#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ons s SER 5 N 0.00 5.34 -0.02 1.09 0.15 -1.26 -4.37 113.70 114.63 1ons s SER 5 Ca 0.00 2.56 0.21 0.00 0.70 0.00 0.00 55.95 59.41 1ons s SER 5 Cb 0.00 -2.62 0.63 0.00 -1.71 0.00 0.00 66.02 62.32 1ons s SER 5 CO 0.00 -1.50 1.53 0.29 1.20 0.00 0.00 173.24 174.76 1ons n LYS 6 N -1.18 2.95 -3.05 5.44 5.02 -1.26 -0.92 118.16 125.16 1ons n LYS 6 Ca 0.11 -2.65 -0.39 0.00 -2.02 0.00 0.00 58.31 53.35 1ons n LYS 6 Cb 0.47 -1.61 -0.05 0.00 -0.02 0.00 0.00 35.03 33.82 1ons n LYS 6 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1ons s ASN 7 N -0.99 7.16 0.70 4.39 0.01 -1.26 -3.22 114.94 121.73 1ons s ASN 7 Ca 0.47 1.38 -0.16 0.00 -0.71 0.00 0.00 52.86 53.84 1ons s ASN 7 Cb 0.26 -2.44 0.02 0.00 0.41 0.00 0.00 41.25 39.50 1ons s ASN 7 CO 0.30 0.07 1.26 -2.16 -1.51 0.00 0.00 177.10 175.05 1ons s PRO 8 N -0.23 2.25 0.07 -0.60 0.04 -1.26 -4.07 135.00 131.19 1ons s PRO 8 Ca 0.36 1.95 0.01 0.00 0.04 0.00 0.00 61.00 63.36 1ons s PRO 8 Cb -0.20 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.48 1ons s PRO 8 CO 0.22 -1.80 0.15 -0.65 0.04 0.00 0.00 177.00 174.96 1ons s GLN 9 N -3.65 3.20 0.18 4.56 -0.21 -0.67 -4.88 119.66 118.20 1ons s GLN 9 Ca 0.79 -0.55 -0.30 0.00 0.02 0.00 0.00 55.36 55.32 1ons s GLN 9 Cb -0.34 -2.90 -0.08 0.00 1.00 0.00 0.00 33.01 30.69 1ons s GLN 9 CO 0.43 0.59 1.10 0.08 -2.12 0.00 0.00 175.29 175.37 1ons s VAL 10 N -1.45 3.87 -0.56 1.09 1.01 -1.26 0.20 120.40 123.29 1ons s VAL 10 Ca 0.32 1.61 -0.03 0.00 0.00 0.00 0.00 61.98 63.89 1ons s VAL 10 Cb -0.13 -4.03 0.15 0.00 0.00 0.00 0.00 36.38 32.37 1ons s VAL 10 CO 0.25 0.28 0.37 -0.62 0.00 0.00 0.00 175.10 175.38 1ons s ASP 11 N -0.12 5.21 0.15 3.32 -1.08 -0.54 -4.74 116.67 118.87 1ons s ASP 11 Ca 0.49 -2.63 0.12 0.00 -0.52 0.00 0.00 52.55 50.02 1ons s ASP 11 Cb -0.29 -1.84 0.62 0.00 -1.46 0.00 0.00 42.92 39.95 1ons s ASP 11 CO 0.35 -0.41 1.38 2.30 0.52 0.00 0.00 175.17 179.31 1ons n ILE 12 N 3.79 1.39 0.20 4.11 -5.35 -1.26 -2.17 119.36 120.07 1ons n ILE 12 Ca 0.05 0.52 0.05 0.00 -0.27 0.00 0.00 62.75 63.10 1ons n ILE 12 Cb 0.39 -1.49 0.42 0.00 -1.74 0.00 0.00 39.64 37.22 1ons n ILE 12 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ons h ALA 13 N 2.09 1.26 -2.12 -1.28 0.00 -1.95 -3.45 119.26 113.82 1ons h ALA 13 Ca 0.00 -0.30 -0.53 0.00 0.00 0.00 0.00 54.91 54.08 1ons h ALA 13 Cb 0.07 -0.05 -0.14 0.00 0.00 0.00 0.00 17.79 17.67 1ons h ALA 13 CO 0.00 0.42 -0.71 -2.00 0.00 0.00 0.00 179.25 176.96 1ons s GLU 14 N -4.04 1.56 -0.28 0.00 2.56 -0.92 -5.10 118.70 112.48 1ons s GLU 14 Ca -0.02 -1.76 -0.29 0.00 0.00 0.00 0.00 54.97 52.90 1ons s GLU 14 Cb 0.13 -1.36 0.00 0.00 2.00 0.00 0.00 34.13 34.90 1ons s GLU 14 CO 0.69 0.15 1.25 0.34 -0.56 0.00 0.00 175.26 177.14 1ons s ASP 15 N -3.45 6.76 -1.34 -1.70 2.15 -1.26 -3.89 116.67 113.93 1ons s ASP 15 Ca 0.28 1.24 -0.03 0.00 0.43 0.00 0.00 52.55 54.48 1ons s ASP 15 Cb 0.01 -2.54 0.02 0.00 -0.30 0.00 0.00 42.92 40.10 1ons s ASP 15 CO 0.12 -1.00 0.80 -3.20 -0.17 0.00 0.00 175.17 171.72 1ons n ASN 16 N 7.34 -2.14 -4.46 -0.34 5.15 -1.26 -4.70 115.26 114.85 1ons n ASN 16 Ca 0.14 -0.78 -0.31 0.00 -0.60 0.00 0.00 54.58 53.03 1ons n ASN 16 Cb 0.46 -4.16 -0.12 0.00 -0.53 0.00 0.00 39.78 35.43 1ons n ASN 16 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ons s ALA 17 N -3.56 2.62 0.03 5.20 0.00 -1.25 -1.29 121.76 123.51 1ons s ALA 17 Ca 0.15 -1.21 0.01 0.00 0.00 0.00 0.00 51.96 50.92 1ons s ALA 17 Cb -0.07 -0.74 -0.02 0.00 0.00 0.00 0.00 23.12 22.29 1ons s ALA 17 CO 0.80 0.58 -0.06 -0.06 0.00 0.00 0.00 175.76 177.02 1ons s PHE 18 N -0.95 0.50 0.52 0.00 0.40 -0.25 -1.46 117.98 116.73 1ons s PHE 18 Ca 0.15 -0.48 -0.00 0.00 -0.60 0.00 0.00 56.93 56.00 1ons s PHE 18 Cb -0.11 -0.31 0.02 0.00 0.51 0.00 0.00 43.02 43.13 1ons s PHE 18 CO 0.06 -0.12 0.75 -0.06 0.70 0.00 0.00 175.22 176.55 1ons s PHE 19 N -1.33 3.05 0.70 0.36 0.40 0.13 -0.37 117.98 120.93 1ons s PHE 19 Ca -0.11 0.17 -0.14 0.00 -0.60 0.00 0.00 56.93 56.24 1ons s PHE 19 Cb -0.09 -2.58 0.02 0.00 0.51 0.00 0.00 43.02 40.88 1ons s PHE 19 CO -0.00 -0.67 1.13 -1.25 0.70 0.00 0.00 175.22 175.14 1ons s PRO 20 N -4.71 2.48 1.01 0.24 0.04 -1.25 -1.66 135.00 131.14 1ons s PRO 20 Ca 0.53 1.47 -0.11 0.00 0.04 0.00 0.00 61.00 62.93 1ons s PRO 20 Cb -0.10 -1.90 0.20 0.00 0.04 0.00 0.00 34.50 32.73 1ons s PRO 20 CO 0.39 -1.52 1.10 -1.54 0.04 0.00 0.00 177.00 175.47 1ons s SER 21 N -2.53 2.19 0.16 6.66 1.04 0.62 -4.24 113.70 117.60 1ons s SER 21 Ca 0.68 1.95 -0.16 0.00 0.48 0.00 0.00 55.95 58.90 1ons s SER 21 Cb -0.22 -2.48 0.05 0.00 0.10 0.00 0.00 66.02 63.46 1ons s SER 21 CO 0.45 -3.52 1.80 -0.33 0.98 0.00 0.00 173.24 172.62 1ons h GLU 22 N -2.16 0.48 -0.07 4.02 5.08 -1.70 -0.48 114.58 119.75 1ons h GLU 22 Ca -0.50 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 57.87 1ons h GLU 22 Cb 1.29 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.39 1ons h GLU 22 CO 0.45 0.32 -0.18 -0.92 -1.00 0.00 0.00 179.01 177.68 1ons h TYR 23 N 0.50 -0.45 -0.49 4.33 5.03 -1.23 0.24 116.97 124.90 1ons h TYR 23 Ca 0.16 0.02 0.10 0.00 2.58 0.00 0.00 58.73 61.59 1ons h TYR 23 Cb 0.01 0.21 -0.09 0.00 1.55 0.00 0.00 36.73 38.41 1ons h TYR 23 CO -0.07 -0.25 -0.07 0.77 -1.32 0.00 0.00 178.16 177.22 1ons h SER 24 N -0.25 -0.35 -0.59 -2.11 0.02 -1.61 -1.29 113.55 107.38 1ons h SER 24 Ca 0.08 0.13 -0.08 0.00 -0.84 0.00 0.00 61.79 61.08 1ons h SER 24 Cb 0.36 0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.14 1ons h SER 24 CO -0.22 -0.12 0.07 -0.07 -1.14 0.00 0.00 176.83 175.34 1ons h LEU 25 N 0.05 0.98 -1.25 5.07 3.38 -0.24 0.17 115.31 123.46 1ons h LEU 25 Ca 0.24 -0.24 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1ons h LEU 25 Cb 0.37 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1ons h LEU 25 CO -0.46 1.00 -0.36 0.77 0.09 0.00 0.00 178.44 179.47 1ons h SER 26 N 0.95 0.02 0.58 -0.43 4.64 0.16 -1.71 113.55 117.77 1ons h SER 26 Ca 0.18 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1ons h SER 26 Cb 0.46 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1ons h SER 26 CO 0.02 0.38 -1.28 0.00 -0.87 0.00 0.00 176.83 175.08 1ons n GLN 27 N -4.10 0.54 0.00 4.77 1.13 -0.55 -4.52 117.38 114.65 1ons n GLN 27 Ca -0.02 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.04 1ons n GLN 27 Cb 0.40 -1.68 0.00 0.00 0.11 0.00 0.00 30.24 29.07 1ons n GLN 27 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1ons n TYR 28 N -2.38 0.00 -4.35 1.08 4.01 0.02 -5.06 117.16 110.48 1ons n TYR 28 Ca -0.01 -0.13 -0.18 0.00 -0.16 0.00 0.00 57.90 57.42 1ons n TYR 28 Cb 0.53 -0.01 -0.10 0.00 -0.31 0.00 0.00 39.34 39.45 1ons n TYR 28 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1ons s THR 29 N -0.26 0.58 -0.26 -0.72 -4.23 -0.65 -5.02 115.64 105.08 1ons s THR 29 Ca 0.00 -2.00 -0.26 0.00 -1.18 0.00 0.00 61.69 58.25 1ons s THR 29 Cb 0.00 -2.60 0.11 0.00 1.34 0.00 0.00 72.50 71.35 1ons s THR 29 CO 0.00 0.00 0.96 -0.55 -0.54 0.00 0.00 174.62 174.49 1ons s SER 30 N -3.37 -0.50 0.28 3.99 0.15 -1.26 -4.77 113.70 108.22 1ons s SER 30 Ca 0.36 0.91 0.20 0.00 0.70 0.00 0.00 55.95 58.12 1ons s SER 30 Cb 0.07 0.91 1.04 0.00 -1.71 0.00 0.00 66.02 66.33 1ons s SER 30 CO 0.15 -0.21 1.61 -0.81 1.20 0.00 0.00 173.24 175.18 1ons n PRO 31 N 2.08 0.13 -4.10 5.44 -0.04 -1.26 -4.11 135.00 133.14 1ons n PRO 31 Ca -0.13 0.60 -0.15 0.00 -0.04 0.00 0.00 63.50 63.78 1ons n PRO 31 Cb 0.56 -1.91 -0.14 0.00 -0.04 0.00 0.00 33.50 31.97 1ons n PRO 31 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ons s VAL 32 N -3.47 0.34 0.75 0.52 1.01 -1.26 -0.51 120.40 117.78 1ons s VAL 32 Ca -0.01 -0.18 -0.04 0.00 0.00 0.00 0.00 61.98 61.75 1ons s VAL 32 Cb 0.06 -0.29 0.12 0.00 0.00 0.00 0.00 36.38 36.27 1ons s VAL 32 CO 0.20 0.10 1.04 -0.94 0.00 0.00 0.00 175.10 175.50 1ons s SER 33 N -0.07 4.27 -0.44 3.32 1.04 -1.26 -4.99 113.70 115.56 1ons s SER 33 Ca 0.01 -0.10 0.04 0.00 0.48 0.00 0.00 55.95 56.38 1ons s SER 33 Cb -0.02 -0.30 0.64 0.00 0.10 0.00 0.00 66.02 66.44 1ons s SER 33 CO -0.00 -1.92 1.87 -0.90 0.98 0.00 0.00 173.24 173.27 1ons n ASP 34 N -2.98 3.80 -4.72 7.02 3.85 -1.26 -4.98 116.55 117.28 1ons n ASP 34 Ca 0.13 -3.64 -0.42 0.00 -0.71 0.00 0.00 54.79 50.15 1ons n ASP 34 Cb 0.60 -0.82 -0.03 0.00 -1.35 0.00 0.00 41.12 39.52 1ons n ASP 34 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.20 175.97 1ons s LEU 35 N -3.32 4.37 0.10 -2.12 1.98 -1.26 -4.89 118.68 113.54 1ons s LEU 35 Ca 0.56 2.76 -0.25 0.00 -2.89 0.00 0.00 54.13 54.32 1ons s LEU 35 Cb 0.47 -3.60 0.08 0.00 0.66 0.00 0.00 46.19 43.81 1ons s LEU 35 CO 0.09 -0.90 1.14 1.51 -1.89 0.00 0.00 176.35 176.30 1ons s ASP 36 N 1.08 0.01 -1.39 3.68 3.84 -1.26 -4.99 116.67 117.64 1ons s ASP 36 Ca 0.71 -0.49 -0.02 0.00 -0.00 0.00 0.00 52.55 52.75 1ons s ASP 36 Cb -0.47 0.36 0.00 0.00 -1.38 0.00 0.00 42.92 41.43 1ons s ASP 36 CO 0.33 -0.71 0.23 0.61 -0.00 0.00 0.00 175.17 175.63 1ons n GLY 37 N -0.80 -0.33 2.62 2.12 0.00 -1.26 -4.90 105.19 102.65 1ons n GLY 37 Ca 0.00 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1ons n GLY 37 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ons n VAL 38 N -4.14 4.77 -3.98 1.61 0.31 -1.26 -4.89 118.33 110.74 1ons n VAL 38 Ca -0.16 -4.16 -0.33 0.00 -0.01 0.00 0.00 64.34 59.68 1ons n VAL 38 Cb 0.63 -2.25 -0.14 0.00 -0.91 0.00 0.00 33.84 31.17 1ons n VAL 38 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ons s ASP 39 N 0.79 4.74 -0.42 4.52 2.15 -1.26 -5.02 116.67 122.18 1ons s ASP 39 Ca 0.50 -1.67 0.03 0.00 