#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3l6r s GLN 4 N 0.00 2.84 0.53 0.00 -0.21 -1.26 -5.12 119.66 116.44 3l6r s GLN 4 Ca 0.00 -0.80 0.02 0.00 0.02 0.00 0.00 55.36 54.60 3l6r s GLN 4 Cb 0.00 -2.22 0.02 0.00 1.00 0.00 0.00 33.01 31.81 3l6r s GLN 4 CO 0.00 0.08 0.17 0.66 -2.12 0.00 0.00 175.29 174.07 3l6r n TYR 5 N 3.80 0.47 0.46 0.91 4.02 -1.26 -5.03 117.16 120.53 3l6r n TYR 5 Ca -0.20 -2.45 0.11 0.00 -0.01 0.00 0.00 57.90 55.35 3l6r n TYR 5 Cb 0.52 -0.38 0.43 0.00 -0.02 0.00 0.00 39.34 39.89 3l6r n TYR 5 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 3l6r n ASP 6 N -1.52 0.45 -4.25 7.72 10.43 -1.26 -4.70 116.55 123.43 3l6r n ASP 6 Ca -0.14 0.61 -0.14 0.00 2.57 0.00 0.00 54.79 57.69 3l6r n ASP 6 Cb 0.64 -0.70 -0.10 0.00 1.84 0.00 0.00 41.12 42.79 3l6r n ASP 6 CO 0.00 0.00 0.00 0.27 -1.07 0.00 0.00 177.20 176.40 3l6r s ILE 7 N -3.20 0.73 0.30 0.53 -4.36 -1.26 -4.83 121.20 109.11 3l6r s ILE 7 Ca 0.06 -1.99 0.05 0.00 -0.26 0.00 0.00 60.65 58.51 3l6r s ILE 7 Cb 0.10 -2.12 -0.06 0.00 1.25 0.00 0.00 42.46 41.63 3l6r s ILE 7 CO 0.37 -0.48 -0.01 -0.94 0.24 0.00 0.00 174.94 174.12 3l6r s SER 8 N -3.18 2.66 0.28 4.36 1.04 -1.26 -5.02 113.70 112.57 3l6r s SER 8 Ca 0.24 -1.27 0.01 0.00 0.48 0.00 0.00 55.95 55.41 3l6r s SER 8 Cb 0.06 -0.15 0.56 0.00 0.10 0.00 0.00 66.02 66.59 3l6r s SER 8 CO 0.04 -0.45 1.83 0.15 0.98 0.00 0.00 173.24 175.78 3l6r h PHE 9 N 2.19 1.11 -0.61 5.02 3.57 -1.98 -2.10 116.94 124.14 3l6r h PHE 9 Ca -0.40 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.16 3l6r h PHE 9 Cb 1.24 -0.35 -0.03 0.00 2.79 0.00 0.00 35.95 39.60 3l6r h PHE 9 CO 0.64 0.42 0.41 0.00 -2.23 0.00 0.00 178.31 177.54 3l6r h ALA 10 N 1.55 1.66 -0.96 2.41 0.00 -1.98 -0.57 119.26 121.35 3l6r h ALA 10 Ca 0.50 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.39 3l6r h ALA 10 Cb 0.53 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 3l6r h ALA 10 CO -0.28 0.28 0.64 -0.44 0.00 0.00 0.00 179.25 179.45 3l6r h ASP 11 N 0.74 1.10 -0.22 0.00 3.32 -1.78 -1.69 116.42 117.89 3l6r h ASP 11 Ca 0.24 -0.03 -0.09 0.00 0.02 0.00 0.00 57.03 57.17 3l6r h ASP 11 Cb 0.05 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.33 3l6r h ASP 11 CO -0.06 0.78 -0.23 0.58 -1.72 0.00 0.00 179.24 178.59 3l6r h VAL 12 N 1.29 1.33 -0.64 -1.35 2.07 -1.11 -1.11 116.25 116.73 3l6r h VAL 12 Ca 0.36 -1.41 0.03 0.00 0.82 0.00 0.00 66.70 66.51 3l6r h VAL 12 Cb -0.12 1.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 3l6r h VAL 12 CO -0.08 0.43 0.39 -0.33 0.02 0.00 0.00 177.57 177.99 3l6r h GLU 13 N 0.22 0.73 -0.55 1.57 5.08 -1.00 -0.93 114.58 119.71 3l6r h GLU 13 Ca 0.03 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 3l6r h GLU 13 Cb 0.79 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 3l6r h GLU 13 CO 0.06 0.48 0.22 -0.22 -1.00 0.00 0.00 179.01 178.55 3l6r h LYS 14 N 0.75 0.82 -0.99 2.33 3.64 -1.24 -2.61 116.57 119.28 3l6r h LYS 14 Ca 0.26 -0.15 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 3l6r h LYS 14 Cb 0.05 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.68 3l6r h LYS 14 CO -0.12 0.71 0.66 0.00 -2.27 0.00 0.00 179.45 178.43 3l6r h ALA 15 N 1.07 1.26 -0.12 5.00 0.00 -0.71 -2.15 119.26 123.61 3l6r h ALA 15 Ca 0.18 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3l6r h ALA 15 Cb 0.19 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3l6r h ALA 15 CO -0.02 0.65 0.06 1.25 0.00 0.00 0.00 179.25 181.19 3l6r h HIS 16 N 1.34 0.17 -1.01 0.00 -0.00 -0.83 -0.96 115.15 113.87 3l6r h HIS 16 Ca 0.36 -0.01 0.11 0.00 -0.00 0.00 