#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ids s PRO 2 N 0.00 4.20 0.27 2.12 0.02 -1.26 -4.96 135.00 135.39 3ids s PRO 2 Ca 0.00 2.40 -0.29 0.00 0.02 0.00 0.00 61.00 63.13 3ids s PRO 2 Cb 0.00 -3.21 -0.09 0.00 0.02 0.00 0.00 34.50 31.22 3ids s PRO 2 CO 0.00 -0.65 1.00 0.96 -0.33 0.00 0.00 177.00 177.98 3ids s ILE 3 N 1.37 3.88 -0.47 2.83 -4.36 -0.50 -4.53 121.20 119.41 3ids s ILE 3 Ca 0.72 1.83 -0.22 0.00 -0.26 0.00 0.00 60.65 62.71 3ids s ILE 3 Cb -0.44 -4.14 0.03 0.00 1.25 0.00 0.00 42.46 39.16 3ids s ILE 3 CO 0.32 0.39 0.76 -0.54 0.24 0.00 0.00 174.94 176.11 3ids s LYS 4 N -1.43 3.34 -0.04 0.37 -0.14 -1.26 -0.45 119.74 120.12 3ids s LYS 4 Ca 0.44 -0.25 0.04 0.00 -1.36 0.00 0.00 55.97 54.83 3ids s LYS 4 Cb -0.27 -3.97 -0.03 0.00 -1.68 0.00 0.00 37.83 31.88 3ids s LYS 4 CO 0.34 -1.15 -0.13 0.08 -0.76 0.00 0.00 175.35 173.72 3ids s VAL 5 N 3.22 3.14 0.01 3.17 1.01 0.51 -1.08 120.40 130.38 3ids s VAL 5 Ca 0.27 -0.74 0.06 0.00 0.00 0.00 0.00 61.98 61.57 3ids s VAL 5 Cb -0.13 -2.25 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 3ids s VAL 5 CO 0.20 0.56 -0.18 -0.83 0.00 0.00 0.00 175.10 174.85 3ids s GLY 6 N -0.84 0.93 -0.30 4.51 0.00 -0.18 -0.66 107.32 110.79 3ids s GLY 6 Ca 0.12 -0.86 -0.05 0.00 0.00 0.00 0.00 44.72 43.94 3ids s GLY 6 CO 0.01 -0.76 0.04 -0.42 0.00 0.00 0.00 173.10 171.97 3ids s ILE 7 N -0.59 3.49 -0.32 0.90 1.01 -0.64 -0.60 121.20 124.45 3ids s ILE 7 Ca 0.06 -1.00 -0.24 0.00 0.00 0.00 0.00 60.65 59.47 3ids s ILE 7 Cb -0.08 -2.87 0.00 0.00 0.01 0.00 0.00 42.46 39.53 3ids s ILE 7 CO 0.00 0.01 0.83 0.21 0.00 0.00 0.00 174.94 175.99 3ids s ASN 8 N 1.39 6.67 0.00 3.58 3.04 -0.11 -0.50 114.94 129.02 3ids s ASN 8 Ca -0.00 0.64 0.00 0.00 0.04 0.00 0.00 52.86 53.54 3ids s ASN 8 Cb -0.18 -2.42 0.00 0.00 -1.54 0.00 0.00 41.25 37.11 3ids s ASN 8 CO 0.00 -0.68 0.00 0.61 -3.04 0.00 0.00 177.10 173.99 3ids n GLY 9 N 4.23 0.16 2.41 1.21 0.00 0.72 -0.79 105.19 113.14 3ids n GLY 9 Ca 0.05 -1.07 -0.19 0.00 0.00 0.00 0.00 46.02 44.80 3ids n GLY 9 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3ids n PHE 10 N 2.32 2.50 0.00 1.61 7.35 -1.20 -4.21 117.46 125.83 3ids n PHE 10 Ca 0.00 -2.62 0.00 0.00 -0.76 0.00 0.00 57.45 54.07 3ids n PHE 10 Cb 0.00 -0.24 0.00 0.00 0.35 0.00 0.00 39.48 39.59 3ids n PHE 10 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3ids n GLY 11 N -0.51 -1.31 0.33 7.13 0.00 -1.26 -4.60 105.19 104.96 3ids n GLY 11 Ca 0.31 -1.51 -0.04 0.00 0.00 0.00 0.00 46.02 44.78 3ids n GLY 11 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3ids h ARG 12 N 0.00 1.02 0.26 1.61 2.43 -1.96 -0.72 114.38 117.01 3ids h ARG 12 Ca 0.00 -0.17 -0.01 0.00 -0.81 0.00 0.00 59.98 58.99 3ids h ARG 12 Cb 0.00 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 3ids h ARG 12 CO 0.00 0.83 -0.12 0.82 -1.51 0.00 0.00 179.97 179.99 3ids h ILE 13 N 1.00 0.79 -0.55 1.20 1.08 -1.93 -1.08 117.51 118.03 3ids h ILE 13 Ca 0.23 -0.46 -0.02 0.00 -0.39 0.00 0.00 64.86 64.23 3ids h ILE 13 Cb 0.20 1.05 -0.03 0.00 -3.07 0.00 0.00 36.82 34.97 3ids h ILE 13 CO -0.02 0.10 0.28 1.23 -0.69 0.00 0.00 178.15 179.05 3ids h GLY 14 N -0.59 0.84 0.06 5.37 0.00 -1.71 -2.10 103.07 104.94 3ids h GLY 14 Ca -0.04 -0.40 0.10 0.00 0.00 0.00 0.00 47.33 46.99 3ids h GLY 14 CO 0.06 0.38 -0.10 3.21 0.00 0.00 0.00 176.54 180.09 3ids h ARG 15 N 0.74 0.01 0.00 4.80 3.08 -1.08 -1.76 114.38 120.18 3ids h ARG 15 Ca 0.19 -0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.12 3ids h ARG 15 Cb 0.09 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 3ids h ARG 15 CO -0.03 0.01 -0.57 0.52 -1.07 0.00 0.00 179.97 178.84 3ids h MET 16 N 0.01 0.00 -0.56 0.04 2.86 -0.97 -0.86 114.93 115.45 3ids h MET 16 Ca 0.23 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.83 3ids h MET 16 Cb 0.35 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 3ids h MET 16 CO -0.48 0.57 0.21 0.28 1.06 0.00 0.00 176.91 178.54 3ids h VAL 17 N 0.00 1.23 -0.49 -2.22 2.07 -1.11 -1.07 116.25 114.65 3ids h VAL 17 Ca -0.01 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 3ids h VAL 17 Cb 1.17 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 3ids h VAL 17 CO 0.07 0.28 0.24 0.15 0.02 0.00 0.00 177.57 178.34 3ids h PHE 18 N 0.78 0.71 -0.73 1.57 3.04 -0.86 -1.89 116.94 119.54 3ids h PHE 18 Ca 0.19 -0.03 -0.04 0.00 3.98 0.00 0.00 57.97 62.06 3ids h PHE 18 Cb 0.23 -0.22 -0.03 0.00 2.56 0.00 0.00 35.95 38.49 3ids h PHE 18 CO 0.01 0.55 0.30 1.96 -2.02 0.00 0.00 178.31 179.11 3ids h GLN 19 N 0.65 1.09 -0.40 1.11 4.20 -1.04 -1.42 115.11 119.29 3ids h GLN 19 Ca 0.17 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 3ids h GLN 19 Cb 0.11 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 3ids h GLN 19 CO -0.02 0.89 0.21 0.00 -0.67 0.00 0.00 178.83 179.24 3ids h ALA 20 N 1.14 0.52 -0.45 3.87 0.00 -1.08 0.06 119.26 123.32 3ids h ALA 20 Ca 0.24 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.12 3ids h ALA 20 Cb 0.21 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 3ids h ALA 20 CO -0.02 0.06 0.16 1.25 0.00 0.00 0.00 179.25 180.70 3ids h LEU 21 N 0.52 0.18 -0.42 0.00 6.46 -1.10 -1.44 115.31 119.50 3ids h LEU 21 Ca 0.14 0.05 -0.06 0.00 -0.12 0.00 0.00 57.88 57.89 3ids h LEU 21 Cb 0.08 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.02 3ids h LEU 21 CO -0.02 0.13 0.03 0.00 -0.62 0.00 0.00 178.44 177.97 3ids h GLU 23 N 0.57 0.47 0.00 0.00 4.81 -0.63 -0.42 114.58 119.38 3ids h GLU 23 Ca 0.12 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 3ids h GLU 23 Cb 0.43 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.71 3ids h GLU 23 CO 0.02 0.31 0.00 -0.25 -0.73 0.00 0.00 179.01 178.36 3ids n ASP 24 N -4.48 0.00 -0.54 1.04 8.00 -0.57 -4.88 116.55 115.12 3ids n ASP 24 Ca 0.06 -1.09 -0.05 0.00 0.71 0.00 0.00 54.79 54.42 3ids n ASP 24 Cb 0.20 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.29 3ids n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ids n GLY 25 N 0.76 0.33 0.02 0.44 0.00 -0.17 -4.95 105.19 101.63 3ids n GLY 25 Ca 0.18 -0.71 0.11 0.00 0.00 0.00 0.00 46.02 45.60 3ids n GLY 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ids n LEU 26 N -0.71 0.20 -4.68 0.99 4.77 -1.01 -4.72 117.00 111.85 3ids n LEU 26 Ca -0.06 0.02 -0.42 0.00 -0.03 0.00 0.00 56.01 55.51 3ids n LEU 26 Cb 0.44 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.49 3ids n LEU 26 CO 0.07 -0.01 1.15 -0.22 -1.33 0.00 0.00 177.39 177.05 3ids s LEU 27 N -4.52 4.29 0.00 2.23 2.96 -1.26 -1.02 118.68 121.36 3ids s LEU 27 Ca -0.06 2.05 0.00 0.00 -0.22 0.00 0.00 54.13 55.91 3ids s LEU 27 Cb 0.14 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.27 3ids s LEU 27 CO 0.89 -0.76 0.00 0.61 -1.32 0.00 0.00 176.35 175.77 3ids n GLY 28 N 3.71 2.53 0.47 7.98 0.00 -0.53 -4.81 105.19 114.54 3ids n GLY 28 Ca 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.12 3ids n GLY 28 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ids n THR 29 N -2.00 1.01 -0.06 2.61 -2.24 -1.01 -4.86 114.28 107.73 3ids n THR 29 Ca 0.00 0.26 -0.04 0.00 -2.27 0.00 0.00 64.05 62.01 3ids n THR 29 Cb 0.00 -1.83 -0.13 0.00 -2.10 0.00 0.00 70.33 66.28 3ids n THR 29 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ids n GLU 30 N -3.63 1.21 -4.13 -0.78 -0.58 -0.41 -4.48 120.64 107.84 3ids n GLU 30 Ca -0.06 -0.04 -0.25 0.00 -0.42 0.00 0.00 57.16 56.39 3ids n GLU 30 Cb 0.22 -1.40 -0.17 0.00 -0.57 0.00 0.00 31.44 29.52 3ids n GLU 30 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3ids s ILE 31 N -2.58 0.91 -0.63 -3.67 1.01 -0.19 -1.42 121.20 114.63 3ids s ILE 31 Ca -0.07 -0.27 -0.19 0.00 0.00 0.00 0.00 60.65 60.12 3ids s ILE 31 Cb 0.06 -0.91 0.11 0.00 0.01 0.00 0.00 42.46 41.74 3ids s ILE 31 CO 0.66 0.33 0.75 -0.62 0.00 0.00 0.00 174.94 176.06 3ids s ASP 32 N 1.30 6.24 -0.58 3.58 2.15 0.40 -1.46 116.67 128.31 3ids s ASP 32 Ca -0.03 -1.52 -0.27 0.00 0.43 0.00 0.00 52.55 51.15 3ids s ASP 32 Cb -0.14 -2.31 0.00 0.00 -0.30 0.00 0.00 42.92 40.18 3ids s ASP 32 CO -0.03 -1.10 1.55 -0.69 -0.17 0.00 0.00 175.17 174.73 3ids s VAL 33 N 2.63 3.63 0.04 1.11 1.01 -1.26 -0.36 120.40 127.19 3ids s VAL 33 Ca 0.14 0.49 -0.17 0.00 0.00 0.00 0.00 61.98 62.44 3ids s VAL 33 Cb -0.22 -4.30 -0.24 0.00 0.00 0.00 0.00 36.38 31.63 3ids s VAL 33 CO 0.04 -1.13 1.15 0.58 0.00 0.00 0.00 175.10 175.74 3ids h VAL 34 N 6.51 1.34 -2.80 2.92 2.07 -1.19 -3.41 116.25 121.69 3ids h VAL 34 Ca -0.27 -2.19 -0.07 0.00 0.82 0.00 0.00 66.70 64.99 3ids h VAL 34 Cb 1.11 2.49 -0.17 0.00 -1.52 0.00 0.00 31.29 33.20 3ids h VAL 34 CO 1.19 0.66 -0.02 0.00 0.02 0.00 0.00 177.57 179.42 3ids s ALA 35 N -3.25 -1.22 0.08 1.67 0.00 -1.25 -2.08 121.76 115.71 3ids s ALA 35 Ca -0.11 0.55 0.08 0.00 0.00 0.00 0.00 51.96 52.48 3ids s ALA 35 Cb 0.05 0.31 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 3ids s ALA 35 CO 0.88 -0.46 -0.19 0.14 0.00 0.00 0.00 175.76 176.14 3ids s VAL 36 N -2.23 2.75 -0.07 0.00 -7.23 -0.35 -1.62 120.40 111.65 3ids s VAL 36 Ca -0.07 -1.38 0.04 0.00 -1.81 0.00 0.00 61.98 58.76 3ids s VAL 36 Cb -0.01 -2.21 0.00 0.00 0.56 0.00 0.00 36.38 34.72 3ids s VAL 36 CO -0.00 0.21 -0.18 -0.69 -0.31 0.00 0.00 175.10 174.13 3ids s VAL 37 N -1.03 1.58 0.05 1.32 1.01 0.34 -0.44 120.40 123.23 3ids s VAL 37 Ca 0.16 -0.76 -0.27 0.00 0.00 0.00 0.00 61.98 61.11 3ids s VAL 37 Cb -0.10 -1.38 0.09 0.00 0.00 0.00 0.00 36.38 34.98 3ids s VAL 37 CO 0.07 0.45 0.93 -0.62 0.00 0.00 0.00 175.10 175.94 3ids s ASP 38 N 0.36 -0.28 0.24 3.32 -1.08 -0.82 -0.20 116.67 118.20 3ids s ASP 38 Ca -0.13 -0.16 -0.07 0.00 -0.52 0.00 0.00 52.55 51.68 3ids s ASP 38 Cb -0.15 0.41 0.28 0.00 -1.46 0.00 0.00 42.92 42.00 3ids s ASP 38 CO 0.05 -0.71 1.88 -0.03 0.52 0.00 0.00 175.17 176.87 3ids h MET 39 N 2.00 1.04 -6.05 4.34 -1.53 -1.92 -0.55 114.93 112.27 3ids h MET 39 Ca -0.23 -0.06 -0.59 0.00 -3.44 0.00 0.00 59.70 55.38 3ids h MET 39 Cb 1.24 -0.23 -0.05 0.00 -0.55 0.00 0.00 31.60 32.00 3ids h MET 39 CO 0.29 0.69 -0.52 0.54 0.14 0.00 0.00 176.91 178.05 3ids s ASN 40 N -5.87 6.07 -0.01 1.39 2.20 -1.26 -4.73 114.94 112.73 3ids s ASN 40 Ca -0.13 0.12 0.01 0.00 -0.94 0.00 0.00 52.86 51.92 3ids s ASN 40 Cb 0.18 -1.78 0.01 0.00 -2.00 0.00 0.00 41.25 37.66 3ids s ASN 40 CO 0.79 0.11 0.90 0.35 -2.94 0.00 0.00 177.10 176.32 3ids n THR 41 N -0.07 0.81 -2.24 0.54 -2.24 -1.26 -4.84 114.28 104.98 3ids n THR 41 Ca -0.07 -0.83 -0.34 0.00 -2.27 0.00 0.00 64.05 60.54 3ids n THR 41 Cb 0.53 0.57 -0.04 0.00 -2.10 0.00 0.00 70.33 69.29 3ids n THR 41 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ids s ASP 42 N -0.87 5.63 0.42 3.42 -1.08 -1.26 -4.41 116.67 118.52 3ids s ASP 42 Ca 0.02 -0.67 0.12 0.00 -0.52 0.00 0.00 52.55 51.50 3ids s ASP 42 Cb 0.01 -2.56 0.96 0.00 -1.46 0.00 0.00 42.92 39.87 3ids s ASP 42 CO 0.00 -2.25 1.97 0.00 0.52 0.00 0.00 175.17 175.41 3ids h ALA 43 N 11.44 1.93 -0.69 3.66 0.00 -1.72 -1.85 119.26 132.03 3ids h ALA 43 Ca 0.02 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.97 3ids h ALA 43 Cb 1.04 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.67 3ids h ALA 43 CO 1.28 -0.06 0.39 0.93 0.00 0.00 0.00 179.25 181.79 3ids h GLU 44 N 0.50 0.69 -0.34 0.00 5.08 -1.89 0.17 114.58 118.80 3ids h GLU 44 Ca 0.28 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.55 3ids h GLU 44 Cb 0.46 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 3ids h GLU 44 CO -0.09 0.46 -0.01 -0.92 -1.00 0.00 0.00 179.01 177.46 3ids h TYR 45 N 0.72 0.65 -0.87 4.33 3.20 -1.75 -1.65 116.97 121.60 3ids h TYR 45 Ca 0.30 -0.12 0.04 0.00 3.14 0.00 0.00 58.73 62.10 3ids h TYR 45 Cb 0.18 -0.17 -0.05 0.00 1.54 0.00 0.00 36.73 38.23 3ids h TYR 45 CO -0.07 0.72 0.56 0.74 -1.64 0.00 0.00 178.16 178.47 3ids h PHE 46 N 0.40 1.05 -0.66 -3.82 0.05 -0.99 0.26 116.94 113.24 3ids h PHE 46 Ca 0.09 0.03 -0.07 0.00 3.82 0.00 0.00 57.97 61.84 3ids h PHE 46 Cb 0.46 -0.35 -0.03 0.00 2.00 0.00 0.00 35.95 38.04 3ids h PHE 46 CO 0.04 0.60 0.14 0.00 -0.18 0.00 0.00 178.31 178.91 3ids h ALA 47 N 1.37 0.87 -0.51 2.45 0.00 -0.51 -0.79 119.26 122.14 3ids h ALA 47 Ca 0.35 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3ids h ALA 47 Cb 0.03 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 3ids h ALA 47 CO -0.12 0.61 0.34 -0.92 0.00 0.00 0.00 179.25 179.15 3ids h TYR 48 N 