#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 2.94 0.13 2.12 0.02 -1.25 -4.98 135.00 133.98 3ids s PRO 2 Ca 0.00 1.76 -0.31 0.00 0.02 0.00 0.00 61.00 62.47 3ids s PRO 2 Cb 0.00 -1.93 -0.10 0.00 0.02 0.00 0.00 34.50 32.48 3ids s PRO 2 CO 0.00 -1.21 1.81 0.42 -0.33 0.00 0.00 177.00 177.69 3ids s ILE 3 N -1.70 2.49 -0.42 2.83 1.01 0.01 -4.66 121.20 120.76 3ids s ILE 3 Ca 0.76 0.06 -0.22 0.00 0.00 0.00 0.00 60.65 61.25 3ids s ILE 3 Cb -0.29 -3.04 0.02 0.00 0.01 0.00 0.00 42.46 39.16 3ids s ILE 3 CO 0.34 0.00 0.73 -0.54 0.00 0.00 0.00 174.94 175.46 3ids s LYS 4 N 2.56 3.48 -0.05 2.79 -0.14 -1.26 0.34 119.74 127.46 3ids s LYS 4 Ca 0.80 -0.08 0.04 0.00 -1.36 0.00 0.00 55.97 55.38 3ids s LYS 4 Cb -0.46 -3.90 -0.02 0.00 -1.68 0.00 0.00 37.83 31.77 3ids s LYS 4 CO 0.36 -0.99 -0.17 0.08 -0.76 0.00 0.00 175.35 173.87 3ids s VAL 5 N 3.05 2.78 -0.03 3.17 1.01 0.44 -1.41 120.40 129.41 3ids s VAL 5 Ca 0.27 -0.82 0.07 0.00 0.00 0.00 0.00 61.98 61.50 3ids s VAL 5 Cb -0.13 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 3ids s VAL 5 CO 0.20 0.58 -0.22 -0.83 0.00 0.00 0.00 175.10 174.83 3ids s GLY 6 N -0.58 1.36 -0.24 4.51 0.00 -0.49 -0.44 107.32 111.44 3ids s GLY 6 Ca 0.08 -1.08 -0.04 0.00 0.00 0.00 0.00 44.72 43.68 3ids s GLY 6 CO 0.01 -0.88 -0.01 -0.42 0.00 0.00 0.00 173.10 171.79 3ids s ILE 7 N -0.66 3.46 -0.51 0.90 1.01 -0.45 -1.02 121.20 123.93 3ids s ILE 7 Ca 0.11 -0.61 -0.18 0.00 0.00 0.00 0.00 60.65 59.97 3ids s ILE 7 Cb -0.10 -2.65 0.07 0.00 0.01 0.00 0.00 42.46 39.78 3ids s ILE 7 CO -0.00 0.31 0.58 0.21 0.00 0.00 0.00 174.94 176.04 3ids s ASN 8 N 1.46 6.20 0.00 3.58 3.04 -0.33 -0.73 114.94 128.17 3ids s ASN 8 Ca 0.04 -1.08 0.00 0.00 0.04 0.00 0.00 52.86 51.87 3ids s ASN 8 Cb -0.15 -2.27 0.00 0.00 -1.54 0.00 0.00 41.25 37.29 3ids s ASN 8 CO -0.02 -0.86 0.00 0.61 -3.04 0.00 0.00 177.10 173.79 3ids n GLY 9 N 5.19 0.79 2.73 1.21 0.00 0.29 -1.03 105.19 114.37 3ids n GLY 9 Ca -0.08 -0.91 -0.37 0.00 0.00 0.00 0.00 46.02 44.65 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 1.82 3.11 -1.31 1.61 7.35 -1.00 -4.11 117.46 124.93 3ids n PHE 10 Ca 0.00 -2.88 0.00 0.00 -0.76 0.00 0.00 57.45 53.81 3ids n PHE 10 Cb 0.00 -1.00 0.00 0.00 0.35 0.00 0.00 39.48 38.83 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 -0.17 3.44 0.35 7.13 0.00 -1.26 -4.47 105.19 110.20 3ids n GLY 11 Ca 0.44 -1.83 -0.11 0.00 0.00 0.00 0.00 46.02 44.51 3ids n GLY 11 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3ids h ARG 12 N 0.00 -0.34 -0.03 1.61 2.47 -1.94 -0.15 114.38 116.00 3ids h ARG 12 Ca 0.00 0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.74 3ids h ARG 12 Cb 0.00 0.08 -0.00 0.00 -1.65 0.00 0.00 29.97 28.40 3ids h ARG 12 CO 0.00 -0.23 0.01 0.82 0.56 0.00 0.00 179.97 181.13 3ids h ILE 13 N -0.36 1.19 -0.66 2.04 1.08 -1.91 -0.50 117.51 118.40 3ids h ILE 13 Ca 0.04 -0.57 0.14 0.00 -0.39 0.00 0.00 64.86 64.08 3ids h ILE 13 Cb 0.48 1.53 -0.11 0.00 -3.07 0.00 0.00 36.82 35.64 3ids h ILE 13 CO -0.40 0.15 0.01 1.23 -0.69 0.00 0.00 178.15 178.45 3ids h GLY 14 N -0.19 0.72 1.21 5.37 0.00 -1.68 0.45 103.07 108.95 3ids h GLY 14 Ca 0.01 0.08 -0.25 0.00 0.00 0.00 0.00 47.33 47.17 3ids h GLY 14 CO 0.00 -0.22 -0.92 3.21 0.00 0.00 0.00 176.54 178.61 3ids h ARG 15 N 0.12 0.74 -0.37 4.80 3.08 -0.98 -2.08 114.38 119.70 3ids h ARG 15 Ca 0.35 -0.70 -0.08 0.00 0.07 0.00 0.00 59.98 59.61 3ids h ARG 15 Cb 0.57 0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.78 3ids h ARG 15 CO -0.56 1.29 -0.11 0.52 -1.07 0.00 0.00 179.97 180.04 3ids h MET 16 N 0.46 0.64 -0.39 0.04 2.86 -0.75 0.15 114.93 117.95 3ids h MET 16 Ca -0.09 -0.20 0.03 0.00 -2.06 0.00 0.00 59.70 57.38 3ids h MET 16 Cb 1.56 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 33.13 3ids h MET 16 CO 0.18 0.74 0.19 0.28 1.06 0.00 0.00 176.91 179.37 3ids h VAL 17 N 0.59 0.97 -0.33 -2.22 2.07 -0.06 -0.88 116.25 116.40 3ids h VAL 17 Ca 0.10 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 3ids h VAL 17 Cb 0.54 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 3ids h VAL 17 CO 0.03 0.07 0.17 0.15 0.02 0.00 0.00 177.57 178.02 3ids h PHE 18 N 0.39 0.46 -0.66 1.57 3.04 -0.89 -2.29 116.94 118.55 3ids h PHE 18 Ca 0.16 -0.02 0.11 0.00 3.98 0.00 0.00 57.97 62.21 3ids h PHE 18 Cb 0.08 -0.15 -0.08 0.00 2.56 0.00 0.00 35.95 38.36 3ids h PHE 18 CO -0.10 0.38 0.25 1.96 -2.02 0.00 0.00 178.31 178.78 3ids h GLN 19 N 0.40 0.40 -0.15 1.11 4.20 -0.46 -1.67 115.11 118.94 3ids h GLN 19 Ca 0.11 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.82 3ids h GLN 19 Cb 0.08 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 3ids h GLN 19 CO -0.02 0.27 0.03 0.00 -0.67 0.00 0.00 178.83 178.44 3ids h ALA 20 N 1.47 0.15 -0.55 3.87 0.00 -0.97 -0.25 119.26 122.98 3ids h ALA 20 Ca 0.34 0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.37 3ids h ALA 20 Cb 0.46 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 3ids h ALA 20 CO -0.35 -0.42 0.16 1.25 0.00 0.00 0.00 179.25 179.90 3ids h LEU 21 N 0.09 0.11 -0.01 0.00 5.85 -1.11 -2.05 115.31 118.18 3ids h LEU 21 Ca 0.07 0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 3ids h LEU 21 Cb 0.06 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 3ids h LEU 21 CO -0.09 0.08 -0.00 0.00 -0.34 0.00 0.00 178.44 178.09 3ids h GLU 23 N -0.35 0.43 -0.25 0.00 4.81 -0.96 -1.98 114.58 116.27 3ids h GLU 23 Ca 0.00 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 3ids h GLU 23 Cb 0.39 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.70 3ids h GLU 23 CO 0.00 0.46 0.00 -0.25 -0.73 0.00 0.00 179.01 178.49 3ids n ASP 24 N -4.31 1.61 -0.74 1.04 8.00 -0.78 -4.91 116.55 116.46 3ids n ASP 24 Ca 0.01 -1.87 -0.09 0.00 0.71 0.00 0.00 54.79 53.55 3ids n ASP 24 Cb 0.22 -0.17 -0.03 0.00 -0.02 0.00 0.00 41.12 41.12 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 1.04 0.88 0.14 0.44 0.00 -0.74 -4.89 105.19 102.06 3ids n GLY 25 Ca 0.13 -0.61 0.09 0.00 0.00 0.00 0.00 46.02 45.62 3ids n GLY 25 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3ids h LEU 26 N 0.00 0.00 -9.18 0.99 3.38 -1.51 -3.43 115.31 105.55 3ids h LEU 26 Ca -0.19 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.23 3ids h LEU 26 Cb 0.68 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 3ids h LEU 26 CO 0.26 0.15 1.11 -0.22 0.09 0.00 0.00 178.44 179.83 3ids s LEU 27 N -5.76 4.16 0.00 1.67 2.96 -1.22 -1.45 118.68 119.04 3ids s LEU 27 Ca 0.02 2.02 0.00 0.00 -0.22 0.00 0.00 54.13 55.95 3ids s LEU 27 Cb 0.08 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.24 3ids s LEU 27 CO 0.76 -1.05 0.00 0.61 -1.32 0.00 0.00 176.35 175.34 3ids n GLY 28 N 4.33 1.13 0.73 7.98 0.00 0.45 -4.85 105.19 114.95 3ids n GLY 28 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 0.00 0.09 2.61 -2.24 -0.93 -4.87 114.28 106.94 3ids n THR 29 Ca 0.00 0.08 -0.19 0.00 -2.27 0.00 0.00 64.05 61.67 3ids n THR 29 Cb 0.00 -1.04 -0.15 0.00 -2.10 0.00 0.00 70.33 67.05 3ids n THR 29 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3ids h GLU 30 N 0.00 0.33 -4.35 -0.78 3.07 -1.70 -3.32 114.58 107.83 3ids h GLU 30 Ca 0.00 -0.56 -0.42 0.00 -0.50 0.00 0.00 59.36 57.88 3ids h GLU 30 Cb 0.00 0.21 -0.32 0.00 -0.84 0.00 0.00 28.75 27.80 3ids h GLU 30 CO 0.00 1.23 -0.78 0.42 -1.40 0.00 0.00 179.01 178.48 3ids s ILE 31 N -2.62 0.70 -0.36 3.13 1.01 -0.53 -0.81 121.20 121.72 3ids s ILE 31 Ca -0.09 -0.27 -0.10 0.00 0.00 0.00 0.00 60.65 60.19 3ids s ILE 31 Cb 0.06 -0.65 0.02 0.00 0.01 0.00 0.00 42.46 41.90 3ids s ILE 31 CO 0.88 0.24 0.18 -0.62 0.00 0.00 0.00 174.94 175.61 3ids s ASP 32 N 0.49 5.61 -0.68 3.58 -1.08 0.15 -0.41 116.67 124.33 3ids s ASP 32 Ca -0.07 -0.94 -0.23 0.00 -0.52 0.00 0.00 52.55 50.78 3ids s ASP 32 Cb -0.11 -1.99 0.06 0.00 -1.46 0.00 0.00 42.92 39.42 3ids s ASP 32 CO 0.01 -0.34 1.03 -0.69 0.52 0.00 0.00 175.17 175.70 3ids s VAL 33 N 1.53 4.22 0.12 1.11 1.01 -1.26 -0.42 120.40 126.70 3ids s VAL 33 Ca 0.02 -0.25 -0.09 0.00 0.00 0.00 0.00 61.98 61.66 3ids s VAL 33 Cb -0.19 -4.73 -0.18 0.00 0.00 0.00 0.00 36.38 31.28 3ids s VAL 33 CO 0.06 -1.54 1.29 0.58 0.00 0.00 0.00 175.10 175.49 3ids h VAL 34 N 5.99 1.33 -2.88 2.92 2.07 -1.05 -3.41 116.25 121.21 3ids h VAL 34 Ca -0.27 -2.22 -0.08 0.00 0.82 0.00 0.00 66.70 64.94 3ids h VAL 34 Cb 1.06 2.25 -0.18 0.00 -1.52 0.00 0.00 31.29 32.91 3ids h VAL 34 CO 1.20 0.68 -0.10 0.00 0.02 0.00 0.00 177.57 179.37 3ids s ALA 35 N -3.46 -1.07 0.01 1.67 0.00 -1.23 -1.74 121.76 115.93 3ids s ALA 35 Ca -0.08 0.46 0.03 0.00 0.00 0.00 0.00 51.96 52.37 3ids s ALA 35 Cb 0.08 0.24 -0.01 0.00 0.00 0.00 0.00 23.12 23.43 3ids s ALA 35 CO 0.89 -0.40 -0.10 0.14 0.00 0.00 0.00 175.76 176.29 3ids s VAL 36 N -2.03 0.76 -0.03 0.00 -7.23 -0.52 -1.34 120.40 110.00 3ids s VAL 36 Ca -0.08 -0.55 0.04 0.00 -1.81 0.00 0.00 61.98 59.58 3ids s VAL 36 Cb -0.02 -0.67 -0.00 0.00 0.56 0.00 0.00 36.38 36.25 3ids s VAL 36 CO 0.01 0.12 -0.15 0.54 -0.31 0.00 0.00 175.10 175.30 3ids s VAL 37 N -0.42 1.24 0.00 1.32 0.11 0.10 -1.95 120.40 120.80 3ids s VAL 37 Ca 0.02 -0.62 0.00 0.00 -2.93 0.00 0.00 61.98 58.45 3ids s VAL 37 Cb -0.05 -1.07 0.00 0.00 -1.53 0.00 0.00 36.38 33.73 3ids s VAL 37 CO -0.00 0.36 0.00 -0.67 -3.33 0.00 0.00 175.10 171.46 3ids n ASP 38 N 3.10 0.00 -0.23 3.54 2.03 -1.25 -0.55 116.55 123.20 3ids n ASP 38 Ca -0.17 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.06 3ids n ASP 38 Cb 0.53 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.97 3ids n ASP 38 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 3ids h MET 39 N 0.00 0.97 0.00 -0.67 2.86 -1.98 -2.37 114.93 113.73 3ids h MET 39 Ca 0.00 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 3ids h MET 39 Cb 0.00 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.51 3ids h MET 39 CO 0.00 0.83 0.00 0.27 1.06 0.00 0.00 176.91 179.07 3ids n ASN 40 N -4.40 1.36 -0.77 1.22 0.23 -1.26 -4.32 115.26 107.31 3ids n ASN 40 Ca 0.04 -0.82 0.07 0.00 -0.53 0.00 0.00 54.58 53.35 3ids n ASN 40 Cb 0.19 0.00 0.21 0.00 -2.08 0.00 0.00 39.78 38.10 3ids n ASN 40 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 3ids n THR 41 N 0.00 1.77 -2.17 5.53 -2.24 -1.26 -4.56 114.28 111.35 3ids n THR 41 Ca 0.00 -1.54 -0.30 0.00 -2.27 0.00 0.00 64.05 59.94 3ids n THR 41 Cb 0.00 0.05 -0.05 0.00 -2.10 0.00 0.00 70.33 68.23 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 -1.57 5.43 0.36 3.42 2.15 -1.26 -4.26 116.67 120.94 3ids s ASP 42 Ca 0.34 -1.29 0.09 0.00 0.43 0.00 0.00 52.55 52.13 3ids s ASP 42 Cb 0.25 -2.57 0.82 0.00 -0.30 0.00 0.00 42.92 41.12 3ids s ASP 42 CO 0.11 -2.56 1.88 0.00 -0.17 0.00 0.00 175.17 174.43 3ids h ALA 43 N 10.21 1.84 -0.95 3.66 0.00 -1.76 -0.89 119.26 131.37 3ids h ALA 43 Ca 0.19 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.16 3ids h ALA 43 Cb 0.97 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.57 3ids h ALA 43 CO 1.27 -0.06 0.61 1.49 0.00 0.00 0.00 179.25 182.55 3ids h GLU 44 N 0.68 1.10 -0.20 0.00 4.81 -1.88 0.24 114.58 119.34 3ids h GLU 44 Ca 0.43 -0.07 -0.16 0.00 -0.13 0.00 0.00 59.36 59.44 3ids h GLU 44 Cb 0.68 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.81 3ids h GLU 44 CO -0.19 0.73 -0.48 -0.92 -0.73 0.00 0.00 179.01 177.42 3ids h TYR 45 N 1.13 0.88 -0.73 0.92 3.20 -1.58 -1.82 116.97 118.97 3ids h TYR 45 Ca 0.40 -0.33 0.06 0.00 3.14 0.00 0.00 58.73 62.00 3ids h TYR 45 Cb 0.12 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.17 3ids h TYR 45 CO -0.01 1.12 0.42 0.74 -1.64 0.00 0.00 178.16 178.79 3ids h PHE 46 N 0.39 0.77 -0.60 -3.82 -1.00 -0.97 -1.27 116.94 110.44 3ids h PHE 46 Ca -0.00 0.03 -0.04 0.00 2.81 0.00 0.00 57.97 60.77 3ids h PHE 46 Cb 1.09 -0.24 -0.03 0.00 3.61 0.00 0.00 35.95 40.39 3ids h PHE 46 CO 0.09 0.37 0.24 0.00 -1.61 0.00 0.00 178.31 177.39 3ids h ALA 47 N 1.38 0.78 -0.39 2.45 0.00 -0.42 -0.89 119.26 122.16 3ids h ALA 47 Ca 0.33 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.09 3ids h ALA 47 Cb 0.21 