0.43 0.00 0.00 52.55 51.84 1ons s ASP 39 Cb 0.15 -1.64 0.16 0.00 -0.30 0.00 0.00 42.92 41.28 1ons s ASP 39 CO -0.05 -0.30 0.31 -0.31 -0.17 0.00 0.00 175.17 174.64 1ons s TYR 40 N 1.08 1.23 0.32 -5.34 2.02 -1.26 -4.98 117.35 110.42 1ons s TYR 40 Ca -0.00 -2.22 0.31 0.00 -0.37 0.00 0.00 57.07 54.79 1ons s TYR 40 Cb -0.20 -1.11 1.48 0.00 -0.40 0.00 0.00 41.96 41.72 1ons s TYR 40 CO -0.05 -0.81 2.05 -1.00 -1.57 0.00 0.00 175.55 174.18 1ons h PRO 41 N 6.07 0.00 -3.03 -1.71 0.13 -1.95 -3.34 132.00 128.18 1ons h PRO 41 Ca 0.18 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.69 1ons h PRO 41 Cb 0.92 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.64 1ons h PRO 41 CO 0.37 0.09 -0.65 0.15 -0.23 0.00 0.00 178.00 177.73 1ons s LYS 42 N -3.95 2.05 0.51 0.86 1.02 -1.26 -5.11 119.74 113.86 1ons s LYS 42 Ca -0.02 -2.93 -0.19 0.00 0.02 0.00 0.00 55.97 52.86 1ons s LYS 42 Cb 0.11 -3.02 -0.07 0.00 -0.52 0.00 0.00 37.83 34.33 1ons s LYS 42 CO 0.56 -1.26 1.05 -1.25 -0.92 0.00 0.00 175.35 173.53 1ons s PRO 43 N -0.88 3.66 0.34 -1.68 0.04 -1.25 -5.00 135.00 130.22 1ons s PRO 43 Ca 0.24 1.36 -0.28 0.00 0.04 0.00 0.00 61.00 62.36 1ons s PRO 43 Cb -0.09 -2.07 -0.12 0.00 0.04 0.00 0.00 34.50 32.26 1ons s PRO 43 CO -0.13 -0.55 1.37 0.98 0.04 0.00 0.00 177.00 178.71 1ons n TYR 44 N -1.20 2.47 -1.67 0.56 9.36 -0.18 -4.93 117.16 121.57 1ons n TYR 44 Ca 0.09 0.50 0.06 0.00 3.32 0.00 0.00 57.90 61.87 1ons n TYR 44 Cb 0.52 -2.46 0.17 0.00 -0.63 0.00 0.00 39.34 36.95 1ons n TYR 44 CO 0.00 0.00 0.00 2.89 0.22 0.00 0.00 176.86 179.97 1ons n ARG 45 N 0.79 1.31 -0.21 2.98 1.85 -1.26 -4.63 116.66 117.49 1ons n ARG 45 Ca 0.05 -3.00 0.00 0.00 -1.00 0.00 0.00 57.85 53.90 1ons n ARG 45 Cb 0.36 -1.36 0.00 0.00 -1.05 0.00 0.00 32.46 30.41 1ons n ARG 45 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ons n GLY 46 N -0.91 2.32 0.01 2.89 0.00 -1.26 -5.07 105.19 103.16 1ons n GLY 46 Ca 0.16 -2.06 0.08 0.00 0.00 0.00 0.00 46.02 44.21 1ons n GLY 46 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ons n LYS 47 N -0.18 0.78 -1.73 1.61 5.02 -1.26 -5.01 118.16 117.39 1ons n LYS 47 Ca 0.00 -0.12 -0.42 0.00 -2.02 0.00 0.00 58.31 55.75 1ons n LYS 47 Cb 0.00 -1.35 -0.02 0.00 -0.02 0.00 0.00 35.03 33.64 1ons n LYS 47 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1ons n HIS 48 N -1.91 2.72 -4.34 2.13 8.25 -1.26 -4.93 115.22 115.89 1ons n HIS 48 Ca -0.02 0.30 -0.25 0.00 -0.26 0.00 0.00 57.72 57.49 1ons n HIS 48 Cb 0.38 -2.57 -0.09 0.00 1.12 0.00 0.00 29.99 28.84 1ons n HIS 48 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1ons s LYS 49 N -0.57 2.08 -0.15 -0.41 1.02 0.35 -4.59 119.74 117.46 1ons s LYS 49 Ca 0.64 -1.83 -0.17 0.00 0.02 0.00 0.00 55.97 54.64 1ons s LYS 49 Cb -0.52 -1.89 -0.04 0.00 -0.52 0.00 0.00 37.83 34.86 1ons s LYS 49 CO 0.50 0.06 0.43 0.42 -0.92 0.00 0.00 175.35 175.84 1ons s ILE 50 N -2.56 5.20 -0.32 2.17 1.09 -0.63 -1.04 121.20 125.10 1ons s ILE 50 Ca 0.36 0.83 -0.15 0.00 -1.10 0.00 0.00 60.65 60.59 1ons s ILE 50 Cb 0.02 -3.77 -0.02 0.00 -1.06 0.00 0.00 42.46 37.63 1ons s ILE 50 CO 0.20 0.30 0.36 -0.22 -0.10 0.00 0.00 174.94 175.48 1ons s LEU 51 N 0.87 4.32 -0.19 2.97 2.96 0.64 -0.89 118.68 129.36 1ons s LEU 51 Ca 0.23 -0.09 -0.11 0.00 -0.22 0.00 0.00 54.13 53.93 1ons s LEU 51 Cb -0.15 -2.35 -0.05 0.00 0.50 0.00 0.00 46.19 44.14 1ons s LEU 51 CO 0.09 -0.29 0.19 -0.69 -1.32 0.00 0.00 176.35 174.33 1ons s VAL 52 N 2.03 5.37 -0.44 1.68 1.01 0.40 -0.01 120.40 130.43 1ons s VAL 52 Ca 0.12 0.32 -0.09 0.00 0.00 0.00 0.00 61.98 62.33 1ons s VAL 52 Cb -0.16 -3.53 0.10 0.00 0.00 0.00 0.00 36.38 32.78 1ons s VAL 52 CO 0.11 0.41 0.28 -0.63 0.00 0.00 0.00 175.10 175.27 1ons s ILE 53 N 0.49 4.13 0.54 2.22 1.01 -0.21 -0.33 121.20 129.05 1ons s ILE 53 Ca 0.11 -1.59 0.07 0.00 0.00 0.00 0.00 60.65 59.24 1ons s ILE 53 Cb -0.12 -3.62 0.06 0.00 0.01 0.00 0.00 42.46 38.79 1ons s ILE 53 CO 0.01 -0.61 0.74 0.00 0.00 0.00 0.00 174.94 175.08 1ons s ALA 54 N 1.38 4.47 -0.06 9.38 0.00 0.09 -4.34 121.76 132.68 1ons s ALA 54 Ca 0.04 -1.88 -0.21 0.00 0.00 0.00 0.00 51.96 49.91 1ons s ALA 54 Cb -0.24 -1.63 -0.04 0.00 0.00 0.00 0.00 23.12 21.21 1ons s ALA 54 CO 0.01 -0.73 0.62 0.00 0.00 0.00 0.00 175.76 175.65 1ons s ALA 55 N -2.63 3.41 -2.53 0.00 0.00 -1.26 -4.56 121.76 114.19 1ons s ALA 55 Ca 0.60 0.03 0.20 0.00 0.00 0.00 0.00 51.96 52.79 1ons s ALA 55 Cb -0.07 -2.83 0.16 0.00 0.00 0.00 0.00 23.12 20.38 1ons s ALA 55 CO 0.38 -0.00 1.14 -0.40 0.00 0.00 0.00 175.76 176.88 1ons n ASP 56 N 3.44 2.67 -4.14 0.00 3.85 -1.26 -0.92 116.55 120.19 1ons n ASP 56 Ca -0.04 -1.84 -0.26 0.00 -0.71 0.00 0.00 54.79 51.94 1ons n ASP 56 Cb 0.51 0.01 -0.16 0.00 -1.35 0.00 0.00 41.12 40.14 1ons n ASP 56 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 1ons s GLU 57 N -1.72 1.82 -0.14 0.11 2.56 -1.26 -4.77 118.70 115.30 1ons s GLU 57 Ca 0.24 -0.63 0.11 0.00 0.00 0.00 0.00 54.97 54.69 1ons s GLU 57 Cb 0.17 -1.59 -0.23 0.00 2.00 0.00 0.00 34.13 34.48 1ons s GLU 57 CO 0.26 0.25 0.29 -2.13 -0.56 0.00 0.00 175.26 173.37 1ons n ARG 58 N 3.12 0.67 -3.40 4.30 0.63 -1.26 -4.51 116.66 116.21 1ons n ARG 58 Ca -0.18 0.16 -0.38 0.00 -0.92 0.00 0.00 57.85 56.53 1ons n ARG 58 Cb 0.53 -1.65 -0.08 0.00 0.45 0.00 0.00 32.46 31.72 1ons n ARG 58 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1ons s TYR 59 N -2.54 3.35 -0.22 -0.14 2.02 -1.26 -0.39 117.35 118.16 1ons s TYR 59 Ca -0.13 0.56 -0.04 0.00 -0.37 0.00 0.00 57.07 57.10 1ons s TYR 59 Cb 0.07 -2.52 -0.01 0.00 -0.40 0.00 0.00 41.96 39.11 1ons s TYR 59 CO 0.79 -0.04 -0.04 -1.17 -1.57 0.00 0.00 175.55 173.52 1ons s LEU 60 N 1.41 2.92 0.19 -1.29 2.96 -0.43 -4.92 118.68 119.53 1ons s LEU 60 Ca 0.18 -0.40 -0.30 0.00 -0.22 0.00 0.00 54.13 53.38 1ons s LEU 60 Cb -0.15 -1.74 -0.08 0.00 0.50 0.00 0.00 46.19 44.72 1ons s LEU 60 CO 0.08 -0.03 1.21 -2.16 -1.32 0.00 0.00 176.35 174.13 1ons s PRO 61 N 1.48 4.48 0.50 0.98 0.04 -1.26 0.19 135.00 141.40 1ons s PRO 61 Ca 0.06 1.89 0.09 0.00 0.04 0.00 0.00 61.00 63.08 1ons s PRO 61 Cb -0.14 -3.23 0.04 0.00 0.04 0.00 0.00 34.50 31.21 1ons s PRO 61 CO -0.03 -0.10 0.64 0.95 0.04 0.00 0.00 177.00 178.49 1ons s THR 62 N -0.06 2.50 0.54 1.26 -4.23 0.10 -4.62 115.64 111.14 1ons s THR 62 Ca 0.53 -1.07 0.42 0.00 -1.18 0.00 0.00 61.69 60.39 1ons s THR 62 Cb -0.33 -2.57 0.42 0.00 1.34 0.00 0.00 72.50 71.36 1ons s THR 62 CO 0.37 0.00 2.28 -2.24 -0.54 0.00 0.00 174.62 174.49 1ons h ASP 63 N 0.48 0.00 -0.53 3.99 2.03 -0.18 -1.99 116.42 120.22 1ons h ASP 63 Ca -0.35 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.95 1ons h ASP 63 Cb 1.28 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.78 1ons h ASP 63 CO 0.45 0.00 0.00 -0.46 -1.03 0.00 0.00 179.24 178.20 1ons n ASN 64 N -2.98 4.96 0.00 4.15 0.23 -1.26 -4.93 115.26 115.42 1ons n ASN 64 Ca -0.03 -2.74 0.00 0.00 -0.53 0.00 0.00 54.58 51.28 1ons n ASN 64 Cb 0.08 -0.60 0.00 0.00 -2.08 0.00 0.00 39.78 37.17 1ons n ASN 64 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1ons n GLY 65 N 0.59 2.86 3.81 4.83 0.00 -0.75 -5.02 105.19 111.51 1ons n GLY 65 Ca 0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.95 1ons n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ons s LYS 66 N -0.28 3.32 -0.11 1.61 1.02 -1.26 -4.73 119.74 119.31 1ons s LYS 66 Ca 0.00 1.15 -0.03 0.00 0.02 0.00 0.00 55.97 57.11 1ons s LYS 66 Cb 0.00 -2.03 -0.03 0.00 -0.52 0.00 0.00 37.83 35.24 1ons s LYS 66 CO 0.00 -0.81 0.01 -0.51 -0.92 0.00 0.00 175.35 173.12 1ons s LEU 67 N -4.61 3.58 -0.21 3.17 1.43 -0.41 0.03 118.68 121.66 1ons s LEU 67 Ca 0.62 0.10 -0.18 0.00 -1.03 0.00 0.00 54.13 53.65 1ons s LEU 67 Cb -0.15 -1.84 -0.03 0.00 0.03 0.00 0.00 46.19 44.19 1ons s LEU 67 CO 0.39 0.31 0.48 0.12 0.23 0.00 0.00 176.35 177.88 1ons s PHE 68 N -0.48 3.35 -0.84 0.29 5.99 0.13 -1.09 117.98 125.33 1ons s PHE 68 Ca 0.09 0.70 -0.24 0.00 0.00 0.00 0.00 56.93 57.48 1ons s PHE 68 Cb -0.12 -2.64 0.06 0.00 0.00 0.00 0.00 43.02 40.32 1ons s PHE 68 CO 0.02 -0.11 1.25 0.45 -0.00 0.00 0.00 175.22 176.83 1ons s SER 69 N 1.20 6.34 0.00 6.13 0.15 0.50 -1.31 113.70 126.71 1ons s SER 69 Ca 0.22 -1.10 0.00 0.00 0.70 0.00 0.00 55.95 55.77 1ons s SER 69 Cb -0.15 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.65 1ons s SER 69 CO 0.09 -1.55 0.00 1.07 1.20 0.00 0.00 173.24 174.05 1ons n THR 70 N 6.32 0.00 0.00 6.45 5.66 0.47 -4.70 114.28 128.48 1ons n THR 70 Ca 0.14 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.14 1ons n THR 70 Cb 0.49 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.27 1ons n THR 70 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1ons n GLY 71 N 4.47 0.76 3.76 1.09 0.00 -1.24 -4.37 105.19 109.67 1ons n GLY 71 Ca 0.00 -1.84 -0.40 0.00 0.00 0.00 0.00 46.02 43.78 1ons n GLY 71 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ons s ASN 72 N -4.00 7.54 -0.19 1.61 0.02 0.86 -1.76 114.94 119.03 1ons s ASN 72 Ca 0.00 1.83 -0.29 0.00 -1.02 0.00 0.00 52.86 53.38 1ons s ASN 72 Cb 0.00 -2.57 -0.00 0.00 0.02 0.00 0.00 41.25 38.70 1ons s ASN 72 CO 0.00 0.17 1.16 -2.28 0.02 0.00 0.00 177.10 176.17 1ons s HIS 73 N -1.19 3.08 0.25 2.20 5.65 -0.51 -0.86 115.29 123.92 1ons s HIS 73 Ca 0.39 1.22 -0.05 0.00 0.25 0.00 0.00 55.06 56.88 1ons s HIS 73 Cb -0.25 -3.40 0.32 0.00 -1.18 0.00 0.00 32.58 28.08 1ons s HIS 73 CO 0.30 -1.15 1.88 -1.00 -0.65 0.00 0.00 174.74 174.13 1ons h PRO 74 N 7.83 1.11 -0.08 2.88 0.13 -1.87 0.14 132.00 142.14 1ons h PRO 74 Ca -0.24 -0.07 -0.01 0.00 -0.87 0.00 0.00 66.00 64.81 1ons h PRO 74 Cb 1.09 -0.25 -0.00 0.00 0.13 0.00 0.00 31.00 31.97 1ons h PRO 74 CO 0.97 0.74 0.00 0.82 -0.23 0.00 0.00 178.00 180.29 1ons h ILE 75 N 1.15 1.25 -0.83 -3.56 1.08 -1.92 0.87 117.51 115.54 1ons h ILE 75 Ca 0.38 -0.77 0.04 0.00 -0.39 0.00 0.00 64.86 64.12 1ons h ILE 75 Cb 0.06 1.61 -0.05 0.00 -3.07 0.00 0.00 36.82 35.36 1ons h ILE 75 CO -0.14 0.22 0.54 -0.33 -0.69 0.00 0.00 178.15 177.75 1ons h GLU 76 N -0.13 0.96 0.00 2.37 5.08 -1.77 -2.02 114.58 119.06 1ons h GLU 76 Ca 0.02 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1ons h GLU 76 Cb 0.34 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1ons h GLU 76 CO 0.00 0.64 -0.00 1.15 -1.00 0.00 0.00 179.01 179.80 1ons h THR 77 N 0.99 1.67 -0.18 1.13 2.02 -0.58 -3.39 112.91 114.57 1ons h THR 77 Ca 0.34 -2.13 -0.19 0.00 0.77 0.00 0.00 66.41 65.20 1ons h THR 77 Cb 0.09 3.09 0.01 0.00 -1.74 0.00 0.00 68.15 69.60 1ons h THR 77 CO -0.11 0.54 -0.62 -0.07 0.37 0.00 0.00 175.52 175.64 1ons h LEU 78 N -0.93 0.85 0.27 2.58 3.38 -0.80 -3.22 115.31 117.43 1ons h LEU 78 Ca -0.00 -0.60 -0.01 0.00 0.09 0.00 0.00 57.88 57.36 1ons h LEU 78 Cb 0.89 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 1ons h LEU 78 CO 0.00 1.30 -0.16 -0.07 0.09 0.00 0.00 178.44 179.61 1ons h LEU 79 N 0.44 -0.38 -1.73 1.67 4.07 -1.55 0.46 115.31 118.28 1ons h LEU 79 Ca -0.03 0.02 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 1ons h LEU 79 Cb 1.24 0.11 -0.00 0.00 1.08 0.00 0.00 40.66 43.09 1ons h LEU 79 CO 0.13 -0.25 -0.09 1.55 -1.08 0.00 0.00 178.44 178.69 1ons h PRO 80 N -0.41 0.05 0.00 1.13 0.13 -1.71 -1.33 132.00 129.87 1ons h PRO 80 Ca -0.03 -0.01 -0.15 0.00 -0.87 0.00 0.00 66.00 64.94 1ons h PRO 80 Cb 0.33 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.43 1ons h PRO 80 CO 0.04 0.15 -0.73 -0.07 -0.23 0.00 0.00 178.00 177.15 1ons h LEU 81 N 0.05 0.00 -0.36 1.56 3.38 -1.50 -1.88 115.31 116.56 1ons h LEU 81 Ca 0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1ons h LEU 81 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1ons h LEU 81 CO 0.01 0.73 0.04 0.22 0.09 0.00 0.00 178.44 179.54 1ons h TYR 82 N 0.00 0.65 -0.07 1.13 3.20 0.20 0.28 116.97 122.35 1ons h TYR 82 Ca -0.01 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.76 1ons h TYR 82 Cb 1.39 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 39.48 1ons h TYR 82 CO 0.00 0.68 0.03 0.45 -1.64 0.00 0.00 178.16 177.67 1ons h HIS 83 N 0.44 0.11 -0.70 -3.82 3.86 -1.36 -0.70 115.15 112.99 1ons h HIS 83 Ca 0.11 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.29 1ons h HIS 83 Cb 0.39 -0.03 -0.03 0.00 1.06 0.00 0.00 27.41 28.79 1ons h HIS 83 CO 0.03 0.25 0.35 -0.07 0.86 0.00 0.00 177.93 179.35 1ons h LEU 84 N -0.06 0.91 -0.35 2.43 3.38 -1.18 0.30 115.31 120.74 1ons h LEU 84 Ca 0.02 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1ons h LEU 84 Cb 0.19 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1ons h LEU 84 CO -0.00 0.77 0.10 -0.74 0.09 0.00 0.00 178.44 178.66 1ons h HIS 85 N 0.97 0.56 -0.96 1.13 2.76 -0.22 0.43 115.15 119.83 1ons h HIS 85 Ca 0.24 -0.06 -0.00 0.00 -2.20 0.00 0.00 60.37 58.35 1ons h HIS 85 Cb 0.09 -0.16 -0.05 0.00 1.55 0.00 0.00 27.41 28.85 1ons h HIS 85 CO 0.00 0.56 0.59 0.00 -1.30 0.00 0.00 177.93 177.78 1ons h ALA 86 N 0.94 1.24 0.00 5.26 0.00 -0.71 0.02 119.26 126.02 1ons h ALA 86 Ca 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ons h ALA 86 Cb 0.26 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1ons h ALA 86 CO -0.00 0.66 0.00 0.00 0.00 0.00 0.00 179.25 179.91 1ons n ALA 87 N -2.39 2.13 0.00 0.00 0.00 0.10 -4.81 120.51 115.54 1ons n ALA 87 Ca 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ons n ALA 87 Cb 0.05 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.22 1ons n ALA 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ons n GLY 88 N 0.07 0.65 3.46 0.00 0.00 -0.01 -1.01 105.19 108.35 1ons n GLY 88 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1ons n GLY 88 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ons s PHE 89 N -2.00 3.24 0.83 1.61 0.40 0.15 -4.70 117.98 117.51 1ons s PHE 89 Ca 0.00 -0.56 -0.12 0.00 -0.60 0.00 0.00 56.93 55.65 1ons s PHE 89 Cb 0.00 -2.55 0.09 0.00 0.51 0.00 0.00 43.02 41.07 1ons s PHE 89 CO 0.00 -0.55 1.16 -2.00 0.70 0.00 0.00 175.22 174.53 1ons s GLU 90 N 1.67 1.78 0.11 0.44 2.56 -1.26 -2.67 118.70 121.33 1ons s GLU 90 Ca 0.05 0.20 0.01 0.00 0.00 0.00 0.00 54.97 55.23 1ons s GLU 90 Cb -0.19 -1.92 -0.04 0.00 2.00 0.00 0.00 34.13 33.98 1ons s GLU 90 CO 0.10 -1.74 -0.04 -0.59 -0.56 0.00 0.00 175.26 172.43 1ons s PHE 91 N -3.47 0.89 0.10 5.30 -0.71 -1.26 -1.60 117.98 117.24 1ons s PHE 91 Ca 0.62 -0.98 0.07 0.00 -1.04 0.00 0.00 56.93 55.61 1ons s PHE 91 Cb -0.12 -0.52 -0.03 0.00 -1.21 0.00 0.00 43.02 41.13 1ons s PHE 91 CO 0.51 -0.22 -0.18 -1.21 -1.34 0.00 0.00 175.22 172.78 1ons s GLU 92 N -3.87 1.06 -0.03 1.99 2.02 -0.07 -4.90 118.70 114.89 1ons s GLU 92 Ca 0.14 -1.15 0.06 0.00 0.02 0.00 0.00 54.97 54.04 1ons s GLU 92 Cb 0.06 -1.19 -0.02 0.00 0.10 0.00 0.00 34.13 33.08 1ons s GLU 92 CO -0.04 0.27 -0.23 0.08 0.02 0.00 0.00 175.26 175.36 1ons s VAL 93 N -1.41 2.32 0.03 2.63 1.01 -1.26 -0.46 120.40 123.26 1ons s VAL 93 Ca 0.06 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.05 1ons s VAL 93 Cb -0.09 -1.84 -0.02 0.00 0.00 0.00 0.00 36.38 34.43 1ons s VAL 93 CO 0.04 0.58 -0.05 0.00 0.00 0.00 0.00 175.10 175.67 1ons s ALA 94 N -0.55 0.34 0.08 5.51 0.00 0.55 -1.23 121.76 126.45 1ons s ALA 94 Ca 0.08 -0.64 0.03 0.00 0.00 0.00 0.00 51.96 51.43 1ons s ALA 94 Cb -0.11 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.07 1ons s ALA 94 CO 0.00 -0.08 -0.09 0.95 0.00 0.00 0.00 175.76 176.54 1ons s THR 95 N -1.34 0.79 0.12 0.00 -4.23 -0.68 -0.73 115.64 109.58 1ons s THR 95 Ca -0.12 -1.52 -0.24 0.00 -1.18 0.00 0.00 61.69 58.62 1ons s THR 95 Cb -0.09 -1.20 -0.04 0.00 1.34 0.00 0.00 72.50 72.50 1ons s THR 95 CO -0.00 -0.55 1.65 0.40 -0.54 0.00 0.00 174.62 175.58 1ons h ILE 96 N 3.75 0.51 0.00 2.99 2.04 -1.86 -0.20 117.51 124.73 1ons h ILE 96 Ca -0.37 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.44 1ons h ILE 96 Cb 1.19 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1ons h ILE 96 CO 0.51 0.00 -0.27 0.77 0.00 0.00 0.00 178.15 179.16 1ons h SER 97 N -0.31 0.00 0.00 1.72 4.64 -1.96 -3.35 113.55 114.29 1ons h SER 97 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1ons h SER 97 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1ons h SER 97 CO -0.21 0.27 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 1ons n GLY 98 N 1.04 0.76 3.81 -0.77 0.00 -1.09 -4.89 105.19 104.05 1ons n GLY 98 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 1ons n GLY 98 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ons s LEU 99 N 0.00 3.33 0.61 0.99 1.43 -1.26 -4.41 118.68 119.36 1ons s LEU 99 Ca 0.00 1.74 -0.18 0.00 -1.03 0.00 0.00 54.13 54.66 1ons s LEU 99 Cb 0.00 -4.52 -0.05 0.00 0.03 0.00 0.00 46.19 41.65 1ons s LEU 99 CO 0.00 -1.32 0.87 1.15 0.23 0.00 0.00 176.35 177.27 1ons n MET 100 N -2.55 0.78 -1.94 1.70 0.00 -1.25 -4.71 117.12 109.14 1ons n MET 100 Ca 0.08 0.30 -0.41 0.00 0.00 0.00 0.00 57.70 57.68 1ons n MET 100 Cb 0.53 -2.07 -0.01 0.00 0.00 0.00 0.00 33.22 31.67 1ons n MET 100 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 1ons s THR 101 N -1.57 2.39 -0.29 3.17 2.01 -0.37 -4.51 115.64 116.47 1ons s THR 101 Ca 0.75 0.37 -0.05 0.00 0.31 0.00 0.00 61.69 63.07 1ons s THR 101 Cb -0.42 -3.24 0.02 0.00 0.01 0.00 0.00 72.50 68.87 1ons s THR 101 CO 0.48 0.08 0.04 -0.54 -0.69 0.00 0.00 174.62 173.99 1ons s LYS 102 N -1.40 2.99 0.20 4.92 -0.14 -0.09 -4.86 119.74 121.36 1ons s LYS 102 Ca 0.54 -0.91 0.04 0.00 -1.36 0.00 0.00 55.97 54.29 1ons s LYS 102 Cb -0.44 -3.28 -0.03 0.00 -1.68 0.00 0.00 37.83 32.41 1ons s LYS 102 CO 0.53 -0.45 0.28 -0.06 -0.76 0.00 0.00 175.35 174.90 1ons s PHE 103 N 1.45 3.38 -1.06 3.18 0.40 -1.26 -0.10 117.98 123.97 1ons s PHE 103 Ca 0.02 0.02 -0.16 0.00 -0.60 0.00 0.00 56.93 56.21 1ons s PHE 103 Cb -0.17 -1.58 0.17 0.00 0.51 0.00 0.00 43.02 41.95 1ons s PHE 103 CO 0.01 0.49 1.23 -1.21 0.70 0.00 0.00 175.22 176.44 1ons s GLU 104 N -3.59 3.86 0.50 0.44 2.02 -0.04 -4.72 118.70 117.16 1ons s GLU 104 Ca 0.34 -2.28 0.33 0.00 0.02 0.00 0.00 54.97 53.38 1ons s GLU 104 Cb -0.10 -4.92 1.72 0.00 0.10 0.00 0.00 34.13 30.93 1ons s GLU 104 CO 0.28 -1.69 2.02 1.88 0.02 0.00 0.00 175.26 177.76 1ons h TYR 105 N 7.86 0.00 0.00 1.61 0.05 -1.91 -1.54 116.97 123.04 1ons h TYR 105 Ca 0.22 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.00 1ons h TYR 105 Cb 0.95 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.69 1ons h TYR 105 CO 1.10 0.00 0.00 -2.67 -1.05 0.00 0.00 178.16 175.54 1ons n TRP 106 N -2.73 0.00 0.09 4.88 4.27 -1.26 -1.60 117.44 121.09 1ons n TRP 106 Ca -0.01 0.00 0.03 0.00 -3.89 0.00 0.00 57.50 53.62 1ons n TRP 106 Cb 0.11 -0.23 0.05 0.00 -1.36 0.00 0.00 31.31 29.87 1ons n TRP 106 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1ons n ALA 107 N -1.23 2.32 -2.13 -1.67 0.00 -0.58 -4.91 120.51 112.31 1ons n ALA 107 Ca 0.08 -0.77 -0.42 0.00 0.00 0.00 0.00 53.44 52.33 1ons n ALA 107 Cb 0.11 -0.20 -0.03 0.00 0.00 0.00 0.00 19.45 19.33 1ons n ALA 107 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1ons s MET 108 N -0.69 4.25 -1.37 0.00 0.00 -0.63 -4.53 119.30 116.33 1ons s MET 108 Ca 0.08 2.07 -0.16 0.00 0.00 0.00 0.00 55.69 57.69 1ons s MET 108 Cb 0.05 -3.63 0.03 0.00 0.00 0.00 0.00 34.83 31.29 1ons s MET 108 CO 0.07 -0.65 2.08 -0.35 0.00 