0.00 0.01 0.00 0.00 42.46 38.76 2oma s ILE 173 CO 0.31 -0.09 0.00 0.61 0.00 0.00 0.00 174.94 175.77 2oma n GLY 174 N 4.57 1.15 0.12 6.18 0.00 -1.26 -4.89 105.19 111.05 2oma n GLY 174 Ca -0.04 -0.11 0.04 0.00 0.00 0.00 0.00 46.02 45.91 2oma n GLY 174 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2oma n THR 175 N -2.93 0.00 -0.82 2.61 -2.24 -1.26 -4.98 114.28 104.66 2oma n THR 175 Ca -0.20 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 2oma n THR 175 Cb 0.63 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.92 2oma n THR 175 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oma n GLY 176 N 0.95 0.38 3.27 3.38 0.00 -1.26 -4.96 105.19 106.96 2oma n GLY 176 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.60 2oma n GLY 176 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2oma s LYS 177 N -0.72 3.18 0.25 1.61 2.47 -1.26 -5.06 119.74 120.21 2oma s LYS 177 Ca 0.00 -2.24 -0.19 0.00 -1.56 0.00 0.00 55.97 51.98 2oma s LYS 177 Cb 0.00 -4.23 -0.08 0.00 -1.46 0.00 0.00 37.83 32.05 2oma s LYS 177 CO 0.00 -1.27 0.74 0.54 0.16 0.00 0.00 175.35 175.52 2oma s VAL 178 N 0.56 4.58 0.22 4.02 0.11 -1.26 -4.10 120.40 124.53 2oma s VAL 178 Ca 0.13 1.23 -0.32 0.00 -2.93 0.00 0.00 61.98 60.10 2oma s VAL 178 Cb -0.18 -3.81 -0.12 0.00 -1.53 0.00 0.00 36.38 30.75 2oma s VAL 178 CO -0.05 0.11 1.68 0.00 -3.33 0.00 0.00 175.10 173.52 2oma s ALA 179 N -1.63 3.89 0.71 1.54 0.00 -1.26 -4.94 121.76 120.07 2oma s ALA 179 Ca 0.46 1.56 -0.16 0.00 0.00 0.00 0.00 51.96 53.82 2oma s ALA 179 Cb -0.15 -3.68 -0.00 0.00 0.00 0.00 0.00 23.12 19.29 2oma s ALA 179 CO 0.20 -0.92 0.95 0.25 0.00 0.00 0.00 175.76 176.24 2oma n THR 180 N 3.65 2.86 -0.35 0.00 -2.24 -1.26 -4.73 114.28 112.21 2oma n THR 180 Ca 0.14 -0.38 0.01 0.00 -2.27 0.00 0.00 64.05 61.55 2oma n THR 180 Cb 0.36 -1.09 0.08 0.00 -2.10 0.00 0.00 70.33 67.58 2oma n THR 180 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2oma h PRO 181 N -0.20 -0.02 -0.98 -0.78 0.11 -1.92 -0.08 132.00 128.14 2oma h PRO 181 Ca -0.47 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.65 2oma h PRO 181 Cb 1.34 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.40 2oma h PRO 181 CO 0.47 -0.01 0.65 0.37 -0.21 0.00 0.00 178.00 179.27 2oma h GLN 182 N -0.02 1.28 -0.32 1.05 5.75 -1.95 0.12 115.11 121.02 2oma h GLN 182 Ca 0.39 -0.08 -0.04 0.00 -0.15 0.00 0.00 58.65 58.77 2oma h GLN 182 Cb 0.64 -0.29 -0.02 0.00 1.07 0.00 0.00 27.48 28.88 2oma h GLN 182 CO -0.95 0.85 0.04 1.96 -2.65 0.00 0.00 178.83 178.08 2oma h GLN 183 N 1.32 0.48 0.07 1.69 4.20 -1.35 -1.88 115.11 119.64 2oma h GLN 183 Ca 0.36 -0.08 -0.13 0.00 0.06 0.00 0.00 58.65 58.86 2oma h GLN 183 Cb -0.14 -0.08 0.01 0.00 0.30 