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3ids h ALA 47 CO -0.19 0.40 0.22 -0.92 0.00 0.00 0.00 179.25 178.76 3ids h TYR 48 N 0.83 0.41 -0.83 0.00 3.20 -0.93 0.29 116.97 119.94 3ids h TYR 48 Ca 0.20 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.07 3ids h TYR 48 Cb 0.21 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 3ids h TYR 48 CO 0.01 0.23 0.46 1.96 -1.64 0.00 0.00 178.16 179.18 3ids h GLN 49 N 0.44 1.14 -0.27 1.82 4.20 -0.82 -2.27 115.11 119.35 3ids h GLN 49 Ca 0.16 -0.12 -0.17 0.00 0.06 0.00 0.00 58.65 58.58 3ids h GLN 49 Cb 0.03 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.58 3ids h GLN 49 CO -0.09 0.83 -0.50 0.52 -0.67 0.00 0.00 178.83 178.92 3ids h MET 50 N 1.15 0.76 -0.46 1.46 2.86 -0.89 -3.31 114.93 116.51 3ids h MET 50 Ca 0.29 -0.46 -0.12 0.00 -2.06 0.00 0.00 59.70 57.36 3ids h MET 50 Cb 0.01 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 3ids h MET 50 CO -0.05 1.08 -0.18 -0.09 1.06 0.00 0.00 176.91 178.73 3ids h ARG 51 N 0.60 0.93 -5.29 1.72 2.43 -0.69 -3.38 114.38 110.70 3ids h ARG 51 Ca 0.02 -0.39 -0.68 0.00 -0.81 0.00 0.00 59.98 58.13 3ids h ARG 51 Cb 1.08 -0.04 -0.33 0.00 -0.42 0.00 0.00 29.97 30.27 3ids h ARG 51 CO 0.11 1.05 -0.86 0.71 -1.51 0.00 0.00 179.97 179.47 3ids s TYR 52 N -4.69 2.63 -0.07 2.20 2.02 -0.88 -1.36 117.35 117.20 3ids s TYR 52 Ca -0.12 -1.10 -0.02 0.00 -0.37 0.00 0.00 57.07 55.46 3ids s TYR 52 Cb 0.12 -1.77 0.03 0.00 -0.40 0.00 0.00 41.96 39.94 3ids s TYR 52 CO 0.86 -0.46 0.05 0.34 -1.57 0.00 0.00 175.55 174.77 3ids s ASP 53 N 0.52 1.42 0.24 2.29 -1.08 -1.15 -4.74 116.67 114.17 3ids s ASP 53 Ca -0.14 -0.07 -0.04 0.00 -0.52 0.00 0.00 52.55 51.79 3ids s ASP 53 Cb -0.17 -0.21 0.44 0.00 -1.46 0.00 0.00 42.92 41.52 3ids s ASP 53 CO 0.05 -0.26 1.75 0.74 0.52 0.00 0.00 175.17 177.97 3ids h THR 54 N 6.42 0.73 0.02 1.71 2.02 -1.97 -1.27 112.91 120.56 3ids h THR 54 Ca -0.14 -0.18 -0.20 0.00 0.77 0.00 0.00 66.41 66.66 3ids h THR 54 Cb 1.12 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.66 3ids h THR 54 CO 0.19 0.10 -1.10 0.58 0.37 0.00 0.00 175.52 175.66 3ids h VAL 55 N 0.54 1.06 -0.39 3.16 2.07 -1.98 -3.39 116.25 117.31 3ids h VAL 55 Ca 0.41 -2.24 0.00 0.00 0.82 0.00 0.00 66.70 65.69 3ids h VAL 55 Cb 0.56 2.49 0.00 0.00 -1.52 0.00 0.00 31.29 32.83 3ids h VAL 55 CO -0.36 0.44 0.00 1.41 0.02 0.00 0.00 177.57 179.08 3ids n HIS 56 N -4.36 0.51 -4.16 1.57 8.25 -1.22 -5.01 115.22 110.80 3ids n HIS 56 Ca -0.28 -0.26 0.00 0.00 -0.26 0.00 0.00 57.72 56.93 3ids n HIS 56 Cb 0.69 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.80 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 1.42 -1.76 3.73 -1.41 0.00 -0.48 -4.85 105.19 101.85 3ids n GLY 57 Ca 0.19 -1.33 -0.41 0.00 0.00 0.00 0.00 46.02 44.47 3ids n GLY 57 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ids s LYS 58 N 0.00 4.57 0.09 1.61 2.20 -1.26 -2.94 119.74 124.02 3ids s LYS 58 Ca 0.00 1.71 -0.31 0.00 -0.36 0.00 0.00 55.97 57.01 3ids s LYS 58 Cb 0.00 -3.29 -0.09 0.00 -1.51 0.00 0.00 37.83 32.94 3ids s LYS 58 CO 0.00 0.03 1.62 0.12 -0.36 0.00 0.00 175.35 176.77 3ids s PHE 59 N -0.03 2.60 -1.07 4.03 5.36 -0.46 -4.89 117.98 123.52 3ids s PHE 59 Ca 0.51 0.41 0.28 0.00 -0.96 0.00 0.00 56.93 57.17 3ids s PHE 59 Cb -0.29 -3.95 1.12 0.00 -0.34 0.00 0.00 43.02 39.56 3ids s PHE 59 CO 0.34 -3.71 1.84 1.63 -1.46 0.00 0.00 175.22 173.85 3ids n LYS 60 N 5.16 0.07 -4.25 10.12 5.02 -1.26 -4.76 118.16 128.26 3ids n LYS 60 Ca 0.15 -0.01 -0.34 0.00 -2.02 0.00 0.00 58.31 56.09 3ids n LYS 60 Cb 0.40 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.83 3ids n LYS 60 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3ids s TYR 61 N -2.94 3.20 0.17 2.13 1.51 -1.26 -5.08 117.35 115.08 3ids s TYR 61 Ca 0.15 0.19 -0.31 0.00 -1.01 0.00 0.00 57.07 56.10 3ids s TYR 61 Cb 0.19 -1.75 -0.09 0.00 -0.11 0.00 0.00 41.96 40.20 3ids s TYR 61 CO 0.55 0.51 1.37 -2.00 -1.11 0.00 0.00 175.55 174.87 3ids s GLU 62 N -1.30 4.33 -0.13 -0.62 2.12 -1.26 -5.01 118.70 116.83 3ids s GLU 62 Ca 0.18 2.11 0.02 0.00 0.36 0.00 0.00 54.97 57.63 3ids s GLU 62 Cb -0.12 -3.20 -0.00 0.00 0.26 0.00 0.00 34.13 31.07 3ids s GLU 62 CO 0.08 -0.37 -0.18 0.08 -0.54 0.00 0.00 175.26 174.32 3ids s VAL 63 N 0.56 2.51 0.27 3.70 1.01 -1.26 -3.77 120.40 123.42 3ids s VAL 63 Ca 0.61 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.81 3ids s VAL 63 Cb -0.38 -2.02 -0.06 0.00 0.00 0.00 0.00 36.38 33.92 3ids s VAL 63 CO 0.35 0.53 -0.06 -0.89 0.00 0.00 0.00 175.10 175.03 3ids s THR 64 N 0.57 1.61 0.20 3.92 2.01 -0.58 -4.98 115.64 118.40 3ids s THR 64 Ca -0.11 -2.13 0.08 0.00 0.31 0.00 0.00 61.69 59.85 3ids s THR 64 Cb -0.16 -2.41 -0.05 0.00 0.01 0.00 0.00 72.50 69.89 3ids s THR 64 CO 0.04 -0.32 -0.15 0.42 -0.69 0.00 0.00 174.62 173.91 3ids s THR 65 N -3.04 1.77 0.39 -0.82 -4.23 -1.26 -0.61 115.64 107.85 3ids s THR 65 Ca 0.29 -2.17 -0.14 0.00 -1.18 0.00 0.00 61.69 58.48 3ids s THR 65 Cb 0.03 -2.02 0.05 0.00 1.34 0.00 0.00 72.50 71.91 3ids s THR 65 CO 0.11 -0.55 0.78 0.28 -0.54 0.00 0.00 174.62 174.70 3ids s THR 66 N -2.80 0.00 -0.11 3.99 -1.32 -0.35 -4.93 115.64 110.11 3ids s THR 66 Ca 0.22 -1.04 -0.04 0.00 -1.21 0.00 0.00 61.69 59.62 3ids s THR 66 Cb -0.02 -2.94 -0.03 0.00 -1.51 0.00 0.00 72.50 68.00 3ids s THR 66 CO 0.07 0.00 0.03 -0.54 -2.21 0.00 0.00 174.62 171.97 3ids s LYS 67 N -2.22 3.24 0.26 7.08 1.02 -1.26 -1.75 119.74 126.12 3ids s LYS 67 Ca 0.17 -0.36 -0.03 0.00 0.02 0.00 0.00 55.97 55.77 3ids s LYS 67 Cb -0.05 -2.92 0.35 0.00 -0.52 0.00 0.00 37.83 34.68 3ids s LYS 67 CO 0.12 0.63 1.81 0.66 -0.92 0.00 0.00 175.35 177.65 3ids h SER 68 N 5.44 0.84 -5.16 2.83 4.64 -1.92 -3.45 113.55 116.77 3ids h SER 68 Ca -0.48 -0.15 -0.07 0.00 -0.47 0.00 0.00 61.79 60.61 3ids h SER 68 Cb 1.19 -0.22 -0.13 0.00 -0.31 0.00 0.00 62.40 62.94 3ids h SER 68 CO 0.58 0.81 -0.24 -0.94 -0.87 0.00 0.00 176.83 176.17 3ids s SER 69 N -6.54 -0.03 0.51 4.97 1.04 -1.26 -5.05 113.70 107.34 3ids s SER 69 Ca -0.10 -0.61 0.34 0.00 0.48 0.00 0.00 55.95 56.06 3ids s SER 69 Cb 0.15 0.43 1.61 0.00 0.10 0.00 0.00 66.02 68.31 3ids s SER 69 CO 0.81 -0.84 2.02 -0.65 0.98 0.00 0.00 173.24 175.56 3ids h PRO 70 N 2.53 0.00 0.00 4.02 0.11 -2.03 -2.84 132.00 133.79 3ids h PRO 70 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3ids h PRO 70 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3ids h PRO 70 CO 0.50 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.16 3ids n SER 71 N -2.84 0.39 -4.77 -2.05 3.41 -1.26 -4.74 113.62 101.74 3ids n SER 71 Ca -0.01 0.60 -0.39 0.00 -0.26 0.00 0.00 58.87 58.81 3ids n SER 71 Cb 0.19 -0.68 -0.06 0.00 -0.26 0.00 0.00 64.21 63.40 3ids n SER 71 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3ids s VAL 72 N -3.19 4.37 -0.02 -3.33 1.01 -1.07 -5.01 120.40 113.16 3ids s VAL 72 Ca 0.05 1.72 -0.26 0.00 0.00 0.00 0.00 61.98 63.50 3ids s VAL 72 Cb 0.09 -4.15 -0.20 0.00 0.00 0.00 0.00 36.38 32.12 3ids s VAL 72 CO 0.33 0.51 1.26 0.00 0.00 0.00 0.00 175.10 177.20 3ids h ALA 73 N 4.39 -0.03 -2.21 5.51 0.00 -1.90 -3.46 119.26 121.55 3ids h ALA 73 Ca -0.47 -0.23 -0.55 0.00 0.00 0.00 0.00 54.91 53.65 3ids h ALA 73 Cb 1.21 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.87 3ids h ALA 73 CO 0.66 -0.28 -0.75 0.15 0.00 0.00 0.00 179.25 179.03 3ids s LYS 74 N -4.29 1.56 0.16 0.00 1.02 -1.26 -5.10 119.74 111.84 3ids s LYS 74 Ca -0.16 -1.71 -0.34 0.00 0.02 0.00 0.00 55.97 53.79 3ids s LYS 74 Cb 0.02 -1.54 -0.15 0.00 -0.52 0.00 0.00 37.83 35.64 3ids s LYS 74 CO 0.66 0.28 1.44 -0.25 -0.92 0.00 0.00 175.35 176.55 3ids n ASP 75 N -0.54 2.49 -0.00 2.83 9.92 -1.26 -4.88 116.55 125.12 3ids n ASP 75 Ca -0.06 1.11 0.00 0.00 -0.53 0.00 0.00 54.79 55.31 3ids n ASP 75 Cb 0.60 -1.35 0.00 0.00 -0.64 0.00 0.00 41.12 39.73 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 2.76 1.38 -3.90 -2.24 5.75 -0.85 -2.23 116.55 117.23 3ids n ASP 76 Ca 0.16 -1.70 -0.21 0.00 -0.01 0.00 0.00 54.79 53.03 3ids n ASP 76 Cb 0.27 -0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.19 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 -0.70 0.60 0.22 2.12 2.01 -0.72 -0.55 115.64 118.63 3ids s THR 77 Ca 0.00 -0.15 -0.16 0.00 0.31 0.00 0.00 61.69 61.70 3ids s THR 77 Cb 0.00 -0.62 -0.08 0.00 0.01 0.00 0.00 72.50 71.81 3ids s THR 77 CO 0.00 0.25 0.66 -0.76 -0.69 0.00 0.00 174.62 174.07 3ids s LEU 78 N 0.99 4.27 -0.14 4.42 1.43 0.41 -1.22 118.68 128.85 3ids s LEU 78 Ca -0.10 1.24 -0.01 0.00 -1.03 0.00 0.00 54.13 54.23 3ids s LEU 78 Cb -0.14 -3.60 0.04 0.00 0.03 0.00 0.00 46.19 42.52 3ids s LEU 78 CO -0.00 -0.00 -0.05 -0.69 0.23 0.00 0.00 176.35 175.84 3ids s VAL 79 N -1.63 0.95 -0.24 -1.59 1.01 0.22 -0.58 120.40 118.54 3ids s VAL 79 Ca 0.44 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.03 3ids s VAL 79 Cb -0.14 -1.09 0.05 0.00 0.00 0.00 0.00 36.38 35.20 3ids s VAL 79 CO 0.20 0.20 -0.12 -0.69 0.00 0.00 0.00 175.10 174.69 3ids s VAL 80 N 1.72 2.03 -1.44 2.92 1.01 0.26 -1.52 120.40 125.37 3ids s VAL 80 Ca 0.03 -1.42 -0.06 0.00 0.00 0.00 0.00 61.98 60.53 3ids s VAL 80 Cb -0.14 -2.10 0.01 0.00 0.00 0.00 0.00 36.38 34.15 3ids s VAL 80 CO -0.08 0.07 0.26 -3.20 0.00 0.00 0.00 175.10 172.16 3ids n ASN 81 N 4.51 -0.45 0.00 3.32 5.15 -1.25 -1.07 115.26 125.48 3ids n ASN 81 Ca -0.15 -1.19 0.00 0.00 -0.60 0.00 0.00 54.58 52.64 3ids n ASN 81 Cb 0.44 -2.13 0.00 0.00 -0.53 0.00 0.00 39.78 37.56 3ids n ASN 81 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3ids n GLY 82 N -2.29 2.95 3.67 8.20 0.00 -1.26 -5.01 105.19 111.44 3ids n GLY 82 Ca -0.28 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.85 3.41 -0.19 1.61 5.04 -0.24 -5.03 115.29 118.04 3ids s HIS 83 Ca 0.00 1.33 -0.12 0.00 -1.54 0.00 0.00 55.06 54.73 3ids s HIS 83 Cb 0.00 -3.09 -0.05 0.00 0.04 0.00 0.00 32.58 29.48 3ids s HIS 83 CO 0.00 -0.30 0.24 1.03 -2.34 0.00 0.00 174.74 173.37 3ids s ARG 84 N 2.38 4.19 -0.13 2.88 0.52 -1.26 -0.58 118.95 126.95 3ids s ARG 84 Ca 0.40 -0.05 0.00 0.00 -0.52 0.00 0.00 55.73 55.57 3ids s ARG 84 Cb -0.16 -3.47 0.02 0.00 0.52 0.00 0.00 34.95 31.86 3ids s ARG 84 CO 0.12 0.17 -0.12 0.42 0.02 0.00 0.00 175.30 175.91 3ids s ILE 85 N 0.70 1.35 0.17 1.52 1.09 0.25 -4.77 121.20 121.51 3ids s ILE 85 Ca 0.13 -0.49 -0.30 0.00 -1.10 0.00 0.00 60.65 58.88 3ids s ILE 85 Cb -0.13 -1.30 -0.07 0.00 -1.06 0.00 0.00 42.46 39.90 3ids s ILE 85 CO 0.03 0.42 1.08 -0.22 -0.10 0.00 0.00 174.94 176.15 3ids s LEU 86 N 1.56 4.49 -0.37 2.97 2.96 -0.71 -0.44 118.68 129.14 3ids s LEU 86 Ca 0.05 2.04 -0.15 0.00 -0.22 0.00 0.00 54.13 55.85 3ids s LEU 86 Cb -0.13 -3.60 -0.00 0.00 0.50 0.00 0.00 46.19 42.96 3ids s LEU 86 CO -0.09 -0.20 0.34 0.00 -1.32 0.00 0.00 176.35 175.08 3ids s VAL 88 N 1.92 4.54 0.20 0.00 -7.23 -0.82 -4.73 120.40 114.28 3ids s VAL 88 Ca 0.10 -0.84 -0.30 0.00 -1.81 0.00 0.00 61.98 59.12 3ids s VAL 88 Cb -0.17 -3.23 -0.08 0.00 0.56 0.00 0.00 36.38 33.46 3ids s VAL 88 CO 0.12 0.06 1.11 -0.75 -0.31 0.00 0.00 175.10 175.33 3ids s LYS 89 N -2.59 4.59 0.76 4.82 2.20 -1.26 -3.83 119.74 124.42 3ids s LYS 89 Ca 0.30 1.76 -0.16 0.00 -0.36 0.00 0.00 55.97 57.51 3ids s LYS 89 Cb -0.12 -3.25 -0.04 0.00 -1.51 0.00 0.00 37.83 32.91 3ids s LYS 89 CO 0.23 0.08 0.44 0.00 -0.36 0.00 0.00 175.35 175.73 3ids n ALA 90 N 2.17 -1.87 -2.57 3.13 0.00 -0.89 -4.93 120.51 115.55 3ids n ALA 90 Ca 0.02 -0.30 -0.23 0.00 0.00 0.00 0.00 53.44 52.93 3ids n ALA 90 Cb 0.46 -1.80 -0.12 0.00 0.00 0.00 0.00 19.45 17.98 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 -2.79 1.07 0.12 0.00 -1.52 -1.26 -5.03 119.66 110.25 3ids s GLN 91 Ca 0.63 -1.13 -0.09 0.00 -1.95 0.00 0.00 55.36 52.82 3ids s GLN 91 Cb -0.33 -1.30 -0.12 0.00 -0.22 0.00 0.00 33.01 31.05 3ids s GLN 91 CO 0.61 0.30 1.31 -0.09 -0.25 0.00 0.00 175.29 177.16 3ids h ARG 92 N 4.10 0.63 -4.82 2.91 1.12 -2.02 -3.43 114.38 112.87 3ids h ARG 92 Ca -0.45 -0.57 -0.67 0.00 -1.11 0.00 0.00 59.98 57.17 3ids h ARG 92 Cb 1.18 0.14 -0.25 0.00 -0.01 