#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ina s GLN 10 N 0.00 4.25 -0.01 -0.78 2.00 -1.26 -4.92 119.66 118.94 3ina s GLN 10 Ca 0.00 2.02 -0.01 0.00 -2.00 0.00 0.00 55.36 55.37 3ina s GLN 10 Cb 0.00 -3.67 -0.00 0.00 0.80 0.00 0.00 33.01 30.14 3ina s GLN 10 CO 0.00 -0.65 -0.02 2.41 -0.50 0.00 0.00 175.29 176.52 3ina n THR 11 N 4.88 0.12 -5.15 -0.34 -1.04 -1.26 -4.75 114.28 106.74 3ina n THR 11 Ca 0.14 0.40 -0.30 0.00 -2.04 0.00 0.00 64.05 62.26 3ina n THR 11 Cb 0.43 -1.49 -0.16 0.00 -1.82 0.00 0.00 70.33 67.29 3ina n THR 11 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3ina s LEU 12 N -5.22 2.03 -0.26 -4.42 1.43 -1.26 -1.69 118.68 109.29 3ina s LEU 12 Ca -0.02 -0.47 0.03 0.00 -1.03 0.00 0.00 54.13 52.64 3ina s LEU 12 Cb 0.00 -1.26 0.06 0.00 0.03 0.00 0.00 46.19 45.03 3ina s LEU 12 CO 0.03 0.22 -0.08 -0.32 0.23 0.00 0.00 176.35 176.43 3ina s MET 13 N -0.13 2.04 0.35 1.70 1.75 -0.35 -4.93 119.30 119.73 3ina s MET 13 Ca -0.03 -1.30 -0.29 0.00 -1.25 0.00 0.00 55.69 52.82 3ina s MET 13 Cb -0.13 -2.84 -0.11 0.00 2.84 0.00 0.00 34.83 34.59 3ina s MET 13 CO 0.03 -0.61 1.53 -2.30 -0.65 0.00 0.00 175.02 173.02 3ina n PRO 14 N 4.47 2.70 -3.89 4.11 -0.02 -1.26 -0.09 135.00 141.03 3ina n PRO 14 Ca -0.12 0.95 -0.33 0.00 -2.02 0.00 0.00 63.50 61.99 3ina n PRO 14 Cb 0.42 -2.70 -0.13 0.00 -0.02 0.00 0.00 33.50 31.07 3ina n PRO 14 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ina s LEU 15 N -1.60 4.75 0.02 2.45 1.43 0.15 -4.85 118.68 121.03 3ina s LEU 15 Ca 0.56 -2.69 0.23 0.00 -1.03 0.00 0.00 54.13 51.21 3ina s LEU 15 Cb -0.48 -1.71 0.07 0.00 0.03 0.00 0.00 46.19 44.10 3ina s LEU 15 CO 0.59 -0.33 1.07 0.35 0.23 0.00 0.00 176.35 178.26 3ina n THR 16 N 3.61 0.08 -2.02 5.49 -2.24 -1.26 -4.59 114.28 113.35 3ina n THR 16 Ca 0.05 -0.13 -0.41 0.00 -2.27 0.00 0.00 64.05 61.28 3ina n THR 16 Cb 0.37 0.41 -0.02 0.00 -2.10 0.00 0.00 70.33 68.99 3ina n THR 16 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3ina s GLU 17 N -3.11 4.28 0.04 -0.78 0.41 -1.26 -4.81 118.70 113.46 3ina s GLU 17 Ca 0.06 2.33 0.04 0.00 -0.41 0.00 0.00 54.97 56.99 3ina s GLU 17 Cb 0.15 -3.05 -0.02 0.00 -1.78 0.00 0.00 34.13 29.44 3ina s GLU 17 CO 0.80 -0.31 -0.12 1.03 -0.49 0.00 0.00 175.26 176.16 3ina s ARG 18 N -1.69 0.82 -0.03 1.61 1.81 -1.26 -4.28 118.95 115.92 3ina s ARG 18 Ca 0.51 -0.71 0.04 0.00 -1.72 0.00 0.00 55.73 53.86 3ina s ARG 18 Cb -0.42 -0.79 -0.01 0.00 -0.45 0.00 0.00 34.95 33.29 3ina s ARG 18 CO 0.54 0.19 -0.16 0.08 -0.68 0.00 0.00 175.30 175.28 3ina s VAL 19 N -0.87 1.33 -0.82 3.52 1.01 -0.23 -4.97 120.40 119.37 3ina s VAL 19 Ca -0.00 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.11 3ina s VAL 19 Cb -0.08 -1.13 0.13 0.00 0.00 0.00 0.00 36.38 35.30 3ina s VAL 19 CO 0.01 0.38 0.98 0.21 0.00 0.00 0.00 175.10 176.69 3ina s ASN 20 N -0.07 6.52 0.52 3.32 3.84 -1.26 -4.64 114.94 123.16 3ina s ASN 20 Ca -0.01 -1.90 0.23 0.00 0.21 0.00 0.00 52.86 51.39 3ina s ASN 20 Cb -0.10 -2.36 1.41 0.00 -0.55 0.00 0.00 41.25 39.66 3ina s ASN 20 CO 0.01 -1.05 2.11 -0.37 -2.79 0.00 0.00 177.10 175.02 3ina h VAL 21 N 5.71 0.77 0.02 -5.21 -1.51 -1.92 0.49 116.25 114.60 3ina h VAL 21 Ca 0.02 -0.34 -0.22 0.00 -1.23 0.00 0.00 66.70 64.93 3ina h VAL 21 Cb 1.04 1.20 -0.02 0.00 -2.13 0.00 0.00 31.29 31.38 3ina h VAL 21 CO 1.06 0.09 -1.02 1.56 -1.23 0.00 0.00 177.57 178.03 3ina h GLN 22 N 0.00 0.06 -0.01 5.19 7.50 -1.90 -2.57 115.11 123.37 3ina h GLN 22 Ca -0.00 -0.09 0.00 0.00 0.50 0.00 0.00 58.65 59.06 3ina h GLN 22 Cb 0.19 0.03 0.00 0.00 0.05 0.00 0.00 27.48 27.76 3ina h GLN 22 CO 0.01 1.02 -0.01 0.00 -1.50 0.00 0.00 178.83 178.35 3ina n ALA 23 N -2.39 2.49 -3.21 3.87 0.00 -1.03 -1.46 120.51 118.78 3ina n ALA 23 Ca -0.02 -0.53 -0.13 0.00 0.00 0.00 0.00 53.44 52.76 3ina n ALA 23 Cb 0.93 -0.18 -0.09 0.00 0.00 0.00 0.00 19.45 20.10 3ina n ALA 23 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3ina s ASP 24 N -0.48 -0.20 0.35 0.00 1.01 0.14 -4.63 116.67 112.85 3ina s ASP 24 Ca 0.06 0.19 -0.20 0.00 0.71 0.00 0.00 52.55 53.32 3ina s ASP 24 Cb 0.05 0.39 -0.10 0.00 1.01 0.00 0.00 42.92 44.26 3ina s ASP 24 CO 0.07 -0.35 0.84 -0.94 0.21 0.00 0.00 175.17 175.01 3ina s SER 25 N -0.94 6.96 0.18 0.27 1.04 -1.26 -4.43 113.70 115.52 3ina s SER 25 Ca -0.10 1.54 -0.30 0.00 0.48 0.00 0.00 55.95 57.56 3ina s SER 25 Cb -0.05 -2.47 -0.07 0.00 0.10 0.00 0.00 66.02 63.53 3ina s SER 25 CO 0.03 -0.21 0.96 0.00 0.98 0.00 0.00 173.24 175.00 3ina s ALA 26 N -1.93 3.30 0.45 5.32 0.00 0.11 -4.91 121.76 124.09 3ina s ALA 26 Ca 0.55 0.61 -0.11 0.00 0.00 0.00 0.00 51.96 53.01 3ina s ALA 26 Cb -0.12 -3.25 -0.06 0.00 0.00 0.00 0.00 23.12 19.69 3ina s ALA 26 CO 0.17 0.08 0.84 1.03 0.00 0.00 0.00 175.76 177.88 3ina s ARG 27 N -0.61 3.77 0.40 0.00 0.52 -1.26 -3.89 118.95 117.88 3ina s ARG 27 Ca 0.44 0.56 0.14 0.00 -0.52 0.00 0.00 55.73 56.36 3ina s ARG 27 Cb -0.25 -2.31 1.00 0.00 0.52 0.00 0.00 34.95 33.91 3ina s ARG 27 CO 0.31 -0.14 1.88 0.97 0.02 0.00 0.00 175.30 178.34 3ina h ILE 28 N 0.85 0.76 0.00 1.52 6.09 -1.97 -0.27 117.51 124.50 3ina h ILE 28 Ca -0.47 -0.17 0.00 0.00 -1.37 0.00 0.00 64.86 62.85 3ina h ILE 28 Cb 1.19 0.23 0.00 0.00 0.47 0.00 0.00 36.82 38.71 3ina h ILE 28 CO 0.63 0.09 0.00 -0.46 -3.07 0.00 0.00 178.15 175.34 3ina n ASN 29 N -4.51 0.00 -0.00 2.19 6.94 -1.26 -3.06 115.26 115.55 3ina n ASN 29 Ca 0.17 -0.44 0.09 0.00 -0.02 0.00 0.00 54.58 54.38 3ina n ASN 29 Cb 0.57 -0.16 -0.12 0.00 -2.36 0.00 0.00 39.78 37.72 3ina n ASN 29 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3ina n GLN 30 N -1.16 0.72 -2.65 -3.83 6.02 -0.12 -4.94 117.38 111.43 3ina n GLN 30 Ca 0.16 -0.05 -0.42 0.00 -0.01 0.00 0.00 57.00 56.68 3ina n GLN 30 Cb 0.16 -1.41 -0.03 0.00 1.02 0.00 0.00 30.24 29.98 3ina n GLN 30 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3ina s ILE 31 N -2.94 4.70 -0.22 5.09 1.01 -1.17 -4.58 121.20 123.09 3ina s ILE 31 Ca 0.03 1.95 -0.10 0.00 0.00 0.00 0.00 60.65 62.53 3ina s ILE 31 Cb 0.14 -4.25 -0.05 0.00 0.01 0.00 0.00 42.46 38.31 3ina s ILE 31 CO 0.78 0.10 0.14 -0.63 0.00 0.00 0.00 174.94 175.34 3ina s ILE 32 N 1.34 5.31 -0.95 2.92 1.01 0.76 -4.46 121.20 127.14 3ina s ILE 32 Ca 0.52 0.16 0.00 0.00 0.00 0.00 0.00 60.65 61.33 3ina s ILE 32 Cb -0.22 -3.45 0.00 0.00 0.01 0.00 0.00 42.46 38.81 3ina s ILE 32 CO 0.25 0.39 0.00 0.47 0.00 0.00 0.00 174.94 176.06 3ina n ASP 33 N 3.92 -3.53 0.00 3.58 10.43 -1.26 -1.61 116.55 128.08 3ina n ASP 33 Ca -0.16 0.23 0.00 0.00 2.57 0.00 0.00 54.79 57.44 3ina n ASP 33 Cb 0.52 -3.04 0.00 0.00 1.84 0.00 0.00 41.12 40.44 3ina n ASP 33 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3ina n GLY 34 N -0.73 0.26 0.00 0.44 0.00 -1.26 -4.73 105.19 99.17 3ina n GLY 34 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3ina n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ina s TRP 36 N 0.00 1.40 0.02 0.00 0.52 -0.64 -4.63 118.94 115.62 3ina s TRP 36 Ca 0.00 -0.78 0.00 0.00 0.02 0.00 0.00 56.10 55.35 3ina s TRP 36 Cb 0.00 -0.73 -0.02 0.00 -1.15 0.00 0.00 33.47 31.57 3ina s TRP 36 CO 0.00 0.09 -0.04 0.14 0.02 0.00 0.00 176.95 177.16 3ina s VAL 37 N -3.30 0.16 0.05 4.03 -7.23 -1.15 -0.17 120.40 112.80 3ina s VAL 37 Ca 0.20 -0.89 0.00 0.00 -1.81 0.00 0.00 61.98 59.49 3ina s VAL 37 Cb 0.03 -0.29 -0.04 0.00 0.56 0.00 0.00 36.38 36.63 3ina s VAL 37 CO 0.03 -0.46 0.17 0.00 -0.31 0.00 0.00 175.10 174.54 3ina s ALA 38 N -1.38 3.89 0.09 1.32 0.00 -1.26 -0.79 121.76 123.62 3ina s ALA 38 Ca -0.14 -0.87 0.04 0.00 0.00 0.00 0.00 51.96 50.99 3ina s ALA 38 Cb -0.10 -1.74 -0.03 0.00 0.00 0.00 0.00 23.12 21.25 3ina s ALA 38 CO -0.01 0.80 -0.11 0.14 0.00 0.00 0.00 175.76 176.58 3ina s VAL 39 N -1.45 1.00 0.00 0.00 -7.23 0.58 -1.06 120.40 112.23 3ina s VAL 39 Ca 0.32 -1.57 0.00 0.00 -1.81 0.00 0.00 61.98 58.93 3ina s VAL 39 Cb -0.13 -1.29 0.00 0.00 0.56 0.00 0.00 36.38 35.52 3ina s VAL 39 CO 0.25 -0.48 0.00 0.61 -0.31 0.00 0.00 175.10 175.17 3ina n GLY 40 N 0.72 -1.67 3.67 2.32 0.00 -1.26 -1.55 105.19 107.42 3ina n GLY 40 Ca -0.17 -2.11 -0.43 0.00 0.00 0.00 0.00 46.02 43.31 3ina n GLY 40 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3ina n THR 41 N -0.03 1.98 -0.07 2.61 5.66 -0.20 -4.92 114.28 119.31 3ina n THR 41 Ca 0.00 -0.49 0.07 0.00 -3.05 0.00 0.00 64.05 60.57 3ina n THR 41 Cb 0.00 -1.43 0.27 0.00 -1.55 0.00 0.00 70.33 67.61 3ina n THR 41 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 3ina n ASN 42 N 0.90 3.72 -4.68 1.09 0.23 -1.26 -4.87 115.26 110.39 3ina n ASN 42 Ca 0.06 -2.36 -0.43 0.00 -0.53 0.00 0.00 54.58 51.32 3ina n ASN 42 Cb 0.35 -0.51 -0.01 0.00 -2.08 0.00 0.00 39.78 37.53 3ina n ASN 42 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3ina n LYS 43 N 0.75 2.02 -0.29 -3.83 4.76 -1.26 -4.81 118.16 115.50 3ina n LYS 43 Ca 0.19 0.71 0.17 0.00 -2.87 0.00 0.00 58.31 56.51 3ina n LYS 43 Cb 0.71 -2.30 0.43 0.00 -1.84 0.00 0.00 35.03 32.03 3ina n LYS 43 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 3ina h PRO 44 N 3.09 0.55 -0.00 1.97 0.11 -1.93 -0.04 132.00 135.74 3ina h PRO 44 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3ina h PRO 44 Cb 1.29 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3ina h PRO 44 CO 0.67 0.36 -0.02 -2.39 -0.21 0.00 0.00 178.00 176.41 3ina n HIS 45 N -4.61 0.00 -0.10 0.65 1.44 -1.26 -3.97 115.22 107.37 3ina n HIS 45 Ca 0.21 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.83 3ina n HIS 45 Cb 0.65 -0.48 -0.02 0.00 0.12 0.00 0.00 29.99 30.26 3ina n HIS 45 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3ina h ALA 46 N 3.01 0.41 -3.38 1.59 0.00 -1.10 -3.32 119.26 116.46 3ina h ALA 46 Ca 0.00 -0.07 -0.31 0.00 0.00 0.00 0.00 54.91 54.53 3ina h ALA 46 Cb 0.49 -0.13 -0.35 0.00 0.00 0.00 0.00 17.79 17.80 3ina h ALA 46 CO 0.00 -0.07 -0.71 0.42 0.00 0.00 0.00 179.25 178.90 3ina s ILE 47 N -5.90 -0.09 -0.01 0.00 1.01 -1.25 -1.38 121.20 113.58 3ina s ILE 47 Ca -0.13 0.29 -0.02 0.00 0.00 0.00 0.00 60.65 60.79 3ina s ILE 47 Cb 0.09 -0.14 -0.00 0.00 0.01 0.00 0.00 42.46 42.42 3ina s ILE 47 CO 0.72 0.12 0.04 -1.10 0.00 0.00 0.00 174.94 174.72 3ina s GLN 48 N 1.52 0.18 0.07 2.79 -0.21 -0.54 -0.67 119.66 122.81 3ina s GLN 48 Ca -0.04 -0.18 -0.30 0.00 0.02 0.00 0.00 55.36 54.86 3ina s GLN 48 Cb -0.12 0.07 -0.06 0.00 1.00 0.00 0.00 33.01 33.90 3ina s GLN 48 CO -0.04 -0.03 1.14 0.50 -2.12 0.00 0.00 175.29 174.74 3ina s ARG 49 N -0.56 4.48 -0.39 2.91 3.52 0.87 -0.58 118.95 129.19 3ina s ARG 49 Ca -0.06 1.70 -0.05 0.00 -0.13 0.00 0.00 55.73 57.19 3ina s ARG 49 Cb -0.04 -3.35 0.09 0.00 -1.56 0.00 0.00 34.95 30.08 3ina s ARG 49 CO -0.00 -0.16 0.19 0.34 -0.81 0.00 0.00 175.30 174.85 3ina s ASP 50 N 0.85 5.33 0.05 -2.12 3.68 0.16 -1.21 116.67 123.40 3ina s ASP 50 Ca 0.56 -1.69 0.28 0.00 2.13 0.00 0.00 52.55 53.83 3ina s ASP 50 Cb -0.28 -1.86 1.13 0.00 -1.45 0.00 0.00 42.92 40.46 3ina s ASP 50 CO 0.30 -0.49 1.89 0.49 0.13 0.00 0.00 175.17 177.49 3ina n PHE 51 N 4.72 0.22 0.89 -5.34 3.01 -0.68 -2.22 117.46 118.05 3ina n PHE 51 Ca -0.07 0.06 0.12 0.00 1.01 0.00 0.00 57.45 58.58 3ina n PHE 51 Cb 0.42 -0.60 0.31 0.00 -0.01 0.00 0.00 39.48 39.60 3ina n PHE 51 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 3ina n THR 52 N -1.68 0.10 -3.59 4.37 -2.24 -1.26 -4.54 114.28 105.45 3ina n THR 52 Ca 0.07 -0.07 -0.29 0.00 -2.27 0.00 0.00 64.05 61.49 3ina n THR 52 Cb 0.36 -0.01 -0.12 0.00 -2.10 0.00 0.00 70.33 68.46 3ina n THR 52 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3ina s ASN 53 N -3.32 3.16 0.31 3.42 3.84 -1.20 -5.12 114.94 116.03 3ina s ASN 53 Ca 0.11 -2.59 -0.21 0.00 0.21 0.00 0.00 52.86 50.38 3ina s ASN 53 Cb 0.17 -0.75 -0.09 0.00 -0.55 0.00 0.00 41.25 40.02 3ina s ASN 53 CO 0.67 -0.26 0.84 -0.76 -2.79 0.00 0.00 177.10 174.80 3ina s LEU 54 N 0.48 4.21 -0.10 3.21 1.43 -1.26 -2.60 118.68 124.04 3ina s LEU 54 Ca 0.20 1.57 0.00 0.00 -1.03 0.00 0.00 54.13 54.88 3ina s LEU 54 Cb -0.19 -3.99 0.02 0.00 0.03 0.00 0.00 46.19 42.06 3ina s LEU 54 CO -0.03 -0.12 -0.08 0.12 0.23 0.00 0.00 176.35 176.47 3ina s PHE 55 N -1.76 1.43 -1.41 0.29 5.36 -0.21 -4.78 117.98 116.90 3ina s PHE 55 Ca 0.51 -0.67 -0.05 0.00 -0.96 0.00 0.00 56.93 55.76 3ina s PHE 55 Cb -0.15 -1.17 0.03 0.00 -0.34 0.00 0.00 43.02 41.39 3ina s PHE 55 CO 0.20 -0.46 0.75 -0.25 -1.46 0.00 0.00 175.22 173.99 3ina n ASP 56 N 4.73 -2.23 -0.78 6.13 9.92 -1.26 -1.96 116.55 131.10 3ina n ASP 56 Ca -0.15 -0.85 -0.10 0.00 -0.53 0.00 0.00 54.79 53.17 3ina n ASP 56 Cb 0.50 -3.79 -0.04 0.00 -0.64 0.00 0.00 41.12 37.15 3ina n ASP 56 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3ina n GLY 57 N -1.67 1.11 3.04 0.44 0.00 -1.26 -5.00 105.19 101.84 3ina n GLY 57 Ca -0.18 -0.29 -0.17 0.00 0.00 0.00 0.00 46.02 45.38 3ina n GLY 57 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ina s LYS 58 N -2.68 0.65 0.34 1.61 2.20 -0.83 -5.10 119.74 115.94 3ina s LYS 58 Ca 0.00 -0.45 -0.29 0.00 -0.36 0.00 0.00 55.97 54.87 3ina s LYS 58 Cb 0.00 -0.60 -0.12 0.00 -1.51 0.00 0.00 37.83 35.61 3ina s LYS 58 CO 0.00 0.15 1.44 -2.30 -0.36 0.00 0.00 175.35 174.28 3ina n PRO 59 N 2.43 2.46 -2.03 4.03 -0.02 -1.26 -1.04 135.00 139.58 3ina n PRO 59 Ca -0.16 0.87 -0.20 0.00 -2.02 0.00 0.00 63.50 61.99 3ina n PRO 59 Cb 0.56 -2.56 0.11 0.00 -0.02 0.00 0.00 33.50 31.60 3ina n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3ina n SER 60 N 0.98 0.84 -4.30 2.55 3.41 -0.94 -4.73 113.62 111.43 3ina n SER 60 Ca 0.04 -1.79 -0.35 0.00 -0.26 0.00 0.00 58.87 56.51 3ina n SER 60 Cb 0.37 -0.60 -0.14 0.00 -0.26 0.00 0.00 64.21 63.58 3ina n SER 60 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3ina s TYR 61 N -2.69 2.96 -0.26 7.33 1.51 -0.64 0.36 117.35 125.92 3ina s TYR 61 Ca 0.56 -0.99 -0.14 0.00 -1.01 0.00 0.00 57.07 55.48 3ina s TYR 61 Cb -0.03 -2.10 -0.04 0.00 -0.11 0.00 0.00 41.96 39.68 3ina s TYR 61 CO 0.38 -0.57 0.35 0.50 -1.11 0.00 0.00 175.55 175.10 3ina s ARG 62 N 1.47 4.04 -0.02 -0.62 3.52 0.25 -1.25 118.95 126.33 3ina s ARG 62 Ca 0.05 0.01 0.01 0.00 -0.13 0.00 0.00 55.73 55.68 3ina s ARG 62 Cb -0.14 -3.63 -0.03 0.00 -1.56 0.00 0.00 34.95 29.58 3ina s ARG 62 CO -0.04 -0.21 -0.02 -0.06 -0.81 0.00 0.00 175.30 174.16 3ina s PHE 63 N 1.86 3.03 -0.23 5.12 0.40 -0.16 -1.47 117.98 126.53 3ina s PHE 63 Ca 0.14 0.07 -0.14 0.00 -0.60 0.00 0.00 56.93 56.40 3ina s PHE 63 Cb -0.15 -1.68 0.07 0.00 0.51 0.00 0.00 43.02 41.77 3ina s PHE 63 CO 0.09 0.43 0.58 -2.00 0.70 0.00 0.00 175.22 175.02 3ina s GLU 64 N -1.33 0.60 -0.17 0.44 2.12 -0.48 -2.20 118.70 117.69 3ina s GLU 64 Ca 0.17 1.03 0.00 0.00 0.36 0.00 0.00 54.97 56.53 3ina s GLU 64 Cb -0.11 0.11 0.03 0.00 0.26 0.00 0.00 34.13 34.42 3ina s GLU 64 CO 0.07 -0.14 -0.10 -0.51 -0.54 0.00 0.00 175.26 174.04 3ina s LEU 65 N 1.38 1.80 0.83 2.70 1.43 -0.29 -3.87 118.68 122.67 3ina s LEU 65 Ca -0.09 -0.65 -0.12 0.00 -1.03 0.00 0.00 54.13 52.24 3ina s LEU 65 Cb -0.06 -1.08 0.10 0.00 0.03 0.00 0.00 46.19 45.18 3ina s LEU 65 CO -0.15 -0.13 1.19 -0.54 0.23 0.00 0.00 176.35 176.95 3ina s LYS 66 N 1.53 1.77 0.46 1.70 1.02 -1.26 -1.84 119.74 123.11 3ina s LYS 66 Ca 0.02 0.08 0.28 0.00 0.02 0.00 0.00 55.97 56.36 3ina s LYS 66 Cb -0.15 -1.93 1.33 0.00 -0.52 0.00 0.00 37.83 36.57 3ina s LYS 66 CO -0.09 -1.73 1.75 0.00 -0.92 0.00 0.00 175.35 174.37 3ina h THR 67 N -1.15 0.40 -0.50 2.17 1.03 -1.90 -0.82 112.91 112.14 3ina h THR 67 Ca -0.46 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 65.87 3ina h THR 67 Cb 1.32 0.19 0.00 0.00 -1.07 0.00 0.00 68.15 68.59 3ina h THR 67 CO 0.63 0.04 0.00 -1.84 -0.01 0.00 0.00 175.52 174.34 3ina n GLU 68 N -4.46 4.38 -0.12 0.00 0.00 -1.26 -4.58 120.64 114.60 3ina n GLU 68 Ca 0.28 -3.08 0.07 0.00 0.00 0.00 0.00 57.16 54.43 3ina n GLU 68 Cb 1.14 -2.15 0.24 0.00 0.00 0.00 0.00 31.44 30.66 3ina n GLU 68 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3ina n ASP 69 N 0.36 1.48 -4.72 -1.84 10.43 -0.31 -4.87 116.55 117.08 3ina n ASP 69 Ca 0.26 -1.87 -0.42 0.00 2.57 0.00 0.00 54.79 55.34 3ina n ASP 69 Cb 1.11 -0.15 -0.03 0.00 1.84 0.00 0.00 41.12 43.89 3ina n ASP 69 CO 0.00 0.00 0.00 0.20 -1.07 0.00 0.00 177.20 176.33 3ina s ASN 70 N -1.22 7.17 0.00 -2.24 -0.87 -1.26 -4.63 114.94 111.90 3ina s ASN 70 Ca 0.24 1.97 0.00 0.00 -1.57 0.00 0.00 52.86 53.50 3ina s ASN 70 Cb 0.13 -2.58 0.00 0.00 -0.02 0.00 0.00 41.25 38.77 3ina s ASN 70 CO 0.18 -0.37 0.36 0.35 -2.57 0.00 0.00 177.10 175.04 3ina n THR 71 N 3.56 0.12 -4.40 1.60 -2.24 -0.86 -4.92 114.28 107.14 3ina n THR 71 Ca 0.07 -0.29 -0.24 0.00 -2.27 0.00 0.00 64.05 61.32 3ina n THR 71 Cb 0.47 1.34 -0.09 0.00 -2.10 0.00 0.00 70.33 69.95 3ina n THR 71 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3ina s LEU 72 N -0.12 2.86 -0.09 3.22 1.02 -0.47 -4.98 118.68 120.12 3ina s LEU 72 Ca 0.00 -0.93 -0.04 0.00 0.02 0.00 0.00 54.13 53.18 3ina s LEU 72 Cb 0.00 -1.32 -0.04 0.00 0.02 0.00 0.00 46.19 44.86 3ina s LEU 72 CO 0.00 -0.06 0.08 -1.61 0.02 0.00 0.00 176.35 174.78 3ina s GLU 73 N -3.61 3.21 0.47 1.70 2.02 -1.26 -0.89 118.70 120.33 3ina s GLU 73 Ca 0.32 -0.29 -0.05 0.00 0.02 0.00 0.00 54.97 54.96 3ina s GLU 73 Cb -0.04 -2.98 0.10 0.00 0.10 0.00 0.00 34.13 31.31 3ina s GLU 73 CO 0.17 0.73 0.64 0.41 0.02 0.00 0.00 175.26 177.23 3ina n GLY 74 N 1.92 -0.53 0.21 -1.39 0.00 -0.40 -4.79 105.19 100.21 3ina n GLY 74 Ca -0.18 -1.81 -0.09 0.00 0.00 0.00 0.00 46.02 43.94 3ina n GLY 74 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3ina h TYR 75 N -1.05 0.67 -3.42 1.61 5.03 -1.98 -3.44 116.97 114.39 3ina h TYR 75 Ca -0.21 -0.24 -0.54 0.00 2.58 0.00 0.00 58.73 60.32 3ina h TYR 75 Cb 0.64 -0.13 -0.04 0.00 1.55 0.00 0.00 36.73 38.75 3ina h TYR 75 CO 0.00 0.96 0.11 0.00 -1.32 0.00 0.00 178.16 177.91 3ina s ALA 76 N -4.00 3.47 0.24 1.82 0.00 -1.26 -5.01 121.76 117.02 3ina s ALA 76 Ca -0.07 0.25 -0.31 0.00 0.00 0.00 0.00 51.96 51.82 3ina s ALA 76 Cb 0.11 -2.87 -0.14 0.00 0.00 0.00 0.00 23.12 20.22 3ina s ALA 76 CO 0.84 0.26 1.28 1.17 0.00 0.00 0.00 175.76 179.31 3ina n LYS 77 N 1.96 1.71 0.00 0.00 0.00 -1.26 -1.75 118.16 118.81 3ina n LYS 77 Ca -0.06 0.61 0.00 0.00 0.00 0.00 0.00 58.31 58.85 3ina n LYS 77 Cb 0.50 -2.18 0.00 0.00 0.00 0.00 0.00 35.03 33.35 3ina n LYS 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3ina n GLY 78 N 1.88 2.49 3.75 3.14 0.00 -1.26 -5.01 105.19 110.18 3ina n GLY 78 Ca 0.12 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 3ina n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ina s GLU 79 N 0.00 3.16 0.24 1.61 2.02 -0.72 -4.94 118.70 120.08 3ina s GLU 79 Ca 0.00 1.98 0.02 0.00 0.02 0.00 0.00 54.97 57.00 3ina s GLU 79 Cb 0.00 -2.14 -0.05 0.00 0.10 0.00 0.00 34.13 32.04 3ina s GLU 79 CO 0.00 -1.10 0.05 0.95 0.02 0.00 0.00 175.26 175.18 3ina s THR 80 N -1.46 0.77 0.20 3.63 -4.23 -1.26 -1.27 115.64 112.02 3ina s THR 80 Ca 0.73 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 59.07 3ina s THR 80 Cb -0.34 -2.47 0.02 0.00 1.34 0.00 0.00 72.50 71.05 3ina s THR 80 CO 0.39 -0.18 0.51 -1.59 -0.54 0.00 0.00 174.62 173.21 3ina s LYS 81 N -3.95 1.41 0.12 3.99 -2.85 -0.06 -3.33 119.74 115.06 3ina s LYS 81 Ca 0.32 -0.95 0.07 0.00 -1.00 0.00 0.00 55.97 54.41 3ina s LYS 81 Cb 0.07 0.51 -0.04 0.00 -2.06 0.00 0.00 37.83 36.31 3ina s LYS 81 CO 0.11 -0.59 -0.16 0.20 0.10 0.00 0.00 175.35 175.00 3ina s GLY 82 N -2.90 1.13 -0.08 0.59 0.00 -0.05 -1.37 107.32 104.64 3ina s GLY 82 Ca 0.12 -1.28 -0.05 0.00 0.00 0.00 0.00 44.72 43.51 3ina s GLY 82 CO -0.00 -1.32 0.19 -1.60 0.00 0.00 0.00 173.10 170.36 3ina s ARG 83 N -2.43 0.17 -0.35 2.90 3.52 -1.26 -0.95 118.95 120.55 3ina s ARG 83 Ca 0.08 0.37 0.05 0.00 -0.13 0.00 0.00 55.73 56.10 3ina s ARG 83 Cb -0.07 -0.05 0.17 0.00 -1.56 0.00 0.00 34.95 33.44 3ina s ARG 83 CO 0.04 -0.11 0.51 0.00 -0.81 0.00 0.00 175.30 174.93 3ina s ALA 84 N 0.78 -1.67 0.21 6.12 0.00 -0.33 -1.03 121.76 125.84 3ina s ALA 84 Ca -0.06 0.12 -0.00 0.00 0.00 0.00 0.00 51.96 52.03 3ina s ALA 84 Cb -0.07 -2.39 -0.04 0.00 0.00 0.00 0.00 23.12 20.62 3ina s ALA 84 CO -0.04 -2.01 0.14 -1.21 0.00 0.00 0.00 175.76 172.64 3ina s GLU 85 N 2.12 1.25 -0.07 0.00 2.02 -0.60 -0.30 118.70 123.13 3ina s GLU 85 Ca 0.13 -1.66 0.02 0.00 0.02 0.00 0.00 54.97 53.48 3ina s GLU 85 Cb -0.10 0.25 -0.03 0.00 0.10 0.00 0.00 34.13 34.36 3ina s GLU 85 CO -0.16 -0.41 -0.10 -0.06 0.02 0.00 0.00 175.26 174.56 3ina s PHE 86 N -4.09 2.84 -0.10 1.61 0.40 -0.10 -0.31 117.98 118.23 3ina s PHE 86 Ca 0.39 -0.09 0.01 0.00 -0.60 0.00 0.00 56.93 56.64 3ina s PHE 86 Cb 0.07 -1.69 -0.02 0.00 0.51 0.00 0.00 43.02 41.89 3ina s PHE 86 CO 0.13 0.24 -0.14 0.45 0.70 0.00 0.00 175.22 176.60 3ina s SER 87 N -0.69 4.01 0.00 1.36 0.15 0.02 -2.54 113.70 116.02 3ina s SER 87 Ca 0.10 -0.28 0.29 0.00 0.70 0.00 0.00 55.95 56.77 3ina s SER 87 Cb -0.11 -1.30 1.32 0.00 -1.71 0.00 0.00 66.02 64.22 3ina s SER 87 CO 0.01 0.24 1.91 0.00 1.20 0.00 0.00 173.24 176.60 3ina n TYR 88 N 3.04 0.00 -4.55 3.44 9.36 -0.61 -2.91 117.16 124.92 3ina n TYR 88 Ca -0.18 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 60.72 3ina n TYR 88 Cb 0.52 -0.12 -0.16 0.00 -0.63 0.00 0.00 39.34 38.95 3ina n TYR 88 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3ina s TYR 90 N 0.92 -0.29 0.18 0.00 1.13 -1.16 -4.93 117.35 113.19 3ina s TYR 90 Ca -0.05 0.29 0.04 0.00 -1.41 0.00 0.00 57.07 55.94 3ina s TYR 90 Cb -0.15 0.51 -0.04 0.00 -1.10 0.00 0.00 41.96 41.18 3ina s TYR 90 CO -0.03 -0.40 0.25 0.00 -2.51 0.00 0.00 175.55 172.85 3ina s ALA 91 N -2.37 3.81 0.44 9.51 0.00 -1.26 -3.14 121.76 128.75 3ina s ALA 91 Ca 0.04 -1.16 0.05 0.00 0.00 0.00 0.00 51.96 50.89 3ina s ALA 91 Cb -0.01 -1.60 -0.05 0.00 0.00 0.00 0.00 23.12 21.46 3ina s ALA 91 CO -0.05 0.44 0.01 0.95 0.00 0.00 0.00 175.76 177.12 3ina s THR 92 N -1.83 1.58 0.25 0.00 -4.23 -1.26 0.06 115.64 110.21 3ina s THR 92 Ca 0.33 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.80 3ina s THR 92 Cb -0.10 -2.65 0.15 0.00 1.34 0.00 0.00 72.50 71.24 3ina s THR 92 CO 0.27 0.00 1.80 -1.28 -0.54 0.00 0.00 174.62 174.87 3ina h SER 93 N 1.64 0.94 -0.16 3.99 0.87 -1.91 -1.78 113.55 117.14 3ina h SER 93 Ca -0.43 -0.16 0.05 0.00 -1.23 0.00 0.00 61.79 60.01 3ina h SER 93 Cb 1.27 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 3ina h SER 93 CO 0.77 0.87 0.15 0.44 -0.53 0.00 0.00 176.83 178.53 3ina h ASP 94 N 0.98 0.00 0.56 6.23 3.32 -1.96 -0.85 116.42 124.70 3ina h ASP 94 Ca 0.22 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.22 3ina h ASP 94 Cb 0.27 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 3ina h ASP 94 CO -0.01 0.00 -0.23 0.44 -1.72 0.00 0.00 179.24 177.72 3ina h ASP 95 N 0.00 0.00 -0.02 6.45 3.45 -1.65 -2.97 116.42 121.68 3ina h ASP 95 Ca 0.08 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.54 3ina h ASP 95 Cb 0.38 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.15 3ina h ASP 95 CO -0.00 0.23 -0.10 0.49 -1.57 0.00 0.00 179.24 178.29 3ina n PHE 96 N -3.66 0.00 -1.69 4.55 3.01 -0.37 -4.99 117.46 114.31 3ina n PHE 96 Ca -0.01 0.00 -0.44 0.00 1.01 0.00 0.00 57.45 58.01 3ina n PHE 96 Cb 0.35 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.79 3ina n PHE 96 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 3ina n LYS 97 N 0.63 2.48 0.00 -1.08 4.81 -0.92 -2.14 118.16 121.93 3ina n LYS 97 Ca 0.09 0.90 0.00 0.00 -0.87 0.00 0.00 58.31 58.43 3ina n LYS 97 Cb 0.40 -2.72 0.00 0.00 0.02 0.00 0.00 35.03 32.73 3ina n LYS 97 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3ina n GLY 98 N 3.78 1.53 3.92 3.14 0.00 -1.26 -5.05 105.19 111.25 3ina n GLY 98 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 3ina n GLY 98 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ina s LEU 99 N 0.00 4.02 0.46 0.99 1.02 -0.91 -5.04 118.68 119.22 3ina s LEU 99 Ca 0.00 0.61 -0.25 0.00 0.02 0.00 0.00 54.13 54.51 3ina s LEU 99 Cb 0.00 -3.45 -0.08 0.00 0.02 0.00 0.00 46.19 42.68 3ina s LEU 99 CO 0.00 -0.25 1.43 -2.84 0.02 0.00 0.00 176.35 174.71 3ina s PRO 100 N -3.91 3.62 0.46 1.29 0.02 -1.26 -4.85 135.00 130.37 3ina s PRO 100 Ca 0.42 2.43 0.24 0.00 0.02 0.00 0.00 61.00 64.11 3ina s PRO 100 Cb -0.10 -2.62 1.25 0.00 0.02 0.00 0.00 34.50 33.05 3ina s PRO 100 CO 0.33 -0.88 1.85 0.00 -0.33 0.00 0.00 177.00 177.98 3ina h ALA 101 N 2.23 2.48 0.00 -1.55 0.00 -1.96 -1.70 119.26 118.75 3ina h ALA 101 Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3ina h ALA 101 Cb 1.27 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3ina h ALA 101 CO 0.61 -0.78 0.00 0.38 0.00 0.00 0.00 179.25 179.46 3ina h ASP 102 N 0.24 0.00 0.08 0.00 2.03 -1.99 -2.79 116.42 114.00 3ina h ASP 102 Ca 0.48 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.77 3ina h ASP 102 Cb 1.46 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.96 3ina h ASP 102 CO -0.13 0.00 -0.04 0.58 -1.03 0.00 0.00 179.24 178.62 3ina h VAL 103 N 0.00 1.08 -0.54 4.15 2.07 -1.66 -0.63 116.25 120.72 3ina h VAL 103 Ca 0.00 -0.60 -0.04 0.00 0.82 0.00 0.00 66.70 66.88 3ina h VAL 103 Cb 0.38 