0.00 0.00 27.48 27.58 2oma h GLN 183 CO -0.08 0.47 -0.57 0.00 -0.67 0.00 0.00 178.83 177.98 2oma h ALA 184 N 1.59 -0.02 -0.72 3.87 0.00 -0.99 -3.19 119.26 119.79 2oma h ALA 184 Ca 0.11 -0.60 0.08 0.00 0.00 0.00 0.00 54.91 54.49 2oma h ALA 184 Cb 0.24 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 2oma h ALA 184 CO 0.00 0.27 0.39 0.37 0.00 0.00 0.00 179.25 180.29 2oma h GLN 185 N -0.42 0.67 -0.63 0.00 5.75 -0.67 0.16 115.11 119.98 2oma h GLN 185 Ca -0.09 -0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.34 2oma h GLN 185 Cb 1.38 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 29.75 2oma h GLN 185 CO 0.11 0.45 0.29 1.49 -2.65 0.00 0.00 178.83 178.52 2oma h GLU 186 N 0.69 0.92 -0.09 1.69 4.81 -1.44 -0.53 114.58 120.64 2oma h GLU 186 Ca 0.34 -0.14 -0.22 0.00 -0.13 0.00 0.00 59.36 59.21 2oma h GLU 186 Cb 0.28 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 29.51 2oma h GLU 186 CO -0.22 0.75 -0.79 0.28 -0.73 0.00 0.00 179.01 178.29 2oma h VAL 187 N 0.88 1.30 -0.02 0.32 2.07 -1.41 -2.54 116.25 116.84 2oma h VAL 187 Ca 0.22 -2.03 -0.00 0.00 0.82 0.00 0.00 66.70 65.71 2oma h VAL 187 Cb 0.14 2.17 -0.00 0.00 -1.52 0.00 0.00 31.29 32.08 2oma h VAL 187 CO -0.02 0.63 0.01 0.45 0.02 0.00 0.00 177.57 178.65 2oma h HIS 188 N 0.38 0.03 0.32 1.57 3.86 -0.31 -1.93 115.15 119.07 2oma h HIS 188 Ca -0.07 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.12 2oma h HIS 188 Cb 1.44 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.90 2oma h HIS 188 CO 0.10 0.02 -0.16 0.93 0.86 0.00 0.00 177.93 179.69 2oma h GLU 189 N 0.03 -0.42 -0.95 2.45 5.08 -1.12 -0.87 114.58 118.78 2oma h GLU 189 Ca 0.01 0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.48 2oma h GLU 189 Cb 0.01 0.10 -0.11 0.00 0.50 0.00 0.00 28.75 29.24 2oma h GLU 189 CO -0.00 -0.09 -0.56 -0.11 -1.00 0.00 0.00 179.01 177.24 2oma n LEU 190 N -5.10 -1.01 0.01 1.33 7.94 -0.96 -0.66 117.00 118.56 2oma n LEU 190 Ca -0.09 1.71 -0.10 0.00 -1.11 0.00 0.00 56.01 56.43 2oma n LEU 190 Cb 0.27 -0.23 -0.03 0.00 0.53 0.00 0.00 43.42 43.96 2oma n LEU 190 CO 0.26 -1.39 0.75 -0.07 -1.11 0.00 0.00 177.39 175.83 2oma h LEU 191 N 0.00 -0.52 -0.68 -1.96 3.38 -1.36 -1.33 115.31 112.83 2oma h LEU 191 Ca 0.15 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 2oma h LEU 191 Cb 0.39 0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 2oma h LEU 191 CO -0.89 -0.22 0.32 -0.09 0.09 0.00 0.00 178.44 177.65 2oma h ARG 192 N -0.23 0.98 -0.53 1.13 2.43 -0.94 -0.24 114.38 116.98 2oma h ARG 192 Ca 0.09 -0.15 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 2oma h ARG 192 Cb 0.35 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 2oma h ARG 192 CO -0.23 