0.00 0.00 29.97 31.03 3ids h ARG 92 CO 0.40 1.19 -0.61 1.21 -3.11 0.00 0.00 179.97 179.04 3ids s ASN 93 N -7.12 5.19 0.55 -3.80 3.04 -1.26 -5.03 114.94 106.50 3ids s ASN 93 Ca -0.08 -0.60 0.30 0.00 0.04 0.00 0.00 52.86 52.51 3ids s ASN 93 Cb 0.09 -1.91 1.47 0.00 -1.54 0.00 0.00 41.25 39.36 3ids s ASN 93 CO 0.89 -0.17 1.90 -0.65 -3.04 0.00 0.00 177.10 176.03 3ids h PRO 94 N 8.25 0.00 0.00 0.43 0.11 -1.85 -2.00 132.00 136.94 3ids h PRO 94 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3ids h PRO 94 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3ids h PRO 94 CO 0.60 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.39 3ids n ALA 95 N -2.64 1.66 0.39 -0.75 0.00 -1.17 -2.12 120.51 115.88 3ids n ALA 95 Ca 0.16 0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.72 3ids n ALA 95 Cb 0.86 -1.30 0.15 0.00 0.00 0.00 0.00 19.45 19.16 3ids n ALA 95 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 3ids h ASP 96 N 0.00 0.00 -3.72 0.00 3.58 -1.66 -3.36 116.42 111.25 3ids h ASP 96 Ca 0.00 -0.10 -0.53 0.00 0.42 0.00 0.00 57.03 56.82 3ids h ASP 96 Cb 0.30 0.00 0.09 0.00 1.72 0.00 0.00 39.33 41.44 3ids h ASP 96 CO 0.00 0.05 0.78 -0.76 -2.88 0.00 0.00 179.24 176.43 3ids s LEU 97 N -4.88 4.35 -0.13 2.28 1.43 -0.90 -4.89 118.68 115.93 3ids s LEU 97 Ca 0.05 2.94 -0.03 0.00 -1.03 0.00 0.00 54.13 56.06 3ids s LEU 97 Cb 0.11 -3.65 -0.04 0.00 0.03 0.00 0.00 46.19 42.63 3ids s LEU 97 CO 0.72 -0.82 2.68 -0.81 0.23 0.00 0.00 176.35 178.35 3ids n PRO 98 N 1.12 1.71 -0.23 1.29 -0.04 -1.26 -4.57 135.00 133.03 3ids n PRO 98 Ca 0.03 -1.01 -0.06 0.00 -0.04 0.00 0.00 63.50 62.43 3ids n PRO 98 Cb 0.39 -1.64 0.05 0.00 -0.04 0.00 0.00 33.50 32.26 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 2.09 0.84 -0.46 0.54 -0.00 -1.85 -1.25 115.95 115.85 3ids h TRP 99 Ca 0.18 0.01 -0.03 0.00 -0.00 0.00 0.00 58.89 59.05 3ids h TRP 99 Cb 1.11 -0.28 -0.02 0.00 -0.00 0.00 0.00 29.16 29.97 3ids h TRP 99 CO 1.06 0.55 0.18 0.78 -0.00 0.00 0.00 178.44 181.01 3ids h GLY 100 N 0.89 0.75 2.00 1.49 0.00 -1.27 -0.45 103.07 106.48 3ids h GLY 100 Ca 0.24 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 3ids h GLY 100 CO -0.05 0.39 -0.04 0.50 0.00 0.00 0.00 176.54 177.34 3ids h LYS 101 N 0.61 0.00 -0.00 4.80 1.57 -1.76 -2.77 116.57 119.01 3ids h LYS 101 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3ids h LYS 101 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 3ids h LYS 101 CO -0.01 0.04 -0.62 1.28 -0.57 0.00 0.00 179.45 179.57 3ids n LEU 102 N -4.26 0.90 -0.41 2.94 4.32 -0.50 -4.96 117.00 115.03 3ids n LEU 102 Ca -0.03 -0.28 -0.05 0.00 -0.02 0.00 0.00 56.01 55.63 3ids n LEU 102 Cb 0.13 -0.12 -0.02 0.00 -1.62 0.00 0.00 43.42 41.78 3ids n LEU 102 CO 0.32 0.20 -0.05 0.61 -1.22 0.00 0.00 177.39 177.26 3ids n GLY 103 N 1.47 0.78 3.70 -0.72 0.00 -0.29 -5.00 105.19 105.12 3ids n GLY 103 Ca 0.06 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.10 4.07 -0.18 1.61 1.01 -0.55 -4.79 120.40 119.48 3ids s VAL 104 Ca 0.00 1.44 0.08 0.00 0.00 0.00 0.00 61.98 63.50 3ids s VAL 104 Cb 0.00 -3.93 -0.16 0.00 0.00 0.00 0.00 36.38 32.29 3ids s VAL 104 CO 0.00 0.03 -0.06 1.21 0.00 0.00 0.00 175.10 176.28 3ids n GLU 105 N 4.85 0.99 -4.74 2.72 2.13 -0.50 -3.98 120.64 122.11 3ids n GLU 105 Ca 0.11 0.05 -0.33 0.00 0.66 0.00 0.00 57.16 57.65 3ids n GLU 105 Cb 0.46 -1.40 -0.16 0.00 0.27 0.00 0.00 31.44 30.61 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 -2.39 2.72 -0.15 4.31 1.51 -0.86 -0.66 117.35 121.82 3ids s TYR 106 Ca -0.17 -1.05 -0.02 0.00 -1.01 0.00 0.00 57.07 54.82 3ids s TYR 106 Cb 0.06 -1.83 -0.02 0.00 -0.11 0.00 0.00 41.96 40.06 3ids s TYR 106 CO 0.55 -0.45 -0.10 0.08 -1.11 0.00 0.00 175.55 174.52 3ids s VAL 107 N 0.65 3.27 -0.33 0.71 1.01 -0.04 -1.39 120.40 124.27 3ids s VAL 107 Ca -0.09 -0.57 -0.19 0.00 0.00 0.00 0.00 61.98 61.13 3ids s VAL 107 Cb -0.16 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 3ids s VAL 107 CO 0.02 0.50 0.57 -0.63 0.00 0.00 0.00 175.10 175.56 3ids s ILE 108 N 0.59 4.98 -0.50 2.22 1.01 -0.19 -1.14 121.20 128.17 3ids s ILE 108 Ca -0.06 0.60 -0.14 0.00 0.00 0.00 0.00 60.65 61.04 3ids s ILE 108 Cb -0.15 -3.97 0.11 0.00 0.01 0.00 0.00 42.46 38.45 3ids s ILE 108 CO 0.03 -0.17 0.42 -0.70 0.00 0.00 0.00 174.94 174.52 3ids s GLU 109 N 2.50 2.88 -0.08 2.79 2.56 0.03 -1.19 118.70 128.19 3ids s GLU 109 Ca 0.22 -1.58 0.14 0.00 0.00 0.00 0.00 54.97 53.74 3ids s GLU 109 Cb -0.15 -4.14 0.27 0.00 2.00 0.00 0.00 34.13 32.11 3ids s GLU 109 CO 0.13 -1.18 1.13 -1.13 -0.56 0.00 0.00 175.26 173.65 3ids n SER 110 N 5.15 1.23 0.11 -1.70 3.41 -0.20 -1.76 113.62 119.85 3ids n SER 110 Ca -0.12 -2.71 -0.02 0.00 -0.26 0.00 0.00 58.87 55.76 3ids n SER 110 Cb 0.42 -0.36 -0.00 0.00 -0.26 0.00 0.00 64.21 64.01 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 3.88 1.31 0.00 6.66 1.35 -1.79 -3.44 112.91 120.89 3ids h THR 111 Ca -0.06 -2.71 0.00 0.00 -0.55 0.00 0.00 66.41 63.09 3ids h THR 111 Cb 1.33 2.56 0.00 0.00 -1.73 0.00 0.00 68.15 70.31 3ids h THR 111 CO 0.02 0.72 0.00 0.61 -0.25 0.00 0.00 175.52 176.62 3ids n GLY 112 N 1.11 0.89 0.01 5.82 0.00 -1.26 -4.91 105.19 106.85 3ids n GLY 112 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 -2.44 0.99 4.32 -1.26 -4.59 117.00 114.03 3ids n LEU 113 Ca 0.00 0.00 -0.25 0.00 -0.02 0.00 0.00 56.01 55.74 3ids n LEU 113 Cb 0.00 0.02 0.00 0.00 -1.62 0.00 0.00 43.42 41.83 3ids n LEU 113 CO 0.00 0.02 0.17 0.49 -1.22 0.00 0.00 177.39 176.85 3ids n PHE 114 N -2.20 3.20 0.69 -1.77 3.72 -1.26 -4.77 117.46 115.06 3ids n PHE 114 Ca -0.05 -2.99 0.13 0.00 -0.05 0.00 0.00 57.45 54.49 3ids n PHE 114 Cb 0.54 -0.13 0.37 0.00 -0.94 0.00 0.00 39.48 39.32 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 -0.49 0.42 -2.54 4.37 -2.24 -1.26 -3.83 114.28 108.70 3ids n THR 115 Ca 0.38 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.51 3ids n THR 115 Cb 0.71 -0.41 -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 -3.10 3.31 0.23 6.98 0.00 -1.26 -1.70 121.76 126.21 3ids s ALA 116 Ca 0.10 0.73 -0.07 0.00 0.00 0.00 0.00 51.96 52.72 3ids s ALA 116 Cb 0.14 -3.39 0.36 0.00 0.00 0.00 0.00 23.12 20.23 3ids s ALA 116 CO 0.63 -0.32 1.72 -0.22 0.00 0.00 0.00 175.76 177.57 3ids h LYS 117 N 6.48 0.35 -0.99 0.00 3.64 -1.42 -0.58 116.57 124.05 3ids h LYS 117 Ca -0.42 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 58.95 3ids h LYS 117 Cb 1.22 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.91 3ids h LYS 117 CO 0.77 0.23 0.65 0.00 -2.27 0.00 0.00 179.45 178.84 3ids h ALA 118 N 1.50 1.28 -0.15 5.00 0.00 -1.89 0.10 119.26 125.10 3ids h ALA 118 Ca 0.36 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 3ids h ALA 118 Cb 0.52 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3ids h ALA 118 CO -0.39 0.66 0.06 0.00 0.00 0.00 0.00 179.25 179.59 3ids h ALA 119 N 1.37 0.19 -0.06 0.00 0.00 -1.48 -3.14 119.26 116.15 3ids h ALA 119 Ca 0.36 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 3ids h ALA 119 Cb -0.15 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3ids h ALA 119 CO -0.08 -0.22 -0.31 0.00 0.00 0.00 0.00 179.25 178.64 3ids h ALA 120 N 0.90 1.38 0.00 0.00 0.00 -0.86 -1.30 119.26 119.38 3ids h ALA 120 Ca 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3ids h ALA 120 Cb 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3ids h ALA 120 CO -0.00 0.45 0.01 0.93 0.00 0.00 0.00 179.25 180.64 3ids h GLU 121 N 0.10 0.00 -0.94 0.00 5.08 -0.93 -1.63 114.58 116.26 3ids h GLU 121 Ca 0.01 0.00 0.21 0.00 -1.00 0.00 0.00 59.36 58.58 3ids h GLU 121 Cb 0.60 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.74 3ids h GLU 121 CO 0.04 0.00 0.50 0.78 -1.00 0.00 0.00 179.01 179.33 3ids h GLY 122 N 0.00 1.66 1.79 -3.84 0.00 -1.27 -2.01 103.07 99.40 3ids h GLY 122 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 3ids h GLY 122 CO 0.00 -0.19 0.07 0.45 0.00 0.00 0.00 176.54 176.87 3ids h HIS 123 N 0.55 0.27 -0.32 5.60 3.86 -1.47 -2.05 115.15 121.59 3ids h HIS 123 Ca 0.57 -0.00 -0.11 0.00 -1.16 0.00 0.00 60.37 59.67 3ids h HIS 123 Cb 1.02 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 29.39 3ids h HIS 123 CO -0.07 0.23 -0.25 -0.07 0.86 0.00 0.00 177.93 178.63 3ids h LEU 124 N 0.28 0.64 -1.42 2.43 3.38 -1.55 -2.14 115.31 116.93 3ids h LEU 124 Ca 0.07 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 3ids h LEU 124 Cb 0.08 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3ids h LEU 124 CO -0.01 0.87 -0.27 0.03 0.09 0.00 0.00 178.44 179.15 3ids h ARG 125 N 0.55 0.00 0.00 1.13 3.08 -1.37 -2.67 114.38 115.10 3ids h ARG 125 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 3ids h ARG 125 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.77 3ids h ARG 125 CO 0.06 0.27 0.00 0.41 -1.07 0.00 0.00 179.97 179.64 3ids n GLY 126 N -0.41 -1.05 0.00 0.04 0.00 -0.85 -4.88 105.19 98.05 3ids n GLY 126 Ca -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3ids n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ids n GLY 127 N 1.03 1.36 3.83 -0.02 0.00 -1.00 -1.01 105.19 109.39 3ids n GLY 127 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.01 2.69 -0.13 4.61 0.00 -0.95 -4.35 121.76 121.62 3ids s ALA 128 Ca 0.00 -0.08 0.11 0.00 0.00 0.00 0.00 51.96 51.99 3ids s ALA 128 Cb 0.00 -3.12 -0.16 0.00 0.00 0.00 0.00 23.12 19.84 3ids s ALA 128 CO 0.00 -1.23 0.04 0.54 0.00 0.00 0.00 175.76 175.11 3ids n ARG 129 N -3.11 1.82 -3.90 0.00 1.74 0.16 -4.29 116.66 109.08 3ids n ARG 129 Ca 0.07 -0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.04 3ids n ARG 129 Cb 0.55 -1.33 -0.13 0.00 -1.02 0.00 0.00 32.46 30.53 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 -2.31 0.15 -0.07 5.56 -0.14 -0.65 -4.87 119.74 117.41 3ids s LYS 130 Ca -0.07 -0.21 0.02 0.00 -1.36 0.00 0.00 55.97 54.35 3ids s LYS 130 Cb 0.04 0.06 0.01 0.00 -1.68 0.00 0.00 37.83 36.26 3ids s LYS 130 CO 0.53 -0.03 -0.13 0.08 -0.76 0.00 0.00 175.35 175.04 3ids s VAL 131 N -0.56 1.19 -0.31 3.17 1.01 0.36 -0.87 120.40 124.39 3ids s VAL 131 Ca -0.06 -0.51 -0.07 0.00 0.00 0.00 0.00 61.98 61.34 3ids s VAL 131 Cb -0.04 -1.08 0.02 0.00 0.00 0.00 0.00 36.38 35.28 3ids s VAL 131 CO -0.00 0.37 0.09 -0.69 0.00 0.00 0.00 175.10 174.86 3ids s VAL 132 N 0.66 3.91 -0.21 2.92 1.01 -0.29 -1.05 120.40 127.35 3ids s VAL 132 Ca -0.15 -0.82 -0.27 0.00 0.00 0.00 0.00 61.98 60.74 3ids s VAL 132 Cb -0.16 -3.07 -0.00 0.00 0.00 0.00 0.00 36.38 33.14 3ids s VAL 132 CO 0.04 0.00 0.92 -0.63 0.00 0.00 0.00 175.10 175.43 3ids s ILE 133 N 1.47 4.79 -0.16 2.22 1.01 0.41 -0.79 121.20 130.15 3ids s ILE 133 Ca 0.01 1.79 -0.04 0.00 0.00 0.00 0.00 60.65 62.42 3ids s ILE 133 Cb -0.18 -4.21 -0.08 0.00 0.01 0.00 0.00 42.46 38.00 3ids s ILE 133 CO 0.02 -0.08 2.95 -1.54 0.00 0.00 0.00 174.94 176.30 3ids n SER 134 N 5.83 5.74 -3.59 3.58 3.41 -0.72 -1.72 113.62 126.13 3ids n SER 134 Ca 0.08 -2.73 0.01 0.00 -0.26 0.00 0.00 58.87 55.97 3ids n SER 134 Cb 0.47 -1.28 -0.01 0.00 -0.26 0.00 0.00 64.21 63.13 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 -0.22 -2.38 0.43 7.33 0.00 -1.19 -4.95 121.76 120.77 3ids s ALA 135 Ca 0.50 1.40 -0.24 0.00 0.00 0.00 0.00 51.96 53.62 3ids s ALA 135 Cb 0.28 -0.06 -0.10 0.00 0.00 0.00 0.00 23.12 23.24 3ids s ALA 135 CO -0.06 -0.83 1.05 -2.30 0.00 0.00 0.00 175.76 173.62 3ids n PRO 136 N -0.28 1.42 -4.40 0.00 -0.02 -1.22 -4.18 135.00 126.32 3ids n PRO 136 Ca -0.03 0.51 -0.24 0.00 -2.02 0.00 0.00 63.50 61.72 3ids n PRO 136 Cb 0.60 -2.10 -0.09 0.00 -0.02 0.00 0.00 33.50 31.89 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 -1.27 2.88 0.42 3.55 0.00 -1.26 -4.87 121.76 121.20 3ids s ALA 137 Ca 0.64 -1.76 0.07 0.00 0.00 0.00 0.00 51.96 50.90 3ids s ALA 137 Cb -0.54 -0.46 -0.05 0.00 0.00 0.00 0.00 23.12 22.07 3ids s ALA 137 CO 0.56 0.30 0.18 -1.54 0.00 0.00 0.00 175.76 175.27 3ids s SER 138 N -3.45 4.42 0.00 0.00 1.04 -0.69 -4.83 113.70 110.19 3ids s SER 138 Ca 0.29 -1.10 0.00 0.00 0.48 