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 3ina h VAL 103 CO 0.00 0.15 0.18 0.22 0.02 0.00 0.00 177.57 178.14 3ina h TYR 104 N -0.39 0.86 -0.69 1.57 3.20 -1.70 -1.31 116.97 118.50 3ina h TYR 104 Ca -0.01 -0.08 0.02 0.00 3.14 0.00 0.00 58.73 61.80 3ina h TYR 104 Cb 0.33 -0.25 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 3ina h TYR 104 CO 0.02 0.72 0.45 1.96 -1.64 0.00 0.00 178.16 179.66 3ina h GLN 105 N 0.74 0.87 -0.09 1.82 4.20 -1.43 -0.99 115.11 120.23 3ina h GLN 105 Ca 0.18 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.71 3ina h GLN 105 Cb 0.26 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 3ina h GLN 105 CO -0.01 0.57 -0.49 0.87 -0.67 0.00 0.00 178.83 179.11 3ina h LYS 106 N 0.89 0.22 -0.29 1.46 1.57 -0.97 -2.73 116.57 116.73 3ina h LYS 106 Ca 0.27 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.85 3ina h LYS 106 Cb -0.04 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 3ina h LYS 106 CO -0.08 0.66 -0.13 0.00 -0.57 0.00 0.00 179.45 179.33 3ina h ALA 107 N 1.32 1.24 -0.44 3.86 0.00 -0.47 -0.53 119.26 124.24 3ina h ALA 107 Ca 0.01 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 3ina h ALA 107 Cb 0.93 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 3ina h ALA 107 CO 0.07 0.50 0.03 1.96 0.00 0.00 0.00 179.25 181.81 3ina h GLN 108 N 0.46 0.75 -0.59 0.00 4.20 -0.91 0.90 115.11 119.91 3ina h GLN 108 Ca 0.08 -0.22 -0.10 0.00 0.06 0.00 0.00 58.65 58.47 3ina h GLN 108 Cb 0.50 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 3ina h GLN 108 CO 0.03 0.80 -0.01 0.82 -0.67 0.00 0.00 178.83 179.80 3ina h ILE 109 N 0.60 1.27 -0.00 2.54 2.04 -1.21 -2.32 117.51 120.42 3ina h ILE 109 Ca 0.13 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.83 3ina h ILE 109 Cb 0.44 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 3ina h ILE 109 CO 0.02 0.42 -0.10 0.35 0.00 0.00 0.00 178.15 178.83 3ina n THR 110 N -4.19 0.00 -3.68 -0.27 -2.24 -0.24 -4.92 114.28 98.73 3ina n THR 110 Ca 0.03 -0.08 -0.22 0.00 -2.27 0.00 0.00 64.05 61.51 3ina n THR 110 Cb 0.35 -0.04 0.04 0.00 -2.10 0.00 0.00 70.33 68.58 3ina n THR 110 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3ina n LYS 111 N -0.84 -5.52 -0.33 -0.78 5.02 -0.02 -4.47 118.16 111.21 3ina n LYS 111 Ca 0.15 0.67 0.07 0.00 -2.02 0.00 0.00 58.31 57.19 3ina n LYS 111 Cb 0.28 -5.40 0.13 0.00 -0.02 0.00 0.00 35.03 30.02 3ina n LYS 111 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3ina n THR 112 N -4.36 1.60 -0.19 -0.18 -2.24 0.11 -4.69 114.28 104.32 3ina n THR 112 Ca -0.22 -2.11 -0.01 0.00 -2.27 0.00 0.00 64.05 59.44 3ina n THR 112 Cb 0.64 -0.07 0.09 0.00 -2.10 0.00 0.00 70.33 68.90 3ina n THR 112 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 3ina h VAL 113 N 1.59 0.73 0.00 2.28 2.07 -1.22 0.03 116.25 121.73 3ina h VAL 113 Ca -0.01 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.40 3ina h VAL 113 Cb 1.11 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 3ina h VAL 113 CO 0.01 0.06 0.00 0.00 0.02 0.00 0.00 177.57 177.65 3ina n TYR 114 N -5.06 0.00 0.26 1.57 4.11 -0.97 -1.35 117.16 115.72 3ina n TYR 114 Ca 0.08 0.00 0.14 0.00 -0.00 0.00 0.00 57.90 58.11 3ina n TYR 114 Cb 0.27 -0.27 0.63 0.00 -0.00 0.00 0.00 39.34 39.96 3ina n TYR 114 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.86 178.11 3ina h HIS 115 N 0.00 0.00 -0.11 -3.48 2.76 -1.31 -1.95 115.15 111.06 3ina h HIS 115 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3ina h HIS 115 Cb 0.11 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.07 3ina h HIS 115 CO 0.00 0.11 0.00 0.72 -1.30 0.00 0.00 177.93 177.46 3ina n HIS 116 N -3.30 0.13 -3.80 5.26 8.25 -0.46 -4.96 115.22 116.34 3ina n HIS 116 Ca -0.00 -0.06 -0.23 0.00 -0.26 0.00 0.00 57.72 57.16 3ina n HIS 116 Cb 0.33 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.41 3ina n HIS 116 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3ina s GLY 117 N -1.80 2.25 0.82 -1.41 0.00 -0.73 -4.83 107.32 101.61 3ina s GLY 117 Ca 0.35 -1.83 -0.12 0.00 0.00 0.00 0.00 44.72 43.12 3ina s GLY 117 CO 0.30 -1.82 1.18 -1.59 0.00 0.00 0.00 173.10 171.18 3ina s LYS 118 N -4.09 1.90 0.00 2.90 0.00 -1.19 -4.64 119.74 114.62 3ina s LYS 118 Ca 0.43 0.11 0.00 0.00 0.00 0.00 0.00 55.97 56.51 3ina s LYS 118 Cb -0.01 -1.94 0.00 0.00 0.00 0.00 0.00 37.83 35.88 3ina s LYS 118 CO 0.25 -1.64 0.00 0.41 0.00 0.00 0.00 175.35 174.37 3ina n GLY 119 N -3.28 0.46 3.67 0.59 0.00 -1.26 -3.01 105.19 102.36 3ina n GLY 119 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 3ina n GLY 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ina s ALA 120 N -2.00 3.21 0.23 4.61 0.00 -1.26 -4.40 121.76 122.15 3ina s ALA 120 Ca 0.00 -1.29 0.07 0.00 0.00 0.00 0.00 51.96 50.74 3ina s ALA 120 Cb 0.00 -1.04 -0.04 0.00 0.00 0.00 0.00 23.12 22.04 3ina s ALA 120 CO 0.00 0.55 0.16 0.00 0.00 0.00 0.00 175.76 176.46 3ina s PRO 122 N -3.64 2.31 0.46 0.00 0.02 -1.26 -2.32 135.00 130.57 3ina s PRO 122 Ca 0.32 0.33 -0.25 0.00 0.02 0.00 0.00 61.00 61.42 3ina s PRO 122 Cb -0.08 -1.97 -0.08 0.00 0.02 0.00 0.00 34.50 32.38 3ina s PRO 122 CO 0.24 -1.39 1.42 1.04 -0.33 0.00 0.00 177.00 177.97 3ina n GLN 123 N -3.22 2.20 -1.47 5.54 1.13 -1.26 -2.87 117.38 117.42 3ina n GLN 123 Ca 0.07 0.78 -0.17 0.00 -1.94 0.00 0.00 57.00 55.75 3ina n GLN 123 Cb 0.59 -2.61 -0.07 0.00 0.11 0.00 0.00 30.24 28.25 3ina n GLN 123 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ina n GLY 124 N 0.61 1.58 3.96 1.08 0.00 -1.26 -4.98 105.19 106.18 3ina n GLY 124 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 3ina n GLY 124 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3ina s SER 125 N -2.50 4.49 -0.15 1.61 1.04 -1.14 -4.62 113.70 112.43 3ina s SER 125 Ca 0.00 0.06 0.01 0.00 0.48 0.00 0.00 55.95 56.49 3ina s SER 125 Cb 0.00 -0.57 0.00 0.00 0.10 0.00 0.00 66.02 65.55 3ina s SER 125 CO 0.00 -1.77 -0.17 -0.44 0.98 0.00 0.00 173.24 171.84 3ina s SER 126 N -4.63 3.53 0.05 7.02 0.01 -1.26 -1.48 113.70 116.93 3ina s SER 126 Ca 0.64 -0.50 -0.00 0.00 1.31 0.00 0.00 55.95 57.39 3ina s SER 126 Cb -0.08 -1.54 -0.03 0.00 0.21 0.00 0.00 66.02 64.58 3ina s SER 126 CO 0.45 0.08 -0.04 -0.13 0.41 0.00 0.00 173.24 174.01 3ina s ARG 127 N 0.83 0.56 -0.07 12.44 1.81 -0.16 -4.00 118.95 130.35 3ina s ARG 127 Ca -0.05 -1.04 0.04 0.00 -1.72 0.00 0.00 55.73 52.95 3ina s ARG 127 Cb -0.15 0.08 -0.02 0.00 -0.45 0.00 0.00 34.95 34.41 3ina s ARG 127 CO -0.01 -0.07 -0.17 -0.51 -0.68 0.00 0.00 175.30 173.86 3ina s ASP 128 N -2.45 3.72 0.06 0.23 -0.00 0.36 -0.86 116.67 117.73 3ina s ASP 128 Ca 0.00 -0.32 0.04 0.00 -0.00 0.00 0.00 52.55 52.27 3ina s ASP 128 Cb 0.01 -0.99 -0.03 0.00 -0.00 0.00 0.00 42.92 41.92 3ina s ASP 128 CO -0.06 0.28 -0.13 -0.31 -0.00 0.00 0.00 175.17 174.95 3ina s TYR 129 N -0.33 1.09 -0.10 4.23 1.51 0.12 -1.24 117.35 122.63 3ina s TYR 129 Ca 0.02 -0.44 -0.08 0.00 -1.01 0.00 0.00 57.07 55.56 3ina s TYR 129 Cb -0.13 -0.62 0.03 0.00 -0.11 0.00 0.00 41.96 41.13 3ina s TYR 129 CO 0.02 0.02 0.26 -2.00 -1.11 0.00 0.00 175.55 172.74 3ina s GLU 130 N -1.57 0.28 0.16 -0.62 2.12 0.43 -0.13 118.70 119.36 3ina s GLU 130 Ca -0.03 0.41 -0.22 0.00 0.36 0.00 0.00 54.97 55.49 3ina s GLU 130 Cb -0.09 0.07 0.06 0.00 0.26 0.00 0.00 34.13 34.43 3ina s GLU 130 CO 0.02 -0.07 0.59 -0.59 -0.54 0.00 0.00 175.26 174.66 3ina s PHE 131 N 0.46 -0.49 0.08 5.30 -0.71 -0.99 -0.92 117.98 120.71 3ina s PHE 131 Ca -0.03 0.26 0.07 0.00 -1.04 0.00 0.00 56.93 56.20 3ina s PHE 131 Cb -0.04 0.54 -0.03 0.00 -1.21 0.00 0.00 43.02 42.28 3ina s PHE 131 CO -0.02 -0.86 -0.20 -1.12 -1.34 0.00 0.00 175.22 171.68 3ina s SER 132 N -2.76 2.36 0.05 1.98 0.01 -0.09 -1.00 113.70 114.25 3ina s SER 132 Ca 0.02 -0.62 0.04 0.00 1.31 0.00 0.00 55.95 56.70 3ina s SER 132 Cb -0.01 -0.14 -0.03 0.00 0.21 0.00 0.00 66.02 66.05 3ina s SER 132 CO -0.12 0.07 -0.11 0.54 0.41 0.00 0.00 173.24 174.02 3ina s VAL 133 N -1.05 0.88 -0.17 3.43 0.11 -0.33 -1.48 120.40 121.78 3ina s VAL 133 Ca 0.05 -1.14 -0.00 0.00 -2.93 0.00 0.00 61.98 57.96 3ina s VAL 133 Cb -0.10 -0.86 0.04 0.00 -1.53 0.00 0.00 36.38 33.93 3ina s VAL 133 CO 0.03 -0.24 -0.06 -0.47 -3.33 0.00 0.00 175.10 171.04 3ina s TYR 134 N -1.21 1.80 -0.38 1.54 5.04 0.85 -0.99 117.35 124.01 3ina s TYR 134 Ca -0.04 -1.16 -0.09 0.00 -2.44 0.00 0.00 57.07 53.34 3ina s TYR 134 Cb -0.09 -1.36 0.05 0.00 0.35 0.00 0.00 41.96 40.91 3ina s TYR 134 CO 0.01 -0.64 0.20 0.42 -1.34 0.00 0.00 175.55 174.20 3ina s ILE 135 N 1.60 4.22 0.68 3.14 -1.09 -1.26 -1.67 121.20 126.82 3ina s ILE 135 Ca 0.00 -1.13 -0.14 0.00 -2.23 0.00 0.00 60.65 57.15 3ina s ILE 135 Cb -0.15 -3.45 0.01 0.00 -1.58 0.00 0.00 42.46 37.28 3ina s ILE 135 CO -0.08 -0.32 1.09 -2.16 -1.23 0.00 0.00 174.94 172.25 3ina s PRO 136 N 1.46 2.76 0.61 2.79 0.04 -1.26 -0.42 135.00 140.98 3ina s PRO 136 Ca 0.01 1.28 0.41 0.00 0.04 0.00 0.00 61.00 62.74 3ina s PRO 136 Cb -0.21 -1.95 2.20 0.00 0.04 0.00 0.00 34.50 34.58 3ina s PRO 136 CO 0.04 -1.27 2.25 0.77 0.04 0.00 0.00 177.00 178.83 3ina h SER 137 N -0.24 0.00 0.96 6.66 0.02 -1.97 -1.95 113.55 117.03 3ina h SER 137 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 3ina h SER 137 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.78 3ina h SER 137 CO 0.54 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.69 3ina n SER 138 N -2.97 0.52 -4.67 3.07 3.41 -1.26 -4.79 113.62 106.92 3ina n SER 138 Ca -0.02 0.59 -0.42 0.00 -0.26 0.00 0.00 58.87 58.75 3ina n SER 138 Cb 0.08 -0.71 -0.03 0.00 -0.26 0.00 0.00 64.21 63.29 3ina n SER 138 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3ina s LEU 139 N -4.07 4.30 0.26 1.04 2.96 -0.73 -4.95 118.68 117.49 3ina s LEU 139 Ca 0.08 2.12 -0.30 0.00 -0.22 0.00 0.00 54.13 55.81 3ina s LEU 139 Cb 0.12 -3.55 -0.11 0.00 0.50 0.00 0.00 46.19 43.15 3ina s LEU 139 CO 0.45 -0.82 1.57 -0.62 -1.32 0.00 0.00 176.35 175.61 3ina s ASP 140 N 2.47 6.46 0.56 3.68 2.15 -1.26 -4.89 116.67 125.85 3ina s ASP 140 Ca 0.67 2.84 0.37 0.00 0.43 0.00 0.00 52.55 56.86 3ina s ASP 140 Cb -0.31 -2.62 1.92 0.00 -0.30 0.00 0.00 42.92 41.61 3ina s ASP 140 CO 0.26 -0.86 2.14 0.77 -0.17 0.00 0.00 175.17 177.31 3ina h SER 141 N 5.26 0.00 -0.60 -0.34 4.64 -1.95 -2.91 113.55 117.64 3ina h SER 141 Ca -0.46 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.71 3ina h SER 141 Cb 1.22 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.22 3ina h SER 141 CO 0.82 0.00 0.16 0.59 -0.87 0.00 0.00 176.83 177.53 3ina n ASN 142 N -2.89 4.56 -4.70 4.97 3.02 -1.26 -3.72 115.26 115.25 3ina n ASN 142 Ca -0.02 -3.21 -0.30 0.00 -0.03 0.00 0.00 54.58 51.02 3ina n ASN 142 Cb 0.12 -0.69 0.14 0.00 -0.61 0.00 0.00 39.78 38.74 3ina n ASN 142 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3ina s VAL 143 N -2.97 2.63 -0.43 2.41 -7.23 -1.10 -4.79 120.40 108.92 3ina s VAL 143 Ca 0.52 0.21 0.02 0.00 -1.81 0.00 0.00 61.98 60.91 3ina s VAL 143 Cb 0.42 -2.55 0.14 0.00 0.56 0.00 0.00 36.38 34.95 3ina s VAL 143 CO 0.12 -0.27 0.26 -0.55 -0.31 0.00 0.00 175.10 174.35 3ina s SER 144 N -3.16 3.25 -0.01 4.85 0.15 -1.26 -3.90 113.70 113.61 3ina s SER 144 Ca 0.64 -2.64 -0.08 0.00 0.70 0.00 0.00 55.95 54.56 3ina s SER 144 Cb -0.19 -0.82 0.01 0.00 -1.71 0.00 0.00 66.02 63.30 3ina s SER 144 CO 0.58 -0.25 0.17 0.28 1.20 0.00 0.00 173.24 175.22 3ina s THR 145 N 0.39 0.07 -0.21 6.45 -1.32 -0.66 -1.80 115.64 118.56 3ina s THR 145 Ca 0.20 -0.56 -0.06 0.00 -1.21 0.00 0.00 61.69 60.06 3ina s THR 145 Cb -0.19 -0.44 -0.03 0.00 -1.51 0.00 0.00 72.50 70.33 3ina s THR 145 CO -0.03 -0.31 0.04 -0.63 -2.21 0.00 0.00 174.62 171.48 3ina s ILE 146 N -1.16 4.31 -1.52 5.08 1.01 -0.61 -0.17 121.20 128.14 3ina s ILE 146 Ca -0.12 -0.19 0.19 0.00 0.00 0.00 0.00 60.65 60.52 3ina s ILE 146 Cb -0.06 -2.97 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 3ina s ILE 146 CO 0.02 0.40 0.91 2.22 0.00 0.00 0.00 174.94 178.49 3ina n PHE 147 N 4.28 0.00 -3.64 3.97 -1.74 0.17 -2.15 117.46 118.35 3ina n PHE 147 Ca -0.17 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.63 3ina n PHE 147 Cb 0.52 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.45 3ina n PHE 147 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 3ina s ALA 148 N -2.27 -1.81 -0.01 1.98 0.00 -1.15 -1.99 121.76 116.51 3ina s ALA 148 Ca 0.14 2.26 -0.17 0.00 0.00 0.00 0.00 51.96 54.19 3ina s ALA 148 Cb 0.15 -1.33 0.03 0.00 0.00 0.00 0.00 23.12 21.97 3ina s ALA 148 CO 0.54 -0.36 0.36 1.14 0.00 0.00 0.00 175.76 177.43 3ina s GLN 