0.00 0.00 175.02 176.17 1ons n PRO 109 N 5.65 2.83 0.20 4.11 -0.04 -1.26 -4.76 135.00 141.73 1ons n PRO 109 Ca 0.14 -2.72 0.09 0.00 -0.04 0.00 0.00 63.50 60.97 1ons n PRO 109 Cb 0.43 -3.33 0.48 0.00 -0.04 0.00 0.00 33.50 31.04 1ons n PRO 109 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1ons h HIS 110 N 6.61 0.00 -0.16 0.54 2.07 -1.82 -0.24 115.15 122.15 1ons h HIS 110 Ca 0.52 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.04 1ons h HIS 110 Cb 0.71 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.69 1ons h HIS 110 CO 1.43 0.00 0.00 1.63 -3.07 0.00 0.00 177.93 177.92 1ons n LYS 111 N -2.24 1.64 -2.11 5.12 5.02 0.34 -4.95 118.16 120.98 1ons n LYS 111 Ca -0.01 -1.67 -0.43 0.00 -2.02 0.00 0.00 58.31 54.18 1ons n LYS 111 Cb 0.29 -1.32 -0.02 0.00 -0.02 0.00 0.00 35.03 33.96 1ons n LYS 111 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ons s ASP 112 N -1.19 6.11 0.00 4.39 2.15 -0.10 -4.85 116.67 123.18 1ons s ASP 112 Ca 0.22 1.27 0.10 0.00 0.43 0.00 0.00 52.55 54.57 1ons s ASP 112 Cb 0.14 -2.53 0.56 0.00 -0.30 0.00 0.00 42.92 40.79 1ons s ASP 112 CO 0.20 -1.54 1.16 -0.62 -0.17 0.00 0.00 175.17 174.21 1ons n GLU 113 N 8.17 0.22 -0.02 4.34 1.02 -1.26 -2.41 120.64 130.69 1ons n GLU 113 Ca 0.20 0.12 -0.06 0.00 -0.02 0.00 0.00 57.16 57.40 1ons n GLU 113 Cb 0.47 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.36 1ons n GLU 113 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ons n LYS 114 N -1.18 0.16 -0.09 3.49 5.02 -1.26 -4.63 118.16 119.68 1ons n LYS 114 Ca 0.06 0.07 -0.08 0.00 -2.02 0.00 0.00 58.31 56.34 1ons n LYS 114 Cb 0.06 -0.77 -0.01 0.00 -0.02 0.00 0.00 35.03 34.29 1ons n LYS 114 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1ons h VAL 115 N -0.28 1.03 0.09 -0.18 2.07 -1.93 -2.24 116.25 114.81 1ons h VAL 115 Ca -0.13 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.27 1ons h VAL 115 Cb 0.87 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 1ons h VAL 115 CO -0.08 0.07 -0.10 0.24 0.02 0.00 0.00 177.57 177.71 1ons h MET 116 N 0.36 -0.22 -0.31 1.57 2.86 -1.74 0.21 114.93 117.66 1ons h MET 116 Ca 0.12 0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.74 1ons h MET 116 Cb 0.01 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 1ons h MET 116 CO -0.06 -0.14 0.04 -1.00 1.06 0.00 0.00 176.91 176.81 1ons h PRO 117 N -0.22 0.46 -0.56 -0.22 0.13 -1.77 0.19 132.00 130.01 1ons h PRO 117 Ca 0.01 -0.08 -0.06 0.00 -0.87 0.00 0.00 66.00 65.00 1ons h PRO 117 Cb 0.22 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 31.25 1ons h PRO 117 CO -0.04 0.46 0.10 0.35 -0.23 0.00 0.00 178.00 178.64 1ons h PHE 118 N 0.45 0.92 -0.05 1.56 3.04 -0.84 -1.24 116.94 120.79 1ons h PHE 118 Ca 0.11 -0.10 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 1ons h PHE 118 Cb 0.23 -0.26 -0.00 0.00 2.56 0.00 0.00 35.95 38.47 1ons h PHE 118 CO 0.01 0.79 -0.01 0.35 -2.02 0.00 0.00 178.31 177.42 1ons h PHE 119 N 0.84 0.10 -0.95 0.41 3.04 0.68 -3.19 116.94 117.88 1ons h PHE 119 Ca 0.18 -0.02 0.09 0.00 3.98 0.00 0.00 57.97 62.20 1ons h PHE 119 Cb 0.35 -0.02 -0.07 0.00 2.56 0.00 0.00 35.95 38.76 1ons h PHE 119 CO 0.02 0.43 0.59 0.93 -2.02 0.00 0.00 178.31 178.27 1ons h GLU 120 N -0.26 0.98 0.00 1.11 3.07 -0.42 -0.01 114.58 119.05 1ons h GLU 120 Ca 0.01 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1ons h GLU 120 Cb 0.40 -0.22 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 1ons h GLU 120 CO 0.00 0.65 0.00 1.04 -1.40 0.00 0.00 179.01 179.30 1ons n GLN 121 N -4.61 0.44 0.00 2.33 6.02 -0.49 -3.06 117.38 118.01 1ons n GLN 121 Ca 0.16 0.06 0.00 0.00 -0.01 0.00 0.00 57.00 57.21 1ons n GLN 121 Cb 0.26 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.02 1ons n GLN 121 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1ons n HIS 122 N -1.19 0.00 -0.32 1.08 8.25 -0.59 -4.87 115.22 117.58 1ons n HIS 122 Ca 0.12 -0.10 0.18 0.00 -0.26 0.00 0.00 57.72 57.66 1ons n HIS 122 Cb 0.14 -0.01 0.38 0.00 1.12 0.00 0.00 29.99 31.62 1ons n HIS 122 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 1ons h LYS 123 N 0.00 0.21 -0.12 -0.41 3.64 -0.96 0.90 116.57 119.84 1ons h LYS 123 Ca 0.00 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1ons h LYS 123 Cb 0.50 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1ons h LYS 123 CO 0.00 0.14 -0.01 0.77 -2.27 0.00 0.00 179.45 178.08 1ons h SER 124 N 0.22 0.15 -0.28 4.20 0.02 -1.88 0.66 113.55 116.64 1ons h SER 124 Ca 0.64 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.50 1ons h SER 124 Cb 1.40 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.89 1ons h SER 124 CO -0.67 0.20 -0.08 -0.07 -1.14 0.00 0.00 176.83 175.07 1ons h LEU 125 N 0.16 0.65 0.11 5.07 3.38 -1.11 0.11 115.31 123.67 1ons h LEU 125 Ca 0.04 -0.17 -0.18 0.00 0.09 0.00 0.00 57.88 57.66 1ons h LEU 125 Cb 0.14 -0.17 0.02 0.00 0.09 0.00 0.00 40.66 40.74 1ons h LEU 125 CO 0.00 0.77 -0.76 -0.26 0.09 0.00 0.00 178.44 178.29 1ons h PHE 126 N 0.62 0.56 -0.51 1.13 0.04 -1.31 -3.26 116.94 114.21 1ons h PHE 126 Ca 0.11 -0.38 -0.12 0.00 2.80 0.00 0.00 57.97 60.39 1ons h PHE 126 Cb 0.51 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.61 1ons h PHE 126 CO 0.02 1.27 -0.14 -0.09 -0.60 0.00 0.00 178.31 178.77 1ons h ARG 127 N -0.31 0.97 -2.21 1.51 2.43 -0.82 -0.99 114.38 114.97 1ons h ARG 127 Ca -0.12 -0.37 -0.60 0.00 -0.81 0.00 0.00 59.98 58.08 1ons h ARG 127 Cb 1.56 -0.06 -0.42 0.00 -0.42 0.00 0.00 29.97 30.63 1ons h ARG 127 CO 0.14 1.04 -0.63 -1.71 -1.51 0.00 0.00 179.97 177.31 1ons n ASN 128 N -4.14 3.48 -4.75 -3.80 5.15 0.36 -3.88 115.26 107.68 1ons n ASN 128 Ca 0.01 -3.38 -0.29 0.00 -0.60 0.00 0.00 54.58 50.31 1ons n ASN 128 Cb 0.41 -0.67 0.13 0.00 -0.53 0.00 0.00 39.78 39.12 1ons n ASN 128 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1ons s PRO 129 N -2.35 1.41 0.50 1.20 0.04 -1.23 -4.76 135.00 129.81 1ons s PRO 129 Ca 0.39 0.62 -0.07 0.00 0.04 0.00 0.00 61.00 61.98 1ons s PRO 129 Cb 0.14 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.80 1ons s PRO 129 CO -0.02 -2.09 0.84 0.15 0.04 0.00 0.00 177.00 175.92 1ons s LYS 130 N -5.07 3.59 -0.13 4.56 1.02 -0.37 -4.85 119.74 118.49 1ons s LYS 130 Ca 0.63 0.36 -0.23 0.00 0.02 0.00 0.00 55.97 56.75 1ons s LYS 130 Cb -0.16 -2.31 -0.03 0.00 -0.52 0.00 0.00 37.83 34.81 1ons s LYS 130 CO 0.55 -0.26 0.72 0.21 -0.92 0.00 0.00 175.35 175.66 1ons s LYS 131 N -4.70 4.34 0.22 1.68 2.20 -1.26 -1.68 119.74 120.54 1ons s LYS 131 Ca 0.50 0.86 -0.10 0.00 -0.36 0.00 0.00 55.97 56.86 1ons s LYS 131 Cb -0.10 -3.52 0.33 0.00 -1.51 0.00 0.00 37.83 33.02 1ons s LYS 131 CO 0.45 -0.13 1.65 1.25 -0.36 0.00 0.00 175.35 178.20 1ons h LEU 132 N 7.61 -0.31 -1.20 5.43 5.85 -1.17 -0.94 115.31 130.58 1ons h LEU 132 Ca -0.35 0.17 0.19 0.00 0.84 0.00 0.00 57.88 58.73 1ons h LEU 132 Cb 1.16 0.30 -0.09 0.00 0.37 0.00 0.00 40.66 42.40 1ons h LEU 132 CO 0.78 -0.14 0.61 0.00 -0.34 0.00 0.00 178.44 179.36 1ons h ALA 133 N 1.60 1.86 -0.61 1.25 0.00 -1.85 0.24 119.26 121.76 1ons h ALA 133 Ca 0.34 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.22 1ons h ALA 133 Cb 0.57 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1ons h ALA 133 CO -0.57 -0.19 0.05 -0.44 0.00 0.00 0.00 179.25 178.10 1ons h ASP 134 N 0.65 1.00 -0.03 0.00 3.45 -1.57 -1.56 116.42 118.37 1ons h ASP 134 Ca 0.53 -0.28 -0.00 0.00 0.43 0.00 0.00 57.03 57.71 1ons h ASP 134 Cb 0.96 -0.27 -0.00 0.00 -0.56 0.00 0.00 39.33 39.47 1ons h ASP 134 CO -0.29 1.04 0.01 0.58 -1.57 0.00 0.00 179.24 179.00 1ons h VAL 135 N 0.94 1.19 -0.83 -1.35 2.07 -0.83 -3.14 116.25 114.30 1ons h VAL 135 Ca 0.18 -0.56 0.07 0.00 0.82 0.00 0.00 66.70 67.21 1ons h VAL 135 Cb 0.49 1.52 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 1ons h VAL 135 CO 0.02 0.15 0.54 0.58 0.02 0.00 0.00 177.57 178.88 1ons h VAL 136 N -0.18 1.03 0.00 2.57 2.07 -0.92 -1.93 116.25 118.90 1ons h VAL 136 Ca 0.01 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 1ons h VAL 136 Cb 0.24 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.06 1ons h VAL 136 CO 0.00 0.16 -0.09 0.00 0.02 0.00 0.00 177.57 177.67 1ons h ALA 137 N 1.55 1.44 -0.01 1.67 0.00 -1.23 -2.35 119.26 120.32 1ons h ALA 137 Ca 0.36 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1ons h ALA 137 Cb 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1ons h ALA 137 CO -0.13 0.11 -0.27 0.43 0.00 0.00 0.00 179.25 179.39 1ons n SER 138 N -3.83 1.73 -4.73 0.00 7.64 -0.74 -4.97 113.62 108.71 1ons n SER 138 Ca -0.02 -1.36 -0.42 0.00 1.01 0.00 0.00 58.87 58.08 1ons n SER 138 Cb 0.19 0.22 -0.03 0.00 -1.01 0.00 0.00 64.21 63.58 1ons n SER 138 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1ons s LEU 139 N -2.35 4.39 0.23 -3.43 1.43 -0.89 -4.90 118.68 113.15 1ons s LEU 139 Ca 0.25 2.50 -0.12 0.00 -1.03 0.00 0.00 54.13 55.72 1ons s LEU 139 Cb 0.19 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.80 1ons s LEU 139 CO 0.48 -0.66 0.44 0.54 0.23 0.00 0.00 176.35 177.39 1ons s ASN 140 N 0.67 -0.08 0.61 2.29 2.20 -1.26 -5.01 114.94 114.37 1ons s ASN 140 Ca 0.62 -0.90 0.28 0.00 -0.94 0.00 0.00 52.86 51.92 1ons s ASN 140 Cb -0.39 0.56 1.41 0.00 -2.00 0.00 0.00 41.25 40.83 1ons s ASN 140 CO 0.36 -1.09 1.82 0.00 -2.94 0.00 0.00 177.10 175.25 1ons h ALA 141 N 2.30 2.02 -0.01 3.54 0.00 -1.98 0.77 119.26 125.90 1ons h ALA 141 Ca -0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1ons h ALA 141 Cb 1.25 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1ons h ALA 141 CO 0.38 -0.71 -0.38 -0.25 0.00 0.00 0.00 179.25 178.29 