0.00 0.00 55.95 55.62 3ids s SER 138 Cb -0.06 -0.42 0.00 0.00 0.10 0.00 0.00 66.02 65.64 3ids s SER 138 CO 0.16 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.42 3ids n GLY 139 N -1.26 0.67 1.09 7.32 0.00 -1.26 -1.13 105.19 110.62 3ids n GLY 139 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.61 0.68 3.74 -0.02 0.00 -1.26 -4.75 105.19 100.97 3ids n GLY 140 Ca 0.00 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 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 3.56 0.18 4.61 0.00 -1.26 -4.95 121.76 121.90 3ids s ALA 141 Ca 0.00 1.18 -0.31 0.00 0.00 0.00 0.00 51.96 52.83 3ids s ALA 141 Cb 0.00 -3.51 -0.10 0.00 0.00 0.00 0.00 23.12 19.51 3ids s ALA 141 CO 0.00 -0.60 1.53 0.21 0.00 0.00 0.00 175.76 176.89 3ids s LYS 142 N -0.16 4.23 -0.20 0.00 2.47 -1.24 -4.67 119.74 120.17 3ids s LYS 142 Ca 0.58 2.33 -0.09 0.00 -1.56 0.00 0.00 55.97 57.22 3ids s LYS 142 Cb -0.38 -3.15 -0.05 0.00 -1.46 0.00 0.00 37.83 32.79 3ids s LYS 142 CO 0.39 -0.55 0.12 0.99 0.16 0.00 0.00 175.35 176.46 3ids s THR 143 N 0.88 5.22 -0.08 3.43 2.01 -1.26 -0.76 115.64 125.08 3ids s THR 143 Ca 0.67 0.12 0.02 0.00 0.31 0.00 0.00 61.69 62.81 3ids s THR 143 Cb -0.43 -3.39 0.01 0.00 0.01 0.00 0.00 72.50 68.71 3ids s THR 143 CO 0.34 0.43 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.81 3ids s LEU 144 N 0.50 1.62 -0.23 4.42 1.43 -0.02 -4.85 118.68 121.54 3ids s LEU 144 Ca 0.07 -0.32 0.01 0.00 -1.03 0.00 0.00 54.13 52.85 3ids s LEU 144 Cb -0.12 -0.88 0.04 0.00 0.03 0.00 0.00 46.19 45.26 3ids s LEU 144 CO -0.00 0.02 -0.13 -0.69 0.23 0.00 0.00 176.35 175.78 3ids s VAL 145 N 0.81 2.31 0.14 -1.59 1.01 -1.26 -4.28 120.40 117.54 3ids s VAL 145 Ca -0.12 -1.27 -0.35 0.00 0.00 0.00 0.00 61.98 60.25 3ids s VAL 145 Cb -0.15 -2.19 -0.15 0.00 0.00 0.00 0.00 36.38 33.89 3ids s VAL 145 CO 0.02 0.21 1.49 0.23 0.00 0.00 0.00 175.10 177.05 3ids n MET 146 N 4.55 1.83 -0.15 2.72 2.81 -1.26 -1.19 117.12 126.43 3ids n MET 146 Ca -0.17 0.66 0.00 0.00 -1.81 0.00 0.00 57.70 56.38 3ids n MET 146 Cb 0.46 -2.38 0.00 0.00 -0.71 0.00 0.00 33.22 30.59 3ids n MET 146 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3ids n GLY 147 N 3.05 1.46 0.95 3.03 0.00 -1.26 -4.82 105.19 107.61 3ids n GLY 147 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 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 1.18 -1.62 1.61 0.31 -0.33 -4.95 118.33 112.52 3ids n VAL 148 Ca 0.00 0.35 0.00 0.00 -0.01 0.00 0.00 64.34 64.68 3ids n VAL 148 Cb 0.00 -1.65 0.00 0.00 -0.91 0.00 0.00 33.84 31.28 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 -3.55 0.10 0.28 4.52 6.94 -0.86 -4.92 115.26 117.77 3ids n ASN 149 Ca -0.02 -1.71 0.14 0.00 -0.02 0.00 0.00 54.58 52.97 3ids n ASN 149 Cb 0.09 -0.14 0.84 0.00 -2.36 0.00 0.00 39.78 38.21 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 -1.90 -1.00 115.15 111.79 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 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 3ids h HIS 150 CO 0.06 0.05 0.00 0.72 -3.07 0.00 0.00 177.93 175.69 3ids n HIS 151 N -3.80 0.21 0.65 6.12 8.25 -1.26 -1.65 115.22 123.74 3ids n HIS 151 Ca -0.03 0.09 0.08 0.00 -0.26 0.00 0.00 57.72 57.60 3ids n HIS 151 Cb 0.14 -0.64 0.38 0.00 1.12 0.00 0.00 29.99 30.99 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 -1.70 0.08 -1.78 -0.41 1.02 -0.38 -4.80 120.64 112.66 3ids n GLU 152 Ca 0.03 0.19 -0.42 0.00 -0.02 0.00 0.00 57.16 56.93 3ids n GLU 152 Cb 0.16 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.05 3ids n GLU 152 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 3ids s TYR 153 N -2.87 2.94 -0.27 -0.32 5.04 -0.66 -4.97 117.35 116.24 3ids s TYR 153 Ca 0.11 0.43 0.01 0.00 -2.44 0.00 0.00 57.07 55.18 3ids s TYR 153 Cb 0.11 -4.08 0.08 0.00 0.35 0.00 0.00 41.96 38.41 3ids s TYR 153 CO 0.29 -4.06 -0.00 1.21 -1.34 0.00 0.00 175.55 171.65 3ids s ASN 154 N 1.14 4.04 0.37 4.32 3.84 -1.26 -5.03 114.94 122.36 3ids s ASN 154 Ca 0.73 -1.44 0.12 0.00 0.21 0.00 0.00 52.86 52.48 3ids s ASN 154 Cb -0.48 -1.19 0.93 0.00 -0.55 0.00 0.00 41.25 39.95 3ids s ASN 154 CO 0.32 -0.30 1.83 -0.65 -2.79 0.00 0.00 177.10 175.52 3ids h PRO 155 N 7.92 0.56 0.00 0.43 0.11 -1.90 0.16 132.00 139.28 3ids h PRO 155 Ca -0.14 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.93 3ids h PRO 155 Cb 1.05 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.04 3ids h PRO 155 CO 0.44 0.37 -0.12 0.66 -0.21 0.00 0.00 178.00 179.14 3ids h SER 156 N 0.58 0.00 0.00 -2.05 4.64 -1.97 -3.36 113.55 111.38 3ids h SER 156 Ca 0.50 -0.01 -0.24 0.00 -0.47 0.00 0.00 61.79 61.57 3ids h SER 156 Cb 1.01 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.06 3ids h SER 156 CO -0.25 0.01 -1.90 1.21 -0.87 0.00 0.00 176.83 175.03 3ids n GLU 157 N -2.70 0.84 -3.53 4.77 4.07 -0.55 -4.97 120.64 118.57 3ids n GLU 157 Ca 0.04 0.07 -0.42 0.00 -0.06 0.00 0.00 57.16 56.79 3ids n GLU 157 Cb 0.49 -1.32 -0.09 0.00 -0.06 0.00 0.00 31.44 30.45 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 -2.32 3.31 -0.07 4.31 3.76 0.46 -4.88 115.29 119.86 3ids s HIS 158 Ca -0.17 -1.32 0.03 0.00 -0.15 0.00 0.00 55.06 53.45 3ids s HIS 158 Cb 0.05 -3.03 -0.07 0.00 1.11 0.00 0.00 32.58 30.64 3ids s HIS 158 CO 0.41 -0.83 -0.02 0.72 -0.85 0.00 0.00 174.74 174.17 3ids n HIS 159 N 5.02 0.00 -3.96 1.40 8.25 -1.26 -4.73 115.22 119.93 3ids n HIS 159 Ca -0.11 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.01 3ids n HIS 159 Cb 0.43 -0.31 -0.14 0.00 1.12 0.00 0.00 29.99 31.08 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 -2.16 2.88 0.27 1.59 1.01 -1.26 -0.49 120.40 122.24 3ids s VAL 160 Ca -0.07 -0.97 0.08 0.00 0.00 0.00 0.00 61.98 61.02 3ids s VAL 160 Cb 0.02 -2.44 -0.06 0.00 0.00 0.00 0.00 36.38 33.91 3ids s VAL 160 CO 0.23 0.23 -0.09 0.68 0.00 0.00 0.00 175.10 176.15 3ids s VAL 161 N 1.34 1.79 -0.05 2.92 -7.23 -0.22 -3.67 120.40 115.28 3ids s VAL 161 Ca 0.01 -2.18 0.05 0.00 -1.81 0.00 0.00 61.98 58.05 3ids s VAL 161 Cb -0.16 -2.36 -0.02 0.00 0.56 0.00 0.00 36.38 34.39 3ids s VAL 161 CO -0.05 -0.37 -0.17 -0.55 -0.31 0.00 0.00 175.10 173.65 3ids s SER 162 N -3.44 3.76 -0.08 4.85 0.15 0.06 -0.45 113.70 118.56 3ids s SER 162 Ca 0.28 -0.28 0.12 0.00 0.70 0.00 0.00 55.95 56.77 3ids s SER 162 Cb 0.02 -0.76 0.49 0.00 -1.71 0.00 0.00 66.02 64.05 3ids s SER 162 CO 0.11 0.33 1.34 -3.20 1.20 0.00 0.00 173.24 173.02 3ids n ASN 163 N 2.42 3.39 0.00 5.45 5.15 -0.70 -0.84 115.26 130.12 3ids n ASN 163 Ca -0.17 -2.32 0.00 0.00 -0.60 0.00 0.00 54.58 51.49 3ids n ASN 163 Cb 0.52 -0.48 0.00 0.00 -0.53 0.00 0.00 39.78 39.29 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 0.66 0.00 -2.44 5.20 0.00 -1.26 -4.81 120.51 117.85 3ids n ALA 164 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.39 3ids n ALA 164 Cb 0.65 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.05 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 4.79 0.22 0.00 1.04 -1.26 -3.19 113.70 111.30 3ids s SER 165 Ca 0.00 -0.79 -0.09 0.00 0.48 0.00 0.00 55.95 55.56 3ids s SER 165 Cb 0.00 -0.68 0.22 0.00 0.10 0.00 0.00 66.02 65.65 3ids s SER 165 CO 0.00 -0.42 1.87 0.00 0.98 0.00 0.00 173.24 175.67 3ids h THR 167 N 1.02 1.24 -0.11 0.00 2.02 -1.95 -1.85 112.91 113.28 3ids h THR 167 Ca 0.31 -0.86 -0.04 0.00 0.77 0.00 0.00 66.41 66.60 3ids h THR 167 Cb -0.03 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 3ids h THR 167 CO -0.10 0.30 -0.10 0.74 0.37 0.00 0.00 175.52 176.73 3ids h THR 168 N 0.62 1.14 0.00 3.16 2.02 -1.77 -1.49 112.91 116.59 3ids h THR 168 Ca 0.14 -0.61 -0.01 0.00 0.77 0.00 0.00 66.41 66.70 3ids h THR 168 Cb 0.35 1.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 3ids h THR 168 CO 0.00 0.19 -0.06 0.78 0.37 0.00 0.00 175.52 176.80 3ids h ASN 169 N 0.16 0.00 0.11 4.18 2.35 -0.64 0.35 115.58 122.10 3ids h ASN 169 Ca 0.04 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.61 3ids h ASN 169 Cb 0.29 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.67 3ids h ASN 169 CO 0.02 0.06 -0.79 0.00 -1.65 0.00 0.00 177.43 175.07 3ids h LEU 171 N -0.47 0.28 -0.63 0.00 6.46 -1.18 -3.37 115.31 116.40 3ids h LEU 171 Ca -0.15 -0.70 0.07 0.00 -0.12 0.00 0.00 57.88 56.98 3ids h LEU 171 Cb 1.55 -0.08 -0.06 0.00 -0.73 0.00 0.00 40.66 41.34 3ids h LEU 171 CO 0.11 0.94 0.32 0.00 -0.62 0.00 0.00 178.44 179.18 3ids h ALA 172 N 0.35 0.84 -0.93 1.25 0.00 -1.14 -1.68 119.26 117.96 3ids h ALA 172 Ca -0.02 0.04 0.14 0.00 0.00 0.00 0.00 54.91 55.06 3ids h ALA 172 Cb 0.95 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.58 3ids h ALA 172 CO 0.05 -0.04 0.55 -1.35 0.00 0.00 0.00 179.25 178.46 3ids h PRO 173 N 0.58 0.79 0.28 0.00 0.11 -1.76 0.23 132.00 132.22 3ids h PRO 173 Ca 0.30 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.34 3ids h PRO 173 Cb 0.24 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.18 3ids h PRO 173 CO -0.21 0.52 -0.13 0.82 -0.21 0.00 0.00 178.00 178.78 3ids h ILE 174 N 0.81 0.75 -0.71 4.15 1.08 -1.48 -2.42 117.51 119.70 3ids h ILE 174 Ca 0.49 -0.17 -0.03 0.00 -0.39 0.00 0.00 64.86 64.76 3ids h ILE 174 Cb 0.59 0.85 -0.03 0.00 -3.07 0.00 0.00 36.82 35.16 3ids h ILE 174 CO -0.31 0.04 0.34 0.58 -0.69 0.00 0.00 178.15 178.11 3ids h VAL 175 N -0.46 1.23 -0.36 1.67 2.07 -1.04 -2.00 116.25 117.35 3ids h VAL 175 Ca -0.04 -0.64 0.03 0.00 0.82 0.00 0.00 66.70 66.88 3ids h VAL 175 Cb 0.35 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 3ids h VAL 175 CO 0.06 0.27 0.16 -0.74 0.02 0.00 0.00 177.57 177.34 3ids h HIS 176 N 1.01 0.29 -0.30 1.57 -0.00 -0.50 0.35 115.15 117.56 3ids h HIS 176 Ca 0.25 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.63 3ids h HIS 176 Cb 0.10 -0.08 -0.01 0.00 -0.00 0.00 0.00 27.41 27.42 3ids h HIS 176 CO 0.01 0.14 0.16 0.28 -0.00 0.00 0.00 177.93 178.53 3ids h VAL 177 N 0.33 1.13 -1.00 5.26 2.07 -0.92 0.17 116.25 123.29 3ids h VAL 177 Ca 0.16 -0.34 0.03 0.00 0.82 0.00 0.00 66.70 67.37 3ids h VAL 177 Cb 0.10 0.81 -0.06 0.00 -1.52 0.00 0.00 31.29 30.62 3ids h VAL 177 CO -0.13 0.13 0.66 -0.07 0.02 0.00 0.00 177.57 178.18 3ids h LEU 178 N 0.37 1.12 -0.01 2.57 3.38 -1.00 -0.67 115.31 121.06 3ids h LEU 178 Ca 0.11 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 3ids h LEU 178 Cb 0.06 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.56 3ids h LEU 178 CO -0.02 0.78 -0.40 0.58 0.09 0.00 0.00 178.44 179.47 3ids h VAL 179 N 1.30 1.48 -0.74 1.22 2.07 -0.75 -0.87 116.25 119.96 3ids h VAL 179 Ca 0.39 -1.97 -0.06 0.00 0.82 0.00 0.00 66.70 65.88 3ids h VAL 179 Cb -0.05 2.64 -0.03 0.00 -1.52 0.00 0.00 31.29 32.33 3ids h VAL 179 CO -0.11 0.56 0.25 0.50 0.02 0.00 0.00 177.57 178.78 3ids h LYS 180 N -0.30 1.14 -0.00 1.57 3.64 -0.51 -2.51 116.57 119.61 3ids h LYS 180 Ca -0.05 -0.24 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 3ids h LYS 180 Cb 1.12 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 3ids h LYS 180 CO 0.08 0.96 -0.04 0.39 -2.27 0.00 0.00 179.45 178.57 3ids n GLU 181 N -4.28 0.47 -0.63 1.90 -0.58 -0.27 -4.92 120.64 112.33 3ids n GLU 181 Ca 0.06 -0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3ids n GLU 181 Cb 0.22 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.59 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 1.30 0.65 0.26 0.62 0.00 -0.94 -4.94 105.19 102.14 3ids n GLY 182 Ca 0.14 -0.33 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 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 1.04 -0.81 1.61 0.04 -1.46 -3.44 116.94 113.92 3ids h PHE 183 Ca 0.00 -0.25 0.08 0.00 2.80 0.00 0.00 57.97 60.60 3ids h PHE 183 Cb 0.00 -0.24 -0.04 0.00 2.20 0.00 0.00 35.95 37.87 3ids h PHE 183 CO 0.00 1.04 -0.28 0.41 -0.60 0.00 0.00 178.31 178.88 3ids n GLY 184 N -0.09 -2.66 2.85 -1.45 0.00 -0.46 -0.56 105.19 102.82 3ids n GLY 184 Ca -0.01 -1.37 -0.27 0.00 0.00 0.00 0.00 46.02 44.38 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 -3.10 0.88 -0.14 1.61 1.01 -1.26 -3.44 120.40 115.96 3ids s VAL 185 Ca 0.00 -0.46 -0.27 