149 N 1.21 0.74 -0.27 0.00 -2.07 -0.51 -0.50 119.66 118.26 3ina s GLN 149 Ca -0.07 -0.19 -0.06 0.00 -1.82 0.00 0.00 55.36 53.23 3ina s GLN 149 Cb -0.05 0.33 0.00 0.00 -1.09 0.00 0.00 33.01 32.21 3ina s GLN 149 CO -0.13 -0.22 0.03 -1.58 -1.32 0.00 0.00 175.29 172.08 3ina s TRP 150 N -1.54 3.09 0.09 9.60 0.51 -0.15 -1.43 118.94 129.11 3ina s TRP 150 Ca -0.12 -0.98 0.01 0.00 -2.12 0.00 0.00 56.10 52.89 3ina s TRP 150 Cb -0.04 -2.19 -0.04 0.00 -0.81 0.00 0.00 33.47 30.39 3ina s TRP 150 CO 0.04 -0.56 0.23 0.00 -0.51 0.00 0.00 176.95 176.14 3ina s ALA 151 N 1.49 3.98 0.70 0.98 0.00 0.09 -2.41 121.76 126.59 3ina s ALA 151 Ca 0.03 -0.91 -0.06 0.00 0.00 0.00 0.00 51.96 51.03 3ina s ALA 151 Cb -0.16 -1.80 0.07 0.00 0.00 0.00 0.00 23.12 21.23 3ina s ALA 151 CO 0.00 0.74 1.00 0.20 0.00 0.00 0.00 175.76 177.70 3ina s GLY 152 N -2.73 1.71 -0.51 0.00 0.00 -1.26 -1.53 107.32 103.00 3ina s GLY 152 Ca 0.35 -1.03 0.04 0.00 0.00 0.00 0.00 44.72 44.07 3ina s GLY 152 CO 0.28 -0.62 0.35 1.06 0.00 0.00 0.00 173.10 174.17 3ina s MET 153 N -5.21 1.53 0.30 2.90 -1.94 -1.11 -4.87 119.30 110.91 3ina s MET 153 Ca 0.61 -2.45 -0.27 0.00 -1.71 0.00 0.00 55.69 51.87 3ina s MET 153 Cb -0.10 -2.39 -0.10 0.00 2.01 0.00 0.00 34.83 34.25 3ina s MET 153 CO 0.44 -1.27 0.95 -1.25 -0.01 0.00 0.00 175.02 173.88 3ina s PRO 154 N -0.29 4.65 -0.31 2.03 0.04 -1.26 -4.37 135.00 135.49 3ina s PRO 154 Ca 0.24 1.38 -0.13 0.00 0.04 0.00 0.00 61.00 62.54 3ina s PRO 154 Cb -0.10 -2.93 -0.03 0.00 0.04 0.00 0.00 34.50 31.48 3ina s PRO 154 CO -0.11 0.33 0.26 0.34 0.04 0.00 0.00 177.00 177.86 3ina s ASP 155 N -1.49 6.09 0.00 6.66 -1.08 -1.26 -4.91 116.67 120.69 3ina s ASP 155 Ca 0.48 -0.14 0.17 0.00 -0.52 0.00 0.00 52.55 52.54 3ina s ASP 155 Cb -0.21 -2.15 1.01 0.00 -1.46 0.00 0.00 42.92 40.11 3ina s ASP 155 CO 0.26 -0.18 1.42 -2.11 0.52 0.00 0.00 175.17 175.08 3ina n ARG 156 N 5.17 0.55 0.00 4.34 1.85 -1.24 -2.56 116.66 124.77 3ina n ARG 156 Ca -0.12 0.00 0.11 0.00 -1.00 0.00 0.00 57.85 56.84 3ina n ARG 156 Cb 0.51 -1.48 0.55 0.00 -1.05 0.00 0.00 32.46 30.99 3ina n ARG 156 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 3ina n THR 157 N -0.98 0.32 -3.12 8.89 -2.24 -1.26 -4.31 114.28 111.58 3ina n THR 157 Ca 0.13 0.08 -0.42 0.00 -2.27 0.00 0.00 64.05 61.57 3ina n THR 157 Cb 0.06 -0.71 -0.07 0.00 -2.10 0.00 0.00 70.33 67.51 3ina n THR 157 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3ina s LEU 158 N -2.62 4.32 0.39 3.22 2.96 -1.06 -0.18 118.68 125.72 3ina s LEU 158 Ca 0.20 0.00 0.04 0.00 -0.22 0.00 0.00 54.13 54.15 3ina s LEU 158 Cb 0.15 -2.75 -0.05 0.00 0.50 0.00 0.00 46.19 44.04 3ina s LEU 158 CO 0.35 -0.63 0.06 0.68 -1.32 0.00 0.00 176.35 175.49 3ina s VAL 159 N 2.71 1.11 -0.12 1.68 -7.23 0.38 -1.77 120.40 117.16 3ina s VAL 159 Ca 0.23 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.43 3ina s VAL 159 Cb -0.14 -2.58 0.01 0.00 0.56 0.00 0.00 36.38 34.23 3ina s VAL 159 CO 0.16 0.00 -0.18 -1.58 -0.31 0.00 0.00 175.10 173.18 3ina s GLN 160 N -3.81 2.57 0.84 4.82 0.74 -0.31 -0.34 119.66 124.17 3ina s GLN 160 Ca 0.27 -0.69 -0.12 0.00 0.05 0.00 0.00 55.36 54.87 3ina s GLN 160 Cb 0.06 -2.11 0.09 0.00 1.10 0.00 0.00 33.01 32.15 3ina s GLN 160 CO 0.13 -0.02 1.11 0.95 -0.55 0.00 0.00 175.29 176.92 3ina s THR 161 N 0.86 2.65 0.58 -0.34 -4.23 0.09 -2.29 115.64 112.96 3ina s THR 161 Ca -0.08 0.21 0.28 0.00 -1.18 0.00 0.00 61.69 60.92 3ina s THR 161 Cb -0.15 -2.98 0.36 0.00 1.34 0.00 0.00 72.50 71.07 3ina s THR 161 CO -0.01 -0.28 2.09 -0.65 -0.54 0.00 0.00 174.62 175.23 3ina h PRO 162 N -1.22 0.00 -0.03 3.99 0.11 -1.85 0.78 132.00 133.77 3ina h PRO 162 Ca -0.48 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.46 3ina h PRO 162 Cb 1.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 3ina h PRO 162 CO 0.61 0.00 -0.75 1.96 -0.21 0.00 0.00 178.00 179.61 3ina h GLN 163 N 0.00 0.22 0.00 1.05 4.20 -1.91 -3.48 115.11 115.19 3ina h GLN 163 Ca 0.10 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.62 3ina h GLN 163 Cb 0.53 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.36 3ina h GLN 163 CO -0.00 0.87 0.00 0.41 -0.67 0.00 0.00 178.83 179.44 3ina n GLY 164 N 0.59 1.23 3.73 3.46 0.00 0.27 -5.11 105.19 109.35 3ina n GLY 164 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 3ina n GLY 164 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ina s GLU 165 N -0.07 4.58 -0.08 1.61 2.02 -1.26 -4.73 118.70 120.78 3ina s GLU 165 Ca 0.00 1.27 -0.25 0.00 0.02 0.00 0.00 54.97 56.01 3ina s GLU 165 Cb 0.00 -3.39 -0.03 0.00 0.10 0.00 0.00 34.13 30.81 3ina s GLU 165 CO 0.00 0.18 0.78 0.08 0.02 0.00 0.00 175.26 176.32 3ina s VAL 166 N 0.21 4.98 -0.01 2.63 1.01 -1.26 -0.73 120.40 127.22 3ina s VAL 166 Ca 0.44 1.58 0.01 0.00 0.00 0.00 0.00 61.98 64.01 3ina s VAL 166 Cb -0.22 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.06 3ina s VAL 166 CO 0.26 0.18 -0.02 -0.54 0.00 0.00 0.00 175.10 174.98 3ina s LYS 167 N 1.19 0.21 -0.48 2.72 -0.14 0.54 -5.00 119.74 118.78 3ina s LYS 167 Ca 0.40 -0.06 -0.18 0.00 -1.36 0.00 0.00 55.97 54.77 3ina s LYS 167 Cb -0.18 -0.25 0.05 0.00 -1.68 0.00 0.00 37.83 35.78 3ina s LYS 167 CO 0.18 0.02 0.57 0.21 -0.76 0.00 0.00 175.35 175.57 3ina s LYS 168 N 0.15 3.11 0.40 1.68 2.47 -1.26 -0.47 119.74 125.82 3ina s LYS 168 Ca -0.01 -0.88 -0.08 0.00 -1.56 0.00 0.00 55.97 53.43 3ina s LYS 168 Cb -0.03 -4.07 -0.06 0.00 -1.46 0.00 0.00 37.83 32.21 3ina s LYS 168 CO -0.00 -1.12 0.74 -0.51 0.16 0.00 0.00 175.35 174.61 3ina s LEU 169 N 2.44 3.82 0.74 5.43 1.43 0.75 -4.98 118.68 128.31 3ina s LEU 169 Ca 0.14 1.01 -0.11 0.00 -1.03 0.00 0.00 54.13 54.14 3ina s LEU 169 Cb -0.19 -3.90 0.04 0.00 0.03 0.00 0.00 46.19 42.16 3ina s LEU 169 CO 0.12 -0.41 1.10 0.42 0.23 0.00 0.00 176.35 177.81 3ina s THR 170 N -2.41 3.28 0.23 5.49 -4.23 -1.26 -4.77 115.64 111.97 3ina s THR 170 Ca 0.49 0.42 -0.07 0.00 -1.18 0.00 0.00 61.69 61.35 3ina s THR 170 Cb -0.10 -3.31 0.21 0.00 1.34 0.00 0.00 72.50 70.63 3ina s THR 170 CO 0.34 -0.54 1.88 0.58 -0.54 0.00 0.00 174.62 176.34 3ina h VAL 171 N -0.84 1.13 -0.29 2.29 2.07 -1.97 -0.33 116.25 118.31 3ina h VAL 171 Ca -0.46 -0.37 -0.10 0.00 0.82 0.00 0.00 66.70 66.59 3ina h VAL 171 Cb 1.26 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 3ina h VAL 171 CO 0.62 0.20 -0.25 0.44 0.02 0.00 0.00 177.57 178.60 3ina h ASP 172 N 1.07 0.57 -0.10 0.57 3.32 -1.99 -0.31 116.42 119.56 3ina h ASP 172 Ca 0.35 -0.20 -0.13 0.00 0.02 0.00 0.00 57.03 57.06 3ina h ASP 172 Cb 0.02 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 3ina h ASP 172 CO -0.12 0.81 -0.39 -0.33 -1.72 0.00 0.00 179.24 177.49 3ina h GLU 173 N 0.50 0.62 -0.44 3.56 5.08 -1.76 -1.11 114.58 121.03 3ina h GLU 173 Ca 0.07 -0.31 -0.13 0.00 -1.00 0.00 0.00 59.36 57.99 3ina h GLU 173 Cb 0.70 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 3ina h GLU 173 CO 0.05 0.91 -0.22 0.35 -1.00 0.00 0.00 179.01 179.09 3ina h PHE 174 N 0.51 1.07 -0.93 4.33 3.57 -0.72 -1.06 116.94 123.71 3ina h PHE 174 Ca 0.05 -0.27 0.06 0.00 3.53 0.00 0.00 57.97 61.33 3ina h PHE 174 Cb 0.90 -0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.34 3ina h PHE 174 CO 0.04 1.07 0.60 0.28 -2.23 0.00 0.00 178.31 178.08 3ina h VAL 175 N 0.76 1.10 -0.27 1.41 2.07 -0.85 0.94 116.25 121.42 3ina h VAL 175 Ca 0.10 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 3ina h VAL 175 Cb 0.80 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 3ina h VAL 175 CO 0.07 0.20 0.14 -0.08 0.02 0.00 0.00 177.57 177.91 3ina h GLU 176 N 1.09 0.38 -0.68 1.57 4.57 -0.67 -2.83 114.58 118.02 3ina h GLU 176 Ca 0.39 -0.05 -0.05 0.00 -1.18 0.00 0.00 59.36 58.46 3ina h GLU 176 Cb 0.13 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.62 3ina h GLU 176 CO -0.14 0.36 0.21 1.25 -1.18 0.00 0.00 179.01 179.51 3ina h LEU 177 N 0.31 0.99 -2.68 1.64 5.85 -0.33 -2.58 115.31 118.51 3ina h LEU 177 Ca 0.09 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.60 3ina h LEU 177 Cb 0.10 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.87 3ina h LEU 177 CO -0.01 0.94 -0.01 -0.08 -0.34 0.00 0.00 178.44 178.93 3ina h GLU 178 N 0.99 0.00 0.00 1.25 4.22 -0.65 -1.19 114.58 119.21 3ina h GLU 178 Ca 0.22 0.00 -0.07 0.00 0.08 0.00 0.00 59.36 59.59 3ina h GLU 178 Cb 0.30 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 3ina h GLU 178 CO -0.01 0.01 -0.35 0.87 -2.18 0.00 0.00 179.01 177.35 3ina h LYS 179 N 0.00 0.00 -0.03 1.92 1.57 -1.22 -3.20 116.57 115.61 3ina h LYS 179 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3ina h LYS 179 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 3ina h LYS 179 CO 0.00 0.35 0.00 0.25 -0.57 0.00 0.00 179.45 179.48 3ina n THR 180 N -3.79 0.11 -4.36 -0.16 -2.24 -0.54 -4.92 114.28 98.38 3ina n THR 180 Ca -0.01 -0.56 -0.22 0.00 -2.27 0.00 0.00 64.05 60.99 3ina n THR 180 Cb 0.43 1.06 -0.16 0.00 -2.10 0.00 0.00 70.33 69.56 3ina n THR 180 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3ina s THR 181 N -0.58 0.83 -0.30 4.28 2.01 -0.66 -2.48 115.64 118.74 3ina s THR 181 Ca 0.08 -0.30 -0.12 0.00 0.31 0.00 0.00 61.69 61.66 3ina s THR 181 Cb 0.05 -0.80 -0.04 0.00 0.01 0.00 0.00 72.50 71.73 3ina s THR 181 CO 0.08 0.29 0.24 0.12 -0.69 0.00 0.00 174.62 174.66 3ina s PHE 182 N 0.81 3.22 -0.23 4.92 5.36 0.15 -4.60 117.98 127.61 3ina s PHE 182 Ca -0.12 0.06 -0.15 0.00 -0.96 0.00 0.00 56.93 55.75 3ina s PHE 182 Cb -0.15 -2.46 -0.04 0.00 -0.34 0.00 0.00 43.02 40.04 3ina s PHE 182 CO 0.02 -0.25 0.38 -0.06 -1.46 0.00 0.00 175.22 173.85 3ina s PHE 183 N 1.81 3.32 -0.47 10.12 0.40 -1.26 -0.03 117.98 131.86 3ina s PHE 183 Ca 0.08 0.51 -0.13 0.00 -0.60 0.00 0.00 56.93 56.79 3ina s PHE 183 Cb -0.16 -2.53 0.09 0.00 0.51 0.00 0.00 43.02 40.92 3ina s PHE 183 CO 0.11 -0.10 0.37 0.21 0.70 0.00 0.00 175.22 176.51 3ina s LYS 184 N 1.63 2.81 5.95 0.44 2.47 0.15 -4.90 119.74 128.28 3ina s LYS 184 Ca 0.17 -1.51 0.00 0.00 -1.56 0.00 0.00 55.97 53.07 3ina s LYS 184 Cb -0.15 -4.04 0.00 0.00 -1.46 0.00 0.00 37.83 32.18 3ina s LYS 184 CO 0.08 -1.09 0.00 1.63 0.16 0.00 0.00 175.35 176.13 3ina n LYS 185 N 5.09 0.00 -0.00 4.03 5.02 -1.26 -1.47 118.16 129.57 3ina n LYS 185 Ca -0.11 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.27 3ina n LYS 185 Cb 0.42 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.32 3ina n LYS 185 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3ina n ASN 186 N 11.85 0.88 -4.75 4.39 6.94 -1.26 -4.90 115.26 128.40 3ina n ASN 186 Ca 0.00 -0.89 -0.37 0.00 -0.02 0.00 0.00 54.58 53.30 3ina n ASN 186 Cb 0.00 1.06 -0.07 0.00 -2.36 0.00 0.00 39.78 38.41 3ina n ASN 186 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3ina s ALA 187 N -2.86 3.62 0.14 -2.53 0.00 -0.54 -1.15 121.76 118.44 3ina s ALA 187 Ca 0.06 -0.42 -0.24 0.00 0.00 0.00 0.00 51.96 51.36 3ina s ALA 187 Cb 0.14 -2.37 -0.08 0.00 0.00 0.00 0.00 23.12 20.82 3ina s ALA 187 CO 0.79 0.18 0.73 0.20 0.00 0.00 0.00 175.76 177.66 3ina s GLY 188 N 0.15 2.86 0.12 0.00 0.00 0.11 -0.67 107.32 109.89 3ina s GLY 188 Ca 0.18 0.28 0.05 0.00 0.00 0.00 0.00 44.72 45.23 3ina s GLY 188 CO 0.05 0.78 -0.12 0.30 0.00 0.00 0.00 173.10 174.11 3ina s HIS 189 N -1.11 1.28 0.26 1.90 3.76 0.95 -1.76 115.29 120.57 3ina s HIS 189 Ca 0.34 -0.62 -0.31 0.00 -0.15 0.00 0.00 55.06 54.32 3ina s HIS 189 Cb -0.22 -0.67 -0.11 0.00 1.11 0.00 0.00 32.58 32.69 3ina s HIS 189 CO 0.24 0.10 1.60 -1.21 -0.85 0.00 0.00 174.74 174.62 3ina s GLU 190 N -2.93 4.14 -0.44 1.40 2.02 0.02 0.30 118.70 123.21 3ina s GLU 190 Ca 0.10 2.54 -0.27 0.00 0.02 0.00 0.00 54.97 57.35 3ina s GLU 190 Cb -0.03 -3.05 0.03 0.00 0.10 0.00 0.00 34.13 31.17 3ina s GLU 190 CO 0.02 -0.64 1.03 0.21 0.02 0.00 0.00 175.26 175.91 3ina s LYS 191 N 0.00 3.71 -0.14 1.61 2.20 -1.04 -1.16 119.74 124.92 3ina s LYS 191 Ca 0.66 0.48 -0.05 0.00 -0.36 0.00 0.00 55.97 56.70 3ina s LYS 191 Cb -0.47 -3.88 -0.04 0.00 -1.51 0.00 0.00 37.83 31.93 3ina s LYS 191 CO 0.43 -1.23 0.03 0.08 -0.36 0.00 0.00 175.35 174.30 3ina s VAL 192 N 4.02 4.56 0.01 4.02 1.01 -0.40 -4.92 120.40 128.70 3ina s VAL 192 Ca 0.43 -0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.97 3ina s VAL 192 Cb -0.09 -3.00 -0.06 0.00 0.00 0.00 0.00 36.38 33.23 3ina s VAL 192 CO 0.27 0.53 1.52 -0.69 0.00 0.00 0.00 175.10 176.72 3ina s VAL 193 N -0.16 3.48 -0.26 2.92 1.01 -1.26 0.44 120.40 126.57 3ina s VAL 193 Ca 0.06 0.85 -0.23 0.00 0.00 0.00 0.00 61.98 62.66 3ina s VAL 193 Cb -0.12 