1ons n ASP 142 N -3.41 1.58 -4.52 0.00 10.43 -1.26 -4.98 116.55 114.38 1ons n ASP 142 Ca 0.07 -1.24 -0.51 0.00 2.57 0.00 0.00 54.79 55.68 1ons n ASP 142 Cb 0.68 0.33 -0.05 0.00 1.84 0.00 0.00 41.12 43.92 1ons n ASP 142 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1ons n SER 143 N -0.31 0.43 -1.52 -2.24 7.64 0.26 -4.81 113.62 113.07 1ons n SER 143 Ca 0.11 1.15 -0.01 0.00 1.01 0.00 0.00 58.87 61.13 1ons n SER 143 Cb 0.41 -1.09 -0.01 0.00 -1.01 0.00 0.00 64.21 62.51 1ons n SER 143 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1ons n GLU 144 N 1.46 1.05 -3.89 1.43 -0.58 -1.26 -4.82 120.64 114.03 1ons n GLU 144 Ca 0.16 -0.05 -0.35 0.00 -0.42 0.00 0.00 57.16 56.50 1ons n GLU 144 Cb 0.21 -1.05 -0.14 0.00 -0.57 0.00 0.00 31.44 29.90 1ons n GLU 144 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 1ons s TYR 145 N 0.05 3.06 -0.44 -0.32 1.51 -1.26 -0.50 117.35 119.44 1ons s TYR 145 Ca 0.03 -1.20 0.25 0.00 -1.01 0.00 0.00 57.07 55.15 1ons s TYR 145 Cb 0.01 -2.13 0.64 0.00 -0.11 0.00 0.00 41.96 40.38 1ons s TYR 145 CO 0.00 -0.63 1.71 0.00 -1.11 0.00 0.00 175.55 175.52 1ons h ALA 146 N 8.11 1.00 -2.00 3.71 0.00 -1.36 -3.46 119.26 125.26 1ons h ALA 146 Ca -0.35 0.00 0.10 0.00 0.00 0.00 0.00 54.91 54.66 1ons h ALA 146 Cb 1.13 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.74 1ons h ALA 146 CO 0.59 0.00 0.51 0.00 0.00 0.00 0.00 179.25 180.35 1ons s ALA 147 N -3.25 -1.87 -0.16 0.00 0.00 -1.24 -2.16 121.76 113.08 1ons s ALA 147 Ca 0.07 1.24 -0.02 0.00 0.00 0.00 0.00 51.96 53.25 1ons s ALA 147 Cb 0.08 -0.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.18 1ons s ALA 147 CO 0.62 -0.54 -0.07 0.42 0.00 0.00 0.00 175.76 176.18 1ons s ILE 148 N -2.33 3.49 -0.18 0.00 1.01 -0.48 -0.26 121.20 122.46 1ons s ILE 148 Ca 0.02 -0.49 -0.01 0.00 0.00 0.00 0.00 60.65 60.17 1ons s ILE 148 Cb -0.01 -2.52 -0.00 0.00 0.01 0.00 0.00 42.46 39.94 1ons s ILE 148 CO -0.04 0.49 -0.12 0.12 0.00 0.00 0.00 174.94 175.39 1ons s PHE 149 N 0.59 2.85 -0.47 3.97 5.99 0.98 -0.81 117.98 131.09 1ons s PHE 149 Ca -0.05 -1.07 0.01 0.00 0.00 0.00 0.00 56.93 55.82 1ons s PHE 149 Cb -0.15 -1.97 0.12 0.00 0.00 0.00 0.00 43.02 41.02 1ons s PHE 149 CO 0.03 -0.54 0.23 0.08 -0.00 0.00 0.00 175.22 175.02 1ons s VAL 150 N 1.10 2.91 0.86 3.12 1.01 -0.10 -1.05 120.40 128.25 1ons s VAL 150 Ca 0.00 -2.69 -0.11 0.00 0.00 0.00 0.00 61.98 59.18 1ons s VAL 150 Cb -0.14 -3.01 0.11 0.00 0.00 0.00 0.00 36.38 33.34 1ons s VAL 150 CO -0.03 -0.74 1.11 -2.16 0.00 0.00 0.00 175.10 173.27 1ons s PRO 151 N 0.41 1.49 0.00 2.72 0.04 -1.26 -3.79 135.00 134.61 1ons s PRO 151 Ca 0.13 1.21 0.00 0.00 0.04 0.00 0.00 61.00 62.38 1ons s PRO 151 Cb -0.22 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.51 1ons s PRO 151 CO -0.04 -2.19 0.00 0.41 0.04 0.00 0.00 177.00 175.22 1ons n GLY 152 N -0.62 -0.19 0.00 0.56 0.00 -1.20 -4.04 105.19 99.70 1ons n GLY 152 Ca 0.09 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.37 1ons n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ons n GLY 153 N 5.00 3.02 0.03 -0.02 0.00 -1.26 -1.42 105.19 110.54 1ons n GLY 153 Ca 0.00 -1.69 0.06 0.00 0.00 0.00 0.00 46.02 44.39 1ons n GLY 153 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ons n HIS 154 N 0.16 0.17 0.32 1.61 8.25 -1.16 -1.79 115.22 122.79 1ons n HIS 154 Ca 0.00 0.07 0.16 0.00 -0.26 0.00 0.00 57.72 57.69 1ons n HIS 154 Cb 0.00 -0.62 0.66 0.00 1.12 0.00 0.00 29.99 31.15 1ons n HIS 154 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1ons h GLY 155 N 1.52 0.00 2.00 -1.41 0.00 -1.64 -1.94 103.07 101.60 1ons h GLY 155 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ons h GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 1ons n ALA 156 N -1.98 1.63 0.74 3.60 0.00 -0.74 -1.87 120.51 121.89 1ons n ALA 156 Ca 0.01 0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.61 1ons n ALA 156 Cb 0.25 -1.31 0.39 0.00 0.00 0.00 0.00 19.45 18.78 1ons n ALA 156 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ons n LEU 157 N -1.91 0.57 -4.57 0.00 4.77 -0.73 -4.38 117.00 110.74 1ons n LEU 157 Ca 0.03 0.42 -0.40 0.00 -0.03 0.00 0.00 56.01 56.03 1ons n LEU 157 Cb 0.19 -0.32 -0.10 0.00 -2.33 0.00 0.00 43.42 40.87 1ons n LEU 157 CO 0.16 -0.08 0.01 -0.63 -1.33 0.00 0.00 177.39 175.52 1ons s ILE 158 N -3.08 5.20 0.00 -0.08 1.01 -0.78 -4.60 121.20 118.87 1ons s ILE 158 Ca 0.10 0.26 0.00 0.00 0.00 0.00 0.00 60.65 61.02 1ons s ILE 158 Cb 0.15 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.89 1ons s ILE 158 CO 0.62 0.06 0.00 0.61 0.00 0.00 0.00 174.94 176.23 1ons n GLY 159 N 4.88 1.58 0.27 6.18 0.00 -1.26 -4.74 105.19 112.10 1ons n GLY 159 Ca -0.10 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 45.93 1ons n GLY 159 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ons h LEU 160 N 0.00 -0.09 0.00 0.99 3.38 -1.83 -0.90 115.31 116.86 1ons h LEU 160 Ca 0.00 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1ons h LEU 160 Cb 0.00 0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1ons h LEU 160 CO 0.00 -0.08 0.00 -0.81 0.09 0.00 0.00 178.44 177.64 1ons n PRO 161 N -5.21 0.19 -0.71 1.13 -0.04 -1.26 -2.70 135.00 126.40 1ons n PRO 161 Ca 0.14 0.10 0.02 0.00 -0.04 0.00 0.00 63.50 63.72 1ons n PRO 161 Cb 0.47 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.45 1ons n PRO 161 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ons n GLU 162 N -1.14 0.13 -3.57 0.54 1.02 -0.37 -3.30 120.64 113.95 1ons n GLU 162 Ca 0.05 -1.41 -0.37 0.00 -0.02 0.00 0.00 57.16 55.41 1ons n GLU 162 Cb 0.05 -0.48 -0.09 0.00 -0.02 0.00 0.00 31.44 30.90 1ons n GLU 162 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1ons s SER 163 N -1.43 6.21 0.39 1.62 0.15 -1.02 -4.95 113.70 114.68 1ons s SER 163 Ca 0.11 0.24 0.13 0.00 0.70 0.00 0.00 55.95 57.13 1ons s SER 163 Cb 0.12 -2.15 0.79 0.00 -1.71 0.00 0.00 66.02 63.07 1ons s SER 163 CO -0.04 0.01 1.87 1.56 1.20 0.00 0.00 173.24 177.84 1ons h GLN 164 N 7.51 0.01 -0.51 5.44 4.20 -1.91 -2.01 115.11 127.85 1ons h GLN 164 Ca -0.37 -0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.27 1ons h GLN 164 Cb 1.17 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.93 1ons h GLN 164 CO 0.67 0.33 0.07 -0.44 -0.67 0.00 0.00 178.83 178.79 1ons h ASP 165 N 0.01 0.81 -0.62 1.46 3.45 -1.97 -0.28 116.42 119.28 1ons h ASP 165 Ca -0.00 -0.27 -0.08 0.00 0.43 0.00 0.00 57.03 57.11 1ons h ASP 165 Cb 0.57 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 39.10 1ons h ASP 165 CO 0.04 0.87 0.08 0.58 -1.57 0.00 0.00 179.24 179.24 1ons h VAL 166 N 0.72 1.26 0.05 -1.35 2.07 -1.79 -1.04 116.25 116.17 1ons h VAL 166 Ca 0.15 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.62 1ons h VAL 166 Cb 0.41 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1ons h VAL 166 CO 0.01 0.39 -0.03 0.00 0.02 0.00 0.00 177.57 177.96 1ons h ALA 167 N 1.02 -0.07 -0.87 1.67 0.00 -1.01 0.29 119.26 120.29 1ons h ALA 167 Ca 0.19 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.13 1ons h ALA 167 Cb 0.47 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1ons h ALA 167 CO 0.02 -0.54 0.56 0.00 0.00 0.00 0.00 179.25 179.28 1ons h ALA 168 N 0.88 1.17 0.28 0.00 0.00 -0.92 0.58 119.26 121.25 1ons h ALA 168 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1ons h ALA 168 Cb 0.06 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1ons h ALA 168 CO 0.01 0.37 -0.14 0.00 0.00 0.00 0.00 179.25 179.49 1ons h ALA 169 N 1.38 -0.38 -0.95 0.00 0.00 -0.67 -0.63 119.26 118.01 1ons h ALA 169 Ca 0.36 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1ons h ALA 169 Cb 0.07 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1ons h ALA 169 CO -0.14 -0.70 0.57 -0.07 0.00 0.00 0.00 179.25 178.92 1ons h LEU 170 N -0.42 1.14 -0.69 0.00 3.38 -0.64 -1.45 115.31 116.63 1ons h LEU 170 Ca -0.04 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.87 1ons h LEU 170 Cb 0.32 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1ons h LEU 170 CO 0.06 0.88 0.46 1.56 0.09 0.00 0.00 178.44 181.49 1ons h GLN 171 N 1.31 0.90 -0.01 1.13 4.20 -0.63 -1.78 115.11 120.23 1ons h GLN 171 Ca 0.34 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 59.00 1ons h GLN 171 Cb -0.06 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 27.52 1ons h GLN 171 CO -0.06 0.60 0.01 2.35 -0.67 0.00 0.00 178.83 181.05 1ons h TRP 172 N 0.93 0.01 -0.21 2.96 7.01 -0.50 -1.26 115.95 124.89 1ons h TRP 172 Ca 0.25 -0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.29 1ons h TRP 172 Cb -0.11 -0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 26.91 1ons h TRP 172 CO -0.03 0.12 -0.04 0.00 -2.79 0.00 0.00 178.44 175.70 1ons h ALA 173 N 0.90 0.15 0.24 2.65 0.00 -1.02 0.49 119.26 122.65 1ons h ALA 173 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1ons h ALA 173 Cb 0.11 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ons h ALA 173 CO -0.00 -0.47 -0.11 0.82 0.00 0.00 0.00 179.25 179.49 1ons h ILE 174 N 0.01 0.83 -0.75 0.00 1.08 -1.31 0.25 117.51 117.62 1ons h ILE 174 Ca 0.10 -0.54 0.11 0.00 -0.39 0.00 0.00 64.86 64.14 1ons h ILE 174 Cb 0.14 1.13 -0.05 0.00 -3.07 0.00 0.00 36.82 34.98 1ons h ILE 174 CO -0.20 0.12 0.49 0.11 -0.69 0.00 0.00 178.15 177.98 1ons h LYS 175 N -0.61 0.55 -0.69 2.37 6.56 -1.16 -1.70 116.57 121.90 1ons h LYS 175 Ca -0.03 -0.03 -0.00 0.00 -1.06 0.00 0.00 60.65 59.52 1ons h LYS 175 Cb 0.44 -0.12 -0.00 0.00 -0.57 0.00 0.00 32.23 31.97 1ons h LYS 175 CO 0.05 0.36 0.00 0.09 -2.06 0.00 0.00 179.45 177.90 1ons n ASN 176 N -4.50 4.58 -3.79 0.86 