0.00 0.00 0.00 0.00 61.98 61.25 3ids s VAL 185 Cb 0.00 -1.10 -0.24 0.00 0.00 0.00 0.00 36.38 35.04 3ids s VAL 185 CO 0.00 0.11 0.69 -0.61 0.00 0.00 0.00 175.10 175.29 3ids h GLN 186 N 8.18 0.00 -3.09 2.72 4.15 -0.70 -3.46 115.11 122.90 3ids h GLN 186 Ca -0.22 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.06 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 0.37 0.94 -0.34 0.99 -1.93 0.00 0.00 178.83 178.86 3ids s THR 187 N -2.19 0.04 -0.11 2.39 2.01 -1.22 -4.83 115.64 111.72 3ids s THR 187 Ca -0.19 -0.34 -0.18 0.00 0.31 0.00 0.00 61.69 61.29 3ids s THR 187 Cb -0.02 -0.52 0.04 0.00 0.01 0.00 0.00 72.50 72.01 3ids s THR 187 CO 0.65 -0.19 0.46 -0.83 -0.69 0.00 0.00 174.62 174.02 3ids s GLY 188 N -0.82 -0.34 -0.04 4.40 0.00 -0.24 -0.19 107.32 110.09 3ids s GLY 188 Ca -0.09 1.06 0.03 0.00 0.00 0.00 0.00 44.72 45.72 3ids s GLY 188 CO 0.03 0.84 -0.13 1.08 0.00 0.00 0.00 173.10 174.92 3ids s LEU 189 N -0.42 1.80 -0.06 0.66 1.43 0.57 -2.58 118.68 120.09 3ids s LEU 189 Ca -0.06 -0.28 0.03 0.00 -1.03 0.00 0.00 54.13 52.79 3ids s LEU 189 Cb -0.03 -0.79 -0.03 0.00 0.03 0.00 0.00 46.19 45.37 3ids s LEU 189 CO 0.03 0.09 -0.12 -0.32 0.23 0.00 0.00 176.35 176.27 3ids s MET 190 N 0.25 2.62 -0.12 1.70 -2.45 -0.19 -1.08 119.30 120.03 3ids s MET 190 Ca -0.06 -0.65 0.02 0.00 -1.25 0.00 0.00 55.69 53.74 3ids s MET 190 Cb -0.12 -2.46 -0.01 0.00 1.25 0.00 0.00 34.83 33.50 3ids s MET 190 CO 0.02 0.62 -0.18 0.99 1.05 0.00 0.00 175.02 177.52 3ids s THR 191 N -0.71 2.64 -0.16 10.11 2.01 -0.39 -0.98 115.64 128.16 3ids s THR 191 Ca 0.11 -0.81 -0.05 0.00 0.31 0.00 0.00 61.69 61.25 3ids s THR 191 Cb -0.11 -2.07 -0.03 0.00 0.01 0.00 0.00 72.50 70.29 3ids s THR 191 CO 0.01 0.54 -0.01 0.28 -0.69 0.00 0.00 174.62 174.75 3ids s THR 192 N 0.35 4.18 -0.43 -0.82 -1.32 -0.56 -0.08 115.64 116.95 3ids s THR 192 Ca -0.14 -0.26 -0.17 0.00 -1.21 0.00 0.00 61.69 59.92 3ids s THR 192 Cb -0.17 -2.85 0.03 0.00 -1.51 0.00 0.00 72.50 68.00 3ids s THR 192 CO 0.07 0.49 0.40 -0.63 -2.21 0.00 0.00 174.62 172.74 3ids s ILE 193 N 0.31 5.14 -0.08 5.08 1.01 0.09 -0.40 121.20 132.34 3ids s ILE 193 Ca -0.01 -0.51 0.05 0.00 0.00 0.00 0.00 60.65 60.17 3ids s ILE 193 Cb -0.13 -4.03 -0.01 0.00 0.01 0.00 0.00 42.46 38.30 3ids s ILE 193 CO 0.02 -0.42 -0.24 -2.28 0.00 0.00 0.00 174.94 172.02 3ids s HIS 194 N 1.98 2.51 0.61 3.97 2.46 0.57 -1.05 115.29 126.34 3ids s HIS 194 Ca 0.09 -0.87 -0.19 0.00 0.47 0.00 0.00 55.06 54.56 3ids s HIS 194 Cb -0.18 -1.66 -0.03 0.00 -0.13 0.00 0.00 32.58 30.58 3ids s HIS 194 CO 0.12 -0.31 1.23 0.43 -2.47 0.00 0.00 174.74 173.73 3ids n SER 195 N 3.23 1.89 -4.69 9.88 7.64 -1.25 -0.99 113.62 129.33 3ids n SER 195 Ca -0.18 0.86 -0.30 0.00 1.01 0.00 0.00 58.87 60.25 3ids n SER 195 Cb 0.52 -1.52 0.15 0.00 -1.01 0.00 0.00 64.21 62.35 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 -1.39 2.09 0.32 1.43 -0.85 -0.51 -4.77 117.35 113.67 3ids s TYR 196 Ca 0.79 1.44 0.04 0.00 -0.52 0.00 0.00 57.07 58.82 3ids s TYR 196 Cb -0.40 -3.17 -0.03 0.00 0.38 0.00 0.00 41.96 38.74 3ids s TYR 196 CO 0.44 -2.54 0.18 0.95 -1.52 0.00 0.00 175.55 173.05 3ids s THR 197 N -2.80 0.30 0.55 -3.49 -4.23 -1.26 -4.67 115.64 100.03 3ids s THR 197 Ca 0.64 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.43 3ids s THR 197 Cb -0.20 -2.49 0.42 0.00 1.34 0.00 0.00 72.50 71.58 3ids s THR 197 CO 0.58 0.00 1.95 0.00 -0.54 0.00 0.00 174.62 176.61 3ids h ALA 198 N 2.15 2.52 0.00 3.99 0.00 -1.97 -1.19 119.26 124.75 3ids h ALA 198 Ca -0.32 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 3ids h ALA 198 Cb 1.25 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 3ids h ALA 198 CO 0.50 -0.79 -0.10 1.79 0.00 0.00 0.00 179.25 180.65 3ids h THR 199 N 0.00 0.22 -3.89 0.00 1.35 -2.00 -3.46 112.91 105.13 3ids h THR 199 Ca 0.29 -0.88 -0.44 0.00 -0.55 0.00 0.00 66.41 64.83 3ids h THR 199 Cb 1.24 1.73 0.17 0.00 -1.73 0.00 0.00 68.15 69.56 3ids h THR 199 CO -0.00 0.09 0.36 -1.10 -0.25 0.00 0.00 175.52 174.62 3ids s GLN 200 N -3.54 0.18 -0.00 4.72 -0.21 -0.45 -5.02 119.66 115.33 3ids s GLN 200 Ca 0.02 -0.36 0.08 0.00 0.02 0.00 0.00 55.36 55.12 3ids s GLN 200 Cb 0.08 -1.79 -0.02 0.00 1.00 0.00 0.00 33.01 32.29 3ids s GLN 200 CO 0.61 -2.73 -0.25 0.15 -2.12 0.00 0.00 175.29 170.95 3ids s LYS 201 N -5.80 1.92 0.03 2.91 -0.14 -1.26 -5.00 119.74 112.40 3ids s LYS 201 Ca 0.74 -0.94 -0.23 0.00 -1.36 0.00 0.00 55.97 54.19 3ids s LYS 201 Cb -0.05 -1.92 -0.15 0.00 -1.68 0.00 0.00 37.83 34.03 3ids s LYS 201 CO 0.54 0.52 1.42 1.79 -0.76 0.00 0.00 175.35 178.86 3ids h THR 202 N 4.45 1.29 -2.32 2.17 1.35 -1.92 0.38 112.91 118.30 3ids h THR 202 Ca -0.43 -0.92 -0.57 0.00 -0.55 0.00 0.00 66.41 63.94 3ids h THR 202 Cb 1.13 1.72 -0.14 0.00 -1.73 0.00 0.00 68.15 69.13 3ids h THR 202 CO 0.46 0.26 -0.72 0.68 -0.25 0.00 0.00 175.52 175.95 3ids s VAL 203 N -4.77 2.18 -0.38 6.82 -7.23 -1.26 -3.93 120.40 111.83 3ids s VAL 203 Ca -0.15 -2.29 -0.42 0.00 -1.81 0.00 0.00 61.98 57.32 3ids s VAL 203 Cb 0.04 -2.36 -0.17 0.00 0.56 0.00 0.00 36.38 34.46 3ids s VAL 203 CO 0.70 -0.37 1.84 0.47 -0.31 0.00 0.00 175.10 177.43 3ids n ASP 204 N -0.62 1.79 0.00 4.85 8.00 -1.26 -4.42 116.55 124.90 3ids n ASP 204 Ca -0.06 0.94 0.00 0.00 0.71 0.00 0.00 54.79 56.39 3ids n ASP 204 Cb 0.61 -1.05 0.00 0.00 -0.02 0.00 0.00 41.12 40.66 3ids n ASP 204 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ids n GLY 205 N 5.04 5.25 3.50 0.44 0.00 -0.06 -4.95 105.19 114.41 3ids n GLY 205 Ca 0.34 -1.50 -0.34 0.00 0.00 0.00 0.00 46.02 44.52 3ids n GLY 205 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ids s VAL 206 N 1.96 3.98 -0.49 1.61 1.01 -1.26 -4.82 120.40 122.38 3ids s VAL 206 Ca 0.00 -0.32 0.07 0.00 0.00 0.00 0.00 61.98 61.73 3ids s VAL 206 Cb 0.00 -2.76 0.19 0.00 0.00 0.00 0.00 36.38 33.80 3ids s VAL 206 CO 0.00 0.48 0.67 -0.55 0.00 0.00 0.00 175.10 175.70 3ids s SER 207 N 0.50 -1.10 0.47 3.32 0.15 -1.26 -4.86 113.70 110.92 3ids s SER 207 Ca -0.02 -1.79 0.26 0.00 0.70 0.00 0.00 55.95 55.10 3ids s SER 207 Cb -0.14 1.63 1.09 0.00 -1.71 0.00 0.00 66.02 66.88 3ids s SER 207 CO 0.02 -0.08 1.89 0.58 1.20 0.00 0.00 173.24 176.86 3ids h VAL 208 N 4.96 0.47 0.00 4.45 2.07 -1.95 -2.67 116.25 123.58 3ids h VAL 208 Ca 0.08 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.67 3ids h VAL 208 Cb 1.09 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 32.52 3ids h VAL 208 CO 0.06 0.17 -0.81 0.29 0.02 0.00 0.00 177.57 177.31 3ids n LYS 209 N -3.39 0.19 -2.97 1.57 4.76 -1.26 -4.67 118.16 112.39 3ids n LYS 209 Ca -0.00 0.02 -0.12 0.00 -2.87 0.00 0.00 58.31 55.33 3ids n LYS 209 Cb 0.38 -1.58 -0.02 0.00 -1.84 0.00 0.00 35.03 31.96 3ids n LYS 209 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3ids n ASP 210 N -1.83 -2.41 -0.14 4.39 2.03 -1.02 -5.03 116.55 112.52 3ids n ASP 210 Ca 0.03 -2.76 -0.04 0.00 0.52 0.00 0.00 54.79 52.55 3ids n ASP 210 Cb 0.40 0.97 0.05 0.00 -0.72 0.00 0.00 41.12 41.82 3ids n ASP 210 CO 0.00 0.00 0.00 -0.50 -1.92 0.00 0.00 177.20 174.78 3ids h TRP 211 N 5.13 0.22 -0.71 -0.67 4.06 -1.78 -0.59 115.95 121.61 3ids h TRP 211 Ca 0.12 0.03 -0.02 0.00 2.06 0.00 0.00 58.89 61.07 3ids h TRP 211 Cb 1.04 -0.03 -0.03 0.00 -1.00 0.00 0.00 29.16 29.13 3ids h TRP 211 CO 0.15 0.06 0.34 0.00 -3.56 0.00 0.00 178.44 175.43 3ids h ARG 212 N 0.28 1.00 0.00 0.49 3.08 -1.90 -2.45 114.38 114.89 3ids h ARG 212 Ca 0.22 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.14 3ids h ARG 212 Cb 0.25 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3ids h ARG 212 CO -0.25 0.77 0.00 0.41 -1.07 0.00 0.00 179.97 179.83 3ids n GLY 213 N -1.11 -0.98 0.06 0.04 0.00 -0.26 -1.95 105.19 101.00 3ids n GLY 213 Ca 0.07 0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.22 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 -0.34 -1.51 3.84 -0.02 0.00 -0.92 -4.32 105.19 101.92 3ids n GLY 214 Ca 0.02 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 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 -3.10 3.64 -0.10 1.61 1.81 -0.82 -0.88 118.95 121.11 3ids s ARG 215 Ca 0.09 0.95 -0.35 0.00 -1.72 0.00 0.00 55.73 54.70 3ids s ARG 215 Cb 0.14 -2.09 -0.13 0.00 -0.45 0.00 0.00 34.95 32.43 3ids s ARG 215 CO 0.65 -0.53 1.83 0.00 -0.68 0.00 0.00 175.30 176.57 3ids n ALA 216 N -2.11 0.70 -0.08 2.13 0.00 -1.26 -4.50 120.51 115.40 3ids n ALA 216 Ca 0.07 0.32 -0.13 0.00 0.00 0.00 0.00 53.44 53.69 3ids n ALA 216 Cb 0.54 -2.44 -0.01 0.00 0.00 0.00 0.00 19.45 17.54 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 8.57 0.56 -0.56 0.00 0.00 -1.03 -3.21 119.26 123.59 3ids h ALA 217 Ca -0.48 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 53.94 3ids h ALA 217 Cb 1.28 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3ids h ALA 217 CO 0.94 0.68 0.00 0.00 0.00 0.00 0.00 179.25 180.87 3ids n ALA 218 N -2.55 2.73 -0.23 0.00 0.00 -1.26 -3.90 120.51 115.30 3ids n ALA 218 Ca -0.03 -1.17 0.00 0.00 0.00 0.00 0.00 53.44 52.23 3ids n ALA 218 Cb 0.59 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.04 3ids n ALA 218 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 3ids n VAL 219 N 1.04 0.00 -4.36 0.00 3.14 -1.23 -4.73 118.33 112.19 3ids n VAL 219 Ca 0.21 -0.31 -0.21 0.00 -2.96 0.00 0.00 64.34 61.06 3ids n VAL 219 Cb 0.64 1.23 -0.11 0.00 -1.06 0.00 0.00 33.84 34.54 3ids n VAL 219 CO 0.00 0.00 0.00 0.20 -6.46 0.00 0.00 176.83 170.57 3ids s ASN 220 N -0.24 2.82 -0.24 6.55 0.01 -1.21 -5.06 114.94 117.56 3ids s ASN 220 Ca 0.00 -0.92 -0.16 0.00 -0.71 0.00 0.00 52.86 51.07 3ids s ASN 220 Cb 0.00 -0.18 -0.04 0.00 0.41 0.00 0.00 41.25 41.45 3ids s ASN 220 CO 0.00 -0.05 0.40 -0.63 -1.51 0.00 0.00 177.10 175.31 3ids s ILE 221 N -2.33 5.17 -0.28 0.60 1.01 -1.26 -4.14 121.20 119.97 3ids s ILE 221 Ca 0.20 0.67 0.02 0.00 0.00 0.00 0.00 60.65 61.53 3ids s ILE 221 Cb -0.04 -3.73 0.08 0.00 0.01 0.00 0.00 42.46 38.77 3ids s ILE 221 CO 0.08 0.19 -0.01 -0.63 0.00 0.00 0.00 174.94 174.56 3ids s ILE 222 N 1.79 1.75 0.61 2.92 1.01 -0.16 -4.93 121.20 124.19 3ids s ILE 222 Ca 0.17 -1.63 -0.18 0.00 0.00 0.00 0.00 60.65 59.02 3ids s ILE 222 Cb -0.15 -2.10 -0.02 0.00 0.01 0.00 0.00 42.46 40.19 3ids s ILE 222 CO 0.09 -0.31 1.20 -2.84 0.00 0.00 0.00 174.94 173.08 3ids s PRO 223 N 1.24 2.87 -0.05 2.79 0.02 -1.26 -0.41 135.00 140.21 3ids s PRO 223 Ca 0.00 1.77 -0.15 0.00 0.02 0.00 0.00 61.00 62.64 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 -1.27 0.35 0.45 -0.33 0.00 0.00 177.00 176.11 3ids s SER 224 N -1.74 -0.27 0.86 2.53 0.15 -0.14 -4.76 113.70 110.33 3ids s SER 224 Ca 0.76 0.28 -0.11 0.00 0.70 0.00 0.00 55.95 57.58 3ids s SER 224 Cb -0.29 0.43 0.11 0.00 -1.71 0.00 0.00 66.02 64.56 3ids s SER 224 CO 0.35 -0.39 1.11 0.42 1.20 0.00 0.00 173.24 175.93 3ids s THR 225 N -0.97 2.69 -0.10 6.45 -4.23 -1.26 -0.63 115.64 117.59 3ids s THR 225 Ca -0.10 0.22 -0.17 0.00 -1.18 0.00 0.00 61.69 60.46 3ids s THR 225 Cb -0.04 -2.51 0.04 0.00 1.34 0.00 0.00 72.50 71.33 3ids s THR 225 CO 0.04 -0.29 0.43 0.28 -0.54 0.00 0.00 174.62 174.53 3ids s THR 226 N -2.79 0.02 -2.23 3.99 -1.32 -1.25 -4.59 115.64 107.47 3ids s THR 226 Ca 0.64 -0.16 0.27 0.00 -1.21 0.00 0.00 61.69 61.23 3ids s THR 226 Cb -0.20 -0.66 0.38 0.00 -1.51 0.00 0.00 72.50 70.51 3ids s THR 226 CO 0.57 -0.09 1.60 0.61 -2.21 0.00 0.00 174.62 175.10 3ids n GLY 227 N 2.07 -0.14 0.16 6.08 0.00 -1.26 -4.55 105.19 107.55 3ids n GLY 227 Ca -0.17 -0.46 -0.06 0.00 0.00 0.00 0.00 46.02 45.33 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 4.10 0.42 -0.23 4.61 0.00 -1.96 0.18 119.26 126.38 3ids h ALA 228 Ca 0.00 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 3ids h ALA 228 Cb 0.56 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3ids h ALA 228 CO 0.00 -0.25 -0.56 0.00 0.00 0.00 0.00 179.25 178.44 3ids h ALA 229 N 1.22 0.38 -0.54 0.00 0.00 -1.89 -2.72 119.26 115.72 3ids h ALA 229 Ca 0.16 -0.52 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 3ids h ALA 229 Cb 