0.00 60.37 60.84 3l6r h HIS 16 Cb -0.15 -0.06 -0.08 0.00 -0.00 0.00 0.00 27.41 27.12 3l6r h HIS 16 CO -0.00 0.21 0.64 0.82 -0.00 0.00 0.00 177.93 179.59 3l6r h ILE 17 N 0.09 0.95 0.00 6.26 2.04 -1.26 -1.06 117.51 124.53 3l6r h ILE 17 Ca 0.04 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.55 3l6r h ILE 17 Cb 0.09 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.00 3l6r h ILE 17 CO -0.01 0.19 -0.16 0.59 0.00 0.00 0.00 178.15 178.76 3l6r n ASN 18 N -4.60 0.48 -0.00 1.72 3.02 -0.77 -3.73 115.26 111.39 3l6r n ASN 18 Ca 0.18 0.38 0.02 0.00 -0.03 0.00 0.00 54.58 55.14 3l6r n ASN 18 Cb 0.33 -0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 39.05 3l6r n ASN 18 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 3l6r n ILE 19 N -1.89 0.00 0.21 2.41 -5.35 -0.44 -4.79 119.36 109.52 3l6r n ILE 19 Ca 0.06 -0.26 0.11 0.00 -0.27 0.00 0.00 62.75 62.39 3l6r n ILE 19 Cb 0.39 0.71 0.66 0.00 -1.74 0.00 0.00 39.64 39.67 3l6r n ILE 19 CO 0.00 0.00 0.00 0.08 -1.76 0.00 0.00 176.55 174.87 3l6r h ARG 20 N 0.00 0.00 -0.02 6.28 0.11 -1.27 0.45 114.38 119.92 3l6r h ARG 20 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3l6r h ARG 20 Cb 0.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.23 3l6r h ARG 20 CO 0.00 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 179.82 3l6r n ASP 21 N -4.47 0.54 0.00 0.08 8.00 -1.26 -3.52 116.55 115.92 3l6r n ASP 21 Ca -0.00 -1.26 0.00 0.00 0.71 0.00 0.00 54.79 54.24 3l6r n ASP 21 Cb 0.19 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.29 3l6r n ASP 21 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3l6r n SER 22 N -0.54 1.28 -4.44 -2.24 7.64 0.13 -5.04 113.62 110.41 3l6r n SER 22 Ca 0.20 -1.33 -0.23 0.00 1.01 0.00 0.00 58.87 58.53 3l6r n SER 22 Cb 0.19 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.28 3l6r n SER 22 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 3l6r s ILE 23 N -0.33 1.18 0.02 0.44 -4.36 -1.10 -4.99 121.20 112.06 3l6r s ILE 23 Ca 0.00 -2.00 -0.15 0.00 -0.26 0.00 0.00 60.65 58.24 3l6r s ILE 23 Cb 0.00 -2.74 -0.06 0.00 1.25 0.00 0.00 42.46 40.91 3l6r s ILE 23 CO 0.00 0.00 0.42 -1.00 0.24 0.00 0.00 174.94 174.60 3l6r s HIS 24 N -3.24 3.72 -1.00 1.37 3.76 -1.26 -4.93 115.29 113.71 3l6r s HIS 24 Ca 0.34 1.00 -0.20 0.00 -0.15 0.00 0.00 55.06 56.06 3l6r s HIS 24 Cb 0.08 -2.30 0.10 0.00 1.11 0.00 0.00 32.58 31.57 3l6r s HIS 24 CO 0.15 0.62 1.30 -1.17 -0.85 0.00 0.00 174.74 174.80 3l6r s LEU 25 N -1.17 4.43 0.57 0.89 2.96 -1.26 -4.97 118.68 120.12 3l6r s LEU 25 Ca 0.25 -1.93 -0.18 0.00 -0.22 0.00 0.00 54.13 52.06 3l6r s LEU 25 Cb -0.17 -2.47 -0.04 0.00 0.50 0.00 0.00 46.19 44.01 3l6r s LEU 25 CO 0.14 -1.21 1.10 0.42 -1.32 0.00 0.00 176.35 175.49 3l6r s THR 26 N 3.51 3.39 0.72 3.68 -4.23 -1.26 -5.00 115.64 116.45 3l6r s THR 26 Ca 0.39 0.78 -0.11 0.00 -1.18 0.00 0.00 61.69 61.56 3l6r s THR 26 Cb -0.02 -3.28 0.02 0.00 1.34 0.00 0.00 72.50 70.55 3l6r s THR 26 CO -0.08 -0.28 1.09 -2.16 -0.54 0.00 0.00 174.62 172.66 3l6r s PRO 27 N -3.61 2.77 -0.24 3.99 0.04 -1.26 -4.72 135.00 131.98 3l6r s PRO 27 Ca 0.69 0.50 -0.06 0.00 0.04 0.00 0.00 61.00 62.17 3l6r s PRO 27 Cb -0.20 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.31 3l6r s PRO 27 CO 0.31 -1.10 0.03 0.08 0.04 0.00 0.00 177.00 176.35 3l6r s VAL 28 N -3.32 3.97 0.21 -0.36 1.01 -1.26 -1.63 120.40 119.01 3l6r s VAL 28 Ca 0.58 -0.29 0.08 0.00 0.00 0.00 0.00 61.98 62.36 3l6r s VAL 28 Cb -0.12 -2.84 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 3l6r s VAL 28 CO 0.52 0.37 0.01 -0.76 0.00 0.00 0.00 175.10 