3.02 0.15 -4.94 115.26 110.65 1ons n ASN 176 Ca 0.13 -2.71 -0.26 0.00 -0.03 0.00 0.00 54.58 51.71 1ons n ASN 176 Cb 0.40 -0.64 0.04 0.00 -0.61 0.00 0.00 39.78 38.97 1ons n ASN 176 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1ons n ASP 177 N 0.46 -3.83 -4.90 6.41 2.03 -0.64 -5.00 116.55 111.08 1ons n ASP 177 Ca 0.21 -0.75 -0.20 0.00 0.52 0.00 0.00 54.79 54.56 1ons n ASP 177 Cb 0.97 -4.14 -0.02 0.00 -0.72 0.00 0.00 41.12 37.21 1ons n ASP 177 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1ons s ARG 178 N -6.34 2.92 0.44 -0.67 3.00 0.85 -5.04 118.95 114.11 1ons s ARG 178 Ca 0.43 -1.14 -0.20 0.00 0.00 0.00 0.00 55.73 54.82 1ons s ARG 178 Cb -0.21 -2.63 -0.10 0.00 0.00 0.00 0.00 34.95 32.01 1ons s ARG 178 CO 0.81 0.13 0.94 -0.06 0.00 0.00 0.00 175.30 177.12 1ons s PHE 179 N -2.23 3.34 -0.09 -0.53 0.08 -0.92 -4.57 117.98 113.07 1ons s PHE 179 Ca 0.41 1.55 -0.01 0.00 0.12 0.00 0.00 56.93 59.01 1ons s PHE 179 Cb -0.07 -2.82 0.03 0.00 -0.57 0.00 0.00 43.02 39.58 1ons s PHE 179 CO 0.28 -0.15 -0.04 0.08 -0.10 0.00 0.00 175.22 175.29 1ons s VAL 180 N -2.26 0.73 -0.03 -0.44 1.01 -0.48 -1.38 120.40 117.54 1ons s VAL 180 Ca 0.61 -0.11 0.07 0.00 0.00 0.00 0.00 61.98 62.55 1ons s VAL 180 Cb -0.09 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 1ons s VAL 180 CO 0.17 0.32 -0.24 -0.63 0.00 0.00 0.00 175.10 174.72 1ons s ILE 181 N 1.76 1.91 -0.00 2.22 1.01 0.01 -0.89 121.20 127.22 1ons s ILE 181 Ca 0.04 -1.02 -0.29 0.00 0.00 0.00 0.00 60.65 59.38 1ons s ILE 181 Cb -0.13 -1.60 0.10 0.00 0.01 0.00 0.00 42.46 40.85 1ons s ILE 181 CO -0.06 0.54 0.88 -0.55 0.00 0.00 0.00 174.94 175.75 1ons s SER 182 N -0.42 -0.37 0.23 3.58 0.15 -0.29 -0.93 113.70 115.65 1ons s SER 182 Ca 0.05 -0.00 -0.16 0.00 0.70 0.00 0.00 55.95 56.54 1ons s SER 182 Cb -0.11 0.39 0.01 0.00 -1.71 0.00 0.00 66.02 64.61 1ons s SER 182 CO 0.00 -0.63 0.53 -1.48 1.20 0.00 0.00 173.24 172.87 1ons s LEU 183 N -2.49 0.14 0.00 3.45 2.34 -1.25 -1.39 118.68 119.48 1ons s LEU 183 Ca 0.05 -0.68 0.00 0.00 0.06 0.00 0.00 54.13 53.56 1ons s LEU 183 Cb -0.01 2.08 0.00 0.00 -0.56 0.00 0.00 46.19 47.70 1ons s LEU 183 CO -0.09 -1.13 0.00 0.00 -1.06 0.00 0.00 176.35 174.07 1ons n HIS 185 N 7.47 0.00 -0.35 0.00 8.25 -1.26 -1.67 115.22 127.66 1ons n HIS 185 Ca 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.59 1ons n HIS 185 Cb 0.00 -0.03 0.32 0.00 1.12 0.00 0.00 29.99 31.40 1ons n HIS 185 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1ons h GLY 186 N 4.84 1.70 1.43 -1.41 0.00 -0.92 -0.58 103.07 108.13 1ons h GLY 186 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1ons h GLY 186 CO 0.00 -0.02 0.00 -1.55 0.00 0.00 0.00 176.54 174.97 1ons n PRO 187 N -4.72 0.12 0.25 4.80 -0.04 -1.26 -1.90 135.00 132.24 1ons n PRO 187 Ca 0.22 0.17 0.11 0.00 -0.04 0.00 0.00 63.50 63.97 1ons n PRO 187 Cb 0.55 -1.50 0.66 0.00 -0.04 0.00 0.00 33.50 33.17 1ons n PRO 187 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ons h ALA 188 N 2.32 1.33 0.00 0.55 0.00 -1.41 -1.26 119.26 120.78 1ons h ALA 188 Ca 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1ons h ALA 188 Cb 0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1ons h ALA 188 CO 0.00 0.18 -0.08 0.00 0.00 0.00 0.00 179.25 179.36 1ons h ALA 189 N 1.85 1.24 0.00 0.00 0.00 -1.59 -1.29 119.26 119.47 1ons h ALA 189 Ca -0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1ons h ALA 189 Cb 0.37 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1ons h ALA 189 CO 0.02 0.09 -0.03 0.74 0.00 0.00 0.00 179.25 180.07 1ons h PHE 190 N 0.00 0.00 0.00 0.00 0.04 -1.44 -0.86 116.94 114.68 1ons h PHE 190 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1ons h PHE 190 Cb 0.27 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.42 1ons h PHE 190 CO 0.00 0.03 0.00 1.28 -0.60 0.00 0.00 178.31 179.02 1ons n LEU 191 N -3.35 0.00 0.24 1.54 4.77 -0.49 -1.71 117.00 118.01 1ons n LEU 191 Ca -0.02 0.25 0.11 0.00 -0.03 0.00 0.00 56.01 56.33 1ons n LEU 191 Cb 0.15 -0.25 0.60 0.00 -2.33 0.00 0.00 43.42 41.59 1ons n LEU 191 CO 0.25 -0.17 0.89 0.00 -1.33 0.00 0.00 177.39 177.02 1ons h ALA 192 N 2.47 1.16 0.00 -1.18 0.00 -1.14 -2.83 119.26 117.74 1ons h ALA 192 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1ons h ALA 192 Cb 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ons h ALA 192 CO 0.00 0.22 0.00 1.28 0.00 0.00 0.00 179.25 180.75 1ons n LEU 193 N -3.53 0.08 -4.66 0.00 4.77 -0.69 -4.66 117.00 108.32 1ons n LEU 193 Ca -0.01 0.51 -0.32 0.00 -0.03 0.00 0.00 56.01 56.17 1ons n LEU 193 Cb 0.33 -0.49 0.16 0.00 -2.33 0.00 0.00 43.42 41.09 1ons n LEU 193 CO 0.32 -0.14 0.65 0.54 -1.33 0.00 0.00 177.39 177.43 1ons n ARG 194 N -1.58 -0.34 -3.46 3.23 1.74 -1.07 -3.62 116.66 111.56 1ons n ARG 194 Ca 0.05 -0.03 -0.20 0.00 -0.77 0.00 0.00 57.85 56.90 1ons n ARG 194 Cb 0.27 -2.36 0.03 0.00 -1.02 0.00 0.00 32.46 29.39 1ons n ARG 194 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1ons n HIS 195 N -4.04 -2.29 -3.45 -1.55 8.25 -1.26 -4.91 115.22 105.97 1ons n HIS 195 Ca 0.12 0.74 0.00 0.00 -0.26 0.00 0.00 57.72 58.32 1ons n HIS 195 Cb 0.52 -3.65 0.00 0.00 1.12 0.00 0.00 29.99 27.97 1ons n HIS 195 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ons n GLY 196 N -1.60 -1.04 3.67 -1.41 0.00 -1.24 -5.08 105.19 98.48 1ons n GLY 196 Ca -0.09 -1.32 -0.42 0.00 0.00 0.00 0.00 46.02 44.18 1ons n GLY 196 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ons s ASP 197 N -4.00 6.79 -0.65 1.61 2.15 -1.26 -4.96 116.67 116.34 1ons s ASP 197 Ca 0.00 2.06 -0.00 0.00 0.43 0.00 0.00 52.55 55.03 1ons s ASP 197 Cb 0.00 -2.54 0.16 0.00 -0.30 0.00 0.00 42.92 40.24 1ons s ASP 197 CO 0.00 -0.83 0.46 0.21 -0.17 0.00 0.00 175.17 174.84 1ons s ASN 198 N 2.58 5.11 0.00 -0.34 2.47 -1.26 -4.92 114.94 118.58 1ons s ASN 198 Ca 0.66 -3.13 0.14 0.00 0.42 0.00 0.00 52.86 50.95 1ons s ASN 198 Cb -0.30 -1.80 0.75 0.00 -1.45 0.00 0.00 41.25 38.45 1ons s ASN 198 CO 0.25 -0.28 1.30 -0.81 -3.72 0.00 0.00 177.10 173.84 1ons n PRO 199 N 3.07 0.30 -0.03 0.43 -0.04 -1.26 -1.99 135.00 135.49 1ons n PRO 199 Ca 0.10 0.09 0.12 0.00 -0.04 0.00 0.00 63.50 63.77 1ons n PRO 199 Cb 0.36 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.46 1ons n PRO 199 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1ons n LEU 200 N -1.15 2.98 -4.73 1.53 4.77 -1.26 -4.94 117.00 114.19 1ons n LEU 200 Ca 0.08 -1.04 -0.42 0.00 -0.03 0.00 0.00 56.01 54.60 1ons n LEU 200 Cb 0.08 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1ons n LEU 200 CO 0.09 0.52 1.23 -3.20 -1.33 0.00 0.00 177.39 174.70 1ons n ASN 201 N 1.30 3.70 0.00 -1.43 5.15 -0.84 -1.56 115.26 121.58 1ons n ASN 201 Ca 0.15 1.13 0.00 0.00 -0.60 0.00 0.00 54.58 55.26 1ons n ASN 201 Cb 0.59 -1.56 0.00 0.00 -0.53 0.00 0.00 39.78 38.27 1ons n ASN 201 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ons n GLY 202 N 2.45 0.84 3.87 8.20 0.00 0.72 -5.02 105.19 116.26 1ons n GLY 202 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 1ons n GLY 202 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ons s TYR 203 N -3.31 3.47 0.06 1.61 2.02 -0.60 -4.88 117.35 115.72 1ons s TYR 203 Ca 0.00 1.06 0.09 0.00 -0.37 0.00 0.00 57.07 57.84 1ons s TYR 203 Cb 0.00 -2.45 -0.03 0.00 -0.40 0.00 0.00 41.96 39.07 1ons s TYR 203 CO 0.00 -0.13 -0.23 -1.12 -1.57 0.00 0.00 175.55 172.50 1ons s SER 204 N -3.19 3.45 0.26 2.29 0.01 -1.26 -0.79 113.70 114.47 1ons s SER 204 Ca 0.51 -0.54 -0.18 0.00 1.31 0.00 0.00 55.95 57.05 1ons s SER 204 Cb -0.10 -0.41 0.01 0.00 0.21 0.00 0.00 66.02 65.73 1ons s SER 204 CO 0.32 0.25 0.63 0.27 0.41 0.00 0.00 173.24 175.11 1ons s ILE 205 N -0.89 0.00 0.24 1.44 -4.36 0.21 -4.55 121.20 113.29 1ons s ILE 205 Ca 0.13 -1.08 0.10 0.00 -0.26 0.00 0.00 60.65 59.55 1ons s ILE 205 Cb -0.10 -2.00 -0.05 0.00 1.25 0.00 0.00 42.46 41.56 1ons s ILE 205 CO 0.04 -0.01 -0.13 0.00 0.24 0.00 0.00 174.94 175.08 1ons s ALA 207 N -2.12 -1.89 -0.03 0.00 0.00 -1.25 -4.23 121.76 112.23 1ons s ALA 207 Ca 0.28 -0.20 -0.30 0.00 0.00 0.00 0.00 51.96 51.74 1ons s ALA 207 Cb -0.07 0.80 -0.06 0.00 0.00 0.00 0.00 23.12 23.80 1ons s ALA 207 CO 0.16 -1.09 1.56 0.12 0.00 0.00 0.00 175.76 176.51 1ons s PHE 208 N -2.12 2.33 0.28 0.00 5.36 -0.67 -4.70 117.98 118.46 1ons s PHE 208 Ca 0.24 0.42 -0.29 0.00 -0.96 0.00 0.00 56.93 56.34 1ons s PHE 208 Cb -0.02 -3.83 -0.10 0.00 -0.34 0.00 0.00 43.02 38.73 1ons s PHE 208 CO 0.03 -3.36 1.15 -1.25 -1.46 0.00 0.00 175.22 170.33 1ons s PRO 209 N 3.35 4.57 0.39 10.12 0.04 -1.26 -4.87 135.00 147.34 1ons s PRO 209 Ca 0.70 1.89 0.12 0.00 0.04 0.00 0.00 61.00 63.75 1ons s PRO 209 Cb -0.33 -3.17 0.92 0.00 0.04 0.00 0.00 34.50 31.96 1ons s PRO 209 CO 0.28 0.11 1.90 -0.44 0.04 0.00 0.00 177.00 178.88 1ons h ASP 210 N 3.88 0.53 -0.89 6.66 3.45 -1.92 -0.30 116.42 127.83 1ons h ASP 210 Ca -0.47 0.03 0.10 0.00 0.43 0.00 0.00 57.03 57.12 1ons h ASP 210 Cb 1.21 -0.08 -0.07 0.00 -0.56 0.00 0.00 39.33 39.84 1ons h ASP 210 CO 0.67 0.27 0.58 0.00 -1.57 0.00 0.00 179.24 179.20 1ons h ALA 211 N 1.62 1.65 -0.34 3.45 0.00 -1.91 -1.35 119.26 122.38 1ons h ALA 211 Ca 0.40 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 55.15 1ons h ALA 211 Cb 0.76 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1ons h ALA 211 CO -0.16 0.16 -0.44 0.00 0.00 0.00 0.00 179.25 178.81 1ons h ALA 212 N 1.56 0.56 0.00 0.00 0.00 -1.35 -2.89 119.26 117.15 1ons h ALA 212 Ca 0.42 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1ons h ALA 212 Cb 0.44 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1ons