0.12 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3ids h ALA 229 CO -0.16 0.60 0.17 -0.22 0.00 0.00 0.00 179.25 179.64 3ids h LYS 230 N 0.53 0.80 0.00 0.00 3.64 -1.57 -2.83 116.57 117.14 3ids h LYS 230 Ca -0.00 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 3ids h LYS 230 Cb 1.17 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.86 3ids h LYS 230 CO 0.12 0.70 -0.04 0.00 -2.27 0.00 0.00 179.45 177.95 3ids h ALA 231 N 1.40 1.47 0.00 5.00 0.00 -0.34 -1.14 119.26 125.66 3ids h ALA 231 Ca 0.18 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3ids h ALA 231 Cb 0.23 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 3ids h ALA 231 CO -0.01 0.05 -0.02 0.28 0.00 0.00 0.00 179.25 179.56 3ids h VAL 232 N 0.00 0.72 -0.84 0.00 2.07 -1.33 -1.68 116.25 115.18 3ids h VAL 232 Ca -0.00 -0.07 0.12 0.00 0.82 0.00 0.00 66.70 67.57 3ids h VAL 232 Cb 0.11 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 30.86 3ids h VAL 232 CO 0.01 0.02 0.55 1.23 0.02 0.00 0.00 177.57 179.39 3ids h GLY 233 N 0.09 1.11 2.00 2.17 0.00 -1.35 0.68 103.07 107.76 3ids h GLY 233 Ca -0.00 -0.30 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 3ids h GLY 233 CO 0.00 0.13 -0.12 -0.33 0.00 0.00 0.00 176.54 176.22 3ids h MET 234 N 0.70 0.00 0.00 4.80 2.86 -1.47 -2.60 114.93 119.22 3ids h MET 234 Ca 0.41 0.00 -0.30 0.00 -2.06 0.00 0.00 59.70 57.75 3ids h MET 234 Cb 0.60 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.20 3ids h MET 234 CO -0.17 0.12 -2.19 0.28 1.06 0.00 0.00 176.91 176.01 3ids n VAL 235 N -3.14 1.20 -3.44 -2.22 0.31 -0.68 -4.61 118.33 105.75 3ids n VAL 235 Ca 0.03 -0.79 -0.27 0.00 -0.01 0.00 0.00 64.34 63.30 3ids n VAL 235 Cb 0.55 -0.48 -0.10 0.00 -0.91 0.00 0.00 33.84 32.90 3ids n VAL 235 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3ids n ILE 236 N -2.72 -0.56 -0.39 2.52 5.41 0.23 -4.68 119.36 119.16 3ids n ILE 236 Ca -0.26 -3.81 0.33 0.00 1.00 0.00 0.00 62.75 60.02 3ids n ILE 236 Cb 1.04 -1.80 0.64 0.00 -0.71 0.00 0.00 39.64 38.82 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 5.30 0.16 0.00 0.38 0.11 -1.67 0.20 132.00 136.48 3ids h PRO 237 Ca 0.22 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.32 3ids h PRO 237 Cb 0.87 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.94 3ids h PRO 237 CO 0.46 0.10 -0.02 0.66 -0.21 0.00 0.00 178.00 178.99 3ids h SER 238 N 0.16 0.00 0.02 -2.05 4.64 -1.93 -1.72 113.55 112.66 3ids h SER 238 Ca 0.69 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.01 3ids h SER 238 Cb 2.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.32 3ids h SER 238 CO -0.23 0.02 -0.02 0.35 -0.87 0.00 0.00 176.83 176.07 3ids n THR 239 N -3.52 0.00 -1.66 2.95 -2.24 0.71 -4.92 114.28 105.60 3ids n THR 239 Ca -0.03 -0.22 -0.48 0.00 -2.27 0.00 0.00 64.05 61.05 3ids n THR 239 Cb 0.11 0.41 -0.05 0.00 -2.10 0.00 0.00 70.33 68.70 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 -0.00 1.92 -0.96 -0.78 -0.06 -0.65 -1.38 117.38 115.47 3ids n GLN 240 Ca 0.19 0.70 0.00 0.00 -2.00 0.00 0.00 57.00 55.88 3ids n GLN 240 Cb 0.34 -2.46 0.00 0.00 -4.06 0.00 0.00 30.24 24.06 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 3.57 0.77 0.15 1.69 0.00 -1.26 -4.85 105.19 105.27 3ids n GLY 241 Ca 0.19 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.15 1.58 -4.28 1.61 5.02 -0.48 -4.97 118.16 114.50 3ids n LYS 242 Ca 0.00 -0.33 -0.19 0.00 -2.02 0.00 0.00 58.31 55.76 3ids n LYS 242 Cb 0.01 -1.29 -0.15 0.00 -0.02 0.00 0.00 35.03 33.58 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 -2.52 1.71 0.00 -0.35 1.43 -1.25 -1.08 118.68 116.62 3ids s LEU 243 Ca 0.09 -0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 53.04 3ids s LEU 243 Cb 0.13 -0.46 0.00 0.00 0.03 0.00 0.00 46.19 45.90 3ids s LEU 243 CO 0.58 0.03 0.29 1.07 0.23 0.00 0.00 176.35 178.55 3ids n THR 244 N 3.42 0.00 -3.98 5.49 5.66 -1.06 -3.56 114.28 120.25 3ids n THR 244 Ca -0.19 -1.10 0.01 0.00 -3.05 0.00 0.00 64.05 59.72 3ids n THR 244 Cb 0.54 0.66 0.00 0.00 -1.55 0.00 0.00 70.33 69.99 3ids n THR 244 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3ids n GLY 245 N -0.35 0.38 3.42 1.09 0.00 -1.26 -1.02 105.19 107.46 3ids n GLY 245 Ca 0.01 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 45.07 3ids n GLY 245 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3ids s MET 246 N -2.00 1.56 0.06 1.61 0.23 -0.15 -3.81 119.30 116.79 3ids s MET 246 Ca 0.05 -1.56 0.09 0.00 -1.03 0.00 0.00 55.69 53.23 3ids s MET 246 Cb -0.00 0.39 -0.03 0.00 -1.53 0.00 0.00 34.83 33.66 3ids s MET 246 CO -0.00 -0.61 -0.24 0.45 -2.03 0.00 0.00 175.02 172.59 3ids s SER 247 N -3.15 2.87 -0.23 -1.18 0.15 0.20 -1.50 113.70 110.87 3ids s SER 247 Ca 0.31 -0.58 -0.00 0.00 0.70 0.00 0.00 55.95 56.37 3ids s SER 247 Cb 0.02 -0.24 0.03 0.00 -1.71 0.00 0.00 66.02 64.11 3ids s SER 247 CO 0.14 0.20 -0.10 -0.36 1.20 0.00 0.00 173.24 174.32 3ids s PHE 248 N -0.84 3.01 -0.18 3.44 0.08 0.46 -0.97 117.98 122.98 3ids s PHE 248 Ca 0.10 -1.64 -0.24 0.00 0.12 0.00 0.00 56.93 55.28 3ids s PHE 248 Cb -0.10 -2.01 -0.02 0.00 -0.57 0.00 0.00 43.02 40.33 3ids s PHE 248 CO 0.02 -0.76 0.76 1.03 -0.10 0.00 0.00 175.22 176.18 3ids s ARG 249 N 1.30 4.27 0.22 0.44 0.52 0.46 -0.31 118.95 125.84 3ids s ARG 249 Ca 0.01 0.88 0.07 0.00 -0.52 0.00 0.00 55.73 56.17 3ids s ARG 249 Cb -0.16 -3.57 -0.05 0.00 0.52 0.00 0.00 34.95 31.69 3ids s ARG 249 CO -0.07 -0.29 -0.12 0.14 0.02 0.00 0.00 175.30 174.98 3ids s VAL 250 N 2.05 1.71 -1.14 3.52 -7.23 -0.16 -0.99 120.40 118.16 3ids s VAL 250 Ca 0.35 -2.19 -0.10 0.00 -1.81 0.00 0.00 61.98 58.23 3ids s VAL 250 Cb -0.16 -2.15 -0.07 0.00 0.56 0.00 0.00 36.38 34.55 3ids s VAL 250 CO 0.12 -0.51 2.34 -2.65 -0.31 0.00 0.00 175.10 174.08 3ids n PRO 251 N -0.44 2.53 -4.54 4.82 -0.02 -1.26 -2.97 135.00 133.13 3ids n PRO 251 Ca -0.07 -1.81 -0.22 0.00 -2.02 0.00 0.00 63.50 59.37 3ids n PRO 251 Cb 0.61 -2.68 -0.14 0.00 -0.02 0.00 0.00 33.50 31.27 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 3.25 1.29 -0.83 3.45 -4.23 -1.26 -5.01 115.64 112.30 3ids s THR 252 Ca 0.51 -0.95 0.27 0.00 -1.18 0.00 0.00 61.69 60.34 3ids s THR 252 Cb 0.13 -1.12 0.23 0.00 1.34 0.00 0.00 72.50 73.07 3ids s THR 252 CO -0.03 0.16 1.76 -0.81 -0.54 0.00 0.00 174.62 175.16 3ids n PRO 253 N 2.12 0.16 -3.51 3.99 -0.04 -1.26 -1.42 135.00 135.04 3ids n PRO 253 Ca -0.17 0.11 -0.11 0.00 -0.04 0.00 0.00 63.50 63.29 3ids n PRO 253 Cb 0.54 -1.67 -0.04 0.00 -0.04 0.00 0.00 33.50 32.30 3ids n PRO 253 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3ids s ASP 254 N -3.86 -0.46 0.00 3.54 2.15 -1.26 -4.71 116.67 112.07 3ids s ASP 254 Ca 0.11 0.24 0.00 0.00 0.43 0.00 0.00 52.55 53.33 3ids s ASP 254 Cb 0.15 0.43 0.00 0.00 -0.30 0.00 0.00 42.92 43.20 3ids s ASP 254 CO 0.59 -0.61 0.00 0.52 -0.17 0.00 0.00 175.17 175.50 3ids n VAL 255 N 0.20 -1.09 -4.31 1.11 0.31 -1.26 -4.89 118.33 108.40 3ids n VAL 255 Ca -0.13 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.04 3ids n VAL 255 Cb 0.60 -1.09 -0.10 0.00 -0.91 0.00 0.00 33.84 32.35 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 -0.56 1.27 -0.02 4.52 0.01 0.19 -3.90 113.70 115.20 3ids s SER 256 Ca 0.00 -1.35 -0.01 0.00 1.31 0.00 0.00 55.95 55.90 3ids s SER 256 Cb 0.00 0.14 0.02 0.00 0.21 0.00 0.00 66.02 66.39 3ids s SER 256 CO 0.00 -0.70 0.05 0.54 0.41 0.00 0.00 173.24 173.54 3ids s VAL 257 N -3.71 -0.03 -0.10 3.43 0.11 -0.22 -1.40 120.40 118.48 3ids s VAL 257 Ca 0.36 0.12 -0.16 0.00 -2.93 0.00 0.00 61.98 59.36 3ids s VAL 257 Cb 0.08 -0.10 -0.05 0.00 -1.53 0.00 0.00 36.38 34.78 3ids s VAL 257 CO 0.12 0.05 0.42 -0.69 -3.33 0.00 0.00 175.10 171.67 3ids s VAL 258 N 0.63 5.18 -0.47 2.04 1.01 0.17 -0.73 120.40 128.23 3ids s VAL 258 Ca -0.05 0.83 0.04 0.00 0.00 0.00 0.00 61.98 62.80 3ids s VAL 258 Cb -0.07 -3.75 0.13 0.00 0.00 0.00 0.00 36.38 32.68 3ids s VAL 258 CO -0.02 0.39 0.22 -0.62 0.00 0.00 0.00 175.10 175.07 3ids s ASP 259 N 0.22 4.26 -0.19 3.32 2.15 0.88 -0.92 116.67 126.40 3ids s ASP 259 Ca 0.23 -2.77 -0.17 0.00 0.43 0.00 0.00 52.55 50.27 3ids s ASP 259 Cb -0.15 -1.51 -0.04 0.00 -0.30 0.00 0.00 42.92 40.92 3ids s ASP 259 CO 0.09 -0.27 0.45 -0.22 -0.17 0.00 0.00 175.17 175.05 3ids s LEU 260 N 0.06 4.17 -0.11 -1.34 2.96 -0.22 -1.27 118.68 122.93 3ids s LEU 260 Ca 0.16 0.61 0.01 0.00 -0.22 0.00 0.00 54.13 54.69 3ids s LEU 260 Cb -0.24 -2.60 -0.01 0.00 0.50 0.00 0.00 46.19 43.83 3ids s LEU 260 CO -0.02 -0.09 -0.15 -0.89 -1.32 0.00 0.00 176.35 173.88 3ids s THR 261 N 1.28 2.87 0.11 3.68 2.01 -0.24 -0.53 115.64 124.82 3ids s THR 261 Ca 0.22 -0.74 -0.14 0.00 0.31 0.00 0.00 61.69 61.34 3ids s THR 261 Cb -0.15 -2.18 0.03 0.00 0.01 0.00 0.00 72.50 70.21 3ids s THR 261 CO 0.09 0.54 0.35 0.72 -0.69 0.00 0.00 174.62 175.62 3ids s PHE 262 N 0.19 -0.12 -0.22 4.92 -0.71 -0.43 -0.32 117.98 121.29 3ids s PHE 262 Ca -0.09 -0.21 -0.06 0.00 -1.04 0.00 0.00 56.93 55.52 3ids s PHE 262 Cb -0.15 0.18 -0.03 0.00 -1.21 0.00 0.00 43.02 41.80 3ids s PHE 262 CO 0.05 -0.65 0.04 0.99 -1.34 0.00 0.00 175.22 174.31 3ids s THR 263 N -3.73 4.19 0.74 -4.49 2.01 0.74 -1.46 115.64 113.63 3ids s THR 263 Ca 0.03 -0.22 -0.11 0.00 0.31 0.00 0.00 61.69 61.70 3ids s THR 263 Cb 0.02 -2.93 0.04 0.00 0.01 0.00 0.00 72.50 69.64 3ids s THR 263 CO -0.11 0.39 1.08 0.00 -0.69 0.00 0.00 174.62 175.28 3ids s ALA 264 N 1.26 2.43 -1.07 7.40 0.00 0.20 -0.06 121.76 131.92 3ids s ALA 264 Ca 0.04 0.21 0.26 0.00 0.00 0.00 0.00 51.96 52.47 3ids s ALA 264 Cb -0.15 -3.24 0.64 0.00 0.00 0.00 0.00 23.12 20.38 3ids s ALA 264 CO 0.02 -1.54 1.51 0.00 0.00 0.00 0.00 175.76 175.75 3ids n ALA 265 N -3.33 3.33 -2.36 0.00 0.00 0.28 -4.48 120.51 113.96 3ids n ALA 265 Ca 0.09 -0.32 -0.10 0.00 0.00 0.00 0.00 53.44 53.11 3ids n ALA 265 Cb 0.53 -1.17 -0.09 0.00 0.00 0.00 0.00 19.45 18.72 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 -2.95 1.07 0.22 0.00 1.70 -1.15 -5.00 118.95 112.84 3ids s ARG 266 Ca 0.13 -1.40 -0.31 0.00 -0.47 0.00 0.00 55.73 53.67 3ids s ARG 266 Cb 0.18 0.29 -0.12 0.00 -0.57 0.00 0.00 34.95 34.74 3ids s ARG 266 CO 0.66 -0.35 1.67 -0.51 -1.08 0.00 0.00 175.30 175.69 3ids s ASP 267 N -3.05 6.41 0.00 -2.89 1.11 -1.26 -4.79 116.67 112.20 3ids s ASP 267 Ca 0.25 2.85 0.00 0.00 0.18 0.00 0.00 52.55 55.83 3ids s ASP 267 Cb 0.06 -2.61 0.00 0.00 1.07 0.00 0.00 42.92 41.44 3ids s ASP 267 CO 0.04 -0.94 0.00 1.07 1.18 0.00 0.00 175.17 176.52 3ids n THR 268 N 3.61 0.00 -3.56 -1.27 5.66 -0.36 -5.05 114.28 113.30 3ids n THR 268 Ca 0.14 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 61.02 3ids n THR 268 Cb 0.36 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.10 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 1.55 -0.38 0.38 1.09 1.04 -1.26 -4.25 113.70 111.86 3ids s SER 269 Ca 0.00 -0.10 0.05 0.00 0.48 0.00 0.00 55.95 56.39 3ids s SER 269 Cb 0.00 0.51 0.74 0.00 0.10 0.00 0.00 66.02 67.37 3ids s SER 269 CO 0.00 -0.84 1.99 -0.29 0.98 0.00 0.00 173.24 175.07 3ids h ILE 270 N 2.39 1.14 -0.69 -1.02 6.09 -1.94 -2.01 117.51 121.48 3ids h ILE 270 Ca -0.33 -0.41 -0.03 0.00 -1.37 0.00 0.00 64.86 62.72 3ids h ILE 270 Cb 1.26 0.62 -0.03 0.00 0.47 0.00 0.00 36.82 39.14 3ids h ILE 270 CO 0.43 0.17 0.33 1.56 -3.07 0.00 0.00 178.15 177.56 3ids h GLN 271 N 0.58 0.99 -0.44 2.19 7.50 -1.97 0.32 115.11 124.28 3ids h GLN 271 Ca 0.15 -0.15 -0.07 0.00 0.50 0.00 0.00 58.65 59.07 3ids h GLN 271 Cb 0.07 -0.18 -0.02 0.00 0.05 0.00 0.00 27.48 27.41 3ids h GLN 271 CO -0.02 0.79 -0.01 1.49 -1.50 0.00 0.00 178.83 179.58 3ids h GLU 272 N 0.96 0.79 -0.12 1.46 4.81 -1.86 -1.65 114.58 118.97 3ids h GLU 272 Ca 0.24 -0.26 -0.01 0.00 -0.13 0.00 0.00 59.36 59.20 3ids h GLU 272 Cb 0.13 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 3ids h GLU 272 CO -0.03 0.86 0.05 0.82 -0.73 0.00 0.00 179.01 179.98 3ids h ILE 273 N 0.63 1.16 -0.66 2.32 2.04 -1.15 -1.66 117.51 120.19 3ids h ILE 273 Ca 0.12 -0.48 0.11 0.00 1.00 0.00 0.00 64.86 65.62 3ids h ILE 273 