175.24 3l6r s LEU 29 N 1.56 3.29 0.23 3.92 1.02 -0.45 -4.85 118.68 123.40 3l6r s LEU 29 Ca 0.06 -0.47 0.06 0.00 0.02 0.00 0.00 54.13 53.80 3l6r s LEU 29 Cb -0.15 -1.90 -0.05 0.00 0.02 0.00 0.00 46.19 44.11 3l6r s LEU 29 CO 0.01 0.06 -0.07 0.42 0.02 0.00 0.00 176.35 176.78 3l6r s THR 30 N -1.92 1.44 -0.12 5.49 -4.23 -1.26 -0.27 115.64 114.77 3l6r s THR 30 Ca 0.29 -2.11 -0.04 0.00 -1.18 0.00 0.00 61.69 58.64 3l6r s THR 30 Cb -0.08 -2.22 0.06 0.00 1.34 0.00 0.00 72.50 71.59 3l6r s THR 30 CO 0.19 -0.45 0.19 -0.55 -0.54 0.00 0.00 174.62 173.45 3l6r s SER 31 N -3.33 0.89 0.33 3.99 0.15 -1.26 -5.03 113.70 109.43 3l6r s SER 31 Ca 0.25 0.22 0.13 0.00 0.70 0.00 0.00 55.95 57.25 3l6r s SER 31 Cb 0.03 0.34 0.58 0.00 -1.71 0.00 0.00 66.02 65.26 3l6r s SER 31 CO 0.08 -0.27 1.73 0.77 1.20 0.00 0.00 173.24 176.76 3l6r h SER 32 N 8.34 0.00 -0.42 5.45 4.64 -1.97 -2.08 113.55 127.51 3l6r h SER 32 Ca -0.14 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.13 3l6r h SER 32 Cb 1.12 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.20 3l6r h SER 32 CO 0.18 0.47 0.08 0.40 -0.87 0.00 0.00 176.83 177.09 3l6r h ILE 33 N 0.00 1.24 -0.26 0.95 5.03 -1.97 -1.03 117.51 121.47 3l6r h ILE 33 Ca -0.00 -0.85 -0.13 0.00 -0.12 0.00 0.00 64.86 63.76 3l6r h ILE 33 Cb 0.85 0.99 -0.01 0.00 -3.03 0.00 0.00 36.82 35.62 3l6r h ILE 33 CO 0.06 0.29 -0.37 -0.07 -0.68 0.00 0.00 178.15 177.38 3l6r h LEU 34 N 0.55 0.61 -0.81 1.44 4.07 -1.96 -1.07 115.31 118.13 3l6r h LEU 34 Ca 0.13 -0.26 0.03 0.00 0.08 0.00 0.00 57.88 57.86 3l6r h LEU 34 Cb 0.35 -0.17 -0.05 0.00 1.08 0.00 0.00 40.66 41.87 3l6r h LEU 34 CO 0.01 0.92 0.52 0.78 -1.08 0.00 0.00 178.44 179.59 3l6r h ASN 35 N 0.48 0.87 -0.46 -0.43 2.35 -1.14 -2.44 115.58 114.82 3l6r h ASN 35 Ca 0.05 -0.01 -0.13 0.00 -0.55 0.00 0.00 56.30 55.66 3l6r h ASN 35 Cb 0.87 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 39.03 3l6r h ASN 35 CO 0.07 0.60 -0.21 1.56 -1.65 0.00 0.00 177.43 177.80 3l6r h GLN 36 N 1.02 0.97 -0.05 0.81 4.20 -0.70 -0.48 115.11 120.88 3l6r h GLN 36 Ca 0.32 -0.41 -0.08 0.00 0.06 0.00 0.00 58.65 58.54 3l6r h GLN 36 Cb -0.00 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 3l6r h GLN 36 CO -0.11 1.08 -0.32 -0.07 -0.67 0.00 0.00 178.83 178.75 3l6r h LEU 37 N 0.84 0.10 0.00 1.46 3.38 -0.94 -3.30 115.31 116.85 3l6r h LEU 37 Ca 0.11 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 3l6r h LEU 37 Cb 0.79 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 3l6r h LEU 37 CO 0.07 0.42 -1.86 0.35 0.09 0.00 0.00 178.44 177.50 3l6r n THR 38 N -4.13 0.24 -1.00 0.22 -2.24 -0.94 -4.98 114.28 101.44 3l6r n THR 38 Ca -0.02 -0.46 -0.00 0.00 -2.27 0.00 0.00 64.05 61.30 3l6r n THR 38 Cb 0.38 -0.04 -0.00 0.00 -2.10 0.00 0.00 70.33 68.57 3l6r n THR 38 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3l6r n GLY 39 N 1.62 0.46 3.71 3.38 0.00 -0.21 -5.02 105.19 109.13 3l6r n GLY 39 Ca -0.08 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 3l6r n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3l6r s ARG 40 N -0.28 2.10 -0.50 1.61 1.81 -1.23 -5.05 118.95 117.42 3l6r s ARG 40 Ca 0.00 -2.17 -0.05 0.00 -1.72 0.00 0.00 55.73 51.79 3l6r s ARG 40 Cb 0.00 -1.68 0.13 0.00 -0.45 0.00 0.00 34.95 32.95 3l6r s ARG 40 CO 0.00 -0.21 0.32 -0.80 -0.68 0.00 0.00 175.30 173.93 3l6r s ASN 41 N -3.84 5.45 0.17 0.23 0.02 -0.37 -4.51 114.94 112.09 3l6r s ASN 41 Ca 0.25 -2.22 -0.12 0.00 -1.02 0.00 0.00 52.86 49.75 3l6r s ASN 41 Cb 0.05 -1.91 -0.07 0.00 0.02 0.00 0.00 41.25 39.35 3l6r s ASN 41 CO 0.13 -0.55 0.53 -0.76 0.02 0.00 