h ALA 212 CO -0.18 0.68 -0.02 -0.44 0.00 0.00 0.00 179.25 179.28 1ons h ASP 213 N 0.72 0.00 0.55 0.00 3.45 -1.12 0.11 116.42 120.12 1ons h ASP 213 Ca 0.05 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.51 1ons h ASP 213 Cb 1.03 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.80 1ons h ASP 213 CO 0.10 0.02 -0.17 0.29 -1.57 0.00 0.00 179.24 177.92 1ons n LYS 214 N -3.55 0.36 -0.06 3.56 5.02 -0.89 -4.23 118.16 118.37 1ons n LYS 214 Ca -0.03 -0.13 -0.09 0.00 -2.02 0.00 0.00 58.31 56.05 1ons n LYS 214 Cb 0.12 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.58 1ons n LYS 214 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1ons n GLN 215 N -1.21 0.30 -0.35 1.97 1.13 0.25 -4.73 117.38 114.74 1ons n GLN 215 Ca 0.11 0.07 0.25 0.00 -1.94 0.00 0.00 57.00 55.49 1ons n GLN 215 Cb 0.31 -1.22 0.51 0.00 0.11 0.00 0.00 30.24 29.94 1ons n GLN 215 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 1ons h THR 216 N -0.03 0.41 0.00 5.09 1.35 -1.39 0.31 112.91 118.66 1ons h THR 216 Ca -0.27 -0.12 -0.00 0.00 -0.55 0.00 0.00 66.41 65.46 1ons h THR 216 Cb 1.41 0.03 -0.00 0.00 -1.73 0.00 0.00 68.15 67.86 1ons h THR 216 CO -0.05 0.06 -0.01 1.55 -0.25 0.00 0.00 175.52 176.82 1ons h PRO 217 N 0.35 0.00 0.00 4.72 0.13 -1.81 -0.54 132.00 134.85 1ons h PRO 217 Ca 0.67 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.75 1ons h PRO 217 Cb 1.69 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.82 1ons h PRO 217 CO -0.39 0.01 -0.21 0.93 -0.23 0.00 0.00 178.00 178.11 1ons h GLU 218 N 0.00 0.00 -0.56 0.86 4.39 -0.68 -1.04 114.58 117.55 1ons h GLU 218 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1ons h GLU 218 Cb 0.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1ons h GLU 218 CO 0.00 0.21 0.00 0.44 -1.16 0.00 0.00 179.01 178.50 1ons n ILE 219 N -4.00 1.44 -1.48 3.13 -5.35 -0.26 -4.97 119.36 107.87 1ons n ILE 219 Ca -0.02 -1.16 -0.08 0.00 -0.27 0.00 0.00 62.75 61.22 1ons n ILE 219 Cb 0.29 0.29 -0.03 0.00 -1.74 0.00 0.00 39.64 38.45 1ons n ILE 219 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ons n GLY 220 N 0.96 0.76 0.21 3.28 0.00 -0.40 -4.32 105.19 105.68 1ons n GLY 220 Ca 0.22 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1ons n GLY 220 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1ons h TYR 221 N 0.00 0.24 -3.96 1.61 3.20 -1.65 0.18 116.97 116.59 1ons h TYR 221 Ca -0.18 -0.05 -0.36 0.00 3.14 0.00 0.00 58.73 61.28 1ons h TYR 221 Cb 0.70 -0.06 -0.21 0.00 1.54 0.00 0.00 36.73 38.70 1ons h TYR 221 CO 0.23 0.50 -0.76 -1.64 -1.64 0.00 0.00 178.16 174.85 1ons s MET 222 N -4.35 0.72 0.00 1.82 -1.94 -1.26 -3.76 119.30 110.52 1ons s MET 222 Ca -0.05 -0.88 0.23 0.00 -1.71 0.00 0.00 55.69 53.29 1ons s MET 222 Cb 0.14 -0.64 1.28 0.00 2.01 0.00 0.00 34.83 37.62 1ons s MET 222 CO 0.75 0.14 1.75 -0.35 -0.01 0.00 0.00 175.02 177.30 1ons n PRO 223 N 1.37 0.55 -2.14 2.03 -0.04 -1.26 -4.60 135.00 130.91 1ons n PRO 223 Ca -0.22 0.03 -0.01 0.00 -0.04 0.00 0.00 63.50 63.27 1ons n PRO 223 Cb 0.54 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.51 1ons n PRO 223 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ons n GLY 224 N 0.53 1.01 3.90 0.55 0.00 -1.26 -4.92 105.19 105.01 1ons n GLY 224 Ca 0.14 -0.96 -0.28 0.00 0.00 0.00 0.00 46.02 44.92 1ons n GLY 224 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ons s HIS 225 N -4.57 3.49 0.64 1.61 3.76 -1.26 -4.78 115.29 114.18 1ons s HIS 225 Ca 0.06 0.69 -0.16 0.00 -0.15 0.00 0.00 55.06 55.50 1ons s HIS 225 Cb -0.01 -2.16 -0.01 0.00 1.11 0.00 0.00 32.58 31.52 1ons s HIS 225 CO 0.01 0.07 1.14 -0.51 -0.85 0.00 0.00 174.74 174.60 1ons s LEU 226 N -3.81 3.49 0.00 0.89 1.43 -1.26 0.52 118.68 119.93 1ons s LEU 226 Ca 0.45 2.13 0.26 0.00 -1.03 0.00 0.00 54.13 55.94 1ons s LEU 226 Cb -0.10 -4.57 0.68 0.00 0.03 0.00 0.00 46.19 42.23 1ons s LEU 226 CO 0.32 -1.62 1.52 0.35 0.23 0.00 0.00 176.35 177.15 1ons n THR 227 N -2.13 0.00 -3.52 5.49 -2.24 -1.26 -4.58 114.28 106.04 1ons n THR 227 Ca 0.11 -0.15 -0.08 0.00 -2.27 0.00 0.00 64.05 61.67 1ons n THR 227 Cb 0.51 0.50 -0.02 0.00 -2.10 0.00 0.00 70.33 69.22 1ons n THR 227 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1ons s TRP 228 N -2.48 -0.31 -0.16 4.78 1.48 -1.26 -5.08 118.94 115.91 1ons s TRP 228 Ca 0.24 0.19 0.01 0.00 -1.06 0.00 0.00 56.10 55.48 1ons s TRP 228 Cb 0.19 0.53 0.02 0.00 -1.16 0.00 0.00 33.47 33.05 1ons s TRP 228 CO 0.52 -0.49 -0.19 0.71 -4.06 0.00 0.00 176.95 173.44 1ons s TYR 229 N -3.01 2.61 0.20 1.66 2.02 -1.26 -5.01 117.35 114.55 1ons s TYR 229 Ca 0.06 -1.48 0.30 0.00 -0.37 0.00 0.00 57.07 55.58 1ons s TYR 229 Cb -0.01 -1.82 1.28 0.00 -0.40 0.00 0.00 41.96 41.02 1ons s TYR 229 CO -0.08 -0.73 1.96 0.27 -1.57 0.00 0.00 175.55 175.40 1ons h PHE 230 N 7.82 0.00 0.99 2.71 -5.15 -1.99 -3.21 116.94 118.11 1ons h PHE 230 Ca -0.41 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 57.31 1ons h PHE 230 Cb 1.15 0.00 0.01 0.00 0.22 0.00 0.00 35.95 37.33 1ons h PHE 230 CO 0.47 0.10 -0.49 0.78 -2.00 0.00 0.00 178.31 177.17 1ons h GLY 231 N 1.75 -1.42 1.55 6.09 0.00 -1.95 -1.00 103.07 108.10 1ons h GLY 231 Ca -0.00 0.53 -0.01 0.00 0.00 0.00 0.00 47.33 47.85 1ons h GLY 231 CO 0.01 -0.51 0.21 1.05 0.00 0.00 0.00 176.54 177.30 1ons h GLU 232 N -1.35 0.59 -0.23 4.80 4.11 -1.99 -1.62 114.58 118.89 1ons h GLU 232 Ca -0.14 -0.06 -0.02 0.00 0.07 0.00 0.00 59.36 59.21 1ons h GLU 232 Cb 1.04 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 1ons h GLU 232 CO 0.21 0.46 0.07 0.93 0.07 0.00 0.00 179.01 180.75 1ons h GLU 233 N 0.59 0.36 -0.70 1.06 4.39 -1.54 -0.51 114.58 118.23 1ons h GLU 233 Ca 0.15 -0.08 0.06 0.00 0.34 0.00 0.00 59.36 59.83 1ons h GLU 233 Cb 0.06 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.62 1ons h GLU 233 CO -0.02 0.45 0.46 -0.07 -1.16 0.00 0.00 179.01 178.67 1ons h LEU 234 N 0.20 0.64 -0.90 1.33 3.38 -0.58 0.81 115.31 120.19 1ons h LEU 234 Ca 0.07 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 1ons h LEU 234 Cb 0.25 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1ons h LEU 234 CO -0.00 0.42 -0.29 0.11 0.09 0.00 0.00 178.44 178.77 1ons h LYS 235 N 0.73 0.47 0.00 1.13 1.57 -0.77 -1.30 116.57 118.40 1ons h LYS 235 Ca 0.30 -0.19 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 1ons h LYS 235 Cb 0.24 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1ons h LYS 235 CO -0.10 0.72 -0.35 0.87 -0.57 0.00 0.00 179.45 180.02 1ons h LYS 236 N 0.41 0.00 -0.07 3.15 1.57 0.68 -2.40 116.57 119.91 1ons h LYS 236 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1ons h LYS 236 Cb 0.71 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1ons h LYS 236 CO 0.05 0.35 0.00 -0.12 -0.57 0.00 0.00 179.45 179.16 1ons n MET 237 N -3.54 1.26 -1.00 3.15 1.56 0.06 -4.88 117.12 113.73 1ons n MET 237 Ca -0.00 -0.40 0.00 0.00 -0.27 0.00 0.00 57.70 57.03 1ons n MET 237 Cb 0.49 -1.26 0.00 0.00 2.15 0.00 0.00 33.22 34.59 1ons n MET 237 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1ons n GLY 238 N 0.85 0.76 3.61 -5.12 0.00 -0.90 -4.67 105.19 99.72 1ons n GLY 238 Ca 0.12 -0.66 -0.28 0.00 0.00 0.00 0.00 46.02 45.20 1ons n GLY 238 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ons s MET 239 N -2.16 2.21 -0.19 1.61 -1.94 -0.57 -0.20 119.30 118.06 1ons s MET 239 Ca 0.00 -1.10 -0.04 0.00 -1.71 0.00 0.00 55.69 52.84 1ons s MET 239 Cb 0.00 -2.30 -0.02 0.00 2.01 0.00 0.00 34.83 34.52 1ons s MET 239 CO 0.00 0.48 -0.04 1.21 -0.01 0.00 0.00 175.02 176.66 1ons s ASN 240 N -2.58 4.56 -0.30 3.03 2.47 0.03 -4.03 114.94 118.12 1ons s ASN 240 Ca 0.24 -0.26 -0.08 0.00 0.42 0.00 0.00 52.86 53.18 1ons s ASN 240 Cb -0.10 -1.76 -0.00 0.00 -1.45 0.00 0.00 41.25 37.94 1ons s ASN 240 CO 0.16 0.08 0.12 -0.63 -3.72 0.00 0.00 177.10 173.11 1ons s ILE 241 N 0.89 4.35 -0.78 -5.21 1.01 -1.26 -0.62 121.20 119.58 1ons s ILE 241 Ca -0.00 -0.52 0.26 0.00 0.00 0.00 0.00 60.65 60.39 1ons s ILE 241 Cb -0.15 -3.22 0.27 0.00 0.01 0.00 0.00 42.46 39.37 1ons s ILE 241 CO 0.01 0.08 1.80 2.30 0.00 0.00 0.00 174.94 179.13 1ons n ILE 242 N 4.94 0.48 -4.32 2.92 -5.35 -0.43 -4.88 119.36 112.72 1ons n ILE 242 Ca -0.14 -0.17 -0.24 0.00 -0.27 0.00 0.00 62.75 61.93 1ons n ILE 242 Cb 0.49 -0.62 -0.12 0.00 -1.74 0.00 0.00 39.64 37.64 1ons n ILE 242 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1ons s ASN 243 N -4.11 2.71 -0.04 7.28 4.22 -1.26 -5.01 114.94 118.73 1ons s ASN 243 Ca 0.11 -0.75 0.05 0.00 -2.14 0.00 0.00 52.86 50.13 1ons s ASN 243 Cb 0.14 -0.16 0.08 0.00 1.28 0.00 0.00 41.25 42.59 1ons s ASN 243 CO 0.56 0.05 0.94 -0.90 -2.04 0.00 0.00 177.10 175.70 1ons n ASP 244 N 0.79 1.38 -3.34 3.54 3.85 -1.26 -4.73 116.55 116.78 1ons n ASP 244 Ca -0.17 -2.10 -0.18 0.00 -0.71 0.00 0.00 54.79 51.63 1ons n ASP 244 Cb 0.55 -0.15 -0.07 0.00 -1.35 0.00 0.00 41.12 40.10 1ons n ASP 244 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.20 177.70 1ons s ASP 245 N -1.31 1.41 -0.24 -1.12 1.47 -1.26 -4.76 116.67 110.86 1ons s ASP 245 Ca 0.09 -1.67 -0.01 0.00 1.18 0.00 0.00 52.55 52.14 1ons s ASP 245 Cb 0.08 0.59 0.02 0.00 -0.34 0.00 0.00 42.92 43.27 1ons s ASP 245 CO 0.01 -1.13 -0.08 -0.63 0.68 0.00 0.00 175.17 174.01 1ons s ILE 246 N -3.33 2.74 0.00 2.11 1.01 -1.26 -4.71 121.20 117.75 1ons s ILE 246 Ca 0.38 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 60.02 1ons s ILE 246 Cb 0.02 -2.36 0.00 0.00 0.01 0.00 0.00 42.46 40.13 1ons s ILE 246 CO 0.25 0.26 0.17 0.35 0.00 0.00 0.00 174.94 175.96 1ons n THR 247 N 4.65 0.00 -0.97 2.92 -2.24 -1.26 -5.00 114.28 112.38 1ons n THR 247 Ca -0.17 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 1ons n THR 247 Cb 0.47 1.