Cb 0.51 1.25 -0.08 0.00 -0.74 0.00 0.00 36.82 37.76 3ids h ILE 273 CO 0.03 0.14 0.25 -0.78 0.00 0.00 0.00 178.15 177.78 3ids h ASP 274 N 0.03 0.23 -0.50 1.72 3.58 -0.33 -1.18 116.42 119.98 3ids h ASP 274 Ca 0.04 0.09 -0.11 0.00 0.42 0.00 0.00 57.03 57.47 3ids h ASP 274 Cb 0.19 0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.29 3ids h ASP 274 CO -0.00 0.12 -0.12 0.00 -2.88 0.00 0.00 179.24 176.36 3ids h ALA 275 N 1.46 0.80 -0.48 -0.78 0.00 -1.07 -2.47 119.26 116.73 3ids h ALA 275 Ca 0.34 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3ids h ALA 275 Cb 0.46 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3ids h ALA 275 CO -0.34 0.66 0.06 0.00 0.00 0.00 0.00 179.25 179.62 3ids h ALA 276 N 0.98 0.63 -0.54 0.00 0.00 -0.71 -1.83 119.26 117.79 3ids h ALA 276 Ca 0.13 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3ids h ALA 276 Cb 0.68 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3ids h ALA 276 CO 0.05 0.38 0.32 -0.07 0.00 0.00 0.00 179.25 179.93 3ids h LEU 277 N 0.67 0.66 -0.52 0.00 3.38 -1.17 0.21 115.31 118.54 3ids h LEU 277 Ca 0.14 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3ids h LEU 277 Cb 0.42 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 3ids h LEU 277 CO 0.01 0.53 0.32 0.11 0.09 0.00 0.00 178.44 179.51 3ids h LYS 278 N 0.73 0.70 -0.36 1.13 1.57 -1.39 -1.57 116.57 117.38 3ids h LYS 278 Ca 0.19 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.86 3ids h LYS 278 Cb 0.00 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 3ids h LYS 278 CO -0.04 0.49 -0.00 0.00 -0.57 0.00 0.00 179.45 179.33 3ids h ARG 279 N 0.70 0.64 -0.80 3.15 2.47 -1.14 -2.53 114.38 116.86 3ids h ARG 279 Ca 0.19 -0.20 0.06 0.00 -1.26 0.00 0.00 59.98 58.76 3ids h ARG 279 Cb -0.03 -0.06 -0.06 0.00 -1.65 0.00 0.00 29.97 28.17 3ids h ARG 279 CO -0.04 0.75 0.49 0.00 0.56 0.00 0.00 179.97 181.73 3ids h ALA 280 N 0.86 1.09 0.00 0.04 0.00 -0.82 -2.27 119.26 118.16 3ids h ALA 280 Ca 0.10 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3ids h ALA 280 Cb 0.47 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3ids h ALA 280 CO 0.02 0.23 -0.16 0.66 0.00 0.00 0.00 179.25 180.00 3ids h SER 281 N 0.91 0.00 0.85 0.00 4.64 -1.03 0.72 113.55 119.63 3ids h SER 281 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 3ids h SER 281 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 3ids h SER 281 CO -0.16 0.16 -0.56 0.29 -0.87 0.00 0.00 176.83 175.69 3ids n LYS 282 N -3.44 0.24 0.00 4.77 5.02 -0.90 -3.62 118.16 120.23 3ids n LYS 282 Ca -0.01 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 3ids n LYS 282 Cb 0.34 -1.66 0.00 0.00 -0.02 0.00 0.00 35.03 33.69 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 -2.01 0.00 0.54 -0.18 -2.24 -0.73 -4.81 114.28 104.84 3ids n THR 283 Ca 0.04 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.92 3ids n THR 283 Cb 0.42 0.00 0.43 0.00 -2.10 0.00 0.00 70.33 69.08 3ids n THR 283 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3ids n TYR 284 N 0.00 0.44 -0.43 4.78 4.11 -1.10 -1.79 117.16 123.16 3ids n TYR 284 Ca 0.00 0.16 0.07 0.00 -0.00 0.00 0.00 57.90 58.13 3ids n TYR 284 Cb 0.00 -0.76 0.22 0.00 -0.00 0.00 0.00 39.34 38.81 3ids n TYR 284 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.86 175.53 3ids n MET 285 N -1.89 3.00 -1.72 -3.48 2.81 0.17 -5.01 117.12 111.00 3ids n MET 285 Ca 0.04 -2.40 -0.43 0.00 -1.81 0.00 0.00 57.70 53.10 3ids n MET 285 Cb 0.25 -1.51 -0.02 0.00 -0.71 0.00 0.00 33.22 31.23 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 0.50 2.57 0.00 0.03 4.81 -0.74 -1.02 118.16 124.31 3ids n LYS 286 Ca 0.17 0.92 0.00 0.00 -0.87 0.00 0.00 58.31 58.53 3ids n LYS 286 Cb 0.61 -2.69 0.00 0.00 0.02 0.00 0.00 35.03 32.97 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 2.63 2.68 0.43 3.14 0.00 -1.26 -4.79 105.19 108.03 3ids n GLY 287 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 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 1.28 -3.90 -0.61 2.08 -0.27 -4.41 119.36 111.53 3ids n ILE 288 Ca 0.00 0.08 -0.36 0.00 0.56 0.00 0.00 62.75 63.04 3ids n ILE 288 Cb 0.00 -1.98 -0.11 0.00 -0.75 0.00 0.00 39.64 36.80 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 -7.40 3.61 0.50 1.39 2.96 -0.19 -0.87 118.68 118.68 3ids s LEU 289 Ca -0.21 -0.08 0.04 0.00 -0.22 0.00 0.00 54.13 53.66 3ids s LEU 289 Cb 0.05 -1.94 -0.01 0.00 0.50 0.00 0.00 46.19 44.79 3ids s LEU 289 CO 0.29 0.06 0.16 -0.83 -1.32 0.00 0.00 176.35 174.71 3ids s GLY 290 N 1.04 2.68 0.10 7.98 0.00 0.53 -4.42 107.32 115.22 3ids s GLY 290 Ca 0.04 -1.07 -0.07 0.00 0.00 0.00 0.00 44.72 43.62 3ids s GLY 290 CO 0.03 -2.07 0.16 -2.52 0.00 0.00 0.00 173.10 168.71 3ids s TYR 291 N -2.79 0.28 0.10 1.90 1.13 -1.26 -0.57 117.35 116.14 3ids s TYR 291 Ca 0.22 -0.72 0.07 0.00 -1.41 0.00 0.00 57.07 55.23 3ids s TYR 291 Cb 0.01 -0.13 -0.03 0.00 -1.10 0.00 0.00 41.96 40.71 3ids s TYR 291 CO 0.13 -0.55 -0.18 -0.08 -2.51 0.00 0.00 175.55 172.37 3ids s THR 292 N -3.90 1.47 -0.11 -3.49 -1.32 0.06 -4.87 115.64 103.48 3ids s THR 292 Ca 0.08 -1.52 0.14 0.00 -1.21 0.00 0.00 61.69 59.19 3ids s THR 292 Cb 0.05 -1.42 0.27 0.00 -1.51 0.00 0.00 72.50 69.89 3ids s THR 292 CO -0.09 -0.18 1.14 -0.90 -2.21 0.00 0.00 174.62 172.38 3ids n ASP 293 N 1.01 1.70 -4.95 8.08 3.85 -1.26 -1.30 116.55 123.68 3ids n ASP 293 Ca -0.19 -2.97 -0.19 0.00 -0.71 0.00 0.00 54.79 50.73 3ids n ASP 293 Cb 0.54 -0.40 -0.01 0.00 -1.35 0.00 0.00 41.12 39.91 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 -2.22 2.77 -1.40 0.11 2.02 -1.26 -4.77 118.70 113.95 3ids s GLU 294 Ca 0.27 -1.30 -0.11 0.00 0.02 0.00 0.00 54.97 53.85 3ids s GLU 294 Cb 0.25 -2.63 0.08 0.00 0.10 0.00 0.00 34.13 31.93 3ids s GLU 294 CO -0.01 -0.17 2.17 0.39 0.02 0.00 0.00 175.26 177.67 3ids n GLU 295 N -1.69 3.37 -3.55 1.61 -0.58 -1.26 -4.85 120.64 113.70 3ids n GLU 295 Ca 0.05 -2.99 -0.29 0.00 -0.42 0.00 0.00 57.16 53.51 3ids n GLU 295 Cb 0.60 -3.05 -0.04 0.00 -0.57 0.00 0.00 31.44 28.38 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 0.75 4.17 0.45 -4.62 1.43 -1.26 -5.11 118.68 114.49 3ids s LEU 296 Ca 0.47 0.58 0.04 0.00 -1.03 0.00 0.00 54.13 54.18 3ids s LEU 296 Cb 0.13 -3.36 -0.04 0.00 0.03 0.00 0.00 46.19 42.95 3ids s LEU 296 CO -0.05 -0.08 0.03 0.68 0.23 0.00 0.00 176.35 177.15 3ids s VAL 297 N -1.91 1.37 0.24 -1.59 -7.23 -1.26 -5.03 120.40 104.99 3ids s VAL 297 Ca 0.41 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.54 3ids s VAL 297 Cb -0.11 -2.52 0.21 0.00 0.56 0.00 0.00 36.38 34.51 3ids s VAL 297 CO 0.28 0.00 1.77 0.77 -0.31 0.00 0.00 175.10 177.61 3ids h SER 298 N 1.62 0.47 -0.33 4.85 4.64 -1.97 -0.83 113.55 121.99 3ids h SER 298 Ca -0.43 0.08 0.10 0.00 -0.47 0.00 0.00 61.79 61.07 3ids h SER 298 Cb 1.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.36 3ids h SER 298 CO 0.74 0.23 0.27 0.00 -0.87 0.00 0.00 176.83 177.21 3ids h ALA 299 N 1.49 2.18 0.00 5.18 0.00 -1.97 -1.68 119.26 124.46 3ids h ALA 299 Ca 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3ids h ALA 299 Cb 0.49 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3ids h ALA 299 CO -0.32 -0.44 0.00 -0.25 0.00 0.00 0.00 179.25 178.24 3ids n ASP 300 N -4.17 0.31 -0.78 0.00 8.00 -0.32 -2.36 116.55 117.24 3ids n ASP 300 Ca 0.05 0.56 0.12 0.00 0.71 0.00 0.00 54.79 56.23 3ids n ASP 300 Cb 0.44 -0.63 0.08 0.00 -0.02 0.00 0.00 41.12 40.99 3ids n ASP 300 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3ids n PHE 301 N -1.82 0.00 -1.69 1.24 3.01 -0.63 -4.91 117.46 112.65 3ids n PHE 301 Ca 0.04 0.00 -0.44 0.00 1.01 0.00 0.00 57.45 58.06 3ids n PHE 301 Cb 0.27 -0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.70 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 0.81 0.03 -1.11 4.37 5.41 -1.00 -1.55 119.36 126.32 3ids n ILE 302 Ca 0.12 -0.01 -0.04 0.00 1.00 0.00 0.00 62.75 63.83 3ids n ILE 302 Cb 0.54 -1.76 -0.02 0.00 -0.71 0.00 0.00 39.64 37.69 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 3.65 -4.06 -4.69 4.38 5.03 -1.26 -5.00 115.26 113.32 3ids n ASN 303 Ca 0.16 0.09 -0.42 0.00 0.87 0.00 0.00 54.58 55.28 3ids n ASN 303 Cb 0.32 -1.89 -0.03 0.00 -1.02 0.00 0.00 39.78 37.16 3ids n ASN 303 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3ids s ASP 304 N -2.43 7.23 0.00 6.41 -1.08 -0.60 -4.92 116.67 121.28 3ids s ASP 304 Ca 0.00 1.57 0.29 0.00 -0.52 0.00 0.00 52.55 53.88 3ids s ASP 304 Cb 0.00 -2.56 1.29 0.00 -1.46 0.00 0.00 42.92 40.19 3ids s ASP 304 CO 0.00 -0.46 1.88 -0.46 0.52 0.00 0.00 175.17 176.65 3ids n ASN 305 N 4.99 1.03 -4.81 -0.34 2.04 -1.26 -3.66 115.26 113.25 3ids n ASN 305 Ca 0.09 -1.36 -0.33 0.00 -0.44 0.00 0.00 54.58 52.54 3ids n ASN 305 Cb 0.49 -0.01 0.01 0.00 -2.53 0.00 0.00 39.78 37.74 3ids n ASN 305 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 3ids s ARG 306 N -1.99 3.36 0.34 -3.83 3.00 -1.26 -4.63 118.95 113.94 3ids s ARG 306 Ca 0.40 1.16 0.16 0.00 0.00 0.00 0.00 55.73 57.46 3ids s ARG 306 Cb 0.21 -2.04 0.56 0.00 0.00 0.00 0.00 34.95 33.68 3ids s ARG 306 CO 0.34 -0.77 1.68 0.77 0.00 0.00 0.00 175.30 177.32 3ids h SER 307 N 0.42 0.00 -2.78 0.23 0.02 -1.21 -3.40 113.55 106.83 3ids h SER 307 Ca -0.47 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.46 3ids h SER 307 Cb 1.22 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.52 3ids h SER 307 CO 0.58 0.45 -0.16 -0.55 -1.14 0.00 0.00 176.83 176.01 3ids s SER 308 N -6.55 -0.76 -0.34 3.07 0.15 -0.99 -3.53 113.70 104.75 3ids s SER 308 Ca -0.00 1.28 0.03 0.00 0.70 0.00 0.00 55.95 57.96 3ids s SER 308 Cb 0.11 1.41 0.10 0.00 -1.71 0.00 0.00 66.02 65.93 3ids s SER 308 CO 0.71 -0.22 0.07 -0.63 1.20 0.00 0.00 173.24 174.37 3ids s ILE 309 N 1.99 2.03 0.17 6.45 1.09 0.51 -0.35 121.20 133.10 3ids s ILE 309 Ca -0.08 -2.22 -0.31 0.00 -1.10 0.00 0.00 60.65 56.94 3ids s ILE 309 Cb -0.08 -2.50 -0.10 0.00 -1.06 0.00 0.00 42.46 38.71 3ids s ILE 309 CO -0.17 -0.62 1.54 -0.47 -0.10 0.00 0.00 174.94 175.12 3ids s TYR 310 N 0.98 3.07 -0.58 3.97 5.04 0.26 -0.45 117.35 129.63 3ids s TYR 310 Ca 0.11 0.70 -0.17 0.00 -2.44 0.00 0.00 57.07 55.26 3ids s TYR 310 Cb -0.19 -3.90 0.12 0.00 0.35 0.00 0.00 41.96 38.34 3ids s TYR 310 CO -0.11 -3.27 0.62 0.34 -1.34 0.00 0.00 175.55 171.80 3ids s ASP 311 N 1.05 6.22 0.08 4.32 -1.08 -0.29 -0.76 116.67 126.19 3ids s ASP 311 Ca 0.68 -1.66 -0.18 0.00 -0.52 0.00 0.00 52.55 50.87 3ids s ASP 311 Cb -0.43 -2.26 -0.09 0.00 -1.46 0.00 0.00 42.92 38.68 3ids s ASP 311 CO 0.33 -0.98 1.47 -1.28 0.52 0.00 0.00 175.17 175.23 3ids h SER 312 N 8.99 0.46 -0.20 -0.34 0.87 -1.50 -1.80 113.55 120.03 3ids h SER 312 Ca -0.27 -0.37 -0.02 0.00 -1.23 0.00 0.00 61.79 59.89 3ids h SER 312 Cb 1.09 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.92 3ids h SER 312 CO 1.06 0.73 0.03 0.11 -0.53 0.00 0.00 176.83 178.22 3ids h LYS 313 N 0.19 0.33 -0.78 2.24 1.79 -1.86 0.19 116.57 118.67 3ids h LYS 313 Ca 0.06 -0.09 0.06 0.00 -2.18 0.00 0.00 60.65 58.50 3ids h LYS 313 Cb 0.53 -0.04 -0.06 0.00 -1.58 0.00 0.00 32.23 31.08 3ids h LYS 313 CO 0.02 0.49 0.47 0.00 -1.08 0.00 0.00 179.45 179.36 3ids h ALA 314 N 0.83 1.06 -0.07 3.86 0.00 -1.92 -1.15 119.26 121.86 3ids h ALA 314 Ca 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 3ids h ALA 314 Cb 0.33 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3ids h ALA 314 CO 0.00 0.18 -0.27 1.15 0.00 0.00 0.00 179.25 180.32 3ids h THR 315 N 0.85 1.42 -0.07 0.00 2.02 -1.15 -3.06 112.91 112.93 3ids h THR 315 Ca 0.34 -1.66 -0.08 0.00 0.77 0.00 0.00 66.41 65.78 3ids h THR 315 Cb 0.17 2.30 -0.01 0.00 -1.74 0.00 0.00 68.15 68.87 3ids h THR 315 CO -0.17 0.48 -0.33 -0.07 0.37 0.00 0.00 175.52 175.80 3ids h LEU 316 N -0.18 0.13 0.00 2.58 3.38 -0.56 -3.18 115.31 117.48 3ids h LEU 316 Ca -0.01 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3ids h LEU 316 Cb 0.91 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.63 3ids h LEU 316 CO 0.06 0.46 -0.32 1.56 0.09 0.00 0.00 178.44 180.29 