0.99 0.65 -0.84 0.00 3.20 -0.65 -0.70 116.97 119.62 3ids h TYR 48 Ca 0.21 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.06 3ids h TYR 48 Cb 0.39 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.40 3ids h TYR 48 CO 0.03 0.41 0.40 1.96 -1.64 0.00 0.00 178.16 179.32 3ids h GLN 49 N 0.69 1.21 -0.33 1.82 4.20 -0.61 -2.51 115.11 119.59 3ids h GLN 49 Ca 0.19 -0.18 -0.15 0.00 0.06 0.00 0.00 58.65 58.57 3ids h GLN 49 Cb -0.08 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.48 3ids h GLN 49 CO -0.04 0.93 -0.39 0.52 -0.67 0.00 0.00 178.83 179.18 3ids h MET 50 N 1.20 0.78 -0.35 1.46 2.86 -0.96 -3.31 114.93 116.61 3ids h MET 50 Ca 0.29 -0.40 -0.13 0.00 -2.06 0.00 0.00 59.70 57.39 3ids h MET 50 Cb 0.12 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 3ids h MET 50 CO -0.04 1.03 -0.31 -0.09 1.06 0.00 0.00 176.91 178.57 3ids h ARG 51 N 0.64 0.77 -4.70 1.72 2.43 -0.87 -3.37 114.38 110.99 3ids h ARG 51 Ca 0.05 -0.35 -0.58 0.00 -0.81 0.00 0.00 59.98 58.29 3ids h ARG 51 Cb 0.95 -0.01 -0.35 0.00 -0.42 0.00 0.00 29.97 30.14 3ids h ARG 51 CO 0.09 0.97 -0.83 0.71 -1.51 0.00 0.00 179.97 179.40 3ids s TYR 52 N -4.47 1.96 -0.06 2.20 2.02 -0.97 -3.13 117.35 114.90 3ids s TYR 52 Ca -0.09 -0.94 0.00 0.00 -0.37 0.00 0.00 57.07 55.67 3ids s TYR 52 Cb 0.12 -1.43 0.02 0.00 -0.40 0.00 0.00 41.96 40.28 3ids s TYR 52 CO 0.84 -0.50 -0.05 0.34 -1.57 0.00 0.00 175.55 174.62 3ids s ASP 53 N 1.07 1.39 0.25 2.29 -1.08 -0.89 -4.72 116.67 114.98 3ids s ASP 53 Ca -0.05 -0.17 -0.05 0.00 -0.52 0.00 0.00 52.55 51.76 3ids s ASP 53 Cb -0.15 -0.56 0.34 0.00 -1.46 0.00 0.00 42.92 41.10 3ids s ASP 53 CO -0.03 -0.08 1.86 0.74 0.52 0.00 0.00 175.17 178.18 3ids h THR 54 N 6.16 1.06 0.00 1.71 2.02 -1.97 -1.95 112.91 119.95 3ids h THR 54 Ca -0.32 -0.35 -0.20 0.00 0.77 0.00 0.00 66.41 66.31 3ids h THR 54 Cb 1.15 -0.06 -0.03 0.00 -1.74 0.00 0.00 68.15 67.47 3ids h THR 54 CO 0.41 0.19 -1.09 0.58 0.37 0.00 0.00 175.52 175.98 3ids h VAL 55 N 1.03 0.98 -0.12 3.16 2.07 -1.98 -3.40 116.25 117.99 3ids h VAL 55 Ca 0.38 -2.15 0.00 0.00 0.82 0.00 0.00 66.70 65.75 3ids h VAL 55 Cb 0.15 2.27 0.00 0.00 -1.52 0.00 0.00 31.29 32.19 3ids h VAL 55 CO -0.17 0.33 0.00 1.41 0.02 0.00 0.00 177.57 179.17 3ids n HIS 56 N -4.46 0.14 -4.32 1.57 8.25 -1.24 -4.98 115.22 110.18 3ids n HIS 56 Ca -0.29 -0.07 0.00 0.00 -0.26 0.00 0.00 57.72 57.10 3ids n HIS 56 Cb 0.64 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.75 3ids n HIS 56 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ids n GLY 57 N 1.27 1.08 3.77 -1.41 0.00 -0.73 -4.84 105.19 104.33 3ids n GLY 57 Ca 0.17 -0.77 -0.39 0.00 0.00 0.00 0.00 46.02 45.03 3ids n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ids s LYS 58 N 0.00 4.26 0.13 1.61 -0.14 -1.26 -2.08 119.74 122.25 3ids s LYS 58 Ca 0.00 0.67 -0.31 0.00 -1.36 0.00 0.00 55.97 54.96 3ids s LYS 58 Cb 0.00 -3.32 -0.09 0.00 -1.68 0.00 0.00 37.83 32.74 3ids s LYS 58 CO 0.00 0.42 1.45 0.12 -0.76 0.00 0.00 175.35 176.57 3ids s PHE 59 N -0.33 3.18 0.49 3.18 5.36 -1.18 -4.92 117.98 123.76 3ids s PHE 59 Ca 0.29 0.85 0.29 0.00 -0.96 0.00 0.00 56.93 57.40 3ids s PHE 59 Cb -0.18 -3.76 1.63 0.00 -0.34 0.00 0.00 43.02 40.37 3ids s PHE 59 CO 0.16 -2.71 2.15 -0.22 -1.46 0.00 0.00 175.22 173.15 3ids h LYS 60 N 6.81 0.00 -6.16 10.12 3.64 -1.95 -3.43 116.57 125.61 3ids h LYS 60 Ca -0.42 0.00 -0.53 0.00 -1.27 0.00 0.00 60.65 58.43 3ids h LYS 60 Cb 1.21 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.96 3ids h LYS 60 CO 0.88 0.07 -0.54 0.71 -2.27 0.00 0.00 179.45 178.30 3ids s TYR 61 N -4.36 2.83 0.17 1.91 1.51 -1.26 -5.11 117.35 113.03 3ids s TYR 61 Ca -0.04 -0.28 -0.27 0.00 -1.01 0.00 0.00 57.07 55.48 3ids s TYR 61 Cb 0.14 -1.54 -0.08 0.00 -0.11 0.00 0.00 41.96 40.37 3ids s TYR 61 CO 0.56 0.40 0.83 -2.00 -1.11 0.00 0.00 175.55 174.23 3ids s GLU 62 N -3.84 4.64 -0.13 -0.62 2.12 -1.26 -5.02 118.70 114.59 3ids s GLU 62 Ca 0.36 1.25 0.02 0.00 0.36 0.00 0.00 54.97 56.96 3ids s GLU 62 Cb -0.05 -3.28 -0.00 0.00 0.26 0.00 0.00 34.13 31.05 3ids s GLU 62 CO 0.23 0.51 -0.18 0.08 -0.54 0.00 0.00 175.26 175.35 3ids s VAL 63 N -0.97 2.47 0.42 3.70 1.01 -1.26 -4.37 120.40 121.41 3ids s VAL 63 Ca 0.38 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.55 3ids s VAL 63 Cb -0.24 -2.01 -0.05 0.00 0.00 0.00 0.00 36.38 34.09 3ids s VAL 63 CO 0.28 0.54 0.04 0.42 0.00 0.00 0.00 175.10 176.37 3ids s THR 64 N 0.57 1.32 0.17 3.92 -4.23 -0.62 -4.97 115.64 111.80 3ids s THR 64 Ca -0.11 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.47 3ids s THR 64 Cb -0.16 -2.58 -0.04 0.00 1.34 0.00 0.00 72.50 71.06 3ids s THR 64 CO 0.04 0.00 -0.13 0.42 -0.54 0.00 0.00 174.62 174.41 3ids s THR 65 N -2.97 1.49 0.17 3.99 -4.23 -1.26 -0.13 115.64 112.69 3ids s THR 65 Ca 0.24 -2.08 -0.03 0.00 -1.18 0.00 0.00 61.69 58.64 3ids s THR 65 Cb 0.06 -1.89 0.01 0.00 1.34 0.00 0.00 72.50 72.01 3ids s THR 65 CO 0.12 -0.61 0.28 1.07 -0.54 0.00 0.00 174.62 174.94 3ids n THR 66 N -0.16 0.00 -4.34 3.99 5.66 -0.52 -4.92 114.28 113.99 3ids n THR 66 Ca -0.10 -0.72 -0.32 0.00 -3.05 0.00 0.00 64.05 59.85 3ids n THR 66 Cb 0.60 0.50 -0.09 0.00 -1.55 0.00 0.00 70.33 69.79 3ids n THR 66 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 3ids s LYS 67 N -2.27 2.72 0.41 1.09 1.02 -1.26 -2.01 119.74 119.44 3ids s LYS 67 Ca 0.12 -0.64 0.22 0.00 0.02 0.00 0.00 55.97 55.69 3ids s LYS 67 Cb -0.01 -2.62 0.70 0.00 -0.52 0.00 0.00 37.83 35.38 3ids s LYS 67 CO 0.08 0.62 1.73 0.66 -0.92 0.00 0.00 175.35 177.52 3ids h SER 68 N 4.42 0.00 -4.85 2.83 4.64 -1.95 -3.45 113.55 115.19 3ids h SER 68 Ca -0.49 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.75 3ids h SER 68 Cb 1.17 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.07 3ids h SER 68 CO 0.56 0.26 -0.03 -0.94 -0.87 0.00 0.00 176.83 175.81 3ids s SER 69 N -6.24 -0.46 0.18 4.97 1.04 -1.26 -5.03 113.70 106.90 3ids s SER 69 Ca 0.02 0.51 0.10 0.00 0.48 0.00 0.00 55.95 57.06 3ids s SER 69 Cb 0.09 0.52 0.53 0.00 0.10 0.00 0.00 66.02 67.27 3ids s SER 69 CO 0.66 -0.49 1.23 -2.65 0.98 0.00 0.00 173.24 172.97 3ids n PRO 70 N 1.30 0.06 -0.02 4.02 -0.02 -1.26 -1.52 135.00 137.57 3ids n PRO 70 Ca -0.19 0.51 -0.16 0.00 -2.02 0.00 0.00 63.50 61.64 3ids n PRO 70 Cb 0.56 -1.84 -0.05 0.00 -0.02 0.00 0.00 33.50 32.16 3ids n PRO 70 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3ids h SER 71 N 0.00 0.87 -3.01 2.55 0.02 -1.98 -3.45 113.55 108.54 3ids h SER 71 Ca 0.00 -0.56 -0.56 0.00 -0.84 0.00 0.00 61.79 59.83 3ids h SER 71 Cb 0.26 -0.26 0.09 0.00 0.14 0.00 0.00 62.40 62.63 3ids h SER 71 CO 0.00 1.34 0.70 0.52 -1.14 0.00 0.00 176.83 178.25 3ids n VAL 72 N -3.93 1.15 0.15 2.27 0.31 -0.57 -4.93 118.33 112.78 3ids n VAL 72 Ca -0.07 -0.29 -0.07 0.00 -0.01 0.00 0.00 64.34 63.91 3ids n VAL 72 Cb 0.73 -1.68 -0.03 0.00 -0.91 0.00 0.00 33.84 31.95 3ids n VAL 72 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3ids h ALA 73 N 4.15 -0.59 -2.65 3.52 0.00 -1.90 -3.45 119.26 118.34 3ids h ALA 73 Ca -0.46 -0.10 -0.66 0.00 0.00 0.00 0.00 54.91 53.69 3ids h ALA 73 Cb 1.26 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 19.15 3ids h ALA 73 CO 0.75 -0.56 -0.44 0.15 0.00 0.00 0.00 179.25 179.15 3ids s LYS 74 N -3.10 3.51 0.19 0.00 -0.14 -1.26 -5.05 119.74 113.90 3ids s LYS 74 Ca -0.06 -0.06 -0.32 0.00 -1.36 0.00 0.00 55.97 54.17 3ids s LYS 74 Cb 0.01 -3.19 -0.15 0.00 -1.68 0.00 0.00 37.83 32.81 3ids s LYS 74 CO 0.19 0.77 1.26 -0.25 -0.76 0.00 0.00 175.35 176.56 3ids n ASP 75 N 1.95 1.86 -0.14 2.83 9.92 -1.26 -4.90 116.55 126.81 3ids n ASP 75 Ca -0.19 1.14 0.02 0.00 -0.53 0.00 0.00 54.79 55.23 3ids n ASP 75 Cb 0.55 -1.29 0.03 0.00 -0.64 0.00 0.00 41.12 39.76 3ids n ASP 75 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 3ids n ASP 76 N 2.10 0.97 -3.88 -2.24 5.75 -0.88 -2.01 116.55 116.36 3ids n ASP 76 Ca 0.14 -1.92 -0.16 0.00 -0.01 0.00 0.00 54.79 52.84 3ids n ASP 76 Cb 0.27 -0.14 -0.15 0.00 -1.03 0.00 0.00 41.12 40.07 3ids n ASP 76 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3ids s THR 77 N -0.83 0.27 0.13 2.12 2.01 -0.85 -1.88 115.64 116.61 3ids s THR 77 Ca 0.06 -0.06 -0.05 0.00 0.31 0.00 0.00 61.69 61.96 3ids s THR 77 Cb 0.06 -0.29 -0.05 0.00 0.01 0.00 0.00 72.50 72.22 3ids s THR 77 CO 0.01 0.12 0.37 -0.76 -0.69 0.00 0.00 174.62 173.67 3ids s LEU 78 N 0.47 4.28 -0.07 4.42 1.43 0.08 -1.44 118.68 127.85 3ids s LEU 78 Ca -0.05 0.59 -0.00 0.00 -1.03 0.00 0.00 54.13 53.64 3ids s LEU 78 Cb -0.08 -3.26 0.02 0.00 0.03 0.00 0.00 46.19 42.91 3ids s LEU 78 CO -0.01 0.07 -0.04 -0.69 0.23 0.00 0.00 176.35 175.91 3ids s VAL 79 N -1.63 0.65 -0.07 -1.59 1.01 0.81 -0.62 120.40 118.97 3ids s VAL 79 Ca 0.40 -0.11 -0.00 0.00 0.00 0.00 0.00 61.98 62.27 3ids s VAL 79 Cb -0.12 -0.71 0.03 0.00 0.00 0.00 0.00 36.38 35.57 3ids s VAL 79 CO 0.24 0.28 -0.03 -0.69 0.00 0.00 0.00 175.10 174.91 3ids s VAL 80 N 1.45 0.53 -1.60 2.92 1.01 -0.76 -1.59 120.40 122.36 3ids s VAL 80 Ca -0.02 -0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.80 3ids s VAL 80 Cb -0.13 -0.62 0.11 0.00 0.00 0.00 0.00 36.38 35.74 3ids s VAL 80 CO -0.03 0.27 0.76 0.59 0.00 0.00 0.00 175.10 176.69 3ids n ASN 81 N 4.75 -3.06 0.00 3.32 3.02 -1.26 -1.04 115.26 120.99 3ids n ASN 81 Ca -0.14 -0.95 0.00 0.00 -0.03 0.00 0.00 54.58 53.46 3ids n ASN 81 Cb 0.50 -3.09 0.00 0.00 -0.61 0.00 0.00 39.78 36.58 3ids n ASN 81 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ids n GLY 82 N -1.58 2.44 3.71 7.41 0.00 -1.26 -5.00 105.19 110.92 3ids n GLY 82 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 3ids n GLY 82 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3ids s HIS 83 N -2.58 3.55 -0.13 1.61 5.04 -0.20 -5.04 115.29 117.54 3ids s HIS 83 Ca 0.00 1.22 -0.14 0.00 -1.54 0.00 0.00 55.06 54.60 3ids s HIS 83 Cb 0.00 -2.81 -0.05 0.00 0.04 0.00 0.00 32.58 29.76 3ids s HIS 83 CO 0.00 0.05 0.33 1.03 -2.34 0.00 0.00 174.74 173.81 3ids s ARG 84 N 0.96 4.19 -0.15 2.88 0.52 -1.26 -1.82 118.95 124.27 3ids s ARG 84 Ca 0.37 0.18 0.01 0.00 -0.52 0.00 0.00 55.73 55.76 3ids s ARG 84 Cb -0.17 -3.39 0.02 0.00 0.52 0.00 0.00 34.95 31.93 3ids s ARG 84 CO 0.17 0.31 -0.15 0.42 0.02 0.00 0.00 175.30 176.07 3ids s ILE 85 N 0.23 1.62 0.21 1.52 1.09 0.21 -4.77 121.20 121.32 3ids s ILE 85 Ca 0.19 -0.67 -0.30 0.00 -1.10 0.00 0.00 60.65 58.77 3ids s ILE 85 Cb -0.14 -1.51 -0.08 0.00 -1.06 0.00 0.00 42.46 39.67 3ids s ILE 85 CO 0.06 0.47 1.02 -0.22 -0.10 0.00 0.00 174.94 176.17 3ids s LEU 86 N 1.38 4.56 -0.44 2.97 2.96 -0.88 -0.74 118.68 128.49 3ids s LEU 86 Ca 0.03 2.03 -0.17 0.00 -0.22 0.00 0.00 54.13 55.80 3ids s LEU 86 Cb -0.13 -3.61 0.04 0.00 0.50 0.00 0.00 46.19 42.99 3ids s LEU 86 CO -0.09 -0.04 0.45 0.00 -1.32 0.00 0.00 176.35 175.34 3ids s VAL 88 N 2.11 4.81 0.18 0.00 1.01 0.41 -4.87 120.40 124.06 3ids s VAL 88 Ca 0.11 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 3ids s VAL 88 Cb -0.19 -3.21 -0.09 0.00 0.00 0.00 0.00 36.38 32.89 3ids s VAL 88 CO 0.12 0.33 1.34 -0.75 0.00 0.00 0.00 175.10 176.14 3ids s LYS 89 N -1.82 4.36 0.55 2.72 2.47 -1.26 -1.95 119.74 124.81 3ids s LYS 89 Ca 0.24 2.09 -0.21 0.00 -1.56 0.00 0.00 55.97 56.52 3ids s LYS 89 Cb -0.12 -3.20 -0.05 0.00 -1.46 0.00 0.00 37.83 33.00 3ids s LYS 89 CO 0.15 -0.31 1.31 0.00 0.16 0.00 0.00 175.35 176.66 3ids n ALA 90 N 2.90 1.39 -2.46 3.13 0.00 -0.21 -4.68 120.51 120.57 3ids n ALA 90 Ca 0.07 0.12 -0.30 0.00 0.00 0.00 0.00 53.44 53.33 3ids n ALA 90 Cb 0.42 -2.32 -0.12 0.00 0.00 0.00 0.00 19.45 17.43 3ids n ALA 90 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3ids s GLN 91 N -2.86 1.83 0.22 0.00 -1.52 -1.26 -4.93 119.66 111.14 3ids s GLN 91 Ca 0.72 -1.13 -0.08 0.00 -1.95 0.00 0.00 55.36 52.92 3ids s GLN 91 Cb -0.42 -2.11 0.28 0.00 -0.22 0.00 0.00 33.01 30.54 3ids s GLN 91 CO 0.49 0.50 1.80 -0.09 -0.25 0.00 0.00 175.29 177.74 3ids h ARG 92 N 4.04 0.66 -5.24 2.91 2.43 -1.99 -3.41 114.38 113.78 3ids h ARG 92 Ca -0.49 -0.04 -0.65 0.00 -0.81 0.00 0.00 59.98 57.99 3ids h ARG 92 Cb 1.16 -0.15 -0.25 0.00 -0.42 0.00 0.00 29.97 30.31 3ids h ARG 92 CO 0.46 0.43 -0.72 -0.80 -1.51 0.00 0.00 179.97 177.83 3ids s ASN 93 N -5.57 4.33 0.52 -3.80 0.01 -1.26 -5.00 114.94 104.16 3ids s ASN 93 Ca -0.13 -0.28 0.23 0.00 -0.71 0.00 0.00 52.86 51.97 3ids s ASN 93 Cb 0.17 -1.70 