0.00 177.10 176.47 3l6r s LEU 42 N 0.89 4.28 -0.03 0.60 1.43 -1.26 -1.10 118.68 123.49 3l6r s LEU 42 Ca 0.10 0.98 0.02 0.00 -1.03 0.00 0.00 54.13 54.20 3l6r s LEU 42 Cb -0.23 -3.38 0.01 0.00 0.03 0.00 0.00 46.19 42.62 3l6r s LEU 42 CO -0.03 0.05 -0.08 -0.36 0.23 0.00 0.00 176.35 176.16 3l6r s PHE 43 N -1.58 0.86 -0.28 0.29 0.40 0.46 -4.59 117.98 113.55 3l6r s PHE 43 Ca 0.41 -0.22 -0.03 0.00 -0.60 0.00 0.00 56.93 56.49 3l6r s PHE 43 Cb -0.14 -0.64 0.03 0.00 0.51 0.00 0.00 43.02 42.79 3l6r s PHE 43 CO 0.20 -0.11 0.00 -0.06 0.70 0.00 0.00 175.22 175.95 3l6r s PHE 44 N 0.31 3.17 -0.49 0.36 0.40 0.63 -0.57 117.98 121.80 3l6r s PHE 44 Ca -0.05 -1.57 -0.28 0.00 -0.60 0.00 0.00 56.93 54.44 3l6r s PHE 44 Cb -0.09 -2.13 0.03 0.00 0.51 0.00 0.00 43.02 41.34 3l6r s PHE 44 CO 0.00 -0.73 1.08 0.21 0.70 0.00 0.00 175.22 176.48 3l6r s LYS 45 N 1.33 3.62 -1.30 0.44 2.47 -0.74 -1.34 119.74 124.22 3l6r s LYS 45 Ca -0.02 0.37 -0.13 0.00 -1.56 0.00 0.00 55.97 54.64 3l6r s LYS 45 Cb -0.18 -3.93 0.13 0.00 -1.46 0.00 0.00 37.83 32.38 3l6r s LYS 45 CO -0.01 -1.39 1.81 0.00 0.16 0.00 0.00 175.35 175.92 3l6r n GLU 47 N 5.36 0.05 0.32 0.00 -0.58 -0.67 -2.74 120.64 122.39 3l6r n GLU 47 Ca 0.43 0.18 0.21 0.00 -0.42 0.00 0.00 57.16 57.56 3l6r n GLU 47 Cb 0.40 -1.58 1.10 0.00 -0.57 0.00 0.00 31.44 30.79 3l6r n GLU 47 CO 0.00 0.00 0.00 1.37 -0.48 0.00 0.00 177.13 178.02 3l6r h LEU 48 N 0.00 0.00 -0.93 -4.62 -0.00 -1.65 -0.73 115.31 107.39 3l6r h LEU 48 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 3l6r h LEU 48 Cb 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.07 3l6r h LEU 48 CO 0.00 0.00 -0.02 0.49 -0.00 0.00 0.00 178.44 178.91 3l6r n PHE 49 N -3.11 0.00 -1.28 0.17 3.72 -1.11 -4.37 117.46 111.48 3l6r n PHE 49 Ca -0.02 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.06 3l6r n PHE 49 Cb 0.12 -0.01 0.10 0.00 -0.94 0.00 0.00 39.48 38.75 3l6r n PHE 49 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 3l6r s GLN 50 N -2.04 2.12 0.15 -1.08 2.00 -0.28 -4.90 119.66 115.63 3l6r s GLN 50 Ca 0.37 1.37 -0.34 0.00 -2.00 0.00 0.00 55.36 54.76 3l6r s GLN 50 Cb 0.21 -1.87 -0.15 0.00 0.80 0.00 0.00 33.01 32.00 3l6r s GLN 50 CO 0.35 -1.78 1.48 1.63 -0.50 0.00 0.00 175.29 176.48 3l6r n LYS 51 N -3.31 1.83 -0.91 1.67 5.02 -1.26 -1.76 118.16 119.44 3l6r n LYS 51 Ca 0.10 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 57.05 3l6r n LYS 51 Cb 0.52 -2.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.16 3l6r n LYS 51 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3l6r n THR 52 N 2.98 0.00 -0.19 -0.18 -2.24 -1.26 -4.14 114.28 109.25 3l6r n THR 52 Ca 0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.95 3l6r n THR 52 Cb 0.26 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 3l6r n THR 52 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3l6r n GLY 53 N -2.00 0.60 3.62 3.38 0.00 -0.73 -4.90 105.19 105.17 3l6r n GLY 53 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 3l6r n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3l6r s SER 54 N -2.97 -0.25 -0.19 1.61 1.04 -1.25 -0.74 113.70 110.95 3l6r s SER 54 Ca 0.00 -0.56 -0.25 0.00 0.48 0.00 0.00 55.95 55.61 3l6r s SER 54 Cb 0.00 0.63 -0.29 0.00 0.10 0.00 0.00 66.02 66.46 3l6r s SER 54 CO 0.00 -1.15 1.62 2.22 0.98 0.00 0.00 173.24 176.91 3l6r n PHE 55 N -0.38 0.44 0.00 5.02 1.16 -1.01 -4.58 117.46 118.10 3l6r n PHE 55 Ca -0.07 -0.82 0.00 0.00 -1.87 0.00 0.00 57.45 54.69 3l6r n PHE 55 Cb 0.62 -0.96 0.00 0.00 -1.61 0.00 0.00 39.48 37.52 3l6r n PHE 55 CO 0.00 0.00 0.00 1.51 -1.87 