0.78 0.21 0.00 -1.51 0.00 0.00 179.97 179.22 2oma h ARG 193 N 0.95 0.76 -0.18 0.20 3.08 -0.65 0.17 114.38 118.71 2oma h ARG 193 Ca 0.23 -0.11 -0.11 0.00 0.07 0.00 0.00 59.98 60.06 2oma h ARG 193 Cb 0.12 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2oma h ARG 193 CO -0.03 0.62 -0.33 2.35 -1.07 0.00 0.00 179.97 181.52 2oma h TRP 194 N 0.75 0.68 -0.49 3.04 7.01 -0.79 -1.78 115.95 124.37 2oma h TRP 194 Ca 0.18 -0.24 0.09 0.00 2.11 0.00 0.00 58.89 61.03 2oma h TRP 194 Cb 0.15 -0.13 -0.08 0.00 -2.10 0.00 0.00 29.16 27.00 2oma h TRP 194 CO 0.01 0.97 0.01 0.28 -2.79 0.00 0.00 178.44 176.92 2oma h VAL 195 N 0.20 0.62 -0.74 2.65 2.07 -0.59 -2.20 116.25 118.27 2oma h VAL 195 Ca 0.01 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 2oma h VAL 195 Cb 0.92 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 2oma h VAL 195 CO 0.07 0.02 0.37 -0.09 0.02 0.00 0.00 177.57 177.96 2oma h ARG 196 N 0.12 1.06 -0.16 1.57 2.43 -0.45 0.15 114.38 119.10 2oma h ARG 196 Ca 0.25 -0.15 0.01 0.00 -0.81 0.00 0.00 59.98 59.28 2oma h ARG 196 Cb 0.37 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 2oma h ARG 196 CO -0.40 0.82 0.11 0.66 -1.51 0.00 0.00 179.97 179.64 2oma h SER 197 N 1.03 0.14 0.17 -3.80 4.64 -0.72 0.16 113.55 115.17 2oma h SER 197 Ca 0.26 -0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.22 2oma h SER 197 Cb 0.10 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 62.11 2oma h SER 197 CO -0.03 0.10 -2.07 0.29 -0.87 0.00 0.00 176.83 174.24 2oma n LYS 198 N -4.51 0.70 -0.00 4.77 4.76 -0.97 -4.70 118.16 118.21 2oma n LYS 198 Ca -0.00 0.22 0.01 0.00 -2.87 0.00 0.00 58.31 55.67 2oma n LYS 198 Cb 0.12 -1.67 -0.01 0.00 -1.84 0.00 0.00 35.03 31.63 2oma n LYS 198 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2oma n LEU 199 N -3.26 0.06 0.00 -0.35 4.77 0.49 -5.12 117.00 113.58 2oma n LEU 199 Ca -0.32 -0.36 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 2oma n LEU 199 Cb 1.05 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.14 2oma n LEU 199 CO 0.40 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 2oma n GLY 200 N 1.43 -0.06 0.32 -0.72 0.00 0.04 -4.48 105.19 101.72 2oma n GLY 200 Ca 0.00 -1.93 -0.10 0.00 0.00 0.00 0.00 46.02 43.99 2oma n GLY 200 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2oma h THR 201 N 0.00 0.30 0.47 2.61 2.02 -1.95 -2.69 112.91 113.68 2oma h THR 201 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 2oma h THR 201 Cb 0.00 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 2oma h THR 201 CO 0.00 0.00 -0.23 0.44 0.37 0.00 0.00 175.52 176.10 2oma h ASP 202 N -0.37 -0.54 -0.54 4.18 3.32 -1.98 -2.16 116.42 118.33 2oma h ASP 202 Ca 0.10 -0.05 0.11 0.00 