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.98 1ons n THR 247 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ons n GLY 248 N 0.22 0.45 3.89 3.38 0.00 -1.26 -4.95 105.19 106.92 1ons n GLY 248 Ca 0.00 -0.97 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 1ons n GLY 248 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ons s ARG 249 N -1.96 3.29 0.15 1.61 0.52 -1.26 -4.06 118.95 117.25 1ons s ARG 249 Ca 0.00 0.37 0.05 0.00 -0.52 0.00 0.00 55.73 55.63 1ons s ARG 249 Cb 0.00 -2.20 -0.04 0.00 0.52 0.00 0.00 34.95 33.23 1ons s ARG 249 CO 0.00 -0.58 -0.12 0.14 0.02 0.00 0.00 175.30 174.76 1ons s VAL 250 N -3.05 1.29 0.04 3.52 -7.23 -1.26 -2.15 120.40 111.56 1ons s VAL 250 Ca 0.53 -2.01 -0.05 0.00 -1.81 0.00 0.00 61.98 58.64 1ons s VAL 250 Cb -0.11 -1.80 -0.01 0.00 0.56 0.00 0.00 36.38 35.02 1ons s VAL 250 CO 0.49 -0.65 0.08 -2.28 -0.31 0.00 0.00 175.10 172.43 1ons s HIS 251 N -3.01 0.21 -0.05 2.82 2.46 -0.57 -5.00 115.29 112.15 1ons s HIS 251 Ca 0.16 -0.52 0.02 0.00 0.47 0.00 0.00 55.06 55.19 1ons s HIS 251 Cb 0.00 -0.15 0.01 0.00 -0.13 0.00 0.00 32.58 32.31 1ons s HIS 251 CO 0.02 -0.35 -0.10 0.21 -2.47 0.00 0.00 174.74 172.05 1ons s LYS 252 N -2.57 1.33 -0.37 2.88 2.20 -1.26 -1.76 119.74 120.19 1ons s LYS 252 Ca -0.05 -0.33 0.01 0.00 -0.36 0.00 0.00 55.97 55.23 1ons s LYS 252 Cb -0.01 -1.16 0.14 0.00 -1.51 0.00 0.00 37.83 35.28 1ons s LYS 252 CO -0.04 0.04 0.22 0.34 -0.36 0.00 0.00 175.35 175.55 1ons s ASP 253 N 0.55 3.11 1.74 1.43 -1.08 -0.77 -5.01 116.67 116.63 1ons s ASP 253 Ca -0.10 -2.30 0.00 0.00 -0.52 0.00 0.00 52.55 49.63 1ons s ASP 253 Cb -0.13 -0.55 0.00 0.00 -1.46 0.00 0.00 42.92 40.78 1ons s ASP 253 CO 0.02 -0.30 0.00 0.54 0.52 0.00 0.00 175.17 175.95 1ons n ARG 254 N 3.92 0.00 -0.57 4.34 1.74 -1.26 -1.72 116.66 123.10 1ons n ARG 254 Ca 0.11 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.28 1ons n ARG 254 Cb 0.36 0.00 0.33 0.00 -1.02 0.00 0.00 32.46 32.13 1ons n ARG 254 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1ons n LYS 255 N 8.92 3.65 -3.30 5.56 5.02 -1.26 -4.84 118.16 131.90 1ons n LYS 255 Ca 0.00 -2.82 -0.43 0.00 -2.02 0.00 0.00 58.31 53.04 1ons n LYS 255 Cb 0.00 -1.85 -0.08 0.00 -0.02 0.00 0.00 35.03 33.07 1ons n LYS 255 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1ons s LEU 256 N -2.00 5.00 -0.17 -0.35 2.96 -0.70 -1.39 118.68 122.03 1ons s LEU 256 Ca 0.47 -0.82 -0.02 0.00 -0.22 0.00 0.00 54.13 53.54 1ons s LEU 256 Cb 0.32 -2.36 -0.01 0.00 0.50 0.00 0.00 46.19 44.63 1ons s LEU 256 CO 0.20 -0.64 -0.08 -0.76 -1.32 0.00 0.00 176.35 173.75 1ons s LEU 257 N 2.15 2.89 0.23 -0.68 1.43 -0.07 -1.85 118.68 122.78 1ons s LEU 257 Ca 0.11 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 1ons s LEU 257 Cb -0.18 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.29 1ons s LEU 257 CO 0.12 0.09 0.10 0.42 0.23 0.00 0.00 176.35 177.31 1ons s THR 258 N 0.80 0.40 0.06 5.49 -4.23 -0.72 -1.14 115.64 116.30 1ons s THR 258 Ca -0.03 -1.99 -0.00 0.00 -1.18 0.00 0.00 61.69 58.49 1ons s THR 258 Cb -0.15 -2.53 -0.04 0.00 1.34 0.00 0.00 72.50 71.12 1ons s THR 258 CO 0.01 -0.06 -0.04 -0.83 -0.54 0.00 0.00 174.62 173.16 1ons s GLY 259 N -3.25 0.51 0.06 3.99 0.00 -0.49 -1.52 107.32 106.62 1ons s GLY 259 Ca 0.36 -1.13 0.23 0.00 0.00 0.00 0.00 44.72 44.18 1ons s GLY 259 CO 0.12 -1.23 1.06 2.09 0.00 0.00 0.00 173.10 175.14 1ons n ASP 260 N 0.36 0.62 -1.70 1.64 5.68 -0.92 -1.91 116.55 120.33 1ons n ASP 260 Ca -0.15 -0.15 0.00 0.00 -0.50 0.00 0.00 54.79 53.98 1ons n ASP 260 Cb 0.60 0.72 0.00 0.00 -1.14 0.00 0.00 41.12 41.30 1ons n ASP 260 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1ons n SER 261 N -2.00 -0.39 0.22 -1.12 3.41 -1.26 -3.11 113.62 109.38 1ons n SER 261 Ca 0.02 -1.15 0.09 0.00 -0.26 0.00 0.00 58.87 57.57 1ons n SER 261 Cb 0.44 0.62 0.52 0.00 -0.26 0.00 0.00 64.21 65.52 1ons n SER 261 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1ons h PRO 262 N 0.00 0.00 0.00 4.33 0.13 -1.97 -1.23 132.00 133.26 1ons h PRO 262 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1ons h PRO 262 Cb 0.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.45 1ons h PRO 262 CO 0.09 0.24 0.00 0.74 -0.23 0.00 0.00 178.00 178.84 1ons h PHE 263 N 0.00 0.00 -0.02 1.56 -1.00 -1.94 -1.84 116.94 113.71 1ons h PHE 263 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1ons h PHE 263 Cb 0.60 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.16 1ons h PHE 263 CO 0.00 0.00 -0.37 0.00 -1.61 0.00 0.00 178.31 176.33 1ons n ALA 264 N -1.88 3.33 -0.08 2.45 0.00 -0.47 -4.58 120.51 119.28 1ons n ALA 264 Ca -0.00 -0.60 -0.08 0.00 0.00 0.00 0.00 53.44 52.76 1ons n ALA 264 Cb 0.15 -0.87 -0.01 0.00 0.00 0.00 0.00 19.45 18.73 1ons n ALA 264 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ons h ALA 265 N 3.95 0.37 -0.69 0.00 0.00 -1.31 -0.05 119.26 121.52 1ons h ALA 265 Ca 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1ons h ALA 265 Cb 0.73 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1ons h ALA 265 CO 0.00 -0.23 0.30 -0.97 0.00 0.00 0.00 179.25 178.35 1ons h ASN 266 N 0.32 0.94 -0.44 0.00 -1.24 -1.81 -1.76 115.58 111.60 1ons h ASN 266 Ca 0.12 -0.16 -0.10 0.00 0.71 0.00 0.00 56.30 56.87 1ons h ASN 266 Cb 0.03 -0.24 -0.02 0.00 0.73 0.00 0.00 38.32 38.82 1ons h ASN 266 CO -0.08 0.84 -0.10 0.00 -1.29 0.00 0.00 177.43 176.80 1ons h ALA 267 N 1.14 0.90 -0.10 1.57 0.00 -1.79 -2.44 119.26 118.55 1ons h ALA 267 Ca 0.23 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1ons h ALA 267 Cb 0.18 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ons h ALA 267 CO -0.02 0.63 -0.28 1.25 0.00 0.00 0.00 179.25 180.84 1ons h LEU 268 N 0.81 0.17 0.12 0.00 5.85 -0.74 -0.45 115.31 121.08 1ons h LEU 268 Ca 0.13 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1ons h LEU 268 Cb 0.61 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.60 1ons h LEU 268 CO 0.04 0.45 -0.06 1.23 -0.34 0.00 0.00 178.44 179.77 1ons h GLY 269 N 0.97 -0.17 0.71 3.75 0.00 -0.91 0.08 103.07 107.50 1ons h GLY 269 Ca 0.02 0.06 0.02 0.00 0.00 0.00 0.00 47.33 47.44 1ons h GLY 269 CO 0.04 -0.06 -0.10 0.50 0.00 0.00 0.00 176.54 176.92 1ons h LYS 270 N -0.43 -0.15 -0.28 4.80 1.57 -1.20 0.11 116.57 120.98 1ons h LYS 270 Ca -0.02 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.81 1ons h LYS 270 Cb 0.35 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.66 1ons h LYS 270 CO 0.03 -0.10 0.04 1.25 -0.57 0.00 0.00 179.45 180.10 1ons h LEU 271 N -0.15 -0.03 -0.33 2.94 5.85 -1.03 0.16 115.31 122.71 1ons h LEU 271 Ca 0.05 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 1ons h LEU 271 Cb 0.22 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1ons h LEU 271 CO -0.12 0.02 0.13 0.00 -0.34 0.00 0.00 178.44 178.13 1ons h ALA 272 N 1.21 0.43 -0.03 1.25 0.00 -0.74 0.11 119.26 121.50 1ons h ALA 272 Ca 0.13 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ons h ALA 272 Cb 0.15 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1ons h ALA 272 CO -0.19 0.04 0.02 0.00 0.00 0.00 0.00 179.25 179.12 1ons h ALA 273 N 0.97 0.04 0.23 0.00 0.00 -0.49 0.17 119.26 120.18 1ons h ALA 273 Ca 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ons h ALA 273 Cb 0.19 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1ons h ALA 273 CO -0.01 -0.43 -0.23 0.37 0.00 0.00 0.00 179.25 178.95 1ons h GLN 274 N -0.02 -0.48 -0.59 0.00 4.15 -0.56 0.32 115.11 117.95 1ons h GLN 274 Ca 0.01 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1ons h GLN 274 Cb 0.06 0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.83 1ons h GLN 274 CO -0.00 -0.32 0.38 0.93 -1.93 0.00 0.00 178.83 177.90 1ons h GLU 275 N -0.49 0.78 -0.28 1.69 4.39 -0.66 -2.34 114.58 117.66 1ons h GLU 275 Ca -0.00 -0.05 -0.16 0.00 0.34 0.00 0.00 59.36 59.49 1ons h GLU 275 Cb 0.46 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1ons h GLU 275 CO -0.06 0.52 -0.46 0.52 -1.16 0.00 0.00 179.01 178.37 1ons h MET 276 N 0.79 0.74 -0.27 2.33 2.86 -0.52 -2.47 114.93 118.39 1ons h MET 276 Ca 0.21 -0.42 -0.01 0.00 -2.06 0.00 0.00 59.70 57.43 1ons h MET 276 Cb -0.08 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 1ons h MET 276 CO -0.05 1.04 0.14 -0.07 1.06 0.00 0.00 176.91 179.04 1ons h LEU 277 N 0.59 0.34 -1.59 1.22 3.38 -0.80 -0.87 115.31 117.58 1ons h LEU 277 Ca 0.03 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.92 1ons h LEU 277 Cb 1.02 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 1ons h LEU 277 CO 0.10 0.35 0.30 0.00 0.09 0.00 0.00 178.44 179.28 1ons h ALA 278 N 1.01 1.75 0.01 1.53 0.00 -1.37 -0.51 119.26 121.68 1ons h ALA 278 Ca 0.09 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.74 1ons h ALA 278 Cb 0.09 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.73 1ons h ALA 278 CO -0.01 0.21 -0.98 0.00 0.00 0.00 0.00 179.25 178.47 1ons h ALA 279 N 1.73 0.30 -0.53 0.00 0.00 -1.01 -3.25 119.26 116.50 1ons h ALA 279 Ca 0.17 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1ons h ALA 279 Cb 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ons h ALA 279 CO -0.04 0.80 0.00 0.66 0.00 0.00 0.00 179.25 180.67 1ons n TYR 280 N -3.75 1.61 -1.22 0.00 4.02 -0.37 -5.11 117.16 112.34 1ons n TYR 280 Ca -0.08 -0.59 0.00 0.00 -0.01 0.00 0.00 57.90 57.23 1ons n TYR 280 Cb 0.86 -0.36 0.00 0.00 -0.02 0.00 0.00 39.34 39.82 1ons n TYR 280 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85