0.00 0.00 176.76 176.40 3l6r n ILE 57 N 6.51 0.00 0.36 1.97 0.13 -1.26 -4.31 119.36 122.76 3l6r n ILE 57 Ca 0.43 0.00 -0.18 0.00 -1.10 0.00 0.00 62.75 61.90 3l6r n ILE 57 Cb 0.37 0.00 -0.09 0.00 -0.84 0.00 0.00 39.64 39.08 3l6r n ILE 57 CO 0.00 0.00 0.00 0.03 2.80 0.00 0.00 176.55 179.38 3l6r h ARG 58 N 0.00 -0.86 0.00 9.51 3.08 -1.88 -0.34 114.38 123.90 3l6r h ARG 58 Ca 0.00 0.06 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 3l6r h ARG 58 Cb 0.00 0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 3l6r h ARG 58 CO 0.00 -0.56 -0.22 0.78 -1.07 0.00 0.00 179.97 178.90 3l6r h GLY 59 N -0.94 0.00 0.44 0.04 0.00 -1.75 -2.26 103.07 98.60 3l6r h GLY 59 Ca -0.09 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.14 3l6r h GLY 59 CO 0.15 0.00 -0.44 0.00 0.00 0.00 0.00 176.54 176.25 3l6r h ALA 60 N 1.78 -0.03 -0.50 3.60 0.00 -1.86 -2.31 119.26 119.93 3l6r h ALA 60 Ca -0.00 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 3l6r h ALA 60 Cb 0.64 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3l6r h ALA 60 CO 0.03 0.20 0.29 -0.07 0.00 0.00 0.00 179.25 179.70 3l6r h LEU 61 N -0.57 0.62 -0.84 0.00 3.38 -1.04 -0.85 115.31 116.00 3l6r h LEU 61 Ca -0.07 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 3l6r h LEU 61 Cb 1.30 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.85 3l6r h LEU 61 CO 0.08 0.52 0.46 -1.13 0.09 0.00 0.00 178.44 178.46 3l6r h ASN 62 N 0.67 1.05 -0.28 -0.43 -1.24 -1.48 -2.07 115.58 111.80 3l6r h ASN 62 Ca 0.18 -0.10 -0.05 0.00 0.71 0.00 0.00 56.30 57.04 3l6r h ASN 62 Cb 0.03 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 38.80 3l6r h ASN 62 CO -0.03 0.85 -0.01 0.00 -1.29 0.00 0.00 177.43 176.95 3l6r h ALA 63 N 1.24 0.38 -0.45 1.57 0.00 -1.18 -2.16 119.26 118.67 3l6r h ALA 63 Ca 0.29 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3l6r h ALA 63 Cb 0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3l6r h ALA 63 CO -0.05 0.14 0.18 0.28 0.00 0.00 0.00 179.25 179.80 3l6r h VAL 64 N 0.29 1.20 -0.10 0.00 2.07 -0.99 -0.43 116.25 118.30 3l6r h VAL 64 Ca 0.08 -0.63 -0.09 0.00 0.82 0.00 0.00 66.70 66.87 3l6r h VAL 64 Cb 0.45 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 3l6r h VAL 64 CO 0.02 0.23 -0.36 -0.09 0.02 0.00 0.00 177.57 177.39 3l6r h ARG 65 N 0.58 0.20 0.00 1.57 2.43 -1.38 -3.22 114.38 114.56 3l6r h ARG 65 Ca 0.15 -0.08 -0.24 0.00 -0.81 0.00 0.00 59.98 59.00 3l6r h ARG 65 Cb 0.20 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 3l6r h ARG 65 CO -0.01 0.54 -1.63 0.43 -1.51 0.00 0.00 179.97 177.79 3l6r n SER 66 N -4.08 0.80 -4.47 -3.80 7.64 -0.82 -4.65 113.62 104.25 3l6r n SER 66 Ca -0.01 0.37 -0.43 0.00 1.01 0.00 0.00 58.87 59.81 3l6r n SER 66 Cb 0.43 0.12 -0.03 0.00 -1.01 0.00 0.00 64.21 63.72 3l6r n SER 66 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3l6r s LEU 67 N -5.90 4.43 0.00 -3.43 2.01 -0.19 -5.08 118.68 110.53 3l6r s LEU 67 Ca -0.04 -1.31 0.00 0.00 0.01 0.00 0.00 54.13 52.78 3l6r s LEU 67 Cb 0.08 -2.43 0.00 0.00 0.01 0.00 0.00 46.19 43.85 3l6r s LEU 67 CO 0.82 -1.36 0.00 0.52 1.01 0.00 0.00 176.35 177.34 3l6r n VAL 68 N 5.91 0.00 0.00 -1.59 0.31 -1.26 -4.88 118.33 116.82 3l6r n VAL 68 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 3l6r n VAL 68 Cb 0.47 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.40 3l6r n VAL 68 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 3l6r n PRO 76 N 0.00 0.00 -0.12 5.55 -0.04 -1.26 -4.73 135.00 134.40 3l6r n PRO 76 Ca 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 3l6r n PRO 76 Cb 0.00 