0.02 0.00 0.00 57.03 57.21 2oma h ASP 202 Cb 0.53 0.14 -0.09 0.00 0.22 0.00 0.00 39.33 40.13 2oma h ASP 202 CO -0.36 -0.28 -0.02 0.40 -1.72 0.00 0.00 179.24 177.26 2oma h ILE 203 N -0.79 0.55 -0.70 0.35 2.04 -1.78 -1.69 117.51 115.49 2oma h ILE 203 Ca -0.07 -0.03 -0.06 0.00 1.00 0.00 0.00 64.86 65.70 2oma h ILE 203 Cb 0.56 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 2oma h ILE 203 CO 0.11 0.02 0.21 0.00 0.00 0.00 0.00 178.15 178.49 2oma h ALA 204 N 1.49 0.92 -0.50 1.87 0.00 -1.22 -1.52 119.26 120.30 2oma h ALA 204 Ca 0.27 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 2oma h ALA 204 Cb 0.42 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2oma h ALA 204 CO -0.47 0.60 -0.04 0.00 0.00 0.00 0.00 179.25 179.34 2oma h ALA 205 N 1.10 0.68 0.00 0.00 0.00 -1.32 -3.23 119.26 116.49 2oma h ALA 205 Ca 0.23 -0.31 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 2oma h ALA 205 Cb 0.31 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2oma h ALA 205 CO -0.01 0.53 -0.60 1.96 0.00 0.00 0.00 179.25 181.14 2oma h GLN 206 N 0.78 0.00 -6.77 0.00 1.08 -0.92 -3.38 115.11 105.90 2oma h GLN 206 Ca 0.14 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.81 2oma h GLN 206 Cb 0.58 0.00 0.06 0.00 -0.05 0.00 0.00 27.48 28.07 2oma h GLN 206 CO 0.03 0.60 0.72 -1.17 -0.95 0.00 0.00 178.83 178.06 2oma s LEU 207 N -6.70 4.40 -0.16 1.46 2.96 -0.61 -4.75 118.68 115.28 2oma s LEU 207 Ca 0.02 2.64 -0.18 0.00 -0.22 0.00 0.00 54.13 56.40 2oma s LEU 207 Cb 0.09 -3.63 -0.04 0.00 0.50 0.00 0.00 46.19 43.12 2oma s LEU 207 CO 0.75 -0.65 0.48 -0.13 -1.32 0.00 0.00 176.35 175.48 2oma s ARG 208 N -0.65 4.25 -0.19 1.98 3.00 -1.26 -4.88 118.95 121.20 2oma s ARG 208 Ca 0.57 0.40 -0.01 0.00 0.00 0.00 0.00 55.73 56.69 2oma s ARG 208 Cb -0.41 -3.50 0.01 0.00 0.00 0.00 0.00 34.95 31.05 2oma s ARG 208 CO 0.45 0.00 -0.14 0.42 0.00 0.00 0.00 175.30 176.03 2oma s ILE 209 N 1.14 2.57 0.04 1.52 1.01 -1.26 -1.96 121.20 124.27 2oma s ILE 209 Ca 0.24 -0.77 0.01 0.00 0.00 0.00 0.00 60.65 60.14 2oma s ILE 209 Cb -0.15 -2.12 -0.04 0.00 0.01 0.00 0.00 42.46 40.16 2oma s ILE 209 CO 0.10 0.50 0.08 -0.76 0.00 0.00 0.00 174.94 174.85 2oma s LEU 210 N 1.28 3.85 -0.11 2.97 1.43 0.41 -0.96 118.68 127.54 2oma s LEU 210 Ca 0.04 0.06 -0.10 0.00 -1.03 0.00 0.00 54.13 53.10 2oma s LEU 210 Cb -0.14 -2.40 -0.05 0.00 0.03 0.00 0.00 46.19 43.64 2oma s LEU 210 CO -0.08 0.22 0.22 -0.47 0.23 0.00 0.00 176.35 176.47 2oma s TYR 211 N -1.30 3.57 -0.01 0.29 5.04 -0.23 -0.15 117.35 124.57 2oma s TYR 211 Ca 0.27 0.61 0.05 0.00 -2.44 0.00 0.00 57.07 55.56 2oma s TYR 211 Cb -0.12 -2.12 -0.01 0.00 0.35 0.00 0.00 41.96 40.05 2oma s TYR 211 CO 0.19 0.56 -0.17 0.20 -1.34 