1.33 0.00 0.41 0.00 0.00 41.25 41.47 3ids s ASN 93 CO 0.76 0.12 2.01 -0.65 -1.51 0.00 0.00 177.10 177.83 3ids h PRO 94 N 7.02 0.06 -0.22 -0.60 0.11 -1.86 -0.43 132.00 136.08 3ids h PRO 94 Ca -0.31 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.86 3ids h PRO 94 Cb 1.19 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3ids h PRO 94 CO 0.59 0.04 0.24 0.00 -0.21 0.00 0.00 178.00 178.66 3ids h ALA 95 N 1.75 1.86 -0.02 -0.75 0.00 -1.84 -2.10 119.26 118.17 3ids h ALA 95 Ca 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3ids h ALA 95 Cb 0.86 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3ids h ALA 95 CO -0.02 -0.35 -0.03 -0.25 0.00 0.00 0.00 179.25 178.61 3ids n ASP 96 N -3.80 1.86 -4.78 0.00 8.00 -0.17 -3.47 116.55 114.19 3ids n ASP 96 Ca 0.03 -1.59 -0.37 0.00 0.71 0.00 0.00 54.79 53.57 3ids n ASP 96 Cb 0.37 0.02 -0.05 0.00 -0.02 0.00 0.00 41.12 41.44 3ids n ASP 96 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ids s LEU 97 N -2.04 4.22 -0.21 0.64 2.01 -0.79 -4.94 118.68 117.57 3ids s LEU 97 Ca 0.34 2.02 -0.01 0.00 0.01 0.00 0.00 54.13 56.49 3ids s LEU 97 Cb 0.21 -4.09 0.12 0.00 0.01 0.00 0.00 46.19 42.44 3ids s LEU 97 CO 0.34 -0.36 2.10 -0.81 1.01 0.00 0.00 176.35 178.63 3ids n PRO 98 N 0.19 1.58 -0.16 1.29 -0.04 -1.26 -4.57 135.00 132.03 3ids n PRO 98 Ca 0.04 -1.09 -0.05 0.00 -0.04 0.00 0.00 63.50 62.37 3ids n PRO 98 Cb 0.49 -1.46 0.14 0.00 -0.04 0.00 0.00 33.50 32.64 3ids n PRO 98 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3ids h TRP 99 N 1.45 0.94 -0.24 0.54 -0.00 -1.86 -1.50 115.95 115.28 3ids h TRP 99 Ca 0.20 -0.11 0.01 0.00 -0.00 0.00 0.00 58.89 58.99 3ids h TRP 99 Cb 0.95 -0.27 -0.02 0.00 -0.00 0.00 0.00 29.16 29.83 3ids h TRP 99 CO 0.69 0.81 0.13 0.78 -0.00 0.00 0.00 178.44 180.84 3ids h GLY 100 N 1.00 0.32 1.92 1.49 0.00 -1.46 -1.00 103.07 105.35 3ids h GLY 100 Ca 0.18 -0.09 -0.10 0.00 0.00 0.00 0.00 47.33 47.32 3ids h GLY 100 CO 0.01 0.08 -0.43 0.50 0.00 0.00 0.00 176.54 176.70 3ids h LYS 101 N 0.27 0.09 -0.00 4.80 1.79 -1.75 -2.67 116.57 119.10 3ids h LYS 101 Ca 0.10 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 3ids h LYS 101 Cb 0.01 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 3ids h LYS 101 CO -0.06 0.51 -0.27 1.28 -1.08 0.00 0.00 179.45 179.83 3ids n LEU 102 N -4.02 0.30 -0.36 2.94 4.32 -0.60 -4.94 117.00 114.64 3ids n LEU 102 Ca -0.02 0.20 -0.05 0.00 -0.02 0.00 0.00 56.01 56.13 3ids n LEU 102 Cb 0.47 -0.34 -0.02 0.00 -1.62 0.00 0.00 43.42 41.90 3ids n LEU 102 CO 0.40 0.07 -0.04 0.61 -1.22 0.00 0.00 177.39 177.21 3ids n GLY 103 N 1.48 0.70 3.70 -0.72 0.00 -0.46 -4.99 105.19 104.90 3ids n GLY 103 Ca 0.07 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 3ids n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ids s VAL 104 N -1.98 3.14 -0.24 1.61 1.01 -0.71 -4.76 120.40 118.48 3ids s VAL 104 Ca 0.00 0.70 0.03 0.00 0.00 0.00 0.00 61.98 62.72 3ids s VAL 104 Cb 0.00 -3.45 -0.17 0.00 0.00 0.00 0.00 36.38 32.76 3ids s VAL 104 CO 0.00 0.02 -0.18 1.21 0.00 0.00 0.00 175.10 176.15 3ids n GLU 105 N 4.83 0.64 -4.57 2.72 2.13 -0.24 -4.12 120.64 122.03 3ids n GLU 105 Ca 0.14 0.12 -0.33 0.00 0.66 0.00 0.00 57.16 57.75 3ids n GLU 105 Cb 0.41 -1.48 -0.14 0.00 0.27 0.00 0.00 31.44 30.49 3ids n GLU 105 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 3ids s TYR 106 N -2.48 2.85 -0.19 4.31 1.51 -0.59 -0.90 117.35 121.85 3ids s TYR 106 Ca -0.30 -0.73 -0.04 0.00 -1.01 0.00 0.00 57.07 54.99 3ids s TYR 106 Cb 0.08 -1.90 -0.02 0.00 -0.11 0.00 0.00 41.96 40.01 3ids s TYR 106 CO 0.58 -0.29 -0.02 0.08 -1.11 0.00 0.00 175.55 174.79 3ids s VAL 107 N 0.60 3.79 -0.46 0.71 1.01 -0.16 -1.01 120.40 124.88 3ids s VAL 107 Ca -0.07 -0.37 -0.21 0.00 0.00 0.00 0.00 61.98 61.34 3ids s VAL 107 Cb -0.15 -2.70 0.03 0.00 0.00 0.00 0.00 36.38 33.56 3ids s VAL 107 CO 0.03 0.44 0.66 -0.63 0.00 0.00 0.00 175.10 175.60 3ids s ILE 108 N 0.94 4.81 -0.64 2.22 1.01 0.23 -1.06 121.20 128.70 3ids s ILE 108 Ca 0.01 -0.03 -0.22 0.00 0.00 0.00 0.00 60.65 60.41 3ids s ILE 108 Cb -0.14 -4.25 0.08 0.00 0.01 0.00 0.00 42.46 38.15 3ids s ILE 108 CO 0.01 -0.69 0.89 -0.70 0.00 0.00 0.00 174.94 174.46 3ids s GLU 109 N 2.85 3.09 0.00 2.79 2.56 0.59 -0.93 118.70 129.65 3ids s GLU 109 Ca 0.21 -0.97 0.01 0.00 0.00 0.00 0.00 54.97 54.22 3ids s GLU 109 Cb -0.15 -4.24 0.02 0.00 2.00 0.00 0.00 34.13 31.76 3ids s GLU 109 CO 0.17 -1.74 0.94 -1.13 -0.56 0.00 0.00 175.26 172.94 3ids n SER 110 N 7.33 1.92 0.20 -1.70 3.41 0.03 -1.83 113.62 122.98 3ids n SER 110 Ca -0.05 -1.85 0.07 0.00 -0.26 0.00 0.00 58.87 56.78 3ids n SER 110 Cb 0.45 -0.02 0.38 0.00 -0.26 0.00 0.00 64.21 64.76 3ids n SER 110 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3ids h THR 111 N 0.16 0.75 0.00 6.66 1.35 -1.85 -3.43 112.91 116.54 3ids h THR 111 Ca 0.00 -1.37 0.00 0.00 -0.55 0.00 0.00 66.41 64.49 3ids h THR 111 Cb 0.44 1.87 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 3ids h THR 111 CO 0.00 0.31 0.00 0.61 -0.25 0.00 0.00 175.52 176.19 3ids n GLY 112 N 0.22 0.88 0.06 5.82 0.00 -1.26 -4.88 105.19 106.02 3ids n GLY 112 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 3ids n GLY 112 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ids n LEU 113 N 0.00 0.47 -2.46 0.99 4.77 -1.26 -4.47 117.00 115.03 3ids n LEU 113 Ca 0.00 0.13 -0.20 0.00 -0.03 0.00 0.00 56.01 55.91 3ids n LEU 113 Cb 0.00 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.07 3ids n LEU 113 CO 0.00 -0.07 0.10 0.49 -1.33 0.00 0.00 177.39 176.58 3ids n PHE 114 N -2.39 2.57 0.83 -1.77 3.72 -1.26 -4.81 117.46 114.35 3ids n PHE 114 Ca -0.01 -2.77 0.13 0.00 -0.05 0.00 0.00 57.45 54.75 3ids n PHE 114 Cb 0.54 -0.21 0.49 0.00 -0.94 0.00 0.00 39.48 39.35 3ids n PHE 114 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3ids n THR 115 N -0.44 0.26 -2.54 4.37 -2.24 -1.26 -3.78 114.28 108.64 3ids n THR 115 Ca 0.30 -0.13 -0.42 0.00 -2.27 0.00 0.00 64.05 61.53 3ids n THR 115 Cb 0.77 -0.47 -0.03 0.00 -2.10 0.00 0.00 70.33 68.50 3ids n THR 115 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ids s ALA 116 N -3.05 3.31 0.21 6.98 0.00 -1.26 -1.56 121.76 126.39 3ids s ALA 116 Ca 0.12 0.73 -0.14 0.00 0.00 0.00 0.00 51.96 52.68 3ids s ALA 116 Cb 0.16 -3.39 0.24 0.00 0.00 0.00 0.00 23.12 20.14 3ids s ALA 116 CO 0.58 -0.31 1.62 -0.22 0.00 0.00 0.00 175.76 177.43 3ids h LYS 117 N 6.42 -0.02 -0.15 0.00 3.64 -1.25 -0.74 116.57 124.47 3ids h LYS 117 Ca -0.42 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 58.89 3ids h LYS 117 Cb 1.22 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 3ids h LYS 117 CO 0.77 -0.01 -0.22 0.00 -2.27 0.00 0.00 179.45 177.72 3ids h ALA 118 N 1.59 1.36 -0.10 5.00 0.00 -1.87 0.13 119.26 125.37 3ids h ALA 118 Ca 0.31 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3ids h ALA 118 Cb 0.50 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 3ids h ALA 118 CO -0.69 0.44 -0.06 0.00 0.00 0.00 0.00 179.25 178.94 3ids h ALA 119 N 1.54 0.15 -0.03 0.00 0.00 -1.60 -3.23 119.26 116.09 3ids h ALA 119 Ca 0.04 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 3ids h ALA 119 Cb 0.52 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3ids h ALA 119 CO 0.04 -0.06 -0.20 0.00 0.00 0.00 0.00 179.25 179.02 3ids h ALA 120 N 0.62 1.61 0.00 0.00 0.00 -0.76 -2.32 119.26 118.41 3ids h ALA 120 Ca 0.02 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3ids h ALA 120 Cb 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3ids h ALA 120 CO 0.02 0.29 0.07 0.93 0.00 0.00 0.00 179.25 180.56 3ids h GLU 121 N 0.05 0.00 -0.46 0.00 5.08 -0.77 -2.05 114.58 116.42 3ids h GLU 121 Ca 0.01 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.41 3ids h GLU 121 Cb 0.39 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 3ids h GLU 121 CO 0.03 0.00 0.31 0.78 -1.00 0.00 0.00 179.01 179.13 3ids h GLY 122 N 0.00 0.55 1.11 -3.84 0.00 -1.53 -1.17 103.07 98.19 3ids h GLY 122 Ca 0.00 -0.19 0.09 0.00 0.00 0.00 0.00 47.33 47.24 3ids h GLY 122 CO 0.00 0.16 0.37 0.45 0.00 0.00 0.00 176.54 177.52 3ids h HIS 123 N 0.47 0.38 -0.55 5.60 3.86 -1.54 -0.87 115.15 122.50 3ids h HIS 123 Ca 0.19 0.01 -0.07 0.00 -1.16 0.00 0.00 60.37 59.34 3ids h HIS 123 Cb 0.18 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.50 3ids h HIS 123 CO -0.00 0.18 0.04 -0.07 0.86 0.00 0.00 177.93 178.95 3ids h LEU 124 N 0.36 0.87 -0.35 2.43 4.07 -1.38 -1.74 115.31 119.56 3ids h LEU 124 Ca 0.25 -0.21 -0.18 0.00 0.08 0.00 0.00 57.88 57.83 3ids h LEU 124 Cb 0.53 -0.23 -0.00 0.00 1.08 0.00 0.00 40.66 42.04 3ids h LEU 124 CO -0.06 0.90 -0.53 -0.09 -1.08 0.00 0.00 178.44 177.58 3ids h ARG 125 N 0.85 0.83 -0.03 1.13 9.65 -1.29 -2.68 114.38 122.83 3ids h ARG 125 Ca 0.17 -0.51 0.01 0.00 -1.10 0.00 0.00 59.98 58.54 3ids h ARG 125 Cb 0.44 0.06 -0.00 0.00 -1.39 0.00 0.00 29.97 29.08 3ids h ARG 125 CO 0.02 1.15 0.17 0.78 2.80 0.00 0.00 179.97 184.88 3ids h GLY 126 N 0.77 0.00 0.00 2.80 0.00 -0.59 -3.45 103.07 102.60 3ids h GLY 126 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 3ids h GLY 126 CO 0.12 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.27 3ids n GLY 127 N -1.20 1.25 3.76 4.60 0.00 -0.72 -1.50 105.19 111.38 3ids n GLY 127 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 3ids n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ids s ALA 128 N -1.23 2.28 -0.16 4.61 0.00 -0.80 -4.34 121.76 122.13 3ids s ALA 128 Ca 0.00 0.35 0.17 0.00 0.00 0.00 0.00 51.96 52.49 3ids s ALA 128 Cb 0.00 -3.29 -0.24 0.00 0.00 0.00 0.00 23.12 19.58 3ids s ALA 128 CO 0.00 -1.68 0.13 0.54 0.00 0.00 0.00 175.76 174.74 3ids n ARG 129 N -3.27 0.90 -3.88 0.00 1.74 -0.08 -4.25 116.66 107.82 3ids n ARG 129 Ca 0.10 -0.04 -0.11 0.00 -0.77 0.00 0.00 57.85 57.02 3ids n ARG 129 Cb 0.53 -1.48 -0.11 0.00 -1.02 0.00 0.00 32.46 30.38 3ids n ARG 129 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3ids s LYS 130 N -2.61 0.32 -0.06 5.56 -0.14 -0.79 -4.84 119.74 117.18 3ids s LYS 130 Ca -0.09 -0.23 0.02 0.00 -1.36 0.00 0.00 55.97 54.31 3ids s LYS 130 Cb 0.07 0.13 0.02 0.00 -1.68 0.00 0.00 37.83 36.37 3ids s LYS 130 CO 0.78 -0.07 -0.08 0.08 -0.76 0.00 0.00 175.35 175.30 3ids s VAL 131 N -0.86 0.84 -0.32 3.17 1.01 0.36 -0.99 120.40 123.61 3ids s VAL 131 Ca -0.10 -0.30 -0.07 0.00 0.00 0.00 0.00 61.98 61.52 3ids s VAL 131 Cb -0.06 -0.80 0.02 0.00 0.00 0.00 0.00 36.38 35.54 3ids s VAL 131 CO 0.01 0.29 0.10 -0.69 0.00 0.00 0.00 175.10 174.81 3ids s VAL 132 N 0.82 3.99 -0.24 2.92 1.01 -0.22 -1.11 120.40 127.58 3ids s VAL 132 Ca -0.12 -0.82 -0.26 0.00 0.00 0.00 0.00 61.98 60.77 3ids s VAL 132 Cb -0.15 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.10 3ids s VAL 132 CO 0.02 -0.02 0.91 -0.63 0.00 0.00 0.00 175.10 175.37 3ids s ILE 133 N 1.48 4.78 -0.23 2.22 1.01 0.54 -0.30 121.20 130.69 3ids s ILE 133 Ca 0.01 1.75 -0.05 0.00 0.00 0.00 0.00 60.65 62.37 3ids s ILE 133 Cb -0.18 -4.19 -0.08 0.00 0.01 0.00 0.00 42.46 38.01 3ids s ILE 133 CO 0.03 -0.11 3.11 -1.54 0.00 0.00 0.00 174.94 176.42 3ids n SER 134 N 6.11 5.88 -3.60 3.58 3.41 -0.76 -2.02 113.62 126.22 3ids n SER 134 Ca 0.08 -2.85 -0.04 0.00 -0.26 0.00 0.00 58.87 55.80 3ids n SER 134 Cb 0.47 -1.31 -0.02 0.00 -0.26 0.00 0.00 64.21 63.10 3ids n SER 134 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ids s ALA 135 N -0.44 -1.95 0.44 7.33 0.00 -1.23 -4.97 121.76 120.94 3ids s ALA 135 Ca 0.60 0.95 -0.24 0.00 0.00 0.00 0.00 51.96 53.27 3ids s ALA 135 Cb 0.34 0.29 -0.09 0.00 0.00 0.00 0.00 23.12 23.65 3ids s ALA 135 CO -0.11 -0.80 1.20 -2.30 0.00 0.00 0.00 175.76 173.75 3ids n PRO 136 N -0.29 1.71 -4.35 0.00 -0.02 -1.23 -4.09 135.00 126.73 3ids n PRO 136 Ca -0.05 0.61 -0.24 0.00 -2.02 0.00 0.00 63.50 61.80 3ids n PRO 136 Cb 0.61 -2.31 -0.09 0.00 -0.02 0.00 0.00 33.50 31.69 3ids n PRO 136 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3ids s ALA 137 N -1.24 3.13 0.37 3.55 0.00 -1.26 -4.89 121.76 121.41 3ids s ALA 137 Ca 0.63 -1.90 0.05 0.00 0.00 0.00 0.00 51.96 50.75 3ids s ALA 137 Cb -0.50 -0.42 -0.07 0.00 0.00 0.00 0.00 23.12 22.12 3ids s ALA 137 CO 0.56 0.13 0.03 -1.54 0.00 0.00 0.00 175.76 174.95 3ids s SER 138 N -3.68 3.13 0.00 0.00 1.04 -0.60 -4.85 113.70 108.74 3ids s SER 138 Ca 0.33 -1.37 0.00 0.00 0.48 0.00 0.00 55.95 55.39 