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 33.48 3l6r n PRO 76 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3l6r h LYS 77 N 0.00 0.89 -2.31 0.54 3.64 -1.91 -3.47 116.57 113.95 3l6r h LYS 77 Ca 0.00 -0.41 0.12 0.00 -1.27 0.00 0.00 60.65 59.08 3l6r h LYS 77 Cb 0.00 -0.01 -0.14 0.00 -0.41 0.00 0.00 32.23 31.67 3l6r h LYS 77 CO 0.00 1.06 0.48 0.00 -2.27 0.00 0.00 179.45 178.73 3l6r s ALA 78 N -4.53 -1.79 0.07 5.00 0.00 -1.26 -4.38 121.76 114.87 3l6r s ALA 78 Ca -0.10 0.87 0.04 0.00 0.00 0.00 0.00 51.96 52.76 3l6r s ALA 78 Cb 0.12 0.47 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 3l6r s ALA 78 CO 0.86 -0.74 0.01 0.14 0.00 0.00 0.00 175.76 176.03 3l6r s VAL 79 N -3.17 4.14 0.04 0.00 -7.23 -0.51 -1.15 120.40 112.53 3l6r s VAL 79 Ca 0.06 -0.87 0.05 0.00 -1.81 0.00 0.00 61.98 59.41 3l6r s VAL 79 Cb -0.01 -2.95 -0.02 0.00 0.56 0.00 0.00 36.38 33.96 3l6r s VAL 79 CO -0.08 0.17 -0.13 -0.69 -0.31 0.00 0.00 175.10 174.06 3l6r s VAL 80 N -1.28 1.05 0.32 1.32 1.01 -0.42 -0.94 120.40 121.45 3l6r s VAL 80 Ca 0.25 -1.02 -0.17 0.00 0.00 0.00 0.00 61.98 61.04 3l6r s VAL 80 Cb -0.12 -0.97 0.03 0.00 0.00 0.00 0.00 36.38 35.32 3l6r s VAL 80 CO 0.17 -0.05 0.70 0.28 0.00 0.00 0.00 175.10 176.19 3l6r s THR 81 N -0.93 0.00 0.11 3.92 -1.32 -1.01 -1.18 115.64 115.24 3l6r s THR 81 Ca 0.00 -1.09 0.10 0.00 -1.21 0.00 0.00 61.69 59.48 3l6r s THR 81 Cb -0.08 -2.37 -0.04 0.00 -1.51 0.00 0.00 72.50 68.50 3l6r s THR 81 CO 0.01 0.00 -0.22 -1.38 -2.21 0.00 0.00 174.62 170.83 3l6r s HIS 82 N -3.33 2.45 -0.17 9.09 -3.43 -1.26 -1.14 115.29 117.49 3l6r s HIS 82 Ca 0.15 -0.31 -0.29 0.00 -0.80 0.00 0.00 55.06 53.81 3l6r s HIS 82 Cb -0.05 -1.32 0.11 0.00 -1.43 0.00 0.00 32.58 29.89 3l6r s HIS 82 CO 0.10 0.35 0.91 0.45 -2.00 0.00 0.00 174.74 174.55 3l6r s SER 83 N -2.04 -0.48 0.00 7.38 0.15 0.35 -4.50 113.70 114.56 3l6r s SER 83 Ca 0.16 0.66 0.27 0.00 0.70 0.00 0.00 55.95 57.74 3l6r s SER 83 Cb -0.10 0.57 1.42 0.00 -1.71 0.00 0.00 66.02 66.20 3l6r s SER 83 CO 0.08 -0.35 1.92 -1.54 1.20 0.00 0.00 173.24 174.55 3l6r n SER 84 N 1.25 0.00 0.00 5.45 3.41 -1.26 -4.14 113.62 118.33 3l6r n SER 84 Ca -0.13 -0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.16 3l6r n SER 84 Cb 0.57 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 3l6r n SER 84 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3l6r n GLY 85 N 0.88 4.38 0.09 5.00 0.00 -1.26 -4.63 105.19 109.65 3l6r n GLY 85 Ca 0.15 -0.70 -0.15 0.00 0.00 0.00 0.00 46.02 45.32 3l6r n GLY 85 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3l6r h ASN 86 N 1.60 0.16 -0.94 1.61 2.35 -1.93 -1.44 115.58 116.99 3l6r h ASN 86 Ca 0.00 -0.84 0.00 0.00 -0.55 0.00 0.00 56.30 54.91 3l6r h ASN 86 Cb 0.00 -0.05 -0.05 0.00 0.05 0.00 0.00 38.32 38.28 3l6r h ASN 86 CO 0.00 0.97 0.59 -0.74 -1.65 0.00 0.00 177.43 176.60 3l6r h HIS 87 N -0.64 1.22 -0.50 1.19 2.76 -1.95 -1.90 115.15 115.33 3l6r h HIS 87 Ca -0.03 0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.19 3l6r h HIS 87 Cb 1.02 -0.40 -0.04 0.00 1.55 0.00 0.00 27.41 29.53 3l6r h HIS 87 CO 0.21 0.79 0.27 0.78 -1.30 0.00 0.00 177.93 178.68 3l6r h GLY 88 N 1.29 0.70 1.56 5.26 0.00 -1.86 0.57 103.07 110.58 3l6r h GLY 88 Ca 0.34 -0.19 -0.16 0.00 0.00 0.00 0.00 47.33 47.32 3l6r h GLY 88 CO -0.07 0.14 -0.59 0.06 0.00 0.00 0.00 176.54 176.08 3l6r h GLN 89 N 0.53 0.46 -0.34 4.80 3.07 -1.11 -1.65 115.11 120.87 3l6r h GLN 89 Ca 0.21 -0.31 -0.02 0.00 0.09 0.00 0.00 58.65 58.63 3l6r h GLN 89 Cb 0.09 0.04 -0.02 0.00 0.08 0.00 0.00 27.48 27.67 3l6r h GLN 89 CO -0.13 0.92 