0.00 0.00 175.55 174.99 2oma s GLY 212 N -0.56 0.83 0.00 8.97 0.00 0.20 -0.69 107.32 116.07 2oma s GLY 212 Ca 0.16 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 44.13 2oma s GLY 212 CO 0.05 -0.64 0.00 0.61 0.00 0.00 0.00 173.10 173.12 2oma n GLY 213 N 2.56 2.00 3.73 0.20 0.00 -1.26 -3.86 105.19 108.56 2oma n GLY 213 Ca -0.15 -0.38 -0.22 0.00 0.00 0.00 0.00 46.02 45.27 2oma n GLY 213 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2oma n SER 214 N 0.00 -1.12 -4.73 1.61 7.64 -0.90 -4.54 113.62 111.58 2oma n SER 214 Ca 0.00 -0.84 -0.41 0.00 1.01 0.00 0.00 58.87 58.63 2oma n SER 214 Cb 0.00 -3.95 -0.04 0.00 -1.01 0.00 0.00 64.21 59.20 2oma n SER 214 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2oma s VAL 215 N -3.69 4.54 0.21 0.44 1.01 -1.26 -4.69 120.40 116.96 2oma s VAL 215 Ca 0.01 2.02 0.01 0.00 0.00 0.00 0.00 61.98 64.02 2oma s VAL 215 Cb -0.01 -4.30 -0.05 0.00 0.00 0.00 0.00 36.38 32.03 2oma s VAL 215 CO 0.82 0.32 0.07 0.42 0.00 0.00 0.00 175.10 176.73 2oma s THR 216 N 0.03 0.44 0.46 3.92 -4.23 -1.26 -4.59 115.64 110.41 2oma s THR 216 Ca 0.46 -1.99 0.15 0.00 -1.18 0.00 0.00 61.69 59.14 2oma s THR 216 Cb -0.23 -2.42 0.33 0.00 1.34 0.00 0.00 72.50 71.52 2oma s THR 216 CO 0.29 -0.17 2.00 0.00 -0.54 0.00 0.00 174.62 176.21 2oma h ALA 217 N 2.55 2.07 0.00 3.99 0.00 -1.93 -2.15 119.26 123.80 2oma h ALA 217 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2oma h ALA 217 Cb 1.23 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2oma h ALA 217 CO 0.60 -0.19 0.00 0.87 0.00 0.00 0.00 179.25 180.52 2oma h LYS 218 N 0.31 0.00 -0.00 0.00 1.57 -1.97 -3.34 116.57 113.15 2oma h LYS 218 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2oma h LYS 218 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2oma h LYS 218 CO -0.06 0.00 -0.06 0.27 -0.57 0.00 0.00 179.45 179.03 2oma n ASN 219 N -2.88 0.15 -0.09 0.86 0.23 -1.12 -4.85 115.26 107.55 2oma n ASN 219 Ca 0.02 -0.58 -0.13 0.00 -0.53 0.00 0.00 54.58 53.36 2oma n ASN 219 Cb 0.36 0.92 -0.04 0.00 -2.08 0.00 0.00 39.78 38.94 2oma n ASN 219 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2oma h ALA 220 N 0.21 0.44 -0.67 -2.53 0.00 -1.51 -2.61 119.26 112.58 2oma h ALA 220 Ca 0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2oma h ALA 220 Cb 0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2oma h ALA 220 CO 0.00 0.48 0.38 0.00 0.00 0.00 0.00 179.25 180.10 2oma h ARG 221 N 0.49 0.92 -0.06 0.00 2.47 -1.80 0.11 114.38 116.51 2oma h ARG 221 Ca 0.04 -0.09 -0.14 0.00 -1.26 0.00 0.00 59.98 58.53 2oma h ARG 221 Cb 0.89 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 29.01 2oma h ARG 221 CO 0.08 0.66 -0.61 1.15 0.56 0.00 0.00 179.97 181.81 2oma h THR 222 N 0.93 1.39 0.02 2.04 2.02 -1.86 -2.79 112.91 114.67 2oma h THR 222 Ca 0.24 -2.01 -0.00 0.00 0.77 0.00 0.00 66.41 65.41 2oma h THR 222 Cb 0.01 2.