3ids s SER 138 Cb -0.02 -0.24 0.00 0.00 0.10 0.00 0.00 66.02 65.86 3ids s SER 138 CO 0.19 -0.53 0.00 0.61 0.98 0.00 0.00 173.24 174.49 3ids n GLY 139 N -0.83 0.46 0.58 7.32 0.00 -1.26 -0.82 105.19 110.64 3ids n GLY 139 Ca -0.04 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3ids n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ids n GLY 140 N -2.94 0.84 3.72 -0.02 0.00 -1.26 -4.67 105.19 100.86 3ids n GLY 140 Ca 0.00 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 3ids n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ids s ALA 141 N -2.00 3.68 0.21 4.61 0.00 -1.26 -4.94 121.76 122.06 3ids s ALA 141 Ca 0.00 1.28 -0.31 0.00 0.00 0.00 0.00 51.96 52.92 3ids s ALA 141 Cb 0.00 -3.58 -0.11 0.00 0.00 0.00 0.00 23.12 19.43 3ids s ALA 141 CO 0.00 -0.71 1.65 0.21 0.00 0.00 0.00 175.76 176.91 3ids s LYS 142 N 0.77 4.16 -0.18 0.00 2.47 -1.25 -4.66 119.74 121.05 3ids s LYS 142 Ca 0.66 2.52 -0.08 0.00 -1.56 0.00 0.00 55.97 57.50 3ids s LYS 142 Cb -0.41 -3.09 -0.04 0.00 -1.46 0.00 0.00 37.83 32.82 3ids s LYS 142 CO 0.34 -0.68 0.08 0.99 0.16 0.00 0.00 175.35 176.24 3ids s THR 143 N 0.96 4.95 -0.08 3.43 2.01 -1.26 -0.68 115.64 124.97 3ids s THR 143 Ca 0.71 0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.75 3ids s THR 143 Cb -0.47 -3.23 0.02 0.00 0.01 0.00 0.00 72.50 68.82 3ids s THR 143 CO 0.34 0.47 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.88 3ids s LEU 144 N 0.28 1.44 -0.20 4.42 1.43 0.32 -4.81 118.68 121.56 3ids s LEU 144 Ca 0.05 -0.27 -0.00 0.00 -1.03 0.00 0.00 54.13 52.87 3ids s LEU 144 Cb -0.12 -0.78 0.02 0.00 0.03 0.00 0.00 46.19 45.34 3ids s LEU 144 CO -0.00 -0.03 -0.14 -0.69 0.23 0.00 0.00 176.35 175.71 3ids s VAL 145 N 1.06 2.44 0.21 -1.59 1.01 -1.26 -4.30 120.40 117.97 3ids s VAL 145 Ca -0.07 -0.92 -0.31 0.00 0.00 0.00 0.00 61.98 60.67 3ids s VAL 145 Cb -0.14 -2.11 -0.11 0.00 0.00 0.00 0.00 36.38 34.01 3ids s VAL 145 CO -0.01 0.42 1.59 -0.04 0.00 0.00 0.00 175.10 177.06 3ids s MET 146 N 1.32 4.19 0.00 2.72 1.00 -1.26 -1.66 119.30 125.61 3ids s MET 146 Ca 0.03 2.45 0.00 0.00 0.00 0.00 0.00 55.69 58.17 3ids s MET 146 Cb -0.14 -3.11 0.00 0.00 0.00 0.00 0.00 34.83 31.58 3ids s MET 146 CO -0.09 -0.61 0.00 0.41 0.00 0.00 0.00 175.02 174.72 3ids n GLY 147 N 3.27 1.59 0.71 -0.03 0.00 -1.26 -4.83 105.19 104.65 3ids n GLY 147 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.12 3ids n GLY 147 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3ids n VAL 148 N -2.00 0.98 -1.54 1.61 0.31 -0.66 -4.91 118.33 112.12 3ids n VAL 148 Ca 0.00 0.28 0.02 0.00 -0.01 0.00 0.00 64.34 64.63 3ids n VAL 148 Cb 0.00 -1.66 0.03 0.00 -0.91 0.00 0.00 33.84 31.30 3ids n VAL 148 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3ids n ASN 149 N -3.47 0.68 0.27 4.52 6.94 -0.78 -4.89 115.26 118.53 3ids n ASN 149 Ca -0.03 -2.13 0.13 0.00 -0.02 0.00 0.00 54.58 52.52 3ids n ASN 149 Cb 0.13 -0.22 0.77 0.00 -2.36 0.00 0.00 39.78 38.10 3ids n ASN 149 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 3ids h HIS 150 N 0.00 0.00 0.00 -2.53 2.07 -1.91 -1.19 115.15 111.59 3ids h HIS 150 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3ids h HIS 150 Cb 1.20 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.18 3ids h HIS 150 CO 0.06 0.09 0.00 0.72 -3.07 0.00 0.00 177.93 175.73 3ids n HIS 151 N -3.73 0.00 1.04 6.12 8.25 -1.26 -1.52 115.22 124.12 3ids n HIS 151 Ca -0.02 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.57 3ids n HIS 151 Cb 0.19 -0.13 0.55 0.00 1.12 0.00 0.00 29.99 31.73 3ids n HIS 151 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 3ids n GLU 152 N -1.13 0.06 -1.68 -0.41 1.02 -0.45 -4.86 120.64 113.18 3ids n GLU 152 Ca 0.07 -0.01 -0.45 0.00 -0.02 0.00 0.00 57.16 56.76 3ids n GLU 152 Cb 0.06 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 29.95 3ids n GLU 152 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 3ids n TYR 153 N -1.46 2.46 -3.99 -0.32 9.36 -0.58 -4.97 117.16 117.65 3ids n TYR 153 Ca 0.07 0.04 -0.31 0.00 3.32 0.00 0.00 57.90 61.02 3ids n TYR 153 Cb 0.33 -2.65 -0.15 0.00 -0.63 0.00 0.00 39.34 36.24 3ids n TYR 153 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3ids s ASN 154 N 2.25 4.48 0.37 2.98 3.84 -1.26 -5.03 114.94 122.57 3ids s ASN 154 Ca 0.82 -1.76 0.15 0.00 0.21 0.00 0.00 52.86 52.28 3ids s ASN 154 Cb -0.59 -1.47 1.01 0.00 -0.55 0.00 0.00 41.25 39.65 3ids s ASN 154 CO 0.40 -0.31 1.76 -0.65 -2.79 0.00 0.00 177.10 175.50 3ids h PRO 155 N 7.75 0.46 0.00 0.43 0.11 -1.90 0.72 132.00 139.58 3ids h PRO 155 Ca -0.11 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.97 3ids h PRO 155 Cb 1.03 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.04 3ids h PRO 155 CO 0.48 0.31 -0.01 0.66 -0.21 0.00 0.00 178.00 179.23 3ids h SER 156 N 0.48 0.00 0.00 -2.05 4.64 -1.97 -3.37 113.55 111.27 3ids h SER 156 Ca 0.61 -0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.74 3ids h SER 156 Cb 1.38 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.43 3ids h SER 156 CO -0.36 0.00 -1.74 1.21 -0.87 0.00 0.00 176.83 175.06 3ids n GLU 157 N -2.70 0.77 -3.50 4.77 4.07 -0.33 -4.95 120.64 118.77 3ids n GLU 157 Ca 0.05 0.06 -0.42 0.00 -0.06 0.00 0.00 57.16 56.78 3ids n GLU 157 Cb 0.48 -1.26 -0.09 0.00 -0.06 0.00 0.00 31.44 30.51 3ids n GLU 157 CO 0.00 0.00 0.00 -1.01 -0.06 0.00 0.00 177.13 176.06 3ids s HIS 158 N -2.26 3.27 -0.06 4.31 3.76 0.10 -4.88 115.29 119.53 3ids s HIS 158 Ca -0.15 -1.08 0.07 0.00 -0.15 0.00 0.00 55.06 53.75 3ids s HIS 158 Cb 0.04 -2.90 -0.10 0.00 1.11 0.00 0.00 32.58 30.74 3ids s HIS 158 CO 0.33 -0.76 0.05 0.72 -0.85 0.00 0.00 174.74 174.23 3ids n HIS 159 N 5.07 0.00 -4.06 1.40 8.25 -1.26 -4.76 115.22 119.86 3ids n HIS 159 Ca -0.11 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.03 3ids n HIS 159 Cb 0.44 -0.33 -0.16 0.00 1.12 0.00 0.00 29.99 31.06 3ids n HIS 159 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3ids s VAL 160 N -2.24 1.93 0.23 1.59 1.01 -1.26 -0.48 120.40 121.18 3ids s VAL 160 Ca -0.04 -1.18 0.07 0.00 0.00 0.00 0.00 61.98 60.84 3ids s VAL 160 Cb 0.03 -1.93 -0.05 0.00 0.00 0.00 0.00 36.38 34.42 3ids s VAL 160 CO 0.31 0.22 -0.11 0.68 0.00 0.00 0.00 175.10 176.19 3ids s VAL 161 N 1.27 1.70 -0.05 2.92 -7.23 -0.27 -3.78 120.40 114.97 3ids s VAL 161 Ca -0.02 -2.19 0.04 0.00 -1.81 0.00 0.00 61.98 58.01 3ids s VAL 161 Cb -0.16 -2.18 -0.02 0.00 0.56 0.00 0.00 36.38 34.57 3ids s VAL 161 CO -0.09 -0.49 -0.17 -0.55 -0.31 0.00 0.00 175.10 173.49 3ids s SER 162 N -3.36 3.81 -0.04 4.85 0.15 0.14 -0.34 113.70 118.91 3ids s SER 162 Ca 0.25 -0.26 0.12 0.00 0.70 0.00 0.00 55.95 56.76 3ids s SER 162 Cb 0.01 -0.76 0.42 0.00 -1.71 0.00 0.00 66.02 63.98 3ids s SER 162 CO 0.09 0.33 1.30 -3.20 1.20 0.00 0.00 173.24 172.96 3ids n ASN 163 N 2.37 2.78 0.00 5.45 5.15 -0.86 -0.52 115.26 129.64 3ids n ASN 163 Ca -0.17 -2.16 0.00 0.00 -0.60 0.00 0.00 54.58 51.65 3ids n ASN 163 Cb 0.52 -0.39 0.00 0.00 -0.53 0.00 0.00 39.78 39.38 3ids n ASN 163 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3ids n ALA 164 N 0.67 0.00 -2.57 5.20 0.00 -1.26 -4.81 120.51 117.75 3ids n ALA 164 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.37 3ids n ALA 164 Cb 0.50 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.89 3ids n ALA 164 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3ids s SER 165 N -4.00 4.89 0.30 0.00 1.04 -1.26 -3.49 113.70 111.17 3ids s SER 165 Ca 0.00 -0.63 -0.00 0.00 0.48 0.00 0.00 55.95 55.80 3ids s SER 165 Cb 0.00 -0.88 0.51 0.00 0.10 0.00 0.00 66.02 65.75 3ids s SER 165 CO 0.00 -0.23 1.93 0.00 0.98 0.00 0.00 173.24 175.92 3ids h THR 167 N 1.05 1.27 -0.90 0.00 2.02 -1.95 -2.01 112.91 112.40 3ids h THR 167 Ca 0.36 -0.97 0.03 0.00 0.77 0.00 0.00 66.41 66.61 3ids h THR 167 Cb 0.11 1.42 -0.05 0.00 -1.74 0.00 0.00 68.15 67.89 3ids h THR 167 CO -0.12 0.30 0.59 0.74 0.37 0.00 0.00 175.52 177.40 3ids h THR 168 N 0.20 1.17 0.00 3.16 2.02 -1.74 -0.27 112.91 117.44 3ids h THR 168 Ca 0.06 -0.39 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 3ids h THR 168 Cb 0.46 -0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 66.79 3ids h THR 168 CO 0.02 0.21 -0.12 0.78 0.37 0.00 0.00 175.52 176.78 3ids h ASN 169 N 1.15 0.00 0.06 4.18 2.35 -0.97 0.91 115.58 123.26 3ids h ASN 169 Ca 0.35 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 56.01 3ids h ASN 169 Cb -0.02 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.36 3ids h ASN 169 CO -0.10 0.12 -0.40 0.00 -1.65 0.00 0.00 177.43 175.40 3ids h LEU 171 N -0.61 0.32 -0.81 0.00 5.85 -0.94 -3.36 115.31 115.75 3ids h LEU 171 Ca -0.07 -0.64 0.08 0.00 0.84 0.00 0.00 57.88 58.09 3ids h LEU 171 Cb 1.27 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 42.14 3ids h LEU 171 CO 0.08 0.90 0.48 0.00 -0.34 0.00 0.00 178.44 179.55 3ids h ALA 172 N 0.42 1.13 -0.73 1.25 0.00 -1.03 -1.52 119.26 118.79 3ids h ALA 172 Ca -0.01 0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.96 3ids h ALA 172 Cb 0.88 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 3ids h ALA 172 CO 0.05 0.16 0.48 -1.35 0.00 0.00 0.00 179.25 178.59 3ids h PRO 173 N 0.85 0.80 0.12 0.00 0.11 -1.75 0.29 132.00 132.41 3ids h PRO 173 Ca 0.37 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.43 3ids h PRO 173 Cb 0.26 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.19 3ids h PRO 173 CO -0.21 0.53 -0.06 0.82 -0.21 0.00 0.00 178.00 178.87 3ids h ILE 174 N 0.82 1.02 -0.71 4.15 1.08 -1.44 -2.21 117.51 120.21 3ids h ILE 174 Ca 0.31 -0.58 -0.04 0.00 -0.39 0.00 0.00 64.86 64.16 3ids h ILE 174 Cb 0.18 1.38 -0.03 0.00 -3.07 0.00 0.00 36.82 35.27 3ids h ILE 174 CO -0.10 0.14 0.29 0.58 -0.69 0.00 0.00 178.15 178.37 3ids h VAL 175 N -0.44 1.24 -0.32 1.67 2.07 -1.11 -2.00 116.25 117.37 3ids h VAL 175 Ca -0.02 -0.76 0.05 0.00 0.82 0.00 0.00 66.70 66.80 3ids h VAL 175 Cb 0.35 0.39 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 3ids h VAL 175 CO 0.03 0.31 0.01 -0.74 0.02 0.00 0.00 177.57 177.20 3ids h HIS 176 N 1.03 0.01 -0.70 1.57 -0.00 -0.38 -0.67 115.15 116.01 3ids h HIS 176 Ca 0.24 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.59 3ids h HIS 176 Cb 0.19 0.05 -0.03 0.00 -0.00 0.00 0.00 27.41 27.62 3ids h HIS 176 CO 0.02 -0.04 0.25 0.28 -0.00 0.00 0.00 177.93 178.44 3ids h VAL 177 N 0.11 1.25 -0.87 5.26 2.07 -1.11 0.16 116.25 123.11 3ids h VAL 177 Ca 0.15 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.85 3ids h VAL 177 Cb 0.20 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 3ids h VAL 177 CO -0.25 0.32 0.52 -0.07 0.02 0.00 0.00 177.57 178.12 3ids h LEU 178 N 1.01 1.05 0.00 2.57 3.38 -0.86 -1.37 115.31 121.10 3ids h LEU 178 Ca 0.23 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 3ids h LEU 178 Cb 0.25 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3ids h LEU 178 CO -0.01 0.81 -0.01 0.58 0.09 0.00 0.00 178.44 179.90 3ids h VAL 179 N 1.21 1.72 -0.64 1.22 2.07 -0.87 -0.92 116.25 120.03 3ids h VAL 179 Ca 0.31 -2.13 0.02 0.00 0.82 0.00 0.00 66.70 65.73 3ids h VAL 179 Cb -0.04 3.17 -0.03 0.00 -1.52 0.00 0.00 31.29 32.86 3ids h VAL 179 CO -0.06 0.55 0.42 0.50 0.02 0.00 0.00 177.57 179.01 3ids h LYS 180 N -0.90 0.79 -0.30 1.57 3.64 -0.71 -2.13 116.57 118.53 3ids h LYS 180 Ca -0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3ids h LYS 180 Cb 0.91 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 3ids h LYS 180 CO 0.00 0.52 0.00 0.39 -2.27 0.00 0.00 179.45 178.09 3ids n GLU 181 N -4.45 1.91 -0.74 1.90 -0.58 -0.52 -4.94 120.64 113.22 3ids n GLU 181 Ca 0.07 -1.40 0.00 0.00 -0.42 0.00 0.00 57.16 55.42 3ids n GLU 181 Cb 0.09 -1.38 0.00 0.00 -0.57 0.00 0.00 31.44 29.58 3ids n GLU 181 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ids n GLY 182 N 1.19 0.61 0.16 0.62 0.00 -0.80 -4.92 105.19 102.04 3ids n GLY 182 Ca 0.16 -0.13 -0.19 0.00 0.00 0.00 0.00 46.02 45.85 3ids n GLY 182 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3ids h PHE 183 N 0.00 0.77 -0.78 1.61 0.04 -1.44 -3.46 116.94 113.68 3ids h PHE 183 Ca 0.00 -0.44 0.07 0.00 2.80 0.00 0.00 57.97 60.40 3ids h PHE 183 Cb 0.00 -0.08 -0.04 0.00 2.20 0.00 0.00 35.95 38.03 3ids h PHE 183 CO 0.00 1.28 -0.28 0.41 -0.60 0.00 0.00 178.31 179.12 3ids n GLY 184 N 1.19 -2.81 2.94 -1.45 0.00 -0.54 -1.20 105.19 