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.70 3ina s VAL 193 CO 0.02 -0.01 0.74 -0.60 0.00 0.00 0.00 175.10 175.24 3ina s ARG 194 N 2.72 4.10 0.22 2.72 3.52 -1.18 -4.80 118.95 126.24 3ina s ARG 194 Ca 0.68 0.71 0.08 0.00 -0.13 0.00 0.00 55.73 57.07 3ina s ARG 194 Cb -0.34 -3.67 -0.04 0.00 -1.56 0.00 0.00 34.95 29.34 3ina s ARG 194 CO 0.28 -0.51 0.06 -0.51 -0.81 0.00 0.00 175.30 173.81 3ina s LEU 195 N 2.73 3.44 0.00 -0.88 2.01 -1.26 -2.09 118.68 122.63 3ina s LEU 195 Ca 0.31 -0.41 0.00 0.00 0.01 0.00 0.00 54.13 54.04 3ina s LEU 195 Cb -0.15 -2.02 0.00 0.00 0.01 0.00 0.00 46.19 44.02 3ina s LEU 195 CO 0.09 0.03 0.00 -0.90 1.01 0.00 0.00 176.35 176.58 3ina n ASP 196 N -0.61 0.00 -0.11 2.29 5.68 -0.78 -4.85 116.55 118.17 3ina n ASP 196 Ca -0.08 -0.85 0.06 0.00 -0.50 0.00 0.00 54.79 53.42 3ina n ASP 196 Cb 0.57 0.00 0.39 0.00 -1.14 0.00 0.00 41.12 40.94 3ina n ASP 196 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 3ina h LYS 197 N 0.00 0.65 -0.99 0.11 3.64 -2.01 -0.68 116.57 117.29 3ina h LYS 197 Ca 0.00 -0.04 -0.25 0.00 -1.27 0.00 0.00 60.65 59.10 3ina h LYS 197 Cb 0.00 -0.15 -0.15 0.00 -0.41 0.00 0.00 32.23 31.53 3ina h LYS 197 CO 0.00 0.43 0.31 1.04 -2.27 0.00 0.00 179.45 178.96 3ina n GLN 198 N -4.47 1.73 -2.55 1.90 3.00 -1.26 -4.89 117.38 110.84 3ina n GLN 198 Ca 0.07 -1.53 -0.07 0.00 -0.01 0.00 0.00 57.00 55.46 3ina n GLN 198 Cb 0.16 -1.62 -0.00 0.00 0.00 0.00 0.00 30.24 28.78 3ina n GLN 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3ina n GLY 199 N -0.29 -0.50 3.87 1.08 0.00 -0.26 -4.94 105.19 104.15 3ina n GLY 199 Ca 0.29 0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.95 3ina n GLY 199 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ina s ASN 200 N -2.07 6.33 0.20 1.61 0.01 -1.26 -4.76 114.94 115.01 3ina s ASN 200 Ca 0.03 0.45 -0.32 0.00 -0.71 0.00 0.00 52.86 52.31 3ina s ASN 200 Cb -0.02 -2.04 -0.12 0.00 0.41 0.00 0.00 41.25 39.48 3ina s ASN 200 CO 0.04 0.40 1.73 -2.65 -1.51 0.00 0.00 177.10 175.11 3ina n PRO 201 N 2.03 2.77 -3.24 -0.60 -0.02 -1.26 -1.87 135.00 132.80 3ina n PRO 201 Ca -0.20 1.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.92 3ina n PRO 201 Cb 0.55 -2.85 -0.06 0.00 -0.02 0.00 0.00 33.50 31.12 3ina n PRO 201 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 3ina s MET 202 N 1.24 4.10 0.50 -0.52 -1.94 -0.89 -4.93 119.30 116.86 3ina s MET 202 Ca 0.75 0.67 0.03 0.00 -1.71 0.00 0.00 55.69 55.43 3ina s MET 202 Cb -0.51 -2.90 -0.01 0.00 2.01 0.00 0.00 34.83 33.42 3ina s MET 202 CO 0.33 0.43 0.10 0.15 -0.01 0.00 0.00 175.02 176.02 3ina s LYS 203 N -1.99 2.19 0.00 2.03 -0.14 -1.26 -1.42 119.74 119.15 3ina s LYS 203 Ca 0.40 -2.26 0.00 0.00 -1.36 0.00 0.00 55.97 52.76 3ina s LYS 203 Cb -0.16 -1.69 0.00 0.00 -1.68 0.00 0.00 37.83 34.30 3ina s LYS 203 CO 0.20 -0.37 0.00 -0.40 -0.76 0.00 0.00 175.35 174.02 3ina n ASP 204 N -1.34 1.93 -0.26 2.83 3.85 -0.67 -4.81 116.55 118.08 3ina n ASP 204 Ca -0.13 -0.05 0.22 0.00 -0.71 0.00 0.00 54.79 54.12 3ina n ASP 204 Cb 0.66 0.00 0.56 0.00 -1.35 0.00 0.00 41.12 40.99 3ina n ASP 204 CO 0.00 0.00 0.00 0.11 -1.01 0.00 0.00 177.20 176.30 3ina h LYS 205 N 0.00 0.31 -0.46 0.11 6.56 -2.02 -1.19 116.57 119.87 3ina h LYS 205 Ca 0.00 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 3ina h LYS 205 Cb 0.00 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 31.59 3ina h LYS 205 CO 0.00 0.20 0.00 0.09 -2.06 0.00 0.00 179.45 177.68 3ina n ASN 206 N -4.48 3.87 -0.22 0.86 4.13 -1.26 -4.93 115.26 113.22 3ina n ASN 206 Ca 0.21 -2.38 -0.03 0.00 1.68 0.00 0.00 54.58 54.06 3ina n ASN 206 Cb 0.82 -0.44 -0.01 0.00 -1.54 0.00 0.00 39.78 38.60 3ina n ASN 206 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3ina n GLY 207 N 0.59 0.60 3.78 7.41 0.00 -0.45 -5.01 105.19 112.11 3ina n GLY 207 Ca 0.20 -0.46 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 3ina n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ina s LYS 208 N -1.57 4.44 0.46 1.61 1.02 -1.26 -4.69 119.74 119.76 3ina s LYS 208 Ca 0.00 1.01 -0.24 0.00 0.02 0.00 0.00 55.97 56.76 3ina s LYS 208 Cb 0.00 -3.27 -0.09 0.00 -0.52 0.00 0.00 37.83 33.96 3ina s LYS 208 CO 0.00 0.56 1.20 -0.35 -0.92 0.00 0.00 175.35 175.84 3ina n PRO 209 N 1.78 1.67 -4.26 -1.68 -0.04 -1.26 -1.67 135.00 129.53 3ina n PRO 209 Ca -0.07 0.60 -0.31 0.00 -0.04 0.00 0.00 63.50 63.69 3ina n PRO 209 Cb 0.49 -2.33 -0.09 0.00 -0.04 0.00 0.00 33.50 31.54 3ina n PRO 209 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3ina s VAL 210 N -1.26 3.74 0.41 0.52 1.01 -0.51 -4.86 120.40 119.45 3ina s VAL 210 Ca 0.65 -0.98 0.04 0.00 0.00 0.00 0.00 61.98 61.69 3ina s VAL 210 Cb -0.49 -2.72 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 3ina s VAL 210 CO 0.55 0.22 0.12 -0.31 0.00 0.00 0.00 175.10 175.67 3ina s TYR 211 N -1.18 1.80 0.09 5.22 2.02 -1.26 -3.12 117.35 120.93 3ina s TYR 211 Ca 0.22 -1.24 0.03 0.00 -0.37 0.00 0.00 57.07 55.71 3ina s TYR 211 Cb -0.11 -1.19 -0.04 0.00 -0.40 0.00 0.00 41.96 40.22 3ina s TYR 211 CO 0.13 -0.24 -0.08 0.21 -1.57 0.00 0.00 175.55 174.00 3ina s LYS 212 N -3.74 0.82 -0.33 -0.62 2.20 0.17 -4.69 119.74 113.54 3ina s LYS 212 Ca 0.24 -1.20 -0.19 0.00 -0.36 0.00 0.00 55.97 54.46 3ina s LYS 212 Cb 0.03 -0.37 -0.01 0.00 -1.51 0.00 0.00 37.83 35.97 3ina s LYS 212 CO 0.14 0.03 0.55 0.00 -0.36 0.00 0.00 175.35 175.71 3ina s ALA 213 N -2.87 3.49 0.29 3.13 0.00 -1.26 -1.27 121.76 123.27 3ina s ALA 213 Ca 0.07 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.14 3ina s ALA 213 Cb 0.00 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 20.09 3ina s ALA 213 CO -0.02 -1.16 0.00 0.41 0.00 0.00 0.00 175.76 174.99 3ina n GLY 214 N 4.68 1.33 3.83 0.00 0.00 -0.31 -4.95 105.19 109.77 3ina n GLY 214 Ca -0.04 -1.59 -0.31 0.00 0.00 0.00 0.00 46.02 44.08 3ina n GLY 214 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ina s LYS 215 N 1.94 3.08 0.32 1.61 3.01 -1.26 -4.46 119.74 123.97 3ina s LYS 215 Ca 0.00 0.88 -0.29 0.00 -1.01 0.00 0.00 55.97 55.55 3ina s LYS 215 Cb 0.00 -2.01 -0.11 0.00 -1.01 0.00 0.00 37.83 34.70 3ina s LYS 215 CO 0.00 -0.98 1.55 -0.51 0.51 0.00 0.00 175.35 175.92 3ina s LEU 216 N -5.46 4.34 -0.05 3.17 1.02 -1.26 -0.80 118.68 119.63 3ina s LEU 216 Ca 0.57 2.98 0.13 0.00 0.02 0.00 0.00 54.13 57.83 3ina s LEU 216 Cb -0.13 -3.65 0.41 0.00 0.02 0.00 0.00 46.19 42.84 3ina s LEU 216 CO 0.55 -0.89 1.34 -0.46 0.02 0.00 0.00 176.35 176.90 3ina n ASN 217 N 1.56 3.35 0.00 2.29 2.04 -0.72 -4.79 115.26 118.99 3ina n ASN 217 Ca 0.05 -2.28 0.00 0.00 -0.44 0.00 0.00 54.58 51.92 3ina n ASN 217 Cb 0.38 -0.35 0.00 0.00 -2.53 0.00 0.00 39.78 37.29 3ina n ASN 217 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3ina n GLY 218 N 0.37 3.16 3.78 4.83 0.00 -1.26 -4.74 105.19 111.33 3ina n GLY 218 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 3ina n GLY 218 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3ina s TRP 219 N -2.16 3.66 0.03 1.61 0.52 -1.26 -3.72 118.94 117.61 3ina s TRP 219 Ca 0.00 1.77 0.03 0.00 0.02 0.00 0.00 56.10 57.92 3ina s TRP 219 Cb 0.00 -2.98 -0.02 0.00 -1.15 0.00 0.00 33.47 29.32 3ina s TRP 219 CO 0.00 0.07 -0.08 -0.51 0.02 0.00 0.00 176.95 176.45 3ina s LEU 220 N -2.01 2.16 0.13 2.99 1.43 -0.97 0.04 118.68 122.45 3ina s LEU 220 Ca 0.50 -0.38 0.08 0.00 -1.03 0.00 0.00 54.13 53.30 3ina s LEU 220 Cb -0.21 -0.30 -0.04 0.00 0.03 0.00 0.00 46.19 45.68 3ina s LEU 220 CO 0.26 -0.06 -0.20 0.68 0.23 0.00 0.00 176.35 177.26 3ina s VAL 221 N -0.85 1.77 -0.04 -1.59 -7.23 -0.30 -1.16 120.40 111.00 3ina s VAL 221 Ca -0.03 -1.71 -0.30 0.00 -1.81 0.00 0.00 61.98 58.12 3ina s VAL 221 Cb -0.07 -1.69 -0.04 0.00 0.56 0.00 0.00 36.38 35.14 3ina s VAL 221 CO 0.00 -0.17 1.33 -0.70 -0.31 0.00 0.00 175.10 175.25 3ina s GLU 222 N -2.31 4.29 0.02 4.82 2.12 -0.73 -4.68 118.70 122.24 3ina s GLU 222 Ca 0.11 1.83 -0.27 0.00 0.36 0.00 0.00 54.97 57.00 3ina s GLU 222 Cb -0.08 -3.62 0.06 0.00 0.26 0.00 0.00 34.13 30.76 3ina s GLU 222 CO 0.05 -0.56 0.61 -1.14 -0.54 0.00 0.00 175.26 173.68 3ina s GLN 223 N 2.57 1.08 3.70 4.30 -0.44 -1.26 -3.64 119.66 125.97 3ina s GLN 223 Ca 0.60 -0.03 0.00 0.00 -2.50 0.00 0.00 55.36 53.43 3ina s GLN 223 Cb -0.28 0.50 0.00 0.00 -1.64 0.00 0.00 33.01 31.60 3ina s GLN 223 CO 0.23 -0.38 0.00 0.41 0.50 0.00 0.00 175.29 176.05 3ina n GLY 224 N 0.54 0.61 0.00 2.59 0.00 -1.26 -4.85 105.19 102.82 3ina n GLY 224 Ca -0.19 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.08 3ina n GLY 224 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ina n GLY 225 N 0.00 2.63 3.73 -0.02 0.00 -1.26 -4.84 105.19 105.42 3ina n GLY 225 Ca 0.00 -1.75 -0.38 0.00 0.00 0.00 0.00 46.02 43.88 3ina n GLY 225 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3ina n TYR 226 N 0.90 2.09 -2.50 1.61 0.53 -1.26 -4.91 117.16 113.62 3ina n TYR 226 Ca 0.00 0.43 -0.41 0.00 -1.02 0.00 0.00 57.90 56.91 3ina n TYR 226 Cb 0.00 -2.33 -0.04 0.00 -1.03 0.00 0.00 39.34 35.94 3ina n TYR 226 CO 0.00 0.00 0.00 -1.25 -1.02 0.00 0.00 176.86 174.59 3ina s PRO 227 N -2.91 4.63 0.61 -0.72 0.04 -1.26 -4.74 135.00 130.64 3ina s PRO 227 Ca 0.73 1.76 0.31 0.00 0.04 0.00 0.00 61.00 63.84 3ina s PRO 227 Cb -0.42 -3.23 1.81 0.00 0.04 0.00 0.00 34.50 32.70 3ina s PRO 227 CO 0.48 0.16 2.17 -1.35 0.04 0.00 0.00 177.00 178.50 3ina h PRO 228 N 4.41 0.00 -3.05 0.56 0.11 -1.70 -3.38 132.00 128.95 3ina h PRO 228 Ca -0.46 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.50 3ina h PRO 228 Cb 1.21 0.00 -0.25 0.00 0.11 0.00 0.00 31.00 32.07 3ina h PRO 228 CO 0.70 0.00 -0.39 -1.17 -0.21 0.00 0.00 178.00 176.92 3ina s LEU 229 N -7.32 0.91 -0.13 2.35 2.96 -1.22 -0.17 118.68 116.06 3ina s LEU 229 Ca -0.05 0.57 -0.12 0.00 -0.22 0.00 0.00 54.13 54.31 3ina s LEU 229 Cb 0.14 0.96 0.03 0.00 0.50 0.00 0.00 46.19 47.83 3ina s LEU 229 CO 0.51 -0.10 0.33 0.00 -1.32 0.00 0.00 176.35 175.78 3ina s ALA 230 N 0.18 -0.83 -0.13 5.97 0.00 -0.17 -0.98 121.76 125.81 3ina s ALA 230 Ca -0.00 0.95 0.00 0.00 0.00 0.00 0.00 51.96 52.91 3ina s ALA 230 Cb -0.02 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.54 3ina s ALA 230 CO 0.00 -0.16 -0.14 -0.06 0.00 0.00 0.00 175.76 175.40 3ina s PHE 231 N 0.19 2.78 0.03 0.00 0.40 0.35 -0.71 117.98 121.01 3ina s PHE 231 Ca -0.00 -0.73 -0.03 0.00 -0.60 0.00 0.00 56.93 55.56 3ina s PHE 231 Cb -0.02 -1.84 0.01 0.00 0.51 0.00 0.00 43.02 41.68 3ina s PHE 231 CO 0.00 -0.27 0.16 0.41 0.70 0.00 0.00 175.22 176.22 3ina n GLY 232 N 3.60 1.16 3.22 4.36 0.00 -0.79 -0.65 105.19 116.08 3ina n GLY 232 Ca -0.18 -0.95 -0.27 0.00 0.00 0.00 0.00 46.02 44.62 3ina n GLY 232 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ina s PHE 233 N -5.25 1.85 -0.28 1.61 0.40 0.76 -1.35 117.98 115.73 3ina s PHE 233 Ca 0.04 -0.36 -0.23 0.00 -0.60 0.00 0.00 56.93 55.78 3ina s PHE 233 Cb -0.00 -1.19 0.11 0.00 0.51 0.00 0.00 43.02 42.44 3ina s PHE 233 CO 0.01 -0.04 0.93 0.45 0.70 0.00 0.00 175.22 177.27 3ina s SER 234 N -0.47 -0.56 -1.36 1.36 0.15 -0.27 -1.65 113.70 110.91 3ina s SER 234 Ca 0.08 1.03 -0.02 0.00 0.70 0.00 0.00 55.95 57.73 3ina s SER 234 Cb -0.08 1.09 0.01 0.00 -1.71 0.00 0.00 66.02 65.33 3ina s SER 234 CO -0.01 -0.17 0.19 0.61 1.20 0.00 0.00 173.24 175.06 3ina n GLY 235 N 2.70 -0.50 2.01 9.45 0.00 -1.26 -1.08 105.19 116.50 3ina n GLY 235 Ca -0.14 0.04 -0.00 0.00 0.00 0.00 0.00 46.02 45.91 3ina n GLY 235 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ina n GLY 236 N -1.04 0.41 3.16 -0.02 0.00 -1.24 -4.96 105.19 101.48 3ina n GLY 236 Ca -0.14 -0.99 -0.18 0.00 0.00 0.00 0.00 46.02 44.70 3ina n GLY 236 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ina s LEU 237 N -0.05 2.25 -0.07 0.99 1.43 -0.24 -0.85 118.68 122.13 3ina s LEU 237 Ca 0.00 -0.57 -0.12 0.00 -1.03 0.00 0.00 54.13 52.41 3ina s LEU 237 Cb 0.00 -0.52 -0.05 0.00 0.03 0.00 0.00 46.19 45.65 3ina s LEU 237 CO 0.00 -0.05 0.29 0.12 0.23 0.00 0.00 176.35 176.93 3ina s PHE 238 N -1.17 3.65 0.15 0.29 5.36 0.13 -1.11 117.98 125.28 3ina s PHE 238 Ca -0.01 0.76 -0.11 0.00 -0.96 0.00 0.00 56.93 56.61 3ina s PHE 238 Cb -0.09 -2.16 0.00 0.00 -0.34 0.00 0.00 43.02 40.43 3ina s PHE 238 CO 0.02 0.63 0.32 1.52 -1.46 0.00 0.00 175.22 176.25 3ina s TYR 239 N -0.87 0.20 -0.10 10.12 1.13 -0.46 -0.37 117.35 126.99 3ina s TYR 239 Ca 0.19 -0.56 0.00 0.00 -1.41 0.00 0.00 57.07 55.29 3ina s TYR 239 Cb -0.14 0.06 0.02 0.00 -1.10 0.00 0.00 41.96 40.79 3ina s TYR 239 CO 0.09 -0.72 -0.09 0.42 -2.51 0.00 0.00 175.55 172.73 3ina s ILE 240 N -3.91 