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 2oma h THR 222 CO -0.04 0.59 -0.01 -0.07 0.37 0.00 0.00 175.52 176.36 2oma h LEU 223 N 0.15 -0.02 -2.56 2.58 3.38 -1.17 -3.26 115.31 114.41 2oma h LEU 223 Ca -0.01 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.39 2oma h LEU 223 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2oma h LEU 223 CO 0.09 0.57 0.00 0.22 0.09 0.00 0.00 178.44 179.41 2oma h TYR 224 N -0.62 0.00 0.00 1.13 3.20 -0.69 -1.20 116.97 118.80 2oma h TYR 224 Ca -0.00 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.81 2oma h TYR 224 Cb 0.59 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 2oma h TYR 224 CO 0.13 0.00 -0.28 0.37 -1.64 0.00 0.00 178.16 176.74 2oma h GLN 225 N 0.00 0.00 -6.88 1.82 4.15 -1.54 -3.45 115.11 109.22 2oma h GLN 225 Ca 0.00 0.00 -0.56 0.00 0.77 0.00 0.00 58.65 58.86 2oma h GLN 225 Cb 0.13 0.00 0.13 0.00 0.21 0.00 0.00 27.48 27.95 2oma h GLN 225 CO 0.00 0.28 0.46 -1.33 -1.93 0.00 0.00 178.83 176.31 2oma n MET 226 N -3.76 1.72 0.21 1.69 2.81 -0.45 -4.92 117.12 114.43 2oma n MET 226 Ca -0.01 0.62 0.07 0.00 -1.81 0.00 0.00 57.70 56.57 2oma n MET 226 Cb 0.38 -2.40 0.48 0.00 -0.71 0.00 0.00 33.22 30.98 2oma n MET 226 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2oma h ARG 227 N 1.69 0.00 -0.29 0.03 2.47 -1.89 -3.24 114.38 113.15 2oma h ARG 227 Ca -0.49 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 2oma h ARG 227 Cb 1.31 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.63 2oma h ARG 227 CO 0.58 0.27 0.00 -0.25 0.56 0.00 0.00 179.97 181.13 2oma n ASP 228 N -3.80 2.77 -4.56 7.04 9.92 -1.26 -4.92 116.55 121.73 2oma n ASP 228 Ca -0.01 -1.97 -0.36 0.00 -0.53 0.00 0.00 54.79 51.92 2oma n ASP 228 Cb 0.37 -0.19 -0.11 0.00 -0.64 0.00 0.00 41.12 40.54 2oma n ASP 228 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2oma s ILE 229 N -0.99 4.84 -0.19 0.53 1.01 -1.22 -4.61 121.20 120.57 2oma s ILE 229 Ca 0.20 0.00 0.16 0.00 0.00 0.00 0.00 60.65 61.02 2oma s ILE 229 Cb 0.11 -3.26 0.37 0.00 0.01 0.00 0.00 42.46 39.69 2oma s ILE 229 CO 0.14 0.34 1.26 0.59 0.00 0.00 0.00 174.94 177.27 2oma n ASN 230 N 4.56 3.00 0.00 3.58 5.03 -0.13 -4.85 115.26 126.45 2oma n ASN 230 Ca -0.15 -2.93 0.00 0.00 0.87 0.00 0.00 54.58 52.37 2oma n ASN 230 Cb 0.52 -0.44 0.00 0.00 -1.02 0.00 0.00 39.78 38.84 2oma n ASN 230 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2oma n GLY 231 N -0.88 0.79 3.04 7.41 0.00 -1.26 -2.33 105.19 111.95 2oma n GLY 231 Ca 0.17 -2.