3ids h GLN 317 N 0.12 0.00 0.00 1.13 4.20 -1.26 -3.37 115.11 115.92 3ids h GLN 317 Ca 0.01 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 3ids h GLN 317 Cb 0.64 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.37 3ids h GLN 317 CO 0.05 0.00 -0.55 0.09 -0.67 0.00 0.00 178.83 177.75 3ids n ASN 318 N -2.40 1.63 -4.76 1.46 3.02 -1.16 -5.02 115.26 108.03 3ids n ASN 318 Ca 0.04 -3.60 -0.24 0.00 -0.03 0.00 0.00 54.58 50.76 3ids n ASN 318 Cb 0.46 -0.49 -0.06 0.00 -0.61 0.00 0.00 39.78 39.08 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 -3.04 4.57 -0.02 6.41 0.01 -1.25 -4.86 114.94 116.76 3ids s ASN 319 Ca 0.37 -0.97 -0.30 0.00 -0.71 0.00 0.00 52.86 51.25 3ids s ASN 319 Cb 0.36 -0.54 -0.03 0.00 0.41 0.00 0.00 41.25 41.46 3ids s ASN 319 CO -0.08 -0.52 1.09 -0.76 -1.51 0.00 0.00 177.10 175.33 3ids s LEU 320 N -3.93 4.32 0.14 0.60 1.43 -1.26 -4.99 118.68 114.98 3ids s LEU 320 Ca 0.42 1.75 -0.35 0.00 -1.03 0.00 0.00 54.13 54.92 3ids s LEU 320 Cb 0.01 -3.57 -0.15 0.00 0.03 0.00 0.00 46.19 42.52 3ids s LEU 320 CO 0.23 -0.43 1.51 -2.65 0.23 0.00 0.00 176.35 175.24 3ids n PRO 321 N 4.48 1.84 -0.80 1.29 -0.02 -1.26 -2.46 135.00 138.08 3ids n PRO 321 Ca 0.09 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 3ids n PRO 321 Cb 0.48 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 3ids n PRO 321 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3ids n LYS 322 N 3.16 -0.01 -2.05 -0.52 5.02 -1.26 -4.95 118.16 117.55 3ids n LYS 322 Ca 0.17 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 56.07 3ids n LYS 322 Cb 0.26 -3.33 -0.01 0.00 -0.02 0.00 0.00 35.03 31.93 3ids n LYS 322 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3ids s GLU 323 N -0.42 3.98 -0.01 1.97 2.56 -1.03 -4.95 118.70 120.81 3ids s GLU 323 Ca 0.00 2.16 0.09 0.00 0.00 0.00 0.00 54.97 57.22 3ids s GLU 323 Cb 0.00 -2.77 -0.12 0.00 2.00 0.00 0.00 34.13 33.25 3ids s GLU 323 CO 0.00 -0.49 0.29 0.54 -0.56 0.00 0.00 175.26 175.04 3ids n ARG 324 N 0.15 2.27 0.00 4.30 1.74 -1.26 -4.43 116.66 119.43 3ids n ARG 324 Ca 0.04 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3ids n ARG 324 Cb 0.43 -1.06 0.00 0.00 -1.02 0.00 0.00 32.46 30.82 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 -1.50 0.53 -3.69 5.56 5.12 -1.26 -1.22 116.66 120.20 3ids n ARG 325 Ca 0.00 0.00 -0.39 0.00 -1.93 0.00 0.00 57.85 55.53 3ids n ARG 325 Cb 0.18 -0.67 -0.12 0.00 -1.16 0.00 0.00 32.46 30.69 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 -1.34 3.27 0.10 -1.55 5.36 -1.26 -0.63 117.98 121.93 3ids s PHE 326 Ca 0.00 -1.37 0.03 0.00 -0.96 0.00 0.00 56.93 54.64 3ids s PHE 326 Cb 0.00 -2.45 -0.04 0.00 -0.34 0.00 0.00 43.02 40.19 3ids s PHE 326 CO 0.00 -0.74 -0.09 -0.06 -1.46 0.00 0.00 175.22 172.87 3ids s PHE 327 N 1.43 1.02 -0.11 10.12 0.08 -0.54 -4.77 117.98 125.22 3ids s PHE 327 Ca 0.00 -0.74 0.01 0.00 0.12 0.00 0.00 56.93 56.33 3ids s PHE 327 Cb -0.20 -0.56 -0.01 0.00 -0.57 0.00 0.00 43.02 41.68 3ids s PHE 327 CO 0.03 -0.03 -0.16 0.21 -0.10 0.00 0.00 175.22 175.17 3ids s LYS 328 N -3.19 3.21 -0.09 0.44 2.20 -1.26 -1.32 119.74 119.73 3ids s LYS 328 Ca 0.08 -0.74 0.04 0.00 -0.36 0.00 0.00 55.97 54.99 3ids s LYS 328 Cb 0.00 -2.52 0.00 0.00 -1.51 0.00 0.00 37.83 33.81 3ids s LYS 328 CO -0.01 0.24 -0.22 0.42 -0.36 0.00 0.00 175.35 175.42 3ids s ILE 329 N 0.25 1.90 -0.16 5.43 1.01 0.31 -4.85 121.20 125.09 3ids s ILE 329 Ca -0.11 -0.93 -0.05 0.00 0.00 0.00 0.00 60.65 59.56 3ids s ILE 329 Cb -0.16 -1.66 -0.03 0.00 0.01 0.00 0.00 42.46 40.62 3ids s ILE 329 CO 0.06 0.53 0.01 -0.69 0.00 0.00 0.00 174.94 174.84 3ids s VAL 330 N 0.40 4.31 -0.06 2.92 1.01 -1.26 -1.06 120.40 126.66 3ids s VAL 330 Ca -0.18 -0.21 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 3ids s VAL 330 Cb -0.18 -2.91 0.02 0.00 0.00 0.00 0.00 36.38 33.32 3ids s VAL 330 CO 0.08 0.49 0.16 -0.55 0.00 0.00 0.00 175.10 175.28 3ids s SER 331 N 0.29 -0.16 0.39 3.32 0.15 -0.10 -1.14 113.70 116.45 3ids s SER 331 Ca -0.00 0.33 0.03 0.00 0.70 0.00 0.00 55.95 57.01 3ids s SER 331 Cb -0.13 0.29 -0.01 0.00 -1.71 0.00 0.00 66.02 64.47 3ids s SER 331 CO 0.02 -0.09 0.57 0.26 1.20 0.00 0.00 173.24 175.20 3ids s TRP 332 N 0.44 3.18 -0.28 3.44 0.52 0.40 0.46 118.94 127.11 3ids s TRP 332 Ca -0.03 0.02 -0.19 0.00 0.02 0.00 0.00 56.10 55.91 3ids s TRP 332 Cb -0.04 -2.14 0.08 0.00 -1.15 0.00 0.00 33.47 30.21 3ids s TRP 332 CO -0.02 -0.17 0.73 1.52 0.02 0.00 0.00 176.95 179.02 3ids s TYR 333 N -2.36 -0.93 -0.70 -1.98 1.13 -0.49 -0.36 117.35 111.65 3ids s TYR 333 Ca 0.46 1.98 -0.27 0.00 -1.41 0.00 0.00 57.07 57.83 3ids s TYR 333 Cb -0.10 0.49 0.02 0.00 -1.10 0.00 0.00 41.96 41.28 3ids s TYR 333 CO 0.34 -0.46 1.34 0.34 -2.51 0.00 0.00 175.55 174.61 3ids s ASP 334 N 1.15 6.09 0.60 -0.18 -1.08 -1.26 -0.64 116.67 121.36 3ids s ASP 334 Ca -0.06 -0.28 0.33 0.00 -0.52 0.00 0.00 52.55 52.02 3ids s ASP 334 Cb -0.05 -2.56 1.93 0.00 -1.46 0.00 0.00 42.92 40.79 3ids s ASP 334 CO -0.12 -1.86 2.27 -0.55 0.52 0.00 0.00 175.17 175.43 3ids h ASN 335 N 10.55 0.00 0.09 -0.34 -1.07 -1.91 -1.99 115.58 120.91 3ids h ASN 335 Ca -0.27 0.00 -0.26 0.00 0.07 0.00 0.00 56.30 55.83 3ids h ASN 335 Cb 1.06 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.30 3ids h ASN 335 CO 1.26 0.01 -1.37 -0.33 0.07 0.00 0.00 177.43 177.06 3ids h GLU 336 N 0.00 0.18 0.11 4.14 5.08 -1.98 -3.40 114.58 118.72 3ids h GLU 336 Ca -0.00 -0.31 -0.24 0.00 -1.00 0.00 0.00 59.36 57.81 3ids h GLU 336 Cb 0.02 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.39 3ids h GLU 336 CO 0.00 1.15 -1.17 2.35 -1.00 0.00 0.00 179.01 180.34 3ids h TRP 337 N -0.44 0.43 -0.17 4.33 2.91 -1.74 -2.76 115.95 118.51 3ids h TRP 337 Ca -0.31 -0.32 -0.03 0.00 1.13 0.00 0.00 58.89 59.37 3ids h TRP 337 Cb 1.66 -0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 30.28 3ids h TRP 337 CO 0.12 1.46 0.00 0.78 -1.03 0.00 0.00 178.44 179.77 3ids h GLY 338 N -0.16 0.31 0.97 2.65 0.00 -1.45 -2.57 103.07 102.82 3ids h GLY 338 Ca -0.25 -0.23 0.02 0.00 0.00 0.00 0.00 47.33 46.87 3ids h GLY 338 CO 0.07 0.21 0.58 -1.82 0.00 0.00 0.00 176.54 175.58 3ids h TYR 339 N 0.04 1.09 -0.54 5.60 5.03 -1.72 -1.86 116.97 124.60 3ids h TYR 339 Ca 0.05 0.03 -0.04 0.00 2.58 0.00 0.00 58.73 61.34 3ids h TYR 339 Cb 0.37 -0.37 -0.03 0.00 1.55 0.00 0.00 36.73 38.26 3ids h TYR 339 CO 0.03 0.67 0.18 0.77 -1.32 0.00 0.00 178.16 178.49 3ids h SER 340 N 1.16 0.74 -0.33 -2.11 0.02 -1.38 -1.15 113.55 110.50 3ids h SER 340 Ca 0.33 -0.11 -0.08 0.00 -0.84 0.00 0.00 61.79 61.09 3ids h SER 340 Cb -0.10 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.23 3ids h SER 340 CO -0.08 0.70 -0.05 0.45 -1.14 0.00 0.00 176.83 176.71 3ids h HIS 341 N 0.79 0.77 -0.49 3.45 3.86 -0.98 -2.94 115.15 119.61 3ids h HIS 341 Ca 0.18 -0.12 -0.09 0.00 -1.16 0.00 0.00 60.37 59.18 3ids h HIS 341 Cb 0.22 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.47 3ids h HIS 341 CO 0.01 0.75 -0.07 0.00 0.86 0.00 0.00 177.93 179.49 3ids h ARG 342 N 0.67 0.87 -0.39 2.45 2.47 -0.48 -0.08 114.38 119.89 3ids h ARG 342 Ca 0.13 -0.28 0.03 0.00 -1.26 0.00 0.00 59.98 58.60 3ids h ARG 342 Cb 0.49 -0.08 -0.04 0.00 -1.65 0.00 0.00 29.97 28.69 3ids h ARG 342 CO 0.03 0.91 0.18 0.28 0.56 0.00 0.00 179.97 181.92 3ids h VAL 343 N 0.79 0.95 -0.24 2.04 2.07 -1.12 0.56 116.25 121.31 3ids h VAL 343 Ca 0.14 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 3ids h VAL 343 Cb 0.57 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3ids h VAL 343 CO 0.03 0.07 0.10 0.58 0.02 0.00 0.00 177.57 178.37 3ids h VAL 344 N 0.36 1.17 -0.71 2.57 2.07 -1.32 -1.42 116.25 118.96 3ids h VAL 344 Ca 0.17 -0.50 0.10 0.00 0.82 0.00 0.00 66.70 67.29 3ids h VAL 344 Cb 0.10 1.05 -0.07 0.00 -1.52 0.00 0.00 31.29 30.84 3ids h VAL 344 CO -0.13 0.17 0.34 0.44 0.02 0.00 0.00 177.57 178.41 3ids h ASP 345 N 0.24 0.43 -0.37 0.57 3.32 -0.65 -1.42 116.42 118.54 3ids h ASP 345 Ca 0.08 0.07 -0.08 0.00 0.02 0.00 0.00 57.03 57.11 3ids h ASP 345 Cb 0.17 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3ids h ASP 345 CO -0.01 0.24 -0.10 0.25 -1.72 0.00 0.00 179.24 177.90 3ids h LEU 346 N 0.58 0.72 -0.65 1.55 5.85 -0.53 -1.10 115.31 121.72 3ids h LEU 346 Ca 0.36 -0.37 0.03 0.00 0.84 0.00 0.00 57.88 58.74 3ids h LEU 346 Cb 0.41 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 3ids h LEU 346 CO -0.29 0.92 0.41 0.58 -0.34 0.00 0.00 178.44 179.72 3ids h VAL 347 N 0.51 1.08 -0.75 1.05 2.07 -0.94 -0.15 116.25 119.13 3ids h VAL 347 Ca 0.09 -0.27 -0.05 0.00 0.82 0.00 0.00 66.70 67.28 3ids h VAL 347 Cb 0.61 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 3ids h VAL 347 CO 0.04 0.15 0.26 0.03 0.02 0.00 0.00 177.57 178.06 3ids h ARG 348 N 0.80 1.15 -0.15 1.57 3.08 -1.03 -0.63 114.38 119.17 3ids h ARG 348 Ca 0.26 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 3ids h ARG 348 Cb 0.02 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 3ids h ARG 348 CO -0.10 0.97 0.05 1.25 -1.07 0.00 0.00 179.97 181.06 3ids h HIS 349 N 1.11 0.24 -0.44 3.04 2.76 -0.84 -1.86 115.15 119.14 3ids h HIS 349 Ca 0.25 -0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.42 3ids h HIS 349 Cb 0.28 -0.07 -0.03 0.00 1.55 0.00 0.00 27.41 29.14 3ids h HIS 349 CO 0.02 0.34 0.26 0.52 -1.30 0.00 0.00 177.93 177.77 3ids h MET 350 N 0.07 0.50 -0.74 5.26 2.86 -0.81 -1.44 114.93 120.63 3ids h MET 350 Ca 0.05 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 3ids h MET 350 Cb 0.21 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.72 3ids h MET 350 CO -0.00 0.33 0.44 0.00 1.06 0.00 0.00 176.91 178.74 3ids h ALA 351 N 1.20 0.94 0.05 6.32 0.00 -1.06 0.20 119.26 126.91 3ids h ALA 351 Ca 0.18 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3ids h ALA 351 Cb 0.03 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3ids h ALA 351 CO -0.09 0.42 -0.06 1.03 0.00 0.00 0.00 179.25 180.55 3ids h SER 352 N 1.01 -0.15 -0.65 0.00 0.87 -1.06 -0.59 113.55 112.98 3ids h SER 352 Ca 0.26 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.81 3ids h SER 352 Cb -0.02 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 61.97 3ids h SER 352 CO -0.05 -0.09 0.30 0.11 -0.53 0.00 0.00 176.83 176.57 3ids h LYS 353 N -0.12 0.94 -0.30 2.24 1.79 -0.98 -1.80 116.57 118.33 3ids h LYS 353 Ca 0.01 -0.15 0.02 0.00 -2.18 0.00 0.00 60.65 58.36 3ids h LYS 353 Cb 0.12 -0.16 -0.03 0.00 -1.58 0.00 0.00 32.23 30.58 3ids h LYS 353 CO -0.03 0.76 0.14 -0.44 -1.08 0.00 0.00 179.45 178.80 3ids h ASP 354 N 0.89 0.19 -0.21 0.86 3.32 -0.47 -0.51 116.42 120.50 3ids h ASP 354 Ca 0.22 0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.34 3ids h ASP 354 Cb 0.14 -0.02 -0.06 0.00 0.22 0.00 0.00 39.33 39.62 3ids h ASP 354 CO -0.03 0.15 -0.15 0.03 -1.72 0.00 0.00 179.24 177.52 3ids h ARG 355 N 0.29 -0.14 -0.74 3.56 3.08 -0.88 -2.64 114.38 116.91 3ids h ARG 355 Ca 0.13 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.21 3ids h ARG 355 Cb 0.06 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.10 3ids h ARG 355 CO -0.10 -0.09 0.49 0.77 -1.07 0.00 0.00 179.97 179.96 3ids h SER 356 N -0.15 0.80 0.95 7.04 0.02 -1.02 -2.46 113.55 118.73 3ids h SER 356 Ca 0.12 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3ids h SER 356 Cb 0.33 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.68 3ids h SER 356 CO -0.30 0.56 0.00 0.00 -1.14 0.00 0.00 176.83 175.95 3ids h ALA 357 N 1.56 1.00 -0.07 3.77 0.00 -0.74 -3.11 119.26 121.67 3ids h ALA 357 Ca 0.28 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 3ids h ALA 357 Cb -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3ids h ALA 357 CO -0.07 0.00 -0.03 0.07 0.00 0.00 0.00 179.25 179.21 3ids h ARG 358 N 0.00 0.15 0.00 0.00 0.11 -1.23 -3.51 114.38 109.89 3ids h ARG 358 Ca 0.00 -0.07 0.00 0.00 0.10 0.00 0.00 59.98 60.01 3ids h ARG 358 Cb 0.47 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.55 3ids h ARG 358 CO 0.00 0.52 0.00 1.47 0.10 0.00 0.00 179.97 182.06