1.10 -0.10 -3.49 1.01 -0.44 -1.89 121.20 113.48 3ina s ILE 240 Ca 0.12 -0.37 0.04 0.00 0.00 0.00 0.00 60.65 60.44 3ina s ILE 240 Cb 0.03 -1.08 0.00 0.00 0.01 0.00 0.00 42.46 41.42 3ina s ILE 240 CO -0.04 0.37 -0.24 -0.75 0.00 0.00 0.00 174.94 174.29 3ina s LYS 241 N 1.40 2.97 -0.03 2.79 2.20 0.11 -0.63 119.74 128.55 3ina s LYS 241 Ca -0.01 -0.86 0.02 0.00 -0.36 0.00 0.00 55.97 54.76 3ina s LYS 241 Cb -0.13 -2.26 -0.03 0.00 -1.51 0.00 0.00 37.83 33.90 3ina s LYS 241 CO -0.05 0.18 -0.06 0.00 -0.36 0.00 0.00 175.35 175.06 3ina s ALA 242 N 0.33 3.01 0.03 3.13 0.00 0.24 -1.00 121.76 127.51 3ina s ALA 242 Ca -0.18 -0.95 0.05 0.00 0.00 0.00 0.00 51.96 50.88 3ina s ALA 242 Cb -0.18 -1.19 -0.02 0.00 0.00 0.00 0.00 23.12 21.73 3ina s ALA 242 CO 0.09 0.59 -0.15 -0.80 0.00 0.00 0.00 175.76 175.49 3ina s ASN 243 N -1.10 1.79 -0.02 0.00 0.02 0.76 -0.44 114.94 115.94 3ina s ASN 243 Ca 0.15 -0.44 0.02 0.00 -1.02 0.00 0.00 52.86 51.57 3ina s ASN 243 Cb -0.11 -0.13 0.00 0.00 0.02 0.00 0.00 41.25 41.03 3ina s ASN 243 CO 0.04 0.07 -0.07 -0.55 0.02 0.00 0.00 177.10 176.62 3ina s SER 244 N -1.04 0.93 -0.21 -1.22 0.15 0.27 -1.31 113.70 111.29 3ina s SER 244 Ca 0.03 -0.14 -0.04 0.00 0.70 0.00 0.00 55.95 56.50 3ina s SER 244 Cb -0.08 -0.23 0.07 0.00 -1.71 0.00 0.00 66.02 64.07 3ina s SER 244 CO 0.01 0.05 0.07 -0.62 1.20 0.00 0.00 173.24 173.95 3ina s ASP 245 N 0.17 2.86 0.00 5.45 -1.08 -0.93 -1.31 116.67 121.82 3ina s ASP 245 Ca -0.02 -0.86 0.26 0.00 -0.52 0.00 0.00 52.55 51.40 3ina s ASP 245 Cb -0.07 -0.44 0.59 0.00 -1.46 0.00 0.00 42.92 41.54 3ina s ASP 245 CO 0.00 -0.35 1.47 -2.11 0.52 0.00 0.00 175.17 174.70 3ina n ARG 246 N 5.15 0.98 -2.18 4.34 1.85 -0.26 -1.07 116.66 125.47 3ina n ARG 246 Ca -0.07 -0.65 -0.40 0.00 -1.00 0.00 0.00 57.85 55.73 3ina n ARG 246 Cb 0.47 -1.49 -0.02 0.00 -1.05 0.00 0.00 32.46 30.37 3ina n ARG 246 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 3ina s LYS 247 N -2.46 4.27 0.05 2.89 2.20 -1.26 -4.50 119.74 120.93 3ina s LYS 247 Ca 0.24 2.09 -0.25 0.00 -0.36 0.00 0.00 55.97 57.69 3ina s LYS 247 Cb 0.19 -2.96 -0.17 0.00 -1.51 0.00 0.00 37.83 33.38 3ina s LYS 247 CO 0.52 -0.22 1.55 2.35 -0.36 0.00 0.00 175.35 179.20 3ina h TRP 248 N 3.17 -0.13 -3.64 4.03 -0.00 -1.82 -3.38 115.95 114.19 3ina h TRP 248 Ca -0.49 -0.00 -0.69 0.00 -0.00 0.00 0.00 58.89 57.71 3ina h TRP 248 Cb 1.23 0.04 -0.27 0.00 -0.00 0.00 0.00 29.16 30.16 3ina h TRP 248 CO 0.56 0.05 -0.61 -1.17 -0.00 0.00 0.00 178.44 177.27 3ina s LEU 249 N -9.87 4.15 0.31 0.65 2.96 -1.26 -4.85 118.68 110.78 3ina s LEU 249 Ca -0.14 -0.96 -0.29 0.00 -0.22 0.00 0.00 54.13 52.52 3ina s LEU 249 Cb 0.04 -1.88 -0.12 0.00 0.50 0.00 0.00 46.19 44.73 3ina s LEU 249 CO 0.64 -0.28 1.43 0.41 -1.32 0.00 0.00 176.35 177.24 3ina n THR 250 N 4.84 1.52 -3.44 3.68 -1.04 -1.26 -4.97 114.28 113.61 3ina n THR 250 Ca -0.13 -0.38 -0.43 0.00 -2.04 0.00 0.00 64.05 61.06 3ina n THR 250 Cb 0.46 -1.73 -0.08 0.00 -1.82 0.00 0.00 70.33 67.16 3ina n THR 250 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3ina s ASP 251 N 0.06 6.01 0.42 8.00 2.15 -1.26 -4.93 116.67 127.13 3ina s ASP 251 Ca 0.60 -1.39 0.30 0.00 0.43 0.00 0.00 52.55 52.49 3ina s ASP 251 Cb -0.55 -2.13 1.31 0.00 -0.30 0.00 0.00 42.92 41.25 3ina s ASP 251 CO 0.56 -0.62 1.88 0.11 -0.17 0.00 0.00 175.17 176.93 3ina h LYS 252 N 8.66 0.00 0.00 4.34 1.57 -1.93 -2.56 116.57 126.65 3ina h LYS 252 Ca -0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 3ina h LYS 252 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.41 3ina h LYS 252 CO 0.85 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 179.48 3ina n ASP 253 N -2.66 0.51 -4.47 0.86 10.43 -1.26 -4.47 116.55 115.49 3ina n ASP 253 Ca 0.01 0.57 -0.43 0.00 2.57 0.00 0.00 54.79 57.51 3ina n ASP 253 Cb 0.22 -0.70 -0.04 0.00 1.84 0.00 0.00 41.12 42.45 3ina n ASP 253 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 3ina s ASP 254 N -3.95 6.24 -0.26 -2.24 2.15 -0.97 -4.89 116.67 112.75 3ina s ASP 254 Ca 0.10 -1.07 -0.00 0.00 0.43 0.00 0.00 52.55 52.00 3ina s ASP 254 Cb 0.13 -2.44 0.20 0.00 -0.30 0.00 0.00 42.92 40.51 3ina s ASP 254 CO 0.50 -1.45 1.88 0.54 -0.17 0.00 0.00 175.17 176.47 3ina n ARG 255 N 7.83 1.66 -1.74 4.34 5.12 -1.26 -4.91 116.66 127.70 3ina n ARG 255 Ca 0.02 -1.33 -0.38 0.00 -1.93 0.00 0.00 57.85 54.22 3ina n ARG 255 Cb 0.47 -1.52 -0.03 0.00 -1.16 0.00 0.00 32.46 30.21 3ina n ARG 255 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3ina s ASN 257 N 9.93 0.26 0.33 0.00 3.84 -1.26 -4.68 114.94 123.36 3ina s ASN 257 Ca 0.88 0.64 -0.29 0.00 0.21 0.00 0.00 52.86 54.30 3ina s ASN 257 Cb -0.19 0.84 -0.10 0.00 -0.55 0.00 0.00 41.25 41.25 3ina s ASN 257 CO 0.27 -0.24 1.34 0.00 -2.79 0.00 0.00 177.10 175.68 3ina s ALA 258 N 2.46 3.52 -0.29 1.71 0.00 -1.26 -5.00 121.76 122.89 3ina s ALA 258 Ca 0.01 1.31 -0.18 0.00 0.00 0.00 0.00 51.96 53.11 3ina s ALA 258 Cb -0.12 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.47 3ina s ALA 258 CO -0.10 -0.71 0.50 1.21 0.00 0.00 0.00 175.76 176.66 3ina s ASN 259 N -0.36 6.37 0.29 0.00 3.84 -1.26 -4.97 114.94 118.85 3ina s ASN 259 Ca 0.50 0.29 0.05 0.00 0.21 0.00 0.00 52.86 53.91 3ina s ASN 259 Cb -0.41 -2.27 0.74 0.00 -0.55 0.00 0.00 41.25 38.76 3ina s ASN 259 CO 0.54 -0.34 1.72 -0.65 -2.79 0.00 0.00 177.10 175.57 3ina h PRO 260 N 8.20 0.48 0.05 0.43 0.11 -1.93 0.11 132.00 139.46 3ina h PRO 260 Ca -0.29 -0.03 -0.26 0.00 0.11 0.00 0.00 66.00 65.53 3ina h PRO 260 Cb 1.14 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 32.15 3ina h PRO 260 CO 0.73 0.32 -1.09 0.78 -0.21 0.00 0.00 178.00 178.53 3ina h GLY 261 N 0.50 0.56 0.61 -0.55 0.00 -1.93 -3.38 103.07 98.89 3ina h GLY 261 Ca 0.57 -1.09 -0.12 0.00 0.00 0.00 0.00 47.33 46.68 3ina h GLY 261 CO -0.48 0.96 -1.61 0.28 0.00 0.00 0.00 176.54 175.69 3ina n LYS 262 N -3.75 0.64 -3.14 4.80 5.02 -0.93 -4.91 118.16 115.89 3ina n LYS 262 Ca -0.10 0.07 -0.39 0.00 -2.02 0.00 0.00 58.31 55.87 3ina n LYS 262 Cb 0.91 -1.70 -0.05 0.00 -0.02 0.00 0.00 35.03 34.17 3ina n LYS 262 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3ina s THR 263 N -3.10 5.07 0.61 -0.18 2.01 0.33 -5.00 115.64 115.38 3ina s THR 263 Ca -0.05 1.22 -0.19 0.00 0.31 0.00 0.00 61.69 62.99 3ina s THR 263 Cb 0.10 -3.95 -0.03 0.00 0.01 0.00 0.00 72.50 68.63 3ina s THR 263 CO 0.83 0.20 1.27 -2.84 -0.69 0.00 0.00 174.62 173.39 3ina s PRO 264 N 1.26 2.83 0.31 4.92 0.02 -1.26 -4.86 135.00 138.21 3ina s PRO 264 Ca 0.31 1.99 -0.29 0.00 0.02 0.00 0.00 61.00 63.02 3ina s PRO 264 Cb -0.16 -1.95 -0.11 0.00 0.02 0.00 0.00 34.50 32.30 3ina s PRO 264 CO 0.13 -1.36 1.49 0.08 -0.33 0.00 0.00 177.00 177.01 3ina s VAL 265 N -1.46 2.28 -1.52 3.83 1.01 -1.26 -3.02 120.40 120.26 3ina s VAL 265 Ca 0.79 0.25 0.00 0.00 0.00 0.00 0.00 61.98 63.02 3ina s VAL 265 Cb -0.35 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 32.87 3ina s VAL 265 CO 0.38 0.05 0.00 0.23 0.00 0.00 0.00 175.10 175.76 3ina n MET 266 N 1.58 -1.86 -3.89 2.72 2.81 0.52 -4.95 117.12 114.05 3ina n MET 266 Ca 0.05 0.86 -0.30 0.00 -1.81 0.00 0.00 57.70 56.50 3ina n MET 266 Cb 0.39 -5.47 -0.14 0.00 -0.71 0.00 0.00 33.22 27.29 3ina n MET 266 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 3ina s LYS 267 N -4.88 1.54 0.32 0.03 -0.14 -1.17 -5.04 119.74 110.42 3ina s LYS 267 Ca 0.00 -2.10 -0.29 0.00 -1.36 0.00 0.00 55.97 52.21 3ina s LYS 267 Cb 0.00 -2.92 -0.12 0.00 -1.68 0.00 0.00 37.83 33.11 3ina s LYS 267 CO 0.00 -1.06 1.53 -0.35 -0.76 0.00 0.00 175.35 174.71 3ina n PRO 268 N 3.72 2.63 -3.22 -1.68 -0.04 -1.26 -4.70 135.00 130.45 3ina n PRO 268 Ca 0.05 0.93 -0.39 0.00 -0.04 0.00 0.00 63.50 64.05 3ina n PRO 268 Cb 0.36 -2.68 -0.06 0.00 -0.04 0.00 0.00 33.50 31.09 3ina n PRO 268 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3ina s LEU 269 N -1.06 4.29 0.10 1.53 2.96 -0.09 -4.89 118.68 121.52 3ina s LEU 269 Ca 0.60 0.94 0.04 0.00 -0.22 0.00 0.00 54.13 55.50 3ina s LEU 269 Cb -0.50 -2.83 -0.04 0.00 0.50 0.00 0.00 46.19 43.33 3ina s LEU 269 CO 0.55 -0.04 -0.12 0.42 -1.32 0.00 0.00 176.35 175.84 3ina s THR 270 N 0.69 1.07 0.00 3.68 -4.23 -1.26 -0.63 115.64 114.96 3ina s THR 270 Ca 0.30 -1.61 0.00 0.00 -1.18 0.00 0.00 61.69 59.20 3ina s THR 270 Cb -0.16 -1.36 0.00 0.00 1.34 0.00 0.00 72.50 72.32 3ina s THR 270 CO 0.13 -0.47 0.00 -1.54 -0.54 0.00 0.00 174.62 172.20 3ina n SER 271 N 0.65 1.26 0.05 3.99 3.41 -0.27 -5.00 113.62 117.71 3ina n SER 271 Ca -0.17 -0.92 -0.12 0.00 -0.26 0.00 0.00 58.87 57.41 3ina n SER 271 Cb 0.57 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.46 3ina n SER 271 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3ina h GLU 272 N 0.00 -0.08 0.00 4.33 4.81 -2.03 -3.34 114.58 118.27 3ina h GLU 272 Ca 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 3ina h GLU 272 Cb 0.00 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.40 3ina h GLU 272 CO 0.00 -0.05 -0.93 0.66 -0.73 0.00 0.00 179.01 177.95 3ina n TYR 273 N -5.16 0.00 -4.37 0.92 4.02 -1.26 -5.01 117.16 106.30 3ina n TYR 273 Ca -0.06 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.58 3ina n TYR 273 Cb 0.09 -0.09 -0.09 0.00 -0.02 0.00 0.00 39.34 39.23 3ina n TYR 273 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 3ina s LYS 274 N -2.50 1.95 -0.06 -0.72 1.02 -1.26 -1.10 119.74 117.08 3ina s LYS 274 Ca 0.02 -1.52 -0.03 0.00 0.02 0.00 0.00 55.97 54.47 3ina s LYS 274 Cb 0.10 -1.99 0.04 0.00 -0.52 0.00 0.00 37.83 35.46 3ina s LYS 274 CO 0.57 0.37 0.14 0.00 -0.92 0.00 0.00 175.35 175.51 3ina s ALA 275 N -2.19 -0.23 -0.13 5.17 0.00 -0.43 -1.11 121.76 122.85 3ina s ALA 275 Ca 0.28 0.64 0.01 0.00 0.00 0.00 0.00 51.96 52.89 3ina s ALA 275 Cb -0.07 -0.46 0.02 0.00 0.00 0.00 0.00 23.12 22.61 3ina s ALA 275 CO 0.16 -0.18 -0.15 0.45 0.00 0.00 0.00 175.76 176.04 3ina s SER 276 N 1.25 2.61 -0.08 0.00 0.15 0.20 -0.56 113.70 117.26 3ina s SER 276 Ca -0.08 -0.47 0.04 0.00 0.70 0.00 0.00 55.95 56.14 3ina s SER 276 Cb -0.12 -1.15 0.00 0.00 -1.71 0.00 0.00 66.02 63.04 3ina s SER 276 CO -0.06 -0.03 -0.20 -0.89 1.20 0.00 0.00 173.24 173.26 3ina s THR 277 N 1.30 1.74 -0.59 6.45 2.01 0.41 -0.91 115.64 126.05 3ina s THR 277 Ca 0.01 -0.85 -0.22 0.00 0.31 0.00 0.00 61.69 60.93 3ina s THR 277 Cb -0.14 -1.51 0.06 0.00 0.01 0.00 0.00 72.50 70.92 3ina s THR 277 CO -0.07 0.49 0.87 -0.63 -0.69 0.00 0.00 174.62 174.59 3ina s ILE 278 N 0.30 4.49 0.10 1.82 -1.09 -1.26 -0.59 121.20 124.96 3ina s ILE 278 Ca -0.13 -0.20 0.18 0.00 -2.23 0.00 0.00 60.65 58.27 3ina s ILE 278 Cb -0.16 -4.55 0.13 0.00 -1.58 0.00 0.00 42.46 36.30 3ina s ILE 278 CO 0.06 -1.19 1.68 0.00 -1.23 0.00 0.00 174.94 174.26 3ina h ALA 279 N 9.34 0.92 -1.64 9.38 0.00 -1.25 0.15 119.26 136.17 3ina h ALA 279 Ca -0.28 -0.36 0.06 0.00 0.00 0.00 0.00 54.91 54.33 3ina h ALA 279 Cb 1.08 -0.06 -0.23 0.00 0.00 0.00 0.00 17.79 18.58 3ina h ALA 279 CO 1.10 0.49 0.48 -0.47 0.00 0.00 0.00 179.25 180.85 3ina s TYR 280 N -3.47 -0.43 -0.00 0.00 5.04 -1.21 -4.59 117.35 112.68 3ina s TYR 280 Ca 0.01 0.79 -0.11 0.00 -2.44 0.00 0.00 57.07 55.31 3ina s TYR 280 Cb 0.10 0.43 0.01 0.00 0.35 0.00 0.00 41.96 42.86 3ina s TYR 280 CO 0.69 -0.37 0.23 -1.59 -1.34 0.00 0.00 175.55 173.17 3ina s LYS 281 N -0.95 0.60 -0.18 4.97 -2.85 -1.26 -1.33 119.74 118.74 3ina s LYS 281 Ca -0.03 -0.33 -0.17 0.00 -1.00 0.00 0.00 55.97 54.45 3ina s LYS 281 Cb -0.01 0.26 0.05 0.00 -2.06 0.00 0.00 37.83 36.07 3ina s LYS 281 CO 0.02 -0.16 0.48 -1.17 0.10 0.00 0.00 175.35 174.62 3ina s LEU 282 N -1.44 0.15 0.27 2.77 2.96 0.50 -4.96 118.68 118.92 3ina s LEU 282 Ca -0.13 0.97 -0.31 0.00 -0.22 0.00 0.00 54.13 54.44 3ina s LEU 282 Cb -0.06 1.66 -0.12 0.00 0.50 0.00 0.00 46.19 48.17 3ina s LEU 282 CO 0.02 -0.17 1.60 -2.65 -1.32 0.00 0.00 176.35 173.83 3ina n PRO 283 N 2.84 2.62 -0.31 0.98 -0.02 -1.26 0.22 135.00 140.07 3ina n PRO 283 Ca -0.13 0.94 0.15 0.00 -2.02 0.00 0.00 63.50 62.43 3ina n PRO 283 Cb 0.57 -2.72 0.33 0.00 -0.02 0.00 0.00 33.50 31.66 3ina n PRO 283 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3ina h PHE 284 N 5.15 0.72 0.00 6.00 3.57 -1.30 0.18 116.94 131.27 3ina h PHE 284 Ca -0.46 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.08 3ina h PHE 284 Cb 1.23 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 39.79 3ina h PHE 284 CO 0.59 -0.04 -0.01 0.00 -2.23 0.00 0.00 178.31 176.62 3ina h ALA 285 N 1.73 1.22 -0.01 2.41 0.00 -1.89 -1.69 119.26 121.03 3ina h ALA 285 Ca 0.59 