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.10 2oma n GLY 231 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oma s PHE 232 N -1.94 0.26 -0.27 1.61 0.08 -0.57 -1.07 117.98 116.07 2oma s PHE 232 Ca 0.00 -0.55 -0.01 0.00 0.12 0.00 0.00 56.93 56.50 2oma s PHE 232 Cb 0.00 -0.19 0.04 0.00 -0.57 0.00 0.00 43.02 42.30 2oma s PHE 232 CO 0.00 -0.26 -0.05 -1.17 -0.10 0.00 0.00 175.22 173.64 2oma s LEU 233 N -1.77 3.55 -0.13 -0.37 2.96 0.13 -1.02 118.68 122.04 2oma s LEU 233 Ca -0.11 -1.18 -0.04 0.00 -0.22 0.00 0.00 54.13 52.59 2oma s LEU 233 Cb -0.06 -1.65 -0.03 0.00 0.50 0.00 0.00 46.19 44.95 2oma s LEU 233 CO -0.02 -0.20 0.00 -0.69 -1.32 0.00 0.00 176.35 174.12 2oma s VAL 234 N 1.24 4.29 0.00 1.68 1.01 0.45 -3.99 120.40 125.08 2oma s VAL 234 Ca -0.04 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.70 2oma s VAL 234 Cb -0.19 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.34 2oma s VAL 234 CO -0.03 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.22 2oma n GLY 235 N 2.90 0.01 0.31 4.51 0.00 -1.26 -0.16 105.19 111.50 2oma n GLY 235 Ca -0.18 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.90 2oma n GLY 235 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2oma h GLY 236 N 0.00 1.39 2.00 -0.02 0.00 -1.91 -0.93 103.07 103.60 2oma h GLY 236 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2oma h GLY 236 CO 0.00 0.04 0.00 0.00 0.00 0.00 0.00 176.54 176.58 2oma n ALA 237 N -2.40 1.67 0.50 3.60 0.00 -1.26 -2.43 120.51 120.19 2oma n ALA 237 Ca 0.16 -0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.72 2oma n ALA 237 Cb 0.38 -1.28 0.39 0.00 0.00 0.00 0.00 19.45 18.95 2oma n ALA 237 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2oma h SER 238 N 0.00 0.00 -0.54 0.00 4.64 -1.39 -3.12 113.55 113.14 2oma h SER 238 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2oma h SER 238 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2oma h SER 238 CO 0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 2oma n LEU 239 N -2.46 5.34 -4.25 5.97 4.77 -1.02 -4.82 117.00 120.54 2oma n LEU 239 Ca 0.04 -2.87 -0.16 0.00 -0.03 0.00 0.00 56.01 52.99 2oma n LEU 239 Cb 0.41 -0.65 -0.10 0.00 -2.33 0.00 0.00 43.42 40.75 2oma n LEU 239 CO 0.29 0.66 -0.43 -0.54 -1.33 0.00 0.00 177.39 176.05 2oma s LYS 240 N -2.64 1.05 0.59 3.23 1.02 -1.18 -5.03 119.74 116.79 2oma s LYS 240 Ca 0.52 -1.37 0.29 0.00 0.02 0.00 0.00 55.97 55.43 2oma s LYS 240 Cb 0.39 -0.76 1.47 0.00 -0.52 0.00 0.00 37.83 38.41 2oma s LYS 240 CO 0.16 0.12 1.88 -1.00 -0.92 0.00 0.00 175.35 175.60 2oma h PRO 241 N 3.08 0.00 -0.41 -1.68 0.13 -1.91 -2.34 132.00 128.87 2oma h PRO 241 Ca -0.38 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.87 2oma h PRO 241 