103.31 3ids n GLY 184 Ca -0.11 -1.35 -0.29 0.00 0.00 0.00 0.00 46.02 44.27 3ids n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ids s VAL 185 N -3.34 1.28 -0.13 1.61 1.01 -1.26 -3.07 120.40 116.50 3ids s VAL 185 Ca 0.00 -0.61 -0.26 0.00 0.00 0.00 0.00 61.98 61.11 3ids s VAL 185 Cb 0.00 -1.34 -0.23 0.00 0.00 0.00 0.00 36.38 34.81 3ids s VAL 185 CO 0.00 0.26 0.70 -0.61 0.00 0.00 0.00 175.10 175.44 3ids h GLN 186 N 8.09 -0.00 -2.89 2.72 4.15 -0.19 -3.46 115.11 123.54 3ids h GLN 186 Ca -0.29 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.01 3ids h GLN 186 Cb 1.12 0.00 -0.22 0.00 0.21 0.00 0.00 27.48 28.59 3ids h GLN 186 CO 0.44 0.87 -0.25 0.99 -1.93 0.00 0.00 178.83 178.95 3ids s THR 187 N -2.20 0.03 -0.06 2.39 2.01 -1.22 -4.83 115.64 111.77 3ids s THR 187 Ca -0.17 -0.25 -0.11 0.00 0.31 0.00 0.00 61.69 61.48 3ids s THR 187 Cb -0.03 -0.60 0.02 0.00 0.01 0.00 0.00 72.50 71.90 3ids s THR 187 CO 0.61 -0.14 0.26 -0.83 -0.69 0.00 0.00 174.62 173.83 3ids s GLY 188 N -0.68 -0.14 -0.07 4.40 0.00 0.40 -0.52 107.32 110.70 3ids s GLY 188 Ca -0.08 0.46 0.03 0.00 0.00 0.00 0.00 44.72 45.12 3ids s GLY 188 CO 0.03 0.31 -0.15 1.08 0.00 0.00 0.00 173.10 174.37 3ids s LEU 189 N -0.60 1.75 -0.07 0.66 1.43 0.15 -2.65 118.68 119.35 3ids s LEU 189 Ca -0.07 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.67 3ids s LEU 189 Cb -0.04 -0.97 -0.03 0.00 0.03 0.00 0.00 46.19 45.18 3ids s LEU 189 CO 0.02 0.06 -0.06 0.00 0.23 0.00 0.00 176.35 176.61 3ids s MET 190 N 0.59 2.82 -0.11 1.70 0.23 -0.12 -0.70 119.30 123.72 3ids s MET 190 Ca -0.16 -0.52 0.03 0.00 -1.03 0.00 0.00 55.69 54.01 3ids s MET 190 Cb -0.16 -2.64 0.01 0.00 -1.53 0.00 0.00 34.83 30.51 3ids s MET 190 CO 0.05 0.66 -0.21 0.99 -2.03 0.00 0.00 175.02 174.47 3ids s THR 191 N -0.78 1.91 -0.17 3.16 2.01 -0.29 -1.21 115.64 120.26 3ids s THR 191 Ca 0.12 -0.92 -0.06 0.00 0.31 0.00 0.00 61.69 61.15 3ids s THR 191 Cb -0.11 -1.67 -0.04 0.00 0.01 0.00 0.00 72.50 70.69 3ids s THR 191 CO 0.02 0.52 0.02 0.28 -0.69 0.00 0.00 174.62 174.77 3ids s THR 192 N 0.58 4.42 -0.39 -0.82 -1.32 -0.42 -0.44 115.64 117.23 3ids s THR 192 Ca -0.14 -0.17 -0.17 0.00 -1.21 0.00 0.00 61.69 60.00 3ids s THR 192 Cb -0.17 -2.97 0.01 0.00 -1.51 0.00 0.00 72.50 67.87 3ids s THR 192 CO 0.04 0.48 0.46 -0.63 -2.21 0.00 0.00 174.62 172.76 3ids s ILE 193 N 0.33 5.06 -0.06 5.08 1.09 -0.59 -0.46 121.20 131.65 3ids s ILE 193 Ca 0.00 -0.09 0.04 0.00 -1.10 0.00 0.00 60.65 59.51 3ids s ILE 193 Cb -0.13 -4.01 -0.00 0.00 -1.06 0.00 0.00 42.46 37.26 3ids s ILE 193 CO 0.01 -0.34 -0.19 -2.28 -0.10 0.00 0.00 174.94 172.03 3ids s HIS 194 N 2.25 1.98 0.63 3.97 2.46 -0.04 -1.34 115.29 125.20 3ids s HIS 194 Ca 0.15 -0.64 -0.19 0.00 0.47 0.00 0.00 55.06 54.85 3ids s HIS 194 Cb -0.16 -1.33 -0.02 0.00 -0.13 0.00 0.00 32.58 30.94 3ids s HIS 194 CO 0.14 -0.23 1.31 0.43 -2.47 0.00 0.00 174.74 173.92 3ids n SER 195 N 3.24 2.20 -4.71 9.88 7.64 -1.25 -0.37 113.62 130.24 3ids n SER 195 Ca -0.19 0.85 -0.30 0.00 1.01 0.00 0.00 58.87 60.24 3ids n SER 195 Cb 0.53 -1.56 0.13 0.00 -1.01 0.00 0.00 64.21 62.29 3ids n SER 195 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 3ids s TYR 196 N -1.37 2.22 0.35 1.43 -0.85 -0.73 -4.71 117.35 113.70 3ids s TYR 196 Ca 0.81 1.47 0.06 0.00 -0.52 0.00 0.00 57.07 58.90 3ids s TYR 196 Cb -0.39 -3.15 -0.02 0.00 0.38 0.00 0.00 41.96 38.78 3ids s TYR 196 CO 0.41 -2.34 0.23 0.25 -1.52 0.00 0.00 175.55 172.59 3ids n THR 197 N -3.88 0.00 0.24 -3.49 -2.24 -1.26 -4.68 114.28 98.97 3ids n THR 197 Ca 0.08 -2.37 0.07 0.00 -2.27 0.00 0.00 64.05 59.56 3ids n THR 197 Cb 0.54 1.08 0.57 0.00 -2.10 0.00 0.00 70.33 70.41 3ids n THR 197 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ids h ALA 198 N 1.92 1.77 0.00 6.98 0.00 -1.97 -2.14 119.26 125.82 3ids h ALA 198 Ca -0.26 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3ids h ALA 198 Cb 1.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3ids h ALA 198 CO 0.39 0.15 0.00 1.79 0.00 0.00 0.00 179.25 181.57 3ids h THR 199 N 0.00 0.00 -4.11 0.00 1.35 -1.99 -3.45 112.91 104.71 3ids h THR 199 Ca -0.00 -0.37 -0.46 0.00 -0.55 0.00 0.00 66.41 65.03 3ids h THR 199 Cb 0.21 1.31 0.12 0.00 -1.73 0.00 0.00 68.15 68.06 3ids h THR 199 CO 0.02 0.00 0.37 -1.10 -0.25 0.00 0.00 175.52 174.56 3ids s GLN 200 N -3.68 1.43 -0.02 4.72 -0.21 -0.81 -4.99 119.66 116.10 3ids s GLN 200 Ca 0.01 -0.23 0.05 0.00 0.02 0.00 0.00 55.36 55.20 3ids s GLN 200 Cb 0.10 -1.96 -0.03 0.00 1.00 0.00 0.00 33.01 32.12 3ids s GLN 200 CO 0.49 -1.88 -0.15 0.15 -2.12 0.00 0.00 175.29 171.78 3ids s LYS 201 N -5.64 2.38 0.08 2.91 -0.14 -1.26 -4.99 119.74 113.09 3ids s LYS 201 Ca 0.67 -0.78 -0.20 0.00 -1.36 0.00 0.00 55.97 54.29 3ids s LYS 201 Cb -0.08 -2.32 -0.10 0.00 -1.68 0.00 0.00 37.83 33.66 3ids s LYS 201 CO 0.50 0.60 1.60 1.79 -0.76 0.00 0.00 175.35 179.08 3ids h THR 202 N 4.21 1.18 -2.10 2.17 1.35 -1.92 0.19 112.91 117.98 3ids h THR 202 Ca -0.47 -0.55 -0.59 0.00 -0.55 0.00 0.00 66.41 64.25 3ids h THR 202 Cb 1.15 1.21 -0.14 0.00 -1.73 0.00 0.00 68.15 68.64 3ids h THR 202 CO 0.50 0.17 -0.67 0.68 -0.25 0.00 0.00 175.52 175.95 3ids s VAL 203 N -5.44 2.07 -0.09 6.82 -7.23 -1.26 -3.92 120.40 111.36 3ids s VAL 203 Ca -0.14 -2.17 -0.34 0.00 -1.81 0.00 0.00 61.98 57.52 3ids s VAL 203 Cb 0.07 -2.63 -0.12 0.00 0.56 0.00 0.00 36.38 34.26 3ids s VAL 203 CO 0.71 -0.21 1.86 0.47 -0.31 0.00 0.00 175.10 177.62 3ids n ASP 204 N -0.75 3.37 -3.68 4.85 8.00 -1.26 -4.33 116.55 122.76 3ids n ASP 204 Ca -0.05 0.98 -0.16 0.00 0.71 0.00 0.00 54.79 56.28 3ids n ASP 204 Cb 0.64 -1.36 -0.08 0.00 -0.02 0.00 0.00 41.12 40.30 3ids n ASP 204 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3ids s GLY 205 N 3.87 1.80 0.10 0.44 0.00 -0.18 -4.95 107.32 108.39 3ids s GLY 205 Ca 0.92 -1.80 -0.31 0.00 0.00 0.00 0.00 44.72 43.54 3ids s GLY 205 CO 0.52 -1.33 1.42 0.14 0.00 0.00 0.00 173.10 173.85 3ids s VAL 206 N -3.67 3.28 -0.46 1.40 1.01 -1.26 -4.59 120.40 116.11 3ids s VAL 206 Ca 0.38 0.89 0.05 0.00 0.00 0.00 0.00 61.98 63.30 3ids s VAL 206 Cb 0.03 -3.57 0.18 0.00 0.00 0.00 0.00 36.38 33.02 3ids s VAL 206 CO 0.20 0.05 0.53 -0.55 0.00 0.00 0.00 175.10 175.33 3ids s SER 207 N 1.30 -0.01 0.45 3.32 0.15 -1.26 -4.92 113.70 112.73 3ids s SER 207 Ca 0.66 -2.26 0.17 0.00 0.70 0.00 0.00 55.95 55.21 3ids s SER 207 Cb -0.37 0.79 1.04 0.00 -1.71 0.00 0.00 66.02 65.77 3ids s SER 207 CO 0.30 -0.12 1.97 0.58 1.20 0.00 0.00 173.24 177.17 3ids h VAL 208 N 4.85 1.04 -0.11 4.45 2.07 -1.96 -1.69 116.25 124.90 3ids h VAL 208 Ca 0.15 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.93 3ids h VAL 208 Cb 1.02 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 3ids h VAL 208 CO 0.18 0.20 0.00 0.29 0.02 0.00 0.00 177.57 178.26 3ids n LYS 209 N -4.14 2.20 -2.94 1.57 5.02 -1.26 -4.65 118.16 113.96 3ids n LYS 209 Ca -0.02 -1.76 -0.02 0.00 -2.02 0.00 0.00 58.31 54.49 3ids n LYS 209 Cb 0.28 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 3ids n LYS 209 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3ids s ASP 210 N -1.87 -1.42 0.10 4.39 2.15 -0.65 -5.05 116.67 114.33 3ids s ASP 210 Ca 0.32 -1.27 -0.25 0.00 0.43 0.00 0.00 52.55 51.79 3ids s ASP 210 Cb 0.21 1.84 -0.11 0.00 -0.30 0.00 0.00 42.92 44.55 3ids s ASP 210 CO 0.31 -0.10 1.69 -0.50 -0.17 0.00 0.00 175.17 176.40 3ids h TRP 211 N 5.79 -0.32 -0.80 -5.34 4.06 -1.80 -2.04 115.95 115.50 3ids h TRP 211 Ca 0.05 0.00 0.09 0.00 2.06 0.00 0.00 58.89 61.09 3ids h TRP 211 Cb 1.14 0.13 -0.07 0.00 -1.00 0.00 0.00 29.16 29.36 3ids h TRP 211 CO 0.11 -0.19 0.45 0.00 -3.56 0.00 0.00 178.44 175.25 3ids h ARG 212 N -0.26 0.74 0.00 0.49 3.08 -1.89 -1.71 114.38 114.83 3ids h ARG 212 Ca 0.01 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3ids h ARG 212 Cb 0.26 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.15 3ids h ARG 212 CO -0.06 0.49 0.00 0.41 -1.07 0.00 0.00 179.97 179.75 3ids n GLY 213 N -1.31 -0.57 0.03 0.04 0.00 -0.79 -1.65 105.19 100.93 3ids n GLY 213 Ca 0.13 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.25 3ids n GLY 213 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ids n GLY 214 N -0.99 -1.41 3.84 -0.02 0.00 -0.64 -4.17 105.19 101.80 3ids n GLY 214 Ca 0.01 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 3ids n GLY 214 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ids s ARG 215 N -3.06 3.99 -0.24 1.61 1.81 -0.66 -1.01 118.95 121.38 3ids s ARG 215 Ca 0.10 0.94 -0.37 0.00 -1.72 0.00 0.00 55.73 54.68 3ids s ARG 215 Cb 0.16 -2.17 -0.14 0.00 -0.45 0.00 0.00 34.95 32.35 3ids s ARG 215 CO 0.66 -0.20 1.88 0.00 -0.68 0.00 0.00 175.30 176.96 3ids n ALA 216 N -1.37 0.39 -0.07 2.13 0.00 -1.26 -4.43 120.51 115.90 3ids n ALA 216 Ca 0.06 0.26 -0.15 0.00 0.00 0.00 0.00 53.44 53.62 3ids n ALA 216 Cb 0.54 -2.37 -0.05 0.00 0.00 0.00 0.00 19.45 17.57 3ids n ALA 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ids h ALA 217 N 8.89 0.40 -0.22 0.00 0.00 -0.73 -3.22 119.26 124.39 3ids h ALA 217 Ca -0.43 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 53.99 3ids h ALA 217 Cb 1.31 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3ids h ALA 217 CO 0.97 0.59 0.00 0.00 0.00 0.00 0.00 179.25 180.81 3ids n ALA 218 N -2.55 2.48 -0.59 0.00 0.00 -1.26 -3.64 120.51 114.95 3ids n ALA 218 Ca -0.05 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.93 3ids n ALA 218 Cb 0.60 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 19.02 3ids n ALA 218 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3ids n VAL 219 N 0.21 0.38 -4.28 0.00 0.24 -1.23 -4.74 118.33 108.91 3ids n VAL 219 Ca 0.11 -0.40 -0.20 0.00 -2.04 0.00 0.00 64.34 61.82 3ids n VAL 219 Cb 0.24 0.85 -0.13 0.00 -1.47 0.00 0.00 33.84 33.34 3ids n VAL 219 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 3ids s ASN 220 N -0.38 1.77 -0.23 -1.34 0.01 -1.22 -5.07 114.94 108.48 3ids s ASN 220 Ca 0.00 -0.54 -0.19 0.00 -0.71 0.00 0.00 52.86 51.41 3ids s ASN 220 Cb 0.00 -0.09 -0.03 0.00 0.41 0.00 0.00 41.25 41.55 3ids s ASN 220 CO 0.00 -0.01 0.57 -0.63 -1.51 0.00 0.00 177.10 175.53 3ids s ILE 221 N -1.05 5.05 -0.30 0.60 1.01 -1.26 -4.17 121.20 121.08 3ids s ILE 221 Ca 0.01 1.04 0.02 0.00 0.00 0.00 0.00 60.65 61.72 3ids s ILE 221 Cb -0.09 -3.89 0.08 0.00 0.01 0.00 0.00 42.46 38.58 3ids s ILE 221 CO 0.02 0.10 0.00 -0.63 0.00 0.00 0.00 174.94 174.43 3ids s ILE 222 N 2.08 1.90 0.62 2.92 1.01 -0.19 -4.95 121.20 124.60 3ids s ILE 222 Ca 0.25 -1.83 -0.18 0.00 0.00 0.00 0.00 60.65 58.90 3ids s ILE 222 Cb -0.16 -2.27 -0.02 0.00 0.01 0.00 0.00 42.46 40.02 3ids s ILE 222 CO 0.09 -0.38 1.19 -2.84 0.00 0.00 0.00 174.94 173.00 3ids s PRO 223 N 1.15 2.84 -0.06 2.79 0.02 -1.26 -0.55 135.00 139.93 3ids s PRO 223 Ca 0.03 1.74 -0.14 0.00 0.02 0.00 0.00 61.00 62.65 3ids s PRO 223 Cb -0.19 -1.92 0.03 0.00 0.02 0.00 0.00 34.50 32.44 3ids s PRO 223 CO -0.09 -1.29 0.32 0.45 -0.33 0.00 0.00 177.00 176.07 3ids s SER 224 N -1.81 -0.26 0.77 2.53 0.15 0.56 -4.73 113.70 110.92 3ids s SER 224 Ca 0.75 0.32 -0.11 0.00 0.70 0.00 0.00 55.95 57.61 3ids s SER 224 Cb -0.28 0.46 0.05 0.00 -1.71 0.00 0.00 66.02 64.54 3ids s SER 224 CO 0.36 -0.32 1.10 0.42 1.20 0.00 0.00 173.24 175.99 3ids s THR 225 N -0.76 3.16 0.02 6.45 -4.23 -1.26 -0.57 115.64 118.44 3ids s THR 225 Ca -0.08 0.41 -0.12 0.00 -1.18 0.00 0.00 61.69 60.71 3ids s THR 225 Cb -0.04 -2.86 0.01 0.00 1.34 0.00 0.00 72.50 70.96 3ids s THR 225 CO 0.03 -0.46 0.26 0.28 -0.54 0.00 0.00 174.62 174.19 3ids s THR 226 N -2.75 0.08 -1.87 3.99 -1.32 -1.25 -4.66 115.64 107.85 3ids s THR 226 Ca 0.63 -0.66 0.25 0.00 -1.21 0.00 0.00 61.69 60.70 3ids s THR 226 Cb -0.19 -0.75 0.20 0.00 -1.51 0.00 0.00 72.50 70.25 3ids s THR 226 CO 0.53 -0.36 1.43 0.61 -2.21 0.00 0.00 174.62 174.62 3ids n GLY 227 N 0.96 -0.39 0.34 6.08 0.00 -1.26 -4.61 105.19 106.31 3ids n GLY 227 Ca -0.20 -0.48 -0.02 0.00 0.00 0.00 0.00 46.02 45.32 3ids n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ids h ALA 228 N 3.77 1.16 -0.07 4.61 0.00 -1.96 0.46 119.26 127.22 3ids h ALA 228 Ca 0.00 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.65 3ids h ALA 228 Cb 0.58 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 18.04 3ids h ALA 228 CO 0.00 0.51 -0.75 0.00 0.00 0.00 0.00 179.25 179.01 3ids h ALA 229 N 