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.49 3ina h ALA 285 Cb 1.14 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3ina h ALA 285 CO -0.53 0.01 -0.26 -0.25 0.00 0.00 0.00 179.25 178.22 3ina n ASP 286 N -3.42 1.13 -4.69 0.00 8.00 0.62 -4.84 116.55 113.35 3ina n ASP 286 Ca -0.03 -0.97 -0.42 0.00 0.71 0.00 0.00 54.79 54.08 3ina n ASP 286 Cb 0.10 0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.33 3ina n ASP 286 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3ina s PHE 287 N -2.47 3.40 0.19 1.24 5.36 -0.64 -4.96 117.98 120.09 3ina s PHE 287 Ca 0.25 1.45 -0.33 0.00 -0.96 0.00 0.00 56.93 57.34 3ina s PHE 287 Cb 0.19 -3.28 -0.14 0.00 -0.34 0.00 0.00 43.02 39.45 3ina s PHE 287 CO 0.51 -0.63 1.41 -2.30 -1.46 0.00 0.00 175.22 172.76 3ina n PRO 288 N 5.07 1.82 -4.20 10.12 -0.02 -1.26 -4.99 135.00 141.54 3ina n PRO 288 Ca 0.10 0.65 -0.25 0.00 -2.02 0.00 0.00 63.50 61.98 3ina n PRO 288 Cb 0.48 -2.31 -0.07 0.00 -0.02 0.00 0.00 33.50 31.58 3ina n PRO 288 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3ina s LYS 289 N 0.10 2.53 -1.52 -0.52 -0.14 -1.26 -4.64 119.74 114.30 3ina s LYS 289 Ca 0.74 -1.14 -0.13 0.00 -1.36 0.00 0.00 55.97 54.08 3ina s LYS 289 Cb -0.73 -2.38 0.09 0.00 -1.68 0.00 0.00 37.83 33.12 3ina s LYS 289 CO 0.46 0.43 0.86 -0.25 -0.76 0.00 0.00 175.35 176.09 3ina n ASP 290 N -0.52 -4.60 -3.57 2.83 8.00 0.44 -4.95 116.55 114.18 3ina n ASP 290 Ca -0.08 -0.71 -0.13 0.00 0.71 0.00 0.00 54.79 54.58 3ina n ASP 290 Cb 0.56 -3.70 -0.05 0.00 -0.02 0.00 0.00 41.12 37.92 3ina n ASP 290 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ina s TRP 292 N -2.99 3.53 -0.17 0.00 0.52 -1.26 -4.26 118.94 114.30 3ina s TRP 292 Ca -0.02 1.47 -0.03 0.00 0.02 0.00 0.00 56.10 57.54 3ina s TRP 292 Cb -0.00 -3.07 -0.02 0.00 -1.15 0.00 0.00 33.47 29.23 3ina s TRP 292 CO -0.06 -0.14 -0.05 0.42 0.02 0.00 0.00 176.95 177.14 3ina s ILE 293 N 1.68 3.64 -0.21 2.03 1.01 -0.16 -4.46 121.20 124.73 3ina s ILE 293 Ca 0.45 -0.43 -0.06 0.00 0.00 0.00 0.00 60.65 60.61 3ina s ILE 293 Cb -0.18 -2.60 -0.03 0.00 0.01 0.00 0.00 42.46 39.66 3ina s ILE 293 CO 0.18 0.47 0.02 -0.89 0.00 0.00 0.00 174.94 174.72 3ina s THR 294 N 0.67 4.06 -0.19 2.92 2.01 0.11 -1.18 115.64 124.04 3ina s THR 294 Ca -0.03 -0.27 -0.08 0.00 0.31 0.00 0.00 61.69 61.62 3ina s THR 294 Cb -0.15 -2.85 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 3ina s THR 294 CO 0.02 0.42 0.08 -0.36 -0.69 0.00 0.00 174.62 174.09 3ina s PHE 295 N 1.06 3.28 -0.27 4.92 0.40 -0.17 -0.65 117.98 126.55 3ina s PHE 295 Ca 0.02 0.12 -0.04 0.00 -0.60 0.00 0.00 56.93 56.44 3ina s PHE 295 Cb -0.14 -2.10 0.02 0.00 0.51 0.00 0.00 43.02 41.30 3ina s PHE 295 CO 0.02 0.17 0.01 1.03 0.70 0.00 0.00 175.22 177.16 3ina s ARG 296 N 0.40 2.96 -0.17 0.44 0.52 -0.53 -2.36 118.95 120.22 3ina s ARG 296 Ca 0.04 -0.92 -0.00 0.00 -0.52 0.00 0.00 55.73 54.33 3ina s ARG 296 Cb -0.12 -3.19 0.00 0.00 0.52 0.00 0.00 34.95 32.16 3ina s ARG 296 CO -0.00 -0.42 -0.15 0.08 0.02 0.00 0.00 175.30 174.83 3ina s VAL 297 N 1.41 2.63 -0.12 3.52 1.01 0.81 -1.41 120.40 128.25 3ina s VAL 297 Ca 0.01 -0.77 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 3ina s VAL 297 Cb -0.17 -2.13 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 3ina s VAL 297 CO -0.01 0.50 -0.08 -2.28 0.00 0.00 0.00 175.10 173.24 3ina s HIS 298 N 1.07 2.92 -0.05 5.22 2.46 0.12 0.13 115.29 127.16 3ina s HIS 298 Ca -0.00 -0.34 0.02 0.00 0.47 0.00 0.00 55.06 55.21 3ina s HIS 298 Cb -0.14 -1.85 0.02 0.00 -0.13 0.00 0.00 32.58 30.47 3ina s HIS 298 CO -0.04 -0.00 -0.09 0.42 -2.47 0.00 0.00 174.74 172.56 3ina s ILE 299 N 0.06 0.87 -0.39 0.89 1.01 -0.04 -1.37 121.20 122.21 3ina s ILE 299 Ca -0.02 -0.33 -0.05 0.00 0.00 0.00 0.00 60.65 60.25 3ina s ILE 299 Cb -0.14 -0.82 0.09 0.00 0.01 0.00 0.00 42.46 41.60 3ina s ILE 299 CO 0.03 0.29 0.18 -1.81 0.00 0.00 0.00 174.94 173.64 3ina s ASP 300 N 0.69 5.30 0.31 3.58 -0.00 -0.05 -0.99 116.67 125.51 3ina s ASP 300 Ca -0.12 -1.72 -0.29 0.00 -0.00 0.00 0.00 52.55 50.42 3ina s ASP 300 Cb -0.14 -1.85 -0.10 0.00 -0.00 0.00 0.00 42.92 40.82 3ina s ASP 300 CO 0.02 -0.49 1.33 0.26 -0.00 0.00 0.00 175.17 176.29 3ina s TRP 301 N 1.25 3.04 0.42 4.23 0.52 -0.55 -0.69 118.94 127.16 3ina s TRP 301 Ca 0.04 1.34 -0.26 0.00 0.02 0.00 0.00 56.10 57.24 3ina s TRP 301 Cb -0.22 -3.71 -0.10 0.00 -1.15 0.00 0.00 33.47 28.30 3ina s TRP 301 CO -0.02 -2.01 1.40 2.41 0.02 0.00 0.00 176.95 178.76 3ina n THR 302 N 1.11 2.52 -3.65 2.01 -1.04 -0.55 -4.31 114.28 110.36 3ina n THR 302 Ca 0.01 -0.50 -0.36 0.00 -2.04 0.00 0.00 64.05 61.16 3ina n THR 302 Cb 0.42 -1.80 -0.09 0.00 -1.82 0.00 0.00 70.33 67.03 3ina n THR 302 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3ina s VAL 303 N -1.17 5.36 0.29 12.58 1.01 -0.17 -4.03 120.40 134.27 3ina s VAL 303 Ca 0.59 0.22 0.08 0.00 0.00 0.00 0.00 61.98 62.87 3ina s VAL 303 Cb -0.47 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 3ina s VAL 303 CO 0.59 0.36 0.19 -0.31 0.00 0.00 0.00 175.10 175.93 3ina s TYR 304 N 0.94 2.94 -0.37 5.22 1.51 -1.26 -0.89 117.35 125.44 3ina s TYR 304 Ca 0.08 -0.22 0.06 0.00 -1.01 0.00 0.00 57.07 55.98 3ina s TYR 304 Cb -0.13 -1.52 0.59 0.00 -0.11 0.00 0.00 41.96 40.79 3ina s TYR 304 CO 0.04 0.41 1.69 0.41 -1.11 0.00 0.00 175.55 176.99 3ina n GLY 305 N -1.20 3.68 7.00 0.71 0.00 0.35 -4.72 105.19 111.01 3ina n GLY 305 Ca -0.05 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.11 3ina n GLY 305 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ina n LYS 306 N -0.46 0.00 0.15 1.61 5.02 -1.26 -1.37 118.16 121.85 3ina n LYS 306 Ca 0.42 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.84 3ina n LYS 306 Cb 1.35 0.00 0.67 0.00 -0.02 0.00 0.00 35.03 37.03 3ina n LYS 306 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3ina h GLU 307 N 0.00 0.00 0.00 1.97 3.07 -1.96 0.16 114.58 117.81 3ina h GLU 307 Ca 0.00 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.82 3ina h GLU 307 Cb 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 3ina h GLU 307 CO 0.00 0.00 -0.17 0.00 -1.40 0.00 0.00 179.01 177.44 3ina h ALA 308 N 1.88 1.25 -3.03 3.43 0.00 -1.63 -3.47 119.26 117.68 3ina h ALA 308 Ca 0.11 -0.16 -0.38 0.00 0.00 0.00 0.00 54.91 54.48 3ina h ALA 308 Cb 0.45 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3ina h ALA 308 CO -0.00 0.22 -0.51 0.39 0.00 0.00 0.00 179.25 179.35 3ina n GLU 309 N -3.65 -2.18 -3.78 0.00 1.02 0.04 -4.98 120.64 107.11 3ina n GLU 309 Ca -0.01 0.91 -0.20 0.00 -0.02 0.00 0.00 57.16 57.83 3ina n GLU 309 Cb 0.30 -5.50 -0.02 0.00 -0.02 0.00 0.00 31.44 26.19 3ina n GLU 309 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3ina s THR 310 N -2.99 4.34 -0.52 2.62 -4.23 -1.26 -4.75 115.64 108.85 3ina s THR 310 Ca 0.06 -1.14 -0.18 0.00 -1.18 0.00 0.00 61.69 59.25 3ina s THR 310 Cb -0.03 -3.48 0.08 0.00 1.34 0.00 0.00 72.50 70.41 3ina s THR 310 CO 0.07 -0.24 0.58 -0.63 -0.54 0.00 0.00 174.62 173.86 3ina s ILE 311 N -2.14 4.98 0.10 2.99 -1.09 -1.26 -0.49 121.20 124.28 3ina s ILE 311 Ca 0.39 -0.85 -0.11 0.00 -2.23 0.00 0.00 60.65 57.85 3ina s ILE 311 Cb -0.08 -4.31 -0.18 0.00 -1.58 0.00 0.00 42.46 36.30 3ina s ILE 311 CO 0.29 -0.84 1.27 0.58 -1.23 0.00 0.00 174.94 175.01 3ina h VAL 312 N 5.85 1.30 -2.44 2.92 2.07 -1.30 -3.46 116.25 121.20 3ina h VAL 312 Ca -0.28 -2.14 -0.07 0.00 0.82 0.00 0.00 66.70 65.03 3ina h VAL 312 Cb 1.10 2.19 -0.25 0.00 -1.52 0.00 0.00 31.29 32.80 3ina h VAL 312 CO 0.99 0.66 -0.24 -0.75 0.02 0.00 0.00 177.57 178.25 3ina s LYS 313 N -3.53 0.45 0.97 1.57 2.20 -1.02 -4.98 119.74 115.40 3ina s LYS 313 Ca -0.09 0.98 -0.11 0.00 -0.36 0.00 0.00 55.97 56.39 3ina s LYS 313 Cb 0.08 0.16 0.17 0.00 -1.51 0.00 0.00 37.83 36.73 3ina s LYS 313 CO 0.90 -0.18 1.11 -2.14 -0.36 0.00 0.00 175.35 174.68 3ina s PRO 314 N 1.84 0.64 0.03 4.03 0.02 -1.26 -1.00 135.00 139.30 3ina s PRO 314 Ca -0.08 1.29 0.00 0.00 0.02 0.00 0.00 61.00 62.24 3ina s PRO 314 Cb -0.09 -1.70 0.01 0.00 0.02 0.00 0.00 34.50 32.74 3ina s PRO 314 CO -0.15 -2.81 0.05 0.41 -0.33 0.00 0.00 177.00 174.17 3ina n GLY 315 N 0.14 1.32 3.30 0.52 0.00 0.97 -4.63 105.19 106.81 3ina n GLY 315 Ca 0.09 -2.04 -0.12 0.00 0.00 0.00 0.00 46.02 43.94 3ina n GLY 315 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3ina s MET 316 N -2.33 0.46 -0.05 1.61 0.00 0.14 -1.68 119.30 117.44 3ina s MET 316 Ca 0.03 0.63 0.02 0.00 0.00 0.00 0.00 55.69 56.38 3ina s MET 316 Cb -0.00 0.17 0.01 0.00 0.00 0.00 0.00 34.83 35.00 3ina s MET 316 CO 0.02 -0.08 -0.11 -1.17 0.00 0.00 0.00 175.02 173.68 3ina s LEU 317 N 0.54 1.65 -0.04 4.11 2.96 -0.42 -0.87 118.68 126.61 3ina s LEU 317 Ca -0.03 -0.25 0.01 0.00 -0.22 0.00 0.00 54.13 53.64 3ina s LEU 317 Cb -0.04 -0.71 0.02 0.00 0.50 0.00 0.00 46.19 45.96 3ina s LEU 317 CO -0.03 0.04 -0.02 -0.62 -1.32 0.00 0.00 176.35 174.39 3ina s ASP 318 N 0.52 0.74 -0.03 3.68 2.15 -0.47 -1.22 116.67 122.05 3ina s ASP 318 Ca -0.10 -0.08 0.01 0.00 0.43 0.00 0.00 52.55 52.80 3ina s ASP 318 Cb -0.13 -0.35 0.02 0.00 -0.30 0.00 0.00 42.92 42.16 3ina s ASP 318 CO 0.02 -0.08 -0.03 -0.69 -0.17 0.00 0.00 175.17 174.23 3ina s VAL 319 N 0.99 0.36 -0.03 1.11 1.01 0.07 -0.70 120.40 123.20 3ina s VAL 319 Ca -0.10 -0.04 0.06 0.00 0.00 0.00 0.00 61.98 61.90 3ina s VAL 319 Cb -0.14 -0.40 -0.02 0.00 0.00 0.00 0.00 36.38 35.82 3ina s VAL 319 CO -0.01 0.17 -0.20 -0.13 0.00 0.00 0.00 175.10 174.94 3ina s ARG 320 N 0.82 2.28 -0.26 2.72 1.81 -0.50 -2.34 118.95 123.49 3ina s ARG 320 Ca -0.09 -0.83 0.03 0.00 -1.72 0.00 0.00 55.73 53.12 3ina s ARG 320 Cb -0.13 -2.21 0.06 0.00 -0.45 0.00 0.00 34.95 32.23 3ina s ARG 320 CO -0.01 0.59 -0.11 1.41 -0.68 0.00 0.00 175.30 176.51 3ina s MET 321 N -0.73 2.19 -0.06 3.54 -2.45 0.83 -1.45 119.30 121.17 3ina s MET 321 Ca 0.11 -1.31 0.02 0.00 -1.25 0.00 0.00 55.69 53.26 3ina s MET 321 Cb -0.10 -2.86 -0.03 0.00 1.25 0.00 0.00 34.83 33.09 3ina s MET 321 CO 0.00 -0.57 -0.09 -0.51 1.05 0.00 0.00 175.02 174.90 3ina s ASP 322 N 1.13 4.42 0.11 1.11 1.11 0.17 -0.39 116.67 124.34 3ina s ASP 322 Ca -0.09 -0.09 -0.26 0.00 0.18 0.00 0.00 52.55 52.30 3ina s ASP 322 Cb -0.20 -1.08 0.07 0.00 1.07 0.00 0.00 42.92 42.79 3ina s ASP 322 CO -0.05 0.35 0.91 -0.72 1.18 0.00 0.00 175.17 176.84 3ina s TYR 323 N -0.73 -0.22 -0.20 4.23 1.13 -0.44 0.03 117.35 121.16 3ina s TYR 323 Ca 0.11 -0.04 -0.12 0.00 -1.41 0.00 0.00 57.07 55.61 3ina s TYR 323 Cb -0.11 0.61 -0.05 0.00 -1.10 0.00 0.00 41.96 41.31 3ina s TYR 323 CO 0.01 -0.76 0.22 -0.65 -2.51 0.00 0.00 175.55 171.85 3ina s GLN 324 N -3.29 4.19 -0.02 -3.49 -1.52 -1.26 -0.66 119.66 113.60 3ina s GLN 324 Ca 0.10 -0.09 -0.00 0.00 -1.95 0.00 0.00 55.36 53.42 3ina s GLN 324 Cb -0.01 -3.46 0.03 0.00 -0.22 0.00 0.00 33.01 29.35 3ina s GLN 324 CO -0.02 0.19 0.03 -2.00 -0.25 0.00 0.00 175.29 173.25 3ina s GLU 325 N 0.65 -0.04 -1.85 2.91 2.56 0.07 -4.77 118.70 118.23 3ina s GLU 325 Ca 0.12 0.22 0.00 0.00 0.00 0.00 0.00 54.97 55.30 3ina s GLU 325 Cb -0.13 -0.29 0.00 0.00 2.00 0.00 0.00 34.13 35.71 3ina s GLU 325 CO 0.02 -0.19 0.00 1.04 -0.56 0.00 0.00 175.26 175.57 3ina n GLN 326 N 4.35 -1.23 -0.92 4.30 1.13 -1.26 -0.34 117.38 123.40 3ina n GLN 326 Ca -0.24 1.10 0.00 0.00 -1.94 0.00 0.00 57.00 55.92 3ina n GLN 326 Cb 0.50 -5.36 0.00 0.00 0.11 0.00 0.00 30.24 25.49 3ina n GLN 326 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3ina n GLY 327 N -0.83 0.85 3.84 1.08 0.00 -1.26 -5.02 105.19 103.84 3ina n GLY 327 Ca -0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 3ina n GLY 327 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ina s LYS 328 N -0.08 3.07 -0.13 1.61 1.02 0.53 -5.09 119.74 120.68 3ina s LYS 328 Ca 0.00 -0.71 -0.25 0.00 0.02 0.00 0.00 55.97 55.02 3ina s LYS 328 Cb 0.00 -2.78 -0.02 0.00 -0.52 0.00 0.00 37.83 34.51 3ina s LYS 328 CO 0.00 0.53 0.82 0.21 -0.92 0.00 0.00 175.35 175.99 3ina s LYS 329 N -2.85 4.36 -0.02 1.68 2.20 -1.26 -0.75 119.74 123.09 3ina s LYS 329 Ca 0.32 1.04 0.07 0.00 -0.36 0.00 0.00 55.97 57.04 3ina s LYS 329 Cb -0.11 -3.53 -0.02 0.00 -1.51 0.00 0.00 37.83 32.65 3ina s LYS 329 CO 0.25 -0.21 -0.25 0.08 -0.36 0.00 0.00 175.35 174.86 3ina s VAL 330 N 1.73 2.18 -0.18 4.02 1.01 0.17 -4.96 120.40 124.36 3ina s VAL 330 Ca 0.40 -1.06 -0.05 0.00 0.00 0.00 0.00 61.98 61.27 3ina s VAL 330 Cb -0.17 -1.76 0.07 0.00 0.00 0.00 0.00 36.38 34.51 3ina s VAL 330 CO 0.15 0.58 0.12 -0.55 0.00 0.00 0.00 175.10 175.41 3ina s SER 331 N -0.61 2.14 -0.23 3.32 0.15 -1.26 -1.33 113.70 115.88 