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 2oma h PRO 241 CO 0.58 0.00 0.57 1.49 -0.23 0.00 0.00 178.00 180.41 2oma h GLU 242 N 0.00 0.00 -0.23 0.86 4.81 -1.96 -2.17 114.58 115.89 2oma h GLU 242 Ca 0.21 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.33 2oma h GLU 242 Cb 1.18 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 2oma h GLU 242 CO -0.00 0.00 -0.32 0.35 -0.73 0.00 0.00 179.01 178.31 2oma h PHE 243 N 0.00 0.55 -0.83 0.92 3.57 -1.45 -1.85 116.94 117.84 2oma h PHE 243 Ca 0.19 -0.13 0.10 0.00 3.53 0.00 0.00 57.97 61.66 2oma h PHE 243 Cb 1.33 -0.13 -0.07 0.00 2.79 0.00 0.00 35.95 39.87 2oma h PHE 243 CO 0.00 0.74 0.48 0.28 -2.23 0.00 0.00 178.31 177.58 2oma h VAL 244 N 0.41 0.91 -0.47 1.41 2.07 -1.64 -1.15 116.25 117.79 2oma h VAL 244 Ca 0.05 -0.28 -0.09 0.00 0.82 0.00 0.00 66.70 67.20 2oma h VAL 244 Cb 0.76 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2oma h VAL 244 CO 0.06 0.15 -0.08 -0.33 0.02 0.00 0.00 177.57 177.39 2oma h GLU 245 N 0.80 0.84 -0.55 1.57 5.08 -1.52 -1.61 114.58 119.19 2oma h GLU 245 Ca 0.40 -0.27 -0.05 0.00 -1.00 0.00 0.00 59.36 58.44 2oma h GLU 245 Cb 0.37 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 2oma h GLU 245 CO -0.25 0.89 0.14 0.82 -1.00 0.00 0.00 179.01 179.60 2oma h ILE 246 N 0.76 1.23 -0.42 3.13 2.04 -1.01 -2.01 117.51 121.23 2oma h ILE 246 Ca 0.13 -0.82 -0.14 0.00 1.00 0.00 0.00 64.86 65.03 2oma h ILE 246 Cb 0.57 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 2oma h ILE 246 CO 0.03 0.31 -0.30 0.40 0.00 0.00 0.00 178.15 178.59 2oma h ILE 247 N 0.82 1.27 -0.10 -0.67 2.04 -0.80 -2.74 117.51 117.33 2oma h ILE 247 Ca 0.18 -1.47 -0.04 0.00 1.00 0.00 0.00 64.86 64.53 2oma h ILE 247 Cb 0.29 1.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 2oma h ILE 247 CO -0.00 0.50 -0.13 -0.33 0.00 0.00 0.00 178.15 178.19 2oma h GLU 248 N 0.77 0.16 0.00 2.37 5.08 -1.10 -1.10 114.58 120.77 2oma h GLU 248 Ca 0.08 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2oma h GLU 248 Cb 0.89 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2oma h GLU 248 CO 0.08 0.29 0.00 0.00 -1.00 0.00 0.00 179.01 178.39 2oma n ALA 249 N -2.50 2.19 0.47 3.43 0.00 -0.77 -1.87 120.51 121.46 2oma n ALA 249 Ca -0.01 -0.11 0.06 0.00 0.00 0.00 0.00 53.44 53.38 2oma n ALA 249 Cb 0.25 -1.35 0.20 0.00 0.00 0.00 0.00 19.45 18.55 2oma n ALA 249 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2oma n THR 250 N -1.17 0.80 1.03 0.00 -2.24 -0.41 -4.46 114.28 107.82 2oma n THR 250 Ca 0.13 -0.63 0.08 0.00 -2.27 0.00 0.00 64.05 61.36 2oma n THR 250 Cb 0.13 0.15 0.49 0.00 -2.10 0.00 0.00 70.33 69.00 2oma n THR 250 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67