1.34 0.19 -0.73 0.00 0.00 -1.89 -2.97 119.26 115.21 3ids h ALA 229 Ca 0.34 -0.60 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3ids h ALA 229 Cb -0.10 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 3ids h ALA 229 CO -0.09 0.55 0.42 0.87 0.00 0.00 0.00 179.25 181.00 3ids h LYS 230 N 0.28 1.00 0.00 0.00 1.57 -1.57 -2.37 116.57 115.49 3ids h LYS 230 Ca -0.07 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.59 3ids h LYS 230 Cb 1.40 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 33.50 3ids h LYS 230 CO 0.15 0.72 -0.11 0.00 -0.57 0.00 0.00 179.45 179.64 3ids h ALA 231 N 1.45 1.22 -0.18 3.86 0.00 -0.82 -1.72 119.26 123.07 3ids h ALA 231 Ca 0.26 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.12 3ids h ALA 231 Cb -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3ids h ALA 231 CO -0.05 0.13 0.13 0.28 0.00 0.00 0.00 179.25 179.74 3ids h VAL 232 N 0.00 0.94 -0.26 0.00 2.07 -1.26 -0.02 116.25 117.72 3ids h VAL 232 Ca -0.00 -0.02 0.08 0.00 0.82 0.00 0.00 66.70 67.58 3ids h VAL 232 Cb 0.35 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 3ids h VAL 232 CO 0.01 0.01 0.30 1.23 0.02 0.00 0.00 177.57 179.14 3ids h GLY 233 N 0.06 0.00 1.47 2.17 0.00 -1.44 0.16 103.07 105.48 3ids h GLY 233 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 3ids h GLY 233 CO -0.01 0.00 -0.48 -0.33 0.00 0.00 0.00 176.54 175.72 3ids h MET 234 N 0.00 0.00 0.00 4.80 2.86 -1.16 -3.10 114.93 118.33 3ids h MET 234 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 3ids h MET 234 Cb 0.72 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.38 3ids h MET 234 CO -0.00 0.00 -1.41 1.33 1.06 0.00 0.00 176.91 177.89 3ids n VAL 235 N -2.62 0.00 -3.53 -2.22 0.24 -0.72 -4.70 118.33 104.79 3ids n VAL 235 Ca 0.03 -0.27 -0.27 0.00 -2.04 0.00 0.00 64.34 61.78 3ids n VAL 235 Cb 0.50 0.34 -0.10 0.00 -1.47 0.00 0.00 33.84 33.12 3ids n VAL 235 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 3ids n ILE 236 N -1.83 0.28 0.09 1.34 5.41 0.49 -4.72 119.36 120.41 3ids n ILE 236 Ca -0.02 -4.23 0.20 0.00 1.00 0.00 0.00 62.75 59.71 3ids n ILE 236 Cb 0.30 -1.94 0.70 0.00 -0.71 0.00 0.00 39.64 38.00 3ids n ILE 236 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 3ids h PRO 237 N 5.08 0.00 0.00 0.38 0.11 -1.77 -0.38 132.00 135.42 3ids h PRO 237 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 3ids h PRO 237 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 3ids h PRO 237 CO 0.56 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.01 3ids h SER 238 N 0.00 0.00 0.07 -2.05 4.64 -1.94 -2.29 113.55 111.98 3ids h SER 238 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3ids h SER 238 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3ids h SER 238 CO -0.00 0.00 -0.17 0.35 -0.87 0.00 0.00 176.83 176.14 3ids n THR 239 N -2.43 0.00 -1.68 2.95 -2.24 -0.15 -4.93 114.28 105.80 3ids n THR 239 Ca 0.02 -0.25 -0.55 0.00 -2.27 0.00 0.00 64.05 61.00 3ids n THR 239 Cb 0.26 0.77 -0.06 0.00 -2.10 0.00 0.00 70.33 69.19 3ids n THR 239 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 3ids n GLN 240 N 0.07 1.31 -0.66 -0.78 -0.06 -0.86 -0.86 117.38 115.54 3ids n GLN 240 Ca 0.14 0.48 0.00 0.00 -2.00 0.00 0.00 57.00 55.62 3ids n GLN 240 Cb 0.42 -2.17 0.00 0.00 -4.06 0.00 0.00 30.24 24.42 3ids n GLN 240 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3ids n GLY 241 N 3.79 1.51 0.32 1.69 0.00 -1.26 -4.86 105.19 106.39 3ids n GLY 241 Ca 0.24 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.36 3ids n GLY 241 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ids n LYS 242 N -2.00 0.82 -4.25 1.61 5.02 -0.04 -4.95 118.16 114.38 3ids n LYS 242 Ca 0.00 -0.65 -0.19 0.00 -2.02 0.00 0.00 58.31 55.44 3ids n LYS 242 Cb 0.00 -1.48 -0.16 0.00 -0.02 0.00 0.00 35.03 33.37 3ids n LYS 242 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3ids s LEU 243 N -2.65 1.61 0.00 -0.35 1.02 -1.25 -0.46 118.68 116.60 3ids s LEU 243 Ca 0.15 -0.14 0.00 0.00 0.02 0.00 0.00 54.13 54.15 3ids s LEU 243 Cb 0.17 -0.46 -0.00 0.00 0.02 0.00 0.00 46.19 45.92 3ids s LEU 243 CO 0.67 0.01 0.23 1.07 0.02 0.00 0.00 176.35 178.35 3ids n THR 244 N 3.60 0.00 -3.98 5.49 5.66 -1.08 -3.72 114.28 120.25 3ids n THR 244 Ca -0.21 -1.02 0.04 0.00 -3.05 0.00 0.00 64.05 59.81 3ids n THR 244 Cb 0.53 0.59 0.01 0.00 -1.55 0.00 0.00 70.33 69.91 3ids n THR 244 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 3ids s GLY 245 N -2.17 -0.24 0.29 1.09 0.00 -1.26 -0.94 107.32 104.09 3ids s GLY 245 Ca 0.17 0.23 -0.07 0.00 0.00 0.00 0.00 44.72 45.05 3ids s GLY 245 CO 0.12 6.10 0.44 -3.16 0.00 0.00 0.00 173.10 176.59 3ids s MET 246 N -2.01 1.68 0.06 2.90 0.23 -0.35 -3.80 119.30 118.01 3ids s MET 246 Ca 0.30 -1.54 0.05 0.00 -1.03 0.00 0.00 55.69 53.48 3ids s MET 246 Cb 0.01 0.44 -0.03 0.00 -1.53 0.00 0.00 34.83 33.72 3ids s MET 246 CO -0.03 -0.69 -0.14 0.45 -2.03 0.00 0.00 175.02 172.59 3ids s SER 247 N -3.14 1.59 -0.26 -1.18 0.15 0.26 -1.30 113.70 109.82 3ids s SER 247 Ca 0.28 -0.54 0.00 0.00 0.70 0.00 0.00 55.95 56.39 3ids s SER 247 Cb 0.00 -0.06 0.05 0.00 -1.71 0.00 0.00 66.02 64.30 3ids s SER 247 CO 0.15 -0.04 -0.07 -0.36 1.20 0.00 0.00 173.24 174.11 3ids s PHE 248 N -1.11 3.19 -0.14 3.44 0.08 0.39 -0.32 117.98 123.51 3ids s PHE 248 Ca -0.01 -1.97 -0.29 0.00 0.12 0.00 0.00 56.93 54.78 3ids s PHE 248 Cb -0.09 -2.01 -0.01 0.00 -0.57 0.00 0.00 43.02 40.34 3ids s PHE 248 CO 0.02 -0.82 1.04 1.03 -0.10 0.00 0.00 175.22 176.39 3ids s ARG 249 N 1.21 4.37 0.24 0.44 1.81 0.29 -0.86 118.95 126.44 3ids s ARG 249 Ca -0.05 1.41 0.09 0.00 -1.72 0.00 0.00 55.73 55.46 3ids s ARG 249 Cb -0.19 -3.57 -0.05 0.00 -0.45 0.00 0.00 34.95 30.69 3ids s ARG 249 CO -0.04 -0.42 -0.15 0.14 -0.68 0.00 0.00 175.30 174.15 3ids s VAL 250 N 2.38 1.97 -0.70 3.52 -7.23 0.50 -1.02 120.40 119.81 3ids s VAL 250 Ca 0.48 -2.26 -0.05 0.00 -1.81 0.00 0.00 61.98 58.33 3ids s VAL 250 Cb -0.18 -2.18 -0.09 0.00 0.56 0.00 0.00 36.38 34.50 3ids s VAL 250 CO 0.15 -0.50 2.27 -2.65 -0.31 0.00 0.00 175.10 174.06 3ids n PRO 251 N -0.48 1.96 -5.00 4.82 -0.02 -1.26 -2.57 135.00 132.46 3ids n PRO 251 Ca -0.07 -1.27 -0.27 0.00 -2.02 0.00 0.00 63.50 59.88 3ids n PRO 251 Cb 0.61 -2.29 -0.16 0.00 -0.02 0.00 0.00 33.50 31.64 3ids n PRO 251 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3ids s THR 252 N 2.82 1.62 -0.29 3.45 -4.23 -1.26 -5.01 115.64 112.74 3ids s THR 252 Ca 0.42 -0.89 0.27 0.00 -1.18 0.00 0.00 61.69 60.31 3ids s THR 252 Cb 0.14 -1.35 0.35 0.00 1.34 0.00 0.00 72.50 72.97 3ids s THR 252 CO -0.03 0.45 1.75 1.55 -0.54 0.00 0.00 174.62 177.80 3ids h PRO 253 N 5.60 0.00 -2.27 3.99 0.13 -1.86 -1.94 132.00 135.66 3ids h PRO 253 Ca -0.39 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.78 3ids h PRO 253 Cb 1.14 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.10 3ids h PRO 253 CO 0.48 0.00 0.38 0.34 -0.23 0.00 0.00 178.00 178.96 3ids s ASP 254 N -5.81 -0.47 0.00 1.44 2.15 -1.26 -4.73 116.67 107.99 3ids s ASP 254 Ca 0.05 0.21 0.00 0.00 0.43 0.00 0.00 52.55 53.24 3ids s ASP 254 Cb 0.07 0.45 0.00 0.00 -0.30 0.00 0.00 42.92 43.14 3ids s ASP 254 CO 0.61 -0.65 0.00 0.52 -0.17 0.00 0.00 175.17 175.48 3ids n VAL 255 N 0.12 -0.72 -4.14 1.11 0.31 -1.26 -4.89 118.33 108.86 3ids n VAL 255 Ca -0.13 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.10 3ids n VAL 255 Cb 0.61 -0.68 -0.10 0.00 -0.91 0.00 0.00 33.84 32.76 3ids n VAL 255 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3ids s SER 256 N -0.76 0.27 -0.01 4.52 0.01 -0.22 -3.79 113.70 113.72 3ids s SER 256 Ca 0.00 -1.20 -0.00 0.00 1.31 0.00 0.00 55.95 56.06 3ids s SER 256 Cb 0.00 0.32 0.01 0.00 0.21 0.00 0.00 66.02 66.56 3ids s SER 256 CO 0.00 -0.76 0.02 0.54 0.41 0.00 0.00 173.24 173.45 3ids s VAL 257 N -4.05 -0.02 -0.12 3.43 0.11 -0.45 -1.07 120.40 118.23 3ids s VAL 257 Ca 0.25 0.07 -0.18 0.00 -2.93 0.00 0.00 61.98 59.19 3ids s VAL 257 Cb 0.07 -0.04 -0.04 0.00 -1.53 0.00 0.00 36.38 34.83 3ids s VAL 257 CO 0.03 0.03 0.46 -0.69 -3.33 0.00 0.00 175.10 171.60 3ids s VAL 258 N 0.35 5.19 -0.45 2.04 1.01 0.14 -1.54 120.40 127.14 3ids s VAL 258 Ca -0.03 0.92 0.02 0.00 0.00 0.00 0.00 61.98 62.89 3ids s VAL 258 Cb -0.04 -3.80 0.12 0.00 0.00 0.00 0.00 36.38 32.66 3ids s VAL 258 CO -0.01 0.34 0.20 -0.62 0.00 0.00 0.00 175.10 175.01 3ids s ASP 259 N 0.54 4.78 -0.24 3.32 2.15 0.41 -0.92 116.67 126.71 3ids s ASP 259 Ca 0.25 -2.52 -0.14 0.00 0.43 0.00 0.00 52.55 50.57 3ids s ASP 259 Cb -0.15 -1.70 -0.04 0.00 -0.30 0.00 0.00 42.92 40.73 3ids s ASP 259 CO 0.10 -0.36 0.34 -0.22 -0.17 0.00 0.00 175.17 174.86 3ids s LEU 260 N 0.41 4.10 -0.15 -1.34 2.96 0.33 -1.14 118.68 123.85 3ids s LEU 260 Ca 0.13 0.34 -0.02 0.00 -0.22 0.00 0.00 54.13 54.36 3ids s LEU 260 Cb -0.22 -2.39 -0.02 0.00 0.50 0.00 0.00 46.19 44.06 3ids s LEU 260 CO -0.04 -0.09 -0.09 -0.89 -1.32 0.00 0.00 176.35 173.92 3ids s THR 261 N 1.56 3.35 0.13 3.68 2.01 0.13 -0.34 115.64 126.16 3ids s THR 261 Ca 0.15 -0.55 -0.12 0.00 0.31 0.00 0.00 61.69 61.49 3ids s THR 261 Cb -0.15 -2.44 0.01 0.00 0.01 0.00 0.00 72.50 69.93 3ids s THR 261 CO 0.08 0.50 0.30 0.72 -0.69 0.00 0.00 174.62 175.54 3ids s PHE 262 N 0.50 0.09 -0.22 4.92 -0.71 -0.30 0.30 117.98 122.56 3ids s PHE 262 Ca -0.07 -0.47 -0.06 0.00 -1.04 0.00 0.00 56.93 55.29 3ids s PHE 262 Cb -0.15 0.07 -0.03 0.00 -1.21 0.00 0.00 43.02 41.70 3ids s PHE 262 CO 0.04 -0.67 0.04 0.95 -1.34 0.00 0.00 175.22 174.24 3ids s THR 263 N -3.87 4.26 0.76 -4.49 -4.23 0.33 -1.33 115.64 107.07 3ids s THR 263 Ca 0.08 -0.20 -0.11 0.00 -1.18 0.00 0.00 61.69 60.28 3ids s THR 263 Cb 0.03 -2.95 0.05 0.00 1.34 0.00 0.00 72.50 70.97 3ids s THR 263 CO -0.08 0.40 1.08 0.00 -0.54 0.00 0.00 174.62 175.48 3ids s ALA 264 N 1.13 2.31 -2.22 3.99 0.00 -0.46 0.48 121.76 127.00 3ids s ALA 264 Ca 0.04 0.11 0.26 0.00 0.00 0.00 0.00 51.96 52.37 3ids s ALA 264 Cb -0.14 -3.21 0.75 0.00 0.00 0.00 0.00 23.12 20.51 3ids s ALA 264 CO 0.03 -1.65 1.57 0.00 0.00 0.00 0.00 175.76 175.70 3ids n ALA 265 N -3.42 2.85 -2.80 0.00 0.00 -0.34 -4.46 120.51 112.33 3ids n ALA 265 Ca 0.08 -0.47 -0.10 0.00 0.00 0.00 0.00 53.44 52.95 3ids n ALA 265 Cb 0.54 -1.08 -0.07 0.00 0.00 0.00 0.00 19.45 18.83 3ids n ALA 265 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3ids s ARG 266 N -2.24 0.81 0.19 0.00 1.70 -1.19 -5.00 118.95 113.22 3ids s ARG 266 Ca 0.30 -0.72 -0.31 0.00 -0.47 0.00 0.00 55.73 54.52 3ids s ARG 266 Cb 0.20 0.34 -0.10 0.00 -0.57 0.00 0.00 34.95 34.82 3ids s ARG 266 CO 0.42 -0.26 1.57 -0.51 -1.08 0.00 0.00 175.30 175.45 3ids s ASP 267 N -2.42 6.56 0.00 -2.89 1.11 -1.26 -4.79 116.67 112.98 3ids s ASP 267 Ca -0.01 2.67 0.00 0.00 0.18 0.00 0.00 52.55 55.40 3ids s ASP 267 Cb 0.01 -2.60 0.00 0.00 1.07 0.00 0.00 42.92 41.40 3ids s ASP 267 CO -0.07 -0.83 0.00 1.07 1.18 0.00 0.00 175.17 176.52 3ids n THR 268 N 3.63 0.00 -3.67 -1.27 5.66 0.09 -5.03 114.28 113.70 3ids n THR 268 Ca 0.13 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 61.02 3ids n THR 268 Cb 0.38 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.11 3ids n THR 268 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 3ids s SER 269 N 1.40 -0.22 0.50 1.09 1.04 -1.26 -4.10 113.70 112.16 3ids s SER 269 Ca 0.00 -0.24 0.18 0.00 0.48 0.00 0.00 55.95 56.37 3ids s SER 269 Cb 0.00 0.44 1.26 0.00 0.10 0.00 0.00 66.02 67.82 3ids s SER 269 CO 0.00 -0.77 2.11 -0.29 0.98 0.00 0.00 173.24 175.27 3ids h ILE 270 N 2.65 0.96 -0.25 -1.02 6.09 -1.95 -2.16 117.51 121.83 3ids h ILE 270 Ca -0.33 -0.24 -0.03 0.00 -1.37 0.00 0.00 64.86 62.88 3ids h ILE 270 Cb 1.23 1.13 -0.01 0.00 0.47 0.00 0.00 36.82 39.65 3ids h ILE 270 CO 0.46 0.07 0.03 1.56 -3.07 0.00 0.00 178.15 177.20 3ids h GLN 271 N 0.00 0.42 -0.30 2.19 7.50 -1.97 -0.22 115.11 122.73 3ids h GLN 271 Ca -0.00 -0.12 0.04 0.00 0.50 0.00 0.00 58.65 59.07 3ids h GLN 271 Cb 0.13 -0.05 -0.04 0.00 0.05 0.00 0.00 27.48 27.58 3ids h GLN 271 CO 0.01 0.56 0.09 0.93 -1.50 0.00 0.00 178.83 178.91 3ids h GLU 272 N 0.22 0.21 0.47 1.46 5.08 -1.85 -1.27 114.58 118.89 3ids h GLU 272 Ca 0.07 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 3ids h GLU 272 Cb 0.35 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 3ids h GLU 272 CO 0.01 0.14 -0.31 0.82 -1.00 0.00 0.00 179.01 178.66 3ids h ILE 273 N 0.21 