0.14 0.00 0.09 0.00 0.00 178.83 179.84 3l6r h ALA 90 N 1.02 0.44 -0.62 0.06 0.00 -1.10 -2.01 119.26 117.04 3l6r h ALA 90 Ca -0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 3l6r h ALA 90 Cb 1.13 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 3l6r h ALA 90 CO 0.11 0.04 0.37 1.25 0.00 0.00 0.00 179.25 181.02 3l6r h LEU 91 N 0.40 0.75 -0.24 0.00 5.85 -0.87 -1.11 115.31 120.09 3l6r h LEU 91 Ca 0.11 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.80 3l6r h LEU 91 Cb 0.19 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 3l6r h LEU 91 CO -0.01 0.59 0.02 0.74 -0.34 0.00 0.00 178.44 179.45 3l6r h THR 92 N 0.84 0.86 0.12 1.05 2.02 -1.19 -0.41 112.91 116.21 3l6r h THR 92 Ca 0.22 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.36 3l6r h THR 92 Cb -0.01 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 3l6r h THR 92 CO -0.04 0.02 -0.09 0.22 0.37 0.00 0.00 175.52 176.00 3l6r h TYR 93 N 0.11 -0.22 -0.88 3.16 3.20 -1.22 -0.33 116.97 120.79 3l6r h TYR 93 Ca 0.11 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.06 3l6r h TYR 93 Cb 0.13 0.08 -0.07 0.00 1.54 0.00 0.00 36.73 38.41 3l6r h TYR 93 CO -0.17 -0.14 0.53 0.00 -1.64 0.00 0.00 178.16 176.74 3l6r h ALA 94 N 0.66 1.24 -0.35 1.82 0.00 -1.01 -2.40 119.26 119.22 3l6r h ALA 94 Ca -0.01 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3l6r h ALA 94 Cb 0.19 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3l6r h ALA 94 CO -0.00 0.21 -0.42 0.00 0.00 0.00 0.00 179.25 179.05 3l6r h ALA 95 N 1.45 0.60 -0.81 0.00 0.00 -0.89 -3.11 119.26 116.50 3l6r h ALA 95 Ca 0.41 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3l6r h ALA 95 Cb 0.29 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 3l6r h ALA 95 CO -0.22 0.68 0.48 -0.22 0.00 0.00 0.00 179.25 179.97 3l6r h LYS 96 N 0.71 1.10 -0.29 0.00 3.64 -0.67 -0.79 116.57 120.27 3l6r h LYS 96 Ca 0.05 -0.10 0.08 0.00 -1.27 0.00 0.00 60.65 59.41 3l6r h LYS 96 Cb 1.00 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.58 3l6r h LYS 96 CO 0.10 0.78 0.23 -0.07 -2.27 0.00 0.00 179.45 178.21 3l6r h LEU 97 N 1.12 0.00 -2.32 5.20 3.38 -1.37 -1.23 115.31 120.09 3l6r h LEU 97 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 3l6r h LEU 97 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3l6r h LEU 97 CO -0.05 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.86 3l6r n GLU 98 N -4.27 2.49 -2.68 1.13 -0.58 -0.57 -4.97 120.64 111.19 3l6r n GLU 98 Ca 0.04 -2.28 -0.16 0.00 -0.42 0.00 0.00 57.16 54.34 3l6r n GLU 98 Cb 0.39 -1.52 0.02 0.00 -0.57 0.00 0.00 31.44 29.76 3l6r n GLU 98 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3l6r n GLY 99 N 1.52 -0.22 3.45 0.62 0.00 -0.47 -5.02 105.19 105.07 3l6r n GLY 99 Ca 0.20 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 3l6r n GLY 99 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3l6r s ILE 100 N -2.95 3.67 0.66 -0.61 1.01 -0.41 -4.99 121.20 117.59 3l6r s ILE 100 Ca 0.17 -0.43 -0.16 0.00 0.00 0.00 0.00 60.65 60.23 3l6r s ILE 100 Cb -0.07 -2.61 0.00 0.00 0.01 0.00 0.00 42.46 39.79 3l6r s ILE 100 CO 0.20 0.49 1.14 -2.84 0.00 0.00 0.00 174.94 173.94 3l6r s PRO 101 N 0.49 2.70 -0.02 2.79 0.02 -1.26 -3.86 135.00 135.86 3l6r s PRO 101 Ca -0.04 1.54 0.05 0.00 0.02 0.00 0.00 61.00 62.57 3l6r s PRO 101 Cb -0.15 -1.92 -0.01 0.00 0.02 0.00 0.00 34.50 32.44 3l6r s PRO 101 CO 0.03 -1.36 -0.16 0.00 -0.33 0.00 0.00 177.00 175.18 3l6r s ALA 102 N -2.13 1.40 -0.18 -1.55 0.00 -1.26 -1.42 121.76 116.63 3l6r s ALA 102 Ca 0.70 -0.68 -0.00 0.00 0.00 0.00 0.00 51.96 51.98 