3ina s SER 331 Ca 0.10 -0.54 -0.09 0.00 0.70 0.00 0.00 55.95 56.12 3ina s SER 331 Cb -0.10 -0.09 -0.04 0.00 -1.71 0.00 0.00 66.02 64.08 3ina s SER 331 CO -0.01 -0.35 0.11 -0.54 1.20 0.00 0.00 173.24 173.66 3ina s LYS 332 N 2.19 3.91 -1.36 5.44 -0.14 0.48 -4.91 119.74 125.34 3ina s LYS 332 Ca 0.03 -0.36 -0.11 0.00 -1.36 0.00 0.00 55.97 54.18 3ina s LYS 332 Cb -0.16 -3.40 0.11 0.00 -1.68 0.00 0.00 37.83 32.70 3ina s LYS 332 CO -0.11 0.03 2.07 1.58 -0.76 0.00 0.00 175.35 178.16 3ina n HIS 333 N 4.33 3.13 0.25 3.18 -0.00 -1.26 -0.12 115.22 124.73 3ina n HIS 333 Ca -0.16 -2.87 0.08 0.00 0.46 0.00 0.00 57.72 55.23 3ina n HIS 333 Cb 0.52 -2.20 0.62 0.00 -0.12 0.00 0.00 29.99 28.82 3ina n HIS 333 CO 0.00 0.00 0.00 -0.84 0.46 0.00 0.00 176.34 175.96 3ina h ILE 334 N 3.77 0.96 -3.33 3.57 3.07 -1.84 -3.36 117.51 120.36 3ina h ILE 334 Ca 0.49 -0.31 -0.57 0.00 1.55 0.00 0.00 64.86 66.01 3ina h ILE 334 Cb 0.61 1.17 -0.40 0.00 -0.27 0.00 0.00 36.82 37.94 3ina h ILE 334 CO 1.73 0.09 -0.76 -0.69 -1.05 0.00 0.00 178.15 177.46 3ina s VAL 335 N -4.76 0.98 -0.71 0.16 1.01 -0.99 -4.85 120.40 111.25 3ina s VAL 335 Ca -0.04 -1.14 -0.19 0.00 0.00 0.00 0.00 61.98 60.60 3ina s VAL 335 Cb 0.16 -1.55 0.12 0.00 0.00 0.00 0.00 36.38 35.11 3ina s VAL 335 CO 0.66 -0.40 0.86 0.21 0.00 0.00 0.00 175.10 176.43 3ina s ASN 336 N 1.61 6.34 -0.87 3.32 3.84 -1.26 -0.75 114.94 127.17 3ina s ASN 336 Ca 0.03 -1.62 -0.14 0.00 0.21 0.00 0.00 52.86 51.34 3ina s ASN 336 Cb -0.18 -2.34 0.02 0.00 -0.55 0.00 0.00 41.25 38.21 3ina s ASN 336 CO -0.15 -1.11 0.26 0.59 -2.79 0.00 0.00 177.10 173.90 3ina n ASN 337 N 6.41 -1.31 -4.69 -4.21 4.13 -1.23 -4.87 115.26 109.49 3ina n ASN 337 Ca 0.02 -0.84 -0.42 0.00 1.68 0.00 0.00 54.58 55.02 3ina n ASN 337 Cb 0.45 -1.02 -0.03 0.00 -1.54 0.00 0.00 39.78 37.64 3ina n ASN 337 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 3ina s GLU 338 N -6.30 4.41 0.26 3.52 0.41 -0.35 -4.85 118.70 115.79 3ina s GLU 338 Ca 0.19 1.23 -0.30 0.00 -0.41 0.00 0.00 54.97 55.68 3ina s GLU 338 Cb -0.11 -3.53 -0.10 0.00 -1.78 0.00 0.00 34.13 28.62 3ina s GLU 338 CO 0.63 -0.24 1.31 0.21 -0.49 0.00 0.00 175.26 176.69 3ina s LYS 339 N 1.77 4.38 0.07 1.61 2.20 -1.26 -1.31 119.74 127.21 3ina s LYS 339 Ca 0.45 2.12 -0.26 0.00 -0.36 0.00 0.00 55.97 57.92 3ina s LYS 339 Cb -0.18 -3.14 0.09 0.00 -1.51 0.00 0.00 37.83 33.09 3ina s LYS 339 CO 0.18 -0.21 0.75 -1.50 -0.36 0.00 0.00 175.35 174.20 3ina s ILE 340 N -0.43 0.00 -0.24 5.43 2.07 -0.68 -4.91 121.20 122.44 3ina s ILE 340 Ca 0.53 -0.01 -0.15 0.00 -1.41 0.00 0.00 60.65 59.62 3ina s ILE 340 Cb -0.38 -1.01 -0.04 0.00 0.13 0.00 0.00 42.46 41.16 3ina s ILE 340 CO 0.44 0.00 0.37 -0.76 -1.91 0.00 0.00 174.94 173.08 3ina s LEU 341 N -2.61 4.10 -0.21 8.50 1.43 -1.26 -0.02 118.68 128.61 3ina s LEU 341 Ca 0.03 0.38 -0.06 0.00 -1.03 0.00 0.00 54.13 53.45 3ina s LEU 341 Cb -0.01 -2.44 0.10 0.00 0.03 0.00 0.00 46.19 43.86 3ina s LEU 341 CO -0.11 -0.12 0.42 -0.51 0.23 0.00 0.00 176.35 176.27 3ina s ILE 342 N 1.65 -0.66 -4.77 -0.59 2.07 -1.26 -4.15 121.20 113.49 3ina s ILE 342 Ca 0.16 0.13 0.00 0.00 -1.41 0.00 0.00 60.65 59.53 3ina s ILE 342 Cb -0.15 -0.70 0.00 0.00 0.13 0.00 0.00 42.46 41.74 3ina s ILE 342 CO 0.08 0.04 0.00 0.61 -1.91 0.00 0.00 174.94 173.77 3ina n GLY 343 N 5.39 0.96 2.92 1.50 0.00 -0.42 -1.48 105.19 114.06 3ina n GLY 343 Ca -0.08 -1.92 -0.11 0.00 0.00 0.00 0.00 46.02 43.91 3ina n GLY 343 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ina s ARG 344 N -1.91 0.13 -1.30 1.61 0.52 -1.26 -2.19 118.95 114.55 3ina s ARG 344 Ca 0.00 -0.25 -0.17 0.00 -0.52 0.00 0.00 55.73 54.79 3ina s ARG 344 Cb 0.00 0.04 0.08 0.00 0.52 0.00 0.00 34.95 35.59 3ina s ARG 344 CO 0.00 -0.02 1.73 -1.71 0.02 0.00 0.00 175.30 175.32 3ina n ASN 345 N 2.48 4.92 -4.45 0.23 5.15 -0.23 -4.89 115.26 118.48 3ina n ASN 345 Ca -0.17 -2.92 -0.23 0.00 -0.60 0.00 0.00 54.58 50.66 3ina n ASN 345 Cb 0.58 -1.73 -0.10 0.00 -0.53 0.00 0.00 39.78 38.00 3ina n ASN 345 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 3ina s ASP 346 N 4.05 2.69 0.03 1.20 1.11 -1.26 -4.63 116.67 119.86 3ina s ASP 346 Ca 0.53 -1.43 -0.17 0.00 0.18 0.00 0.00 52.55 51.66 3ina s ASP 346 Cb 0.04 -0.02 -0.28 0.00 1.07 0.00 0.00 42.92 43.72 3ina s ASP 346 CO 0.07 -0.64 1.07 -0.33 1.18 0.00 0.00 175.17 176.52 3ina h GLU 347 N 2.00 0.55 -6.81 8.23 4.39 -1.90 -3.47 114.58 117.57 3ina h GLU 347 Ca -0.41 -0.72 -0.46 0.00 0.34 0.00 0.00 59.36 58.12 3ina h GLU 347 Cb 1.25 0.24 0.04 0.00 -0.10 0.00 0.00 28.75 30.18 3ina h GLU 347 CO 0.70 1.31 -0.03 -0.51 -1.16 0.00 0.00 179.01 179.32 3ina s ASP 348 N -7.24 5.65 0.00 1.42 1.01 -1.26 -4.64 116.67 111.61 3ina s ASP 348 Ca -0.11 0.30 0.00 0.00 0.71 0.00 0.00 52.55 53.45 3ina s ASP 348 Cb 0.04 -1.41 0.00 0.00 1.01 0.00 0.00 42.92 42.56 3ina s ASP 348 CO 0.90 -0.87 0.00 0.61 0.21 0.00 0.00 175.17 176.01 3ina n GLY 349 N -2.24 1.22 3.20 0.21 0.00 -1.22 -4.62 105.19 101.73 3ina n GLY 349 Ca 0.03 -1.44 -0.15 0.00 0.00 0.00 0.00 46.02 44.47 3ina n GLY 349 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ina s TYR 350 N 1.68 1.13 0.09 1.61 1.51 -0.98 -2.74 117.35 119.65 3ina s TYR 350 Ca 0.00 -0.68 0.03 0.00 -1.01 0.00 0.00 57.07 55.42 3ina s TYR 350 Cb 0.00 -0.61 -0.04 0.00 -0.11 0.00 0.00 41.96 41.21 3ina s TYR 350 CO 0.00 0.03 -0.09 1.52 -1.11 0.00 0.00 175.55 175.89 3ina s TYR 351 N -2.64 0.99 0.17 2.71 1.13 -0.58 -1.23 117.35 117.90 3ina s TYR 351 Ca 0.08 -0.70 -0.08 0.00 -1.41 0.00 0.00 57.07 54.97 3ina s TYR 351 Cb -0.02 -0.55 -0.06 0.00 -1.10 0.00 0.00 41.96 40.23 3ina s TYR 351 CO 0.00 -0.04 0.45 0.12 -2.51 0.00 0.00 175.55 173.58 3ina s PHE 352 N -2.61 3.48 -0.04 -3.49 5.36 -1.26 -0.73 117.98 118.69 3ina s PHE 352 Ca 0.06 0.73 -0.11 0.00 -0.96 0.00 0.00 56.93 56.65 3ina s PHE 352 Cb -0.02 -2.14 0.02 0.00 -0.34 0.00 0.00 43.02 40.54 3ina s PHE 352 CO -0.01 0.38 0.25 0.15 -1.46 0.00 0.00 175.22 174.54 3ina s LYS 353 N -2.58 0.50 0.06 10.12 1.02 -0.52 -1.57 119.74 126.78 3ina s LYS 353 Ca 0.42 -0.05 -0.04 0.00 0.02 0.00 0.00 55.97 56.32 3ina s LYS 353 Cb -0.12 0.22 -0.02 0.00 -0.52 0.00 0.00 37.83 37.39 3ina s LYS 353 CO 0.22 -0.12 0.06 -0.59 -0.92 0.00 0.00 175.35 174.00 3ina s PHE 354 N -0.83 0.35 0.00 3.18 -0.00 -1.05 -1.43 117.98 118.20 3ina s PHE 354 Ca -0.09 -0.83 0.00 0.00 -0.00 0.00 0.00 56.93 56.01 3ina s PHE 354 Cb -0.05 -0.25 0.00 0.00 -0.00 0.00 0.00 43.02 42.73 3ina s PHE 354 CO 0.02 -0.43 0.00 0.41 -0.00 0.00 0.00 175.22 175.22 3ina n GLY 355 N 0.15 0.44 3.04 1.99 0.00 -0.84 -0.93 105.19 109.05 3ina n GLY 355 Ca -0.15 -0.97 -0.28 0.00 0.00 0.00 0.00 46.02 44.62 3ina n GLY 355 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ina s ILE 356 N -1.01 1.44 -0.40 -0.61 1.01 0.59 -4.13 121.20 118.09 3ina s ILE 356 Ca 0.00 -0.60 0.01 0.00 0.00 0.00 0.00 60.65 60.06 3ina s ILE 356 Cb 0.00 -1.32 0.13 0.00 0.01 0.00 0.00 42.46 41.27 3ina s ILE 356 CO 0.00 0.43 0.19 -0.47 0.00 0.00 0.00 174.94 175.09 3ina s TYR 357 N 1.05 1.87 -0.32 3.97 6.04 -0.92 -1.18 117.35 127.86 3ina s TYR 357 Ca -0.06 -2.20 -0.26 0.00 0.04 0.00 0.00 57.07 54.59 3ina s TYR 357 Cb -0.15 -1.81 0.01 0.00 -1.04 0.00 0.00 41.96 38.98 3ina s TYR 357 CO -0.02 -0.82 0.91 0.50 -1.54 0.00 0.00 175.55 174.58 3ina s ARG 358 N 0.76 3.97 0.03 4.97 3.52 -0.12 -1.57 118.95 130.51 3ina s ARG 358 Ca 0.15 0.75 0.00 0.00 -0.13 0.00 0.00 55.73 56.50 3ina s ARG 358 Cb -0.22 -3.75 0.00 0.00 -1.56 0.00 0.00 34.95 29.42 3ina s ARG 358 CO -0.06 -0.80 0.00 1.33 -0.81 0.00 0.00 175.30 174.95 3ina n VAL 359 N 5.72 0.00 -1.85 7.11 0.24 -0.75 -0.87 118.33 127.93 3ina n VAL 359 Ca 0.07 -0.16 -0.15 0.00 -2.04 0.00 0.00 64.34 62.07 3ina n VAL 359 Cb 0.48 0.03 -0.03 0.00 -1.47 0.00 0.00 33.84 32.84 3ina n VAL 359 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ina n GLY 360 N 4.60 0.63 3.07 7.63 0.00 -1.26 -2.40 105.19 117.46 3ina n GLY 360 Ca -0.01 -0.30 -0.22 0.00 0.00 0.00 0.00 46.02 45.48 3ina n GLY 360 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3ina n ASP 361 N -0.58 -5.20 -4.86 1.61 2.03 -1.21 -4.96 116.55 103.38 3ina n ASP 361 Ca -0.16 -0.28 -0.34 0.00 0.52 0.00 0.00 54.79 54.53 3ina n ASP 361 Cb 0.56 -4.24 -0.06 0.00 -0.72 0.00 0.00 41.12 36.66 3ina n ASP 361 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 3ina s SER 362 N -2.64 6.71 -0.04 1.67 0.15 -1.01 -4.86 113.70 113.68 3ina s SER 362 Ca 0.30 0.96 0.05 0.00 0.70 0.00 0.00 55.95 57.96 3ina s SER 362 Cb -0.15 -2.24 0.08 0.00 -1.71 0.00 0.00 66.02 62.00 3ina s SER 362 CO 0.38 0.05 0.93 0.35 1.20 0.00 0.00 173.24 176.14 3ina n THR 363 N 0.47 0.81 -2.15 6.45 -2.24 -1.26 -4.81 114.28 111.55 3ina n THR 363 Ca -0.04 -0.91 -0.42 0.00 -2.27 0.00 0.00 64.05 60.41 3ina n THR 363 Cb 0.52 0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 69.13 3ina n THR 363 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3ina s VAL 364 N -1.08 3.39 0.46 2.28 1.01 -1.26 -4.08 120.40 121.12 3ina s VAL 364 Ca 0.09 0.92 -0.23 0.00 0.00 0.00 0.00 61.98 62.75 3ina s VAL 364 Cb 0.08 -3.59 -0.09 0.00 0.00 0.00 0.00 36.38 32.78 3ina s VAL 364 CO 0.01 0.04 1.08 -2.65 0.00 0.00 0.00 175.10 173.57 3ina n PRO 365 N 4.64 1.42 -4.28 2.72 -0.02 -1.26 -4.84 135.00 133.38 3ina n PRO 365 Ca 0.13 0.51 -0.20 0.00 -2.02 0.00 0.00 63.50 61.92 3ina n PRO 365 Cb 0.42 -2.17 -0.16 0.00 -0.02 0.00 0.00 33.50 31.57 3ina n PRO 365 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3ina s VAL 366 N -1.31 0.65 -0.24 -1.45 1.01 -0.77 -4.65 120.40 113.65 3ina s VAL 366 Ca 0.65 -0.25 -0.11 0.00 0.00 0.00 0.00 61.98 62.28 3ina s VAL 366 Cb -0.51 -0.61 0.09 0.00 0.00 0.00 0.00 36.38 35.35 3ina s VAL 366 CO 0.55 0.22 0.55 0.00 0.00 0.00 0.00 175.10 176.42 3ina s TYR 368 N 2.11 -0.13 0.10 0.00 -0.00 -0.93 -4.57 117.35 113.93 3ina s TYR 368 Ca -0.07 -0.26 0.09 0.00 -0.00 0.00 0.00 57.07 56.83 3ina s TYR 368 Cb -0.09 0.68 -0.04 0.00 -0.00 0.00 0.00 41.96 42.51 3ina s TYR 368 CO -0.16 -1.02 -0.19 -0.80 -0.00 0.00 0.00 175.55 173.38 3ina s ASN 369 N -2.96 3.80 0.08 -0.18 -0.87 -0.67 -0.99 114.94 113.15 3ina s ASN 369 Ca 0.12 -0.55 0.03 0.00 -1.57 0.00 0.00 52.86 50.89 3ina s ASN 369 Cb -0.03 -0.52 -0.03 0.00 -0.02 0.00 0.00 41.25 40.64 3ina s ASN 369 CO 0.05 0.20 -0.08 -0.76 -2.57 0.00 0.00 177.10 173.93 3ina s LEU 370 N -1.97 2.39 0.00 0.60 1.43 -0.38 -0.10 118.68 120.64 3ina s LEU 370 Ca 0.17 -0.79 -0.17 0.00 -1.03 0.00 0.00 54.13 52.31 3ina s LEU 370 Cb -0.10 -0.18 0.06 0.00 0.03 0.00 0.00 46.19 45.99 3ina s LEU 370 CO 0.09 -0.31 0.79 0.00 0.23 0.00 0.00 176.35 177.14 3ina n ALA 371 N 0.67 -2.17 -3.80 4.21 0.00 -0.55 -1.62 120.51 117.25 3ina n ALA 371 Ca -0.17 -0.58 -0.24 0.00 0.00 0.00 0.00 53.44 52.45 3ina n ALA 371 Cb 0.58 0.19 0.02 0.00 0.00 0.00 0.00 19.45 20.24 3ina n ALA 371 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ina n GLY 372 N -0.56 -0.34 3.78 0.00 0.00 -1.26 -0.91 105.19 105.89 3ina n GLY 372 Ca 0.01 0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 3ina n GLY 372 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3ina s TYR 373 N -3.60 3.62 -0.08 1.61 5.04 -1.26 -3.96 117.35 118.73 3ina s TYR 373 Ca 0.19 1.76 -0.30 0.00 -2.44 0.00 0.00 57.07 56.28 3ina s TYR 373 Cb -0.10 -3.00 0.07 0.00 0.35 0.00 0.00 41.96 39.29 3ina s TYR 373 CO 0.83 0.00 0.70 -1.54 -1.34 0.00 0.00 175.55 174.20 3ina s SER 374 N -1.50 -0.65 -0.01 4.32 1.04 -0.09 -4.98 113.70 111.82 3ina s SER 374 Ca 0.50 0.77 -0.04 0.00 0.48 0.00 0.00 55.95 57.66 3ina s SER 374 Cb -0.21 0.61 -0.00 0.00 0.10 0.00 0.00 66.02 66.52 3ina s SER 374 CO 0.27 -0.56 0.08 -1.83 0.98 0.00 0.00 173.24 172.17 3ina s GLU 375 N -1.05 0.30 0.30 4.02 -1.05 -1.26 -0.43 118.70 119.53 3ina s GLU 375 Ca -0.10 -0.25 -0.12 0.00 -0.15 0.00 0.00 54.97 54.35 3ina s GLU 375 Cb -0.00 0.12 0.01 0.00 -0.44 0.00 0.00 34.13 33.82 3ina s GLU 375 CO 0.09 -0.06 0.57 -0.98 0.95 0.00 0.00 175.26 175.83 3ina s ARG 376 N -0.86 1.79 0.47 -4.83 1.70 -0.37 -4.99 118.95 111.86 3ina s ARG 376 Ca -0.09 -1.36 -0.04 0.00 -0.47 0.00 0.00 55.73 53.77 3ina s ARG 376 Cb -0.06 0.51 -0.03 0.00 -0.57 0.00 0.00 34.95 34.81 3ina s ARG 376 CO 0.00 -0.78 0.75 -0.51 -1.08 0.00 0.00 175.30 173.69 3ina s LEU 377 N -3.06 3.65 0.00 -1.89 1.43 -1.26 -0.48 118.68 117.07 3ina s LEU 377 Ca 0.21 0.77 0.00 0.00 -1.03 0.00 0.00 54.13 54.08 3ina s LEU 377 Cb -0.02 -3.69 0.00 0.00 0.03 0.00 0.00 46.19 42.51 3ina s LEU 377 CO 0.12 -0.59 0.00 -0.62 0.23 0.00 0.00 176.35 175.48