0.35 -0.73 3.13 2.04 -1.27 -0.66 117.51 120.58 3ids h ILE 273 Ca 0.14 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.16 3ids h ILE 273 Cb 0.12 0.35 -0.13 0.00 -0.74 0.00 0.00 36.82 36.43 3ids h ILE 273 CO -0.16 0.00 -0.01 -0.78 0.00 0.00 0.00 178.15 177.20 3ids h ASP 274 N -0.76 -0.37 -0.62 1.72 3.58 -1.00 -0.76 116.42 118.22 3ids h ASP 274 Ca -0.05 0.19 -0.03 0.00 0.42 0.00 0.00 57.03 57.56 3ids h ASP 274 Cb 0.63 0.34 -0.03 0.00 1.72 0.00 0.00 39.33 42.00 3ids h ASP 274 CO 0.03 -0.18 0.26 0.00 -2.88 0.00 0.00 179.24 176.48 3ids h ALA 275 N 1.69 0.80 -0.26 -0.78 0.00 -0.89 -2.00 119.26 117.82 3ids h ALA 275 Ca 0.39 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 3ids h ALA 275 Cb 0.67 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3ids h ALA 275 CO -0.65 0.40 0.10 0.00 0.00 0.00 0.00 179.25 179.10 3ids h ALA 276 N 1.11 0.34 -0.46 0.00 0.00 -0.16 -0.74 119.26 119.35 3ids h ALA 276 Ca 0.21 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.04 3ids h ALA 276 Cb 0.18 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 3ids h ALA 276 CO -0.02 -0.07 0.21 -0.07 0.00 0.00 0.00 179.25 179.30 3ids h LEU 277 N 0.27 0.29 -0.36 0.00 3.38 -1.11 0.76 115.31 118.54 3ids h LEU 277 Ca 0.09 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 3ids h LEU 277 Cb 0.18 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3ids h LEU 277 CO -0.01 0.20 0.19 0.11 0.09 0.00 0.00 178.44 179.03 3ids h LYS 278 N 0.42 0.50 -0.33 1.13 1.57 -1.20 -1.65 116.57 117.01 3ids h LYS 278 Ca 0.21 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.93 3ids h LYS 278 Cb 0.14 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 3ids h LYS 278 CO -0.16 0.43 0.21 -0.09 -0.57 0.00 0.00 179.45 179.26 3ids h ARG 279 N 0.45 0.41 -0.61 3.15 2.43 -0.82 -2.59 114.38 116.80 3ids h ARG 279 Ca 0.12 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 3ids h ARG 279 Cb 0.08 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 3ids h ARG 279 CO -0.02 0.27 0.31 0.00 -1.51 0.00 0.00 179.97 179.02 3ids h ALA 280 N 1.13 0.79 -0.00 2.80 0.00 -0.72 -2.31 119.26 120.95 3ids h ALA 280 Ca 0.13 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3ids h ALA 280 Cb -0.03 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 3ids h ALA 280 CO -0.04 0.33 -0.10 0.66 0.00 0.00 0.00 179.25 180.10 3ids h SER 281 N 0.83 0.00 1.11 0.00 4.64 -1.04 0.15 113.55 119.25 3ids h SER 281 Ca 0.21 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3ids h SER 281 Cb 0.09 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 3ids h SER 281 CO -0.03 0.10 -0.37 0.29 -0.87 0.00 0.00 176.83 175.95 3ids n LYS 282 N -4.42 0.28 0.00 4.77 5.02 -0.98 -2.97 118.16 119.86 3ids n LYS 282 Ca -0.03 0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 3ids n LYS 282 Cb 0.17 -1.73 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 3ids n LYS 282 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3ids n THR 283 N -2.17 0.00 0.34 -0.18 -2.24 -0.70 -4.78 114.28 104.55 3ids n THR 283 Ca 0.04 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.97 3ids n THR 283 Cb 0.44 0.00 0.59 0.00 -2.10 0.00 0.00 70.33 69.26 3ids n THR 283 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 3ids h TYR 284 N 0.00 0.00 -0.43 4.78 -0.00 -1.76 -2.62 116.97 116.94 3ids h TYR 284 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 3ids h TYR 284 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 3ids h TYR 284 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 178.16 176.83 3ids n MET 285 N -2.69 2.44 -1.66 0.10 2.81 -0.04 -4.99 117.12 113.10 3ids n MET 285 Ca 0.01 -2.22 -0.46 0.00 -1.81 0.00 0.00 57.70 53.22 3ids n MET 285 Cb 0.27 -1.44 -0.04 0.00 -0.71 0.00 0.00 33.22 31.30 3ids n MET 285 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 3ids n LYS 286 N 1.23 1.99 0.00 0.03 4.81 -0.99 -0.60 118.16 124.63 3ids n LYS 286 Ca 0.18 0.72 0.00 0.00 -0.87 0.00 0.00 58.31 58.33 3ids n LYS 286 Cb 0.54 -2.44 0.00 0.00 0.02 0.00 0.00 35.03 33.15 3ids n LYS 286 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3ids n GLY 287 N 3.02 2.73 0.54 3.14 0.00 -1.26 -4.78 105.19 108.57 3ids n GLY 287 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 3ids n GLY 287 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3ids n ILE 288 N -2.00 1.19 -3.80 -0.61 2.08 0.23 -4.42 119.36 112.03 3ids n ILE 288 Ca 0.00 0.11 -0.36 0.00 0.56 0.00 0.00 62.75 63.06 3ids n ILE 288 Cb 0.00 -1.90 -0.11 0.00 -0.75 0.00 0.00 39.64 36.88 3ids n ILE 288 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 3ids s LEU 289 N -7.26 3.70 0.00 1.39 2.96 -0.27 -0.69 118.68 118.50 3ids s LEU 289 Ca -0.17 -0.07 0.04 0.00 -0.22 0.00 0.00 54.13 53.71 3ids s LEU 289 Cb 0.04 -1.98 0.04 0.00 0.50 0.00 0.00 46.19 44.79 3ids s LEU 289 CO 0.24 0.03 0.35 0.61 -1.32 0.00 0.00 176.35 176.26 3ids n GLY 290 N 4.49 2.87 3.30 7.98 0.00 0.45 -4.46 105.19 119.82 3ids n GLY 290 Ca -0.16 -2.31 -0.09 0.00 0.00 0.00 0.00 46.02 43.46 3ids n GLY 290 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ids s TYR 291 N -2.77 0.08 0.05 1.61 1.13 -1.26 -1.08 117.35 115.11 3ids s TYR 291 Ca 0.27 -0.45 0.05 0.00 -1.41 0.00 0.00 57.07 55.52 3ids s TYR 291 Cb -0.02 0.08 -0.02 0.00 -1.10 0.00 0.00 41.96 40.89 3ids s TYR 291 CO 0.17 -0.67 -0.13 -0.08 -2.51 0.00 0.00 175.55 172.33 3ids s THR 292 N -3.87 1.03 -0.21 -3.49 -1.32 -0.14 -4.87 115.64 102.78 3ids s THR 292 Ca 0.08 -1.13 0.13 0.00 -1.21 0.00 0.00 61.69 59.55 3ids s THR 292 Cb 0.03 -0.98 0.42 0.00 -1.51 0.00 0.00 72.50 70.46 3ids s THR 292 CO -0.08 -0.14 1.27 -0.90 -2.21 0.00 0.00 174.62 172.56 3ids n ASP 293 N 1.59 2.16 -4.92 8.08 3.85 -1.26 -1.42 116.55 124.63 3ids n ASP 293 Ca -0.20 -3.64 -0.20 0.00 -0.71 0.00 0.00 54.79 50.04 3ids n ASP 293 Cb 0.54 -0.53 -0.02 0.00 -1.35 0.00 0.00 41.12 39.77 3ids n ASP 293 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 3ids s GLU 294 N -3.14 2.62 -1.30 0.11 2.02 -1.26 -4.77 118.70 112.99 3ids s GLU 294 Ca 0.38 -1.45 -0.09 0.00 0.02 0.00 0.00 54.97 53.83 3ids s GLU 294 Cb 0.36 -2.50 0.15 0.00 0.10 0.00 0.00 34.13 32.24 3ids s GLU 294 CO -0.02 -0.23 1.94 0.39 0.02 0.00 0.00 175.26 177.35 3ids n GLU 295 N -1.66 3.62 -3.43 1.61 -0.58 -1.26 -4.82 120.64 114.12 3ids n GLU 295 Ca 0.05 -3.44 -0.30 0.00 -0.42 0.00 0.00 57.16 53.05 3ids n GLU 295 Cb 0.61 -2.93 -0.04 0.00 -0.57 0.00 0.00 31.44 28.50 3ids n GLU 295 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3ids s LEU 296 N -0.09 4.14 0.47 -4.62 1.43 -1.26 -5.10 118.68 113.63 3ids s LEU 296 Ca 0.41 0.75 0.03 0.00 -1.03 0.00 0.00 54.13 54.28 3ids s LEU 296 Cb 0.11 -3.53 -0.03 0.00 0.03 0.00 0.00 46.19 42.77 3ids s LEU 296 CO -0.01 -0.11 0.03 0.68 0.23 0.00 0.00 176.35 177.18 3ids s VAL 297 N -1.92 1.18 0.23 -1.59 -7.23 -1.26 -5.04 120.40 104.77 3ids s VAL 297 Ca 0.44 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.54 3ids s VAL 297 Cb -0.11 -2.36 0.19 0.00 0.56 0.00 0.00 36.38 34.66 3ids s VAL 297 CO 0.26 0.00 1.85 0.77 -0.31 0.00 0.00 175.10 177.67 3ids h SER 298 N 1.54 0.79 -0.60 4.85 4.64 -1.97 -1.63 113.55 121.18 3ids h SER 298 Ca -0.42 0.01 0.15 0.00 -0.47 0.00 0.00 61.79 61.06 3ids h SER 298 Cb 1.29 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 63.20 3ids h SER 298 CO 0.72 0.52 0.42 0.00 -0.87 0.00 0.00 176.83 177.61 3ids h ALA 299 N 1.37 2.38 0.00 5.18 0.00 -1.97 -1.02 119.26 125.20 3ids h ALA 299 Ca 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3ids h ALA 299 Cb 0.13 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3ids h ALA 299 CO -0.16 -0.54 0.00 -0.44 0.00 0.00 0.00 179.25 178.11 3ids h ASP 300 N 0.13 0.00 -0.10 0.00 3.32 -1.70 -2.49 116.42 115.59 3ids h ASP 300 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 3ids h ASP 300 Cb 0.95 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.50 3ids h ASP 300 CO -0.04 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 177.97 3ids n PHE 301 N -2.77 0.10 -1.73 4.55 3.01 -0.39 -4.89 117.46 115.34 3ids n PHE 301 Ca 0.00 -0.05 -0.42 0.00 1.01 0.00 0.00 57.45 58.00 3ids n PHE 301 Cb 0.22 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.67 3ids n PHE 301 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 3ids n ILE 302 N 1.04 0.54 -1.18 4.37 5.41 -0.94 -1.81 119.36 126.79 3ids n ILE 302 Ca 0.16 -0.14 -0.06 0.00 1.00 0.00 0.00 62.75 63.72 3ids n ILE 302 Cb 0.53 -1.98 -0.03 0.00 -0.71 0.00 0.00 39.64 37.45 3ids n ILE 302 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3ids n ASN 303 N 3.01 -4.70 -4.72 4.38 3.02 -1.26 -5.00 115.26 109.99 3ids n ASN 303 Ca 0.12 0.15 -0.42 0.00 -0.03 0.00 0.00 54.58 54.40 3ids n ASN 303 Cb 0.36 -2.74 -0.03 0.00 -0.61 0.00 0.00 39.78 36.76 3ids n ASN 303 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3ids s ASP 304 N -2.41 7.01 0.00 6.41 3.68 -0.75 -4.94 116.67 125.68 3ids s ASP 304 Ca 0.00 2.13 0.27 0.00 2.13 0.00 0.00 52.55 57.09 3ids s ASP 304 Cb 0.00 -2.59 0.88 0.00 -1.45 0.00 0.00 42.92 39.77 3ids s ASP 304 CO 0.00 -0.50 1.66 0.59 0.13 0.00 0.00 175.17 177.05 3ids n ASN 305 N 3.69 0.50 -4.86 -0.34 3.02 -1.26 -3.54 115.26 112.47 3ids n ASN 305 Ca 0.09 -0.33 -0.31 0.00 -0.03 0.00 0.00 54.58 53.99 3ids n ASN 305 Cb 0.45 0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.62 3ids n ASN 305 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3ids s ARG 306 N -2.76 3.74 0.22 3.52 3.00 -1.26 -4.57 118.95 120.84 3ids s ARG 306 Ca 0.19 0.79 0.07 0.00 0.00 0.00 0.00 55.73 56.79 3ids s ARG 306 Cb 0.19 -2.13 0.16 0.00 0.00 0.00 0.00 34.95 33.17 3ids s ARG 306 CO 0.57 -0.42 1.49 0.77 0.00 0.00 0.00 175.30 177.72 3ids h SER 307 N 0.24 0.09 -3.20 0.23 0.02 -1.12 -3.39 113.55 106.41 3ids h SER 307 Ca -0.45 -0.06 -0.10 0.00 -0.84 0.00 0.00 61.79 60.33 3ids h SER 307 Cb 1.19 -0.03 -0.26 0.00 0.14 0.00 0.00 62.40 63.44 3ids h SER 307 CO 0.62 0.80 -0.27 -0.55 -1.14 0.00 0.00 176.83 176.29 3ids s SER 308 N -6.84 -0.56 -0.35 3.07 0.15 -0.92 -3.60 113.70 104.65 3ids s SER 308 Ca -0.02 0.95 0.03 0.00 0.70 0.00 0.00 55.95 57.62 3ids s SER 308 Cb 0.12 0.83 0.10 0.00 -1.71 0.00 0.00 66.02 65.35 3ids s SER 308 CO 0.79 -0.20 0.07 -0.63 1.20 0.00 0.00 173.24 174.48 3ids s ILE 309 N 1.42 2.04 0.22 6.45 1.09 0.54 -0.41 121.20 132.55 3ids s ILE 309 Ca -0.10 -2.24 -0.31 0.00 -1.10 0.00 0.00 60.65 56.90 3ids s ILE 309 Cb -0.08 -2.51 -0.11 0.00 -1.06 0.00 0.00 42.46 38.70 3ids s ILE 309 CO -0.13 -0.63 1.64 -0.47 -0.10 0.00 0.00 174.94 175.24 3ids s TYR 310 N 0.96 2.91 -0.76 3.97 5.04 -0.24 -0.65 117.35 128.57 3ids s TYR 310 Ca 0.11 0.57 -0.16 0.00 -2.44 0.00 0.00 57.07 55.15 3ids s TYR 310 Cb -0.19 -4.05 0.17 0.00 0.35 0.00 0.00 41.96 38.24 3ids s TYR 310 CO -0.10 -3.81 0.77 0.34 -1.34 0.00 0.00 175.55 171.40 3ids s ASP 311 N 0.94 6.57 0.12 4.32 -1.08 0.22 -0.96 116.67 126.80 3ids s ASP 311 Ca 0.70 -2.27 -0.18 0.00 -0.52 0.00 0.00 52.55 50.28 3ids s ASP 311 Cb -0.47 -2.25 -0.04 0.00 -1.46 0.00 0.00 42.92 38.70 3ids s ASP 311 CO 0.37 -0.77 1.72 -1.28 0.52 0.00 0.00 175.17 175.72 3ids h SER 312 N 8.32 0.38 -0.38 -0.34 0.87 -1.53 -1.44 113.55 119.43 3ids h SER 312 Ca -0.01 -0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.42 3ids h SER 312 Cb 1.05 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.90 3ids h SER 312 CO 0.90 0.37 0.12 0.11 -0.53 0.00 0.00 176.83 177.80 3ids h LYS 313 N 0.36 0.59 0.00 2.24 1.79 -1.86 0.51 116.57 120.20 3ids h LYS 313 Ca 0.10 -0.13 -0.06 0.00 -2.18 0.00 0.00 60.65 58.38 3ids h LYS 313 Cb 0.08 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.63 3ids h LYS 313 CO -0.02 0.61 -0.30 0.00 -1.08 0.00 0.00 179.45 178.67 3ids h ALA 314 N 0.96 1.34 0.03 3.86 0.00 -1.89 -1.67 119.26 121.90 3ids h ALA 314 Ca 0.12 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 3ids h ALA 314 Cb 0.26 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3ids h ALA 314 CO -0.00 0.37 -0.02 1.15 0.00 0.00 0.00 179.25 180.75 3ids h THR 315 N 0.00 0.96 -0.38 0.00 2.02 -0.98 -3.22 112.91 111.32 3ids h THR 315 Ca -0.00 -1.63 0.03 0.00 0.77 0.00 0.00 66.41 65.59 3ids h THR 315 Cb 0.58 1.79 -0.02 0.00 -1.74 0.00 0.00 68.15 68.76 3ids h THR 315 CO 0.04 0.31 0.25 -0.07 0.37 0.00 0.00 175.52 176.43 3ids h LEU 316 N -0.97 0.33 0.00 2.58 3.38 -0.88 -2.69 115.31 117.05 3ids h LEU 316 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3ids h LEU 316 Cb 0.55 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.22 3ids h LEU 316 CO 0.01 0.23 -0.22 1.56 0.09 0.00 0.00 178.44 180.11 3ids h GLN 317 N 0.38 0.00 0.00 1.13 4.20 -1.43 -3.37 115.11 116.02 3ids h GLN 317 Ca 0.16 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 3ids h GLN 317 Cb 0.15 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 3ids h GLN 317 CO -0.04 0.00 -0.39 0.09 -0.67 0.00 0.00 178.83 177.83 3ids n ASN 318 N -2.61 1.82 -4.77 1.46 3.02 -1.02 -5.02 115.26 108.15 3ids n ASN 318 Ca 0.04 -3.53 -0.22 0.00 -0.03 0.00 0.00 54.58 50.83 3ids n ASN 318 Cb 0.48 -0.48 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 3ids n ASN 318 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3ids s ASN 319 N -3.02 5.02 0.22 6.41 0.01 -1.22 -4.85 114.94 117.51 3ids s ASN 319 Ca 0.35 -0.54 -0.30 0.00 -0.71 0.00 0.00 52.86 51.67 3ids s ASN 319 Cb 0.34 -0.99 -0.09 0.00 0.41 0.00 0.00 41.25 40.92 3ids s ASN 319 CO -0.05 -0.18 1.21 -0.76 -1.51 0.00 0.00 177.10 175.82 3ids s LEU 320 N -3.84 4.46 0.27 0.60 1.43 -1.26 -4.97 118.68 115.36 3ids s LEU 320 Ca 0.36 2.31 -0.30 0.00 -1.03 0.00 0.00 54.13 55.47 3ids s LEU 320 Cb -0.06 -3.61 -0.11 0.00 0.03 0.00 0.00 46.19 42.44 3ids s LEU 320 CO 0.24 -0.38 1.54 -2.16 0.23 0.00 0.00 176.35 175.82 3ids s PRO 321 N -0.56 4.17 0.00 1.29 0.04 -1.26 -2.83 135.00 135.85 3ids s PRO 321 Ca 0.52 2.48 0.00 0.00 0.04 0.00 0.00 61.00 64.04 3ids s PRO 321 Cb -0.34 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.14 3ids s PRO 321 CO 0.39 -0.56 0.00 1.63 0.04 0.00 0.00 177.00 178.50 3ids n LYS 322 N 2.32 -0.91 -1.97 4.56 4.76 -1.26 -4.97 118.16 120.69 3ids n LYS 322 Ca 0.08 0.23 -0.41 0.00 -2.87 0.00 0.00 58.31 55.34 3ids n LYS 322 Cb 0.38 -4.06 -0.02 0.00 -1.84 0.00 0.00 35.03 29.50 3ids n LYS 322 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 3ids s GLU 323 N -1.04 4.24 -0.01 1.97 2.56 -1.13 -4.96 118.70 120.33 3ids s GLU 323 Ca 0.00 2.37 0.13 0.00 0.00 0.00 0.00 54.97 57.47 3ids s GLU 323 Cb 0.00 -3.05 -0.19 0.00 2.00 0.00 0.00 34.13 32.89 3ids s GLU 323 CO 0.00 -0.39 0.34 0.54 -0.56 0.00 0.00 175.26 175.19 3ids n ARG 324 N 1.22 0.86 0.00 4.30 1.74 -1.26 -4.41 116.66 119.12 3ids n ARG 324 Ca 0.03 -0.10 0.00 0.00 -0.77 0.00 0.00 57.85 57.01 3ids n ARG 324 Cb 0.40 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.57 3ids n ARG 324 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3ids n ARG 325 N -1.83 1.01 -3.61 5.56 5.12 -1.26 -0.73 116.66 120.92 3ids n ARG 325 Ca -0.01 0.00 -0.40 0.00 -1.93 0.00 0.00 57.85 55.50 3ids n ARG 325 Cb 0.32 -0.75 -0.11 0.00 -1.16 0.00 0.00 32.46 30.76 3ids n ARG 325 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 3ids s PHE 326 N -1.50 3.28 0.09 -1.55 5.36 -1.26 -1.35 117.98 121.05 3ids s PHE 326 Ca 0.00 -1.24 0.05 0.00 -0.96 0.00 0.00 56.93 54.77 3ids s PHE 326 Cb 0.00 -2.64 -0.03 0.00 -0.34 0.00 0.00 43.02 40.01 3ids s PHE 326 CO 0.00 -0.74 -0.13 -0.06 -1.46 0.00 0.00 175.22 172.83 3ids s PHE 327 N 1.49 1.20 -0.12 10.12 0.08 -0.44 -4.76 117.98 125.55 3ids s PHE 327 Ca 0.02 -0.55 -0.01 0.00 0.12 0.00 0.00 56.93 56.51 3ids s PHE 327 Cb -0.21 -0.66 -0.02 0.00 -0.57 0.00 0.00 43.02 41.56 3ids s PHE 327 CO 0.04 0.06 -0.09 0.21 -0.10 0.00 0.00 175.22 175.35 3ids s LYS 328 N -2.32 3.26 -0.08 0.44 2.20 -1.26 -1.15 119.74 120.82 3ids s LYS 328 Ca 0.03 -0.60 0.04 0.00 -0.36 0.00 0.00 55.97 55.08 3ids s LYS 328 Cb -0.06 -2.70 0.00 0.00 -1.51 0.00 0.00 37.83 33.56 3ids s LYS 328 CO 0.02 0.37 -0.20 0.42 -0.36 0.00 0.00 175.35 175.60 3ids s ILE 329 N -0.02 1.70 -0.17 5.43 1.01 0.54 -4.85 121.20 124.84 3ids s ILE 329 Ca -0.01 -0.82 -0.04 0.00 0.00 0.00 0.00 60.65 59.78 3ids s ILE 329 Cb -0.14 -1.49 -0.03 0.00 0.01 0.00 0.00 42.46 40.82 3ids s ILE 329 CO 0.03 0.48 -0.03 -0.69 0.00 0.00 0.00 174.94 174.73 3ids s VAL 330 N 0.41 3.87 -0.07 2.92 1.01 -1.26 -0.51 120.40 126.77 3ids s VAL 330 Ca -0.16 -0.36 -0.06 0.00 0.00 0.00 0.00 61.98 61.40 3ids s VAL 330 Cb -0.17 -2.71 0.02 0.00 0.00 0.00 0.00 36.38 33.53 3ids s VAL 330 CO 0.07 0.48 0.19 -0.55 0.00 0.00 0.00 175.10 175.28 3ids s SER 331 N 0.51 -0.20 0.30 3.32 0.15 -0.10 -0.61 113.70 117.07 3ids s SER 331 Ca -0.03 0.38 0.06 0.00 0.70 0.00 0.00 55.95 57.06 3ids s SER 331 Cb -0.14 0.38 -0.02 0.00 -1.71 0.00 0.00 66.02 64.53 3ids s SER 331 CO 0.03 -0.07 0.43 0.26 1.20 0.00 0.00 173.24 175.08 3ids s TRP 332 N 0.18 3.25 -0.24 3.44 0.52 0.18 0.27 118.94 126.54 3ids s TRP 332 Ca -0.01 -0.14 -0.20 0.00 0.02 0.00 0.00 56.10 55.78 3ids s TRP 332 Cb -0.02 -1.83 0.06 0.00 -1.15 0.00 0.00 33.47 30.53 3ids s TRP 332 CO -0.00 0.16 0.62 1.52 0.02 0.00 0.00 176.95 179.26 3ids s TYR 333 N -2.10 -0.74 -0.68 -1.98 1.13 -0.23 -0.34 117.35 112.40 3ids s TYR 333 Ca 0.41 1.72 -0.27 0.00 -1.41 0.00 0.00 57.07 57.51 3ids s TYR 333 Cb -0.09 0.30 0.03 0.00 -1.10 0.00 0.00 41.96 41.10 3ids s TYR 333 CO 0.30 -0.36 1.22 0.34 -2.51 0.00 0.00 175.55 174.54 3ids s ASP 334 N 0.63 6.25 0.58 -0.18 -1.08 -1.26 -1.05 116.67 120.56 3ids s ASP 334 Ca -0.02 -0.31 0.29 0.00 -0.52 0.00 0.00 52.55 51.98 3ids s ASP 334 Cb -0.05 -2.54 1.75 0.00 -1.46 0.00 0.00 42.92 40.62 3ids s ASP 334 CO -0.04 -1.68 2.23 -0.55 0.52 0.00 0.00 175.17 175.65 3ids h ASN 335 N 9.83 0.00 0.13 -0.34 -1.07 -1.90 -2.07 115.58 120.17 3ids h ASN 335 Ca -0.27 0.00 -0.29 0.00 0.07 0.00 0.00 56.30 55.81 3ids h ASN 335 Cb 1.05 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.31 3ids h ASN 335 CO 1.24 0.02 -1.44 -0.33 0.07 0.00 0.00 177.43 176.99 3ids h GLU 336 N 0.00 0.28 0.11 4.14 5.08 -1.98 -3.40 114.58 118.82 3ids h GLU 336 Ca -0.00 -0.49 -0.34 0.00 -1.00 0.00 0.00 59.36 57.53 3ids h GLU 336 Cb 0.05 0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 3ids h GLU 336 CO 0.00 1.23 -1.84 2.35 -1.00 0.00 0.00 179.01 179.75 3ids h TRP 337 N -0.22 0.43 -0.24 4.33 2.91 -1.70 -2.97 115.95 118.50 3ids h TRP 337 Ca -0.30 -0.32 -0.02 0.00 1.13 0.00 0.00 58.89 59.39 3ids h TRP 337 Cb 1.83 -0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 30.45 3ids h TRP 337 CO 0.13 1.73 0.08 0.78 -1.03 0.00 0.00 178.44 180.12 3ids h GLY 338 N 0.70 0.39 0.82 2.65 0.00 -1.47 -2.79 103.07 103.38 3ids h GLY 338 Ca -0.40 -0.22 0.05 0.00 0.00 0.00 0.00 47.33 46.75 3ids h GLY 338 CO 0.05 0.21 0.59 -1.82 0.00 0.00 0.00 176.54 175.57 3ids h TYR 339 N 0.22 1.10 -0.44 5.60 5.03 -1.74 -1.02 116.97 125.73 3ids h TYR 339 Ca 0.08 0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.45 3ids h TYR 339 Cb 0.22 -0.36 -0.03 0.00 1.55 0.00 0.00 36.73 38.10 3ids h TYR 339 CO -0.00 0.61 0.23 0.77 -1.32 0.00 0.00 178.16 178.45 3ids h SER 340 N 1.12 0.35 -0.13 -2.11 0.02 -1.42 -1.06 113.55 110.31 3ids h SER 340 Ca 0.38 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.29 3ids h SER 340 Cb 0.06 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 3ids h SER 340 CO -0.14 0.25 -0.06 0.45 -1.14 0.00 0.00 176.83 176.18 3ids h HIS 341 N 0.46 0.45 -0.44 3.45 3.86 -1.08 -2.82 115.15 119.03 3ids h HIS 341 Ca 0.18 -0.05 -0.11 0.00 -1.16 0.00 0.00 60.37 59.23 3ids h HIS 341 Cb 0.07 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.40 3ids h HIS 341 CO -0.09 0.49 -0.17 0.00 0.86 0.00 0.00 177.93 179.02 3ids h ARG 342 N 0.41 0.84 -0.38 2.45 2.47 -0.35 0.50 114.38 120.32 3ids h ARG 342 Ca 0.08 -0.32 0.03 0.00 -1.26 0.00 0.00 59.98 58.51 3ids h ARG 342 Cb 0.37 -0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 28.61 3ids h ARG 342 CO 0.02 0.95 0.20 0.28 0.56 0.00 0.00 179.97 181.98 3ids h VAL 343 N 0.74 0.99 0.12 2.04 2.07 -0.98 0.31 116.25 121.55 3ids h VAL 343 Ca 0.11 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 3ids h VAL 343 Cb 0.69 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3ids h VAL 343 CO 0.05 0.07 -0.06 0.58 0.02 0.00 0.00 177.57 178.24 3ids h VAL 344 N 0.41 0.93 -0.94 2.57 2.07 -1.34 -2.04 116.25 117.91 3ids h VAL 344 Ca 0.16 -0.17 0.19 0.00 0.82 0.00 0.00 66.70 67.70 3ids h VAL 344 Cb 0.05 1.04 -0.11 0.00 -1.52 0.00 0.00 31.29 30.75 3ids h VAL 344 CO -0.10 0.04 0.52 0.44 0.02 0.00 0.00 177.57 178.49 3ids h ASP 345 N -0.24 0.62 -0.15 0.57 3.32 -0.57 -1.44 116.42 118.53 3ids h ASP 345 Ca -0.02 0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.07 3ids h ASP 345 Cb 0.19 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 3ids h ASP 345 CO 0.03 0.20 -0.18 0.25 -1.72 0.00 0.00 179.24 177.81 3ids h LEU 346 N 0.64 0.42 -0.57 1.55 5.85 -0.74 -0.41 115.31 122.06 3ids h LEU 346 Ca 0.55 -0.50 0.09 0.00 0.84 0.00 0.00 57.88 58.85 3ids h LEU 346 Cb 0.88 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.72 3ids h LEU 346 CO -0.41 0.84 0.20 0.58 -0.34 0.00 0.00 178.44 179.31 3ids h VAL 347 N 0.02 0.78 -0.54 1.05 2.07 -1.04 0.66 116.25 119.26 3ids h VAL 347 Ca 0.02 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 3ids h VAL 347 Cb 0.73 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 3ids h VAL 347 CO 0.04 0.07 0.30 0.03 0.02 0.00 0.00 177.57 178.04 3ids h ARG 348 N 0.38 0.74 -0.40 1.57 3.08 -1.14 0.14 114.38 118.74 3ids h ARG 348 Ca 0.28 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.24 3ids h ARG 348 Cb 0.34 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 3ids h ARG 348 CO -0.29 0.56 0.22 1.25 -1.07 0.00 0.00 179.97 180.64 3ids h HIS 349 N 0.72 0.56 -0.57 3.04 2.76 -0.35 -1.30 115.15 120.02 3ids h HIS 349 Ca 0.19 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.34 3ids h HIS 349 Cb 0.03 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 28.78 3ids h HIS 349 CO -0.02 0.43 0.34 0.52 -1.30 0.00 0.00 177.93 177.90 3ids h MET 350 N 0.52 0.77 -0.67 5.26 2.86 -0.64 -1.86 114.93 121.17 3ids h MET 350 Ca 0.14 -0.07 0.02 0.00 -2.06 0.00 0.00 59.70 57.72 3ids h MET 350 Cb 0.06 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.52 3ids h MET 350 CO -0.02 0.56 0.43 0.00 1.06 0.00 0.00 176.91 178.95 3ids h ALA 351 N 1.16 0.86 -0.49 6.32 0.00 -0.80 0.21 119.26 126.52 3ids h ALA 351 Ca 0.20 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3ids h ALA 351 Cb -0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3ids h ALA 351 CO -0.04 0.24 0.12 0.66 0.00 0.00 0.00 179.25 180.23 3ids h SER 352 N 0.87 0.75 -0.51 0.00 4.64 -0.93 -2.69 113.55 115.69 3ids h SER 352 Ca 0.26 -0.23 -0.13 0.00 -0.47 0.00 0.00 61.79 61.22 3ids h SER 352 Cb -0.05 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 61.83 3ids h SER 352 CO -0.08 0.79 -0.17 0.11 -0.87 0.00 0.00 176.83 176.61 3ids h LYS 353 N 0.68 1.02 -0.96 4.77 1.79 -1.00 -2.01 116.57 120.86 3ids h LYS 353 Ca 0.16 -0.41 0.02 0.00 -2.18 0.00 0.00 60.65 58.24 3ids h LYS 353 Cb 0.33 -0.05 -0.05 0.00 -1.58 0.00 0.00 32.23 30.88 3ids h LYS 353 CO 0.00 1.09 0.63 -0.44 -1.08 0.00 0.00 179.45 179.66 3ids h ASP 354 N 0.89 1.06 0.27 0.86 3.32 -0.50 -1.09 116.42 121.23 3ids h ASP 354 Ca 0.12 -0.02 -0.30 0.00 0.02 0.00 0.00 57.03 56.86 3ids h ASP 354 Cb 0.75 -0.25 0.02 0.00 0.22 0.00 0.00 39.33 40.07 3ids h ASP 354 CO 0.06 0.75 -1.27 -0.09 -1.72 0.00 0.00 179.24 176.97 3ids h ARG 355 N 1.24 0.52 -0.79 3.56 2.43 -1.41 -2.72 114.38 117.22 3ids h ARG 355 Ca 0.37 -0.75 -0.00 0.00 -0.81 0.00 0.00 59.98 58.78 3ids h ARG 355 Cb -0.06 0.26 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 3ids h ARG 355 CO -0.10 1.34 0.47 0.77 -1.51 0.00 0.00 179.97 180.94 3ids h SER 356 N 0.21 0.94 0.51 -3.80 0.02 -1.23 -0.57 113.55 109.63 3ids h SER 356 Ca -0.18 -0.05 -0.09 0.00 -0.84 0.00 0.00 61.79 60.62 3ids h SER 356 Cb 1.95 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 64.24 3ids h SER 356 CO 0.23 0.73 -0.42 0.00 -1.14 0.00 0.00 176.83 176.23 3ids h ALA 357 N 1.44 1.21 0.00 3.77 0.00 -1.11 -3.35 119.26 121.22 3ids h ALA 357 Ca 0.28 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3ids h ALA 357 Cb -0.04 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3ids h ALA 357 CO -0.05 0.53 -0.39 0.07 0.00 0.00 0.00 179.25 179.41 3ids h ARG 358 N 0.00 0.00 0.00 0.00 0.11 -1.13 -3.52 114.38 109.85 3ids h ARG 358 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3ids h ARG 358 Cb 0.79 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.87 3ids h ARG 358 CO 0.05 0.15 0.00 1.47 0.10 0.00 0.00 179.97 181.75