3l6r s ALA 102 Cb -0.24 -0.41 0.00 0.00 0.00 0.00 0.00 23.12 22.48 3l6r s ALA 102 CO 0.40 0.30 -0.14 0.71 0.00 0.00 0.00 175.76 177.03 3l6r s TYR 103 N -0.19 2.82 -0.19 0.00 1.51 -0.12 -1.97 117.35 119.21 3l6r s TYR 103 Ca 0.02 -1.22 0.01 0.00 -1.01 0.00 0.00 57.07 54.86 3l6r s TYR 103 Cb -0.08 -1.95 0.02 0.00 -0.11 0.00 0.00 41.96 39.83 3l6r s TYR 103 CO 0.00 -0.61 -0.17 0.42 -1.11 0.00 0.00 175.55 174.08 3l6r s ILE 104 N 1.14 2.21 -0.23 2.71 -1.09 -0.24 -2.39 121.20 123.31 3l6r s ILE 104 Ca 0.01 -0.96 -0.22 0.00 -2.23 0.00 0.00 60.65 57.26 3l6r s ILE 104 Cb -0.14 -1.97 -0.02 0.00 -1.58 0.00 0.00 42.46 38.75 3l6r s ILE 104 CO -0.05 0.47 0.68 -0.69 -1.23 0.00 0.00 174.94 174.12 3l6r s VAL 105 N 1.29 4.96 -0.04 2.92 1.01 -0.29 -0.92 120.40 129.33 3l6r s VAL 105 Ca 0.04 1.27 0.02 0.00 0.00 0.00 0.00 61.98 63.31 3l6r s VAL 105 Cb -0.14 -3.99 0.01 0.00 0.00 0.00 0.00 36.38 32.26 3l6r s VAL 105 CO -0.11 0.03 -0.09 -0.69 0.00 0.00 0.00 175.10 174.23 3l6r s VAL 106 N 2.40 0.83 0.43 2.92 1.01 -0.53 -0.49 120.40 126.98 3l6r s VAL 106 Ca 0.29 -0.35 -0.26 0.00 0.00 0.00 0.00 61.98 61.66 3l6r s VAL 106 Cb -0.16 -0.76 -0.09 0.00 0.00 0.00 0.00 36.38 35.38 3l6r s VAL 106 CO 0.09 0.27 1.41 -2.84 0.00 0.00 0.00 175.10 174.03 3l6r s PRO 107 N 0.40 3.78 0.59 2.72 0.02 -1.26 -0.89 135.00 140.37 3l6r s PRO 107 Ca -0.07 2.38 0.29 0.00 0.02 0.00 0.00 61.00 63.62 3l6r s PRO 107 Cb -0.11 -2.71 1.67 0.00 0.02 0.00 0.00 34.50 33.37 3l6r s PRO 107 CO 0.01 -0.73 2.09 1.96 -0.33 0.00 0.00 177.00 180.01 3l6r h GLN 108 N 2.46 0.00 -0.55 5.54 4.20 -1.37 -1.83 115.11 123.56 3l6r h GLN 108 Ca -0.51 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.20 3l6r h GLN 108 Cb 1.26 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.04 3l6r h GLN 108 CO 0.62 0.00 0.00 0.25 -0.67 0.00 0.00 178.83 179.03 3l6r n THR 109 N -3.75 0.72 -1.47 -0.54 -2.24 -1.26 -4.95 114.28 100.79 3l6r n THR 109 Ca 0.02 -0.78 -0.34 0.00 -2.27 0.00 0.00 64.05 60.67 3l6r n THR 109 Cb 0.33 0.53 0.09 0.00 -2.10 0.00 0.00 70.33 69.18 3l6r n THR 109 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3l6r s ALA 110 N -1.28 2.15 0.31 6.98 0.00 -0.69 -4.93 121.76 124.30 3l6r s ALA 110 Ca 0.41 0.89 -0.29 0.00 0.00 0.00 0.00 51.96 52.97 3l6r s ALA 110 Cb 0.22 -3.47 -0.12 0.00 0.00 0.00 0.00 23.12 19.74 3l6r s ALA 110 CO 0.29 -1.83 1.34 -2.30 0.00 0.00 0.00 175.76 173.26 3l6r n PRO 111 N -2.64 2.16 -0.34 0.00 -0.02 -1.26 -4.84 135.00 128.06 3l6r n PRO 111 Ca 0.13 0.76 0.10 0.00 -2.02 0.00 0.00 63.50 62.48 3l6r n PRO 111 Cb 0.50 -2.38 0.28 0.00 -0.02 0.00 0.00 33.50 31.88 3l6r n PRO 111 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3l6r h ASP 112 N 3.12 0.76 -0.26 2.55 3.32 -1.97 -1.77 116.42 122.17 3l6r h ASP 112 Ca -0.46 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 56.66 3l6r h ASP 112 Cb 1.28 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.76 3l6r h ASP 112 CO 0.67 0.32 0.12 0.00 -1.72 0.00 0.00 179.24 178.62 3l6r h LYS 114 N 0.43 0.51 -0.28 0.00 1.57 -1.70 -2.46 116.57 114.65 3l6r h LYS 114 Ca 0.11 -0.66 0.04 0.00 -1.87 0.00 0.00 60.65 58.27 3l6r h LYS 114 Cb 0.10 0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 3l6r h LYS 114 CO -0.01 1.27 0.06 0.87 -0.57 0.00 0.00 179.45 181.07 3l6r h LYS 115 N 0.06 0.17 -0.73 3.15 1.57 -0.91 -2.34 116.57 117.55 3l6r h LYS 115 Ca -0.14 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 3l6r h LYS 115 Cb 1.67 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.91 3l6r h LYS 115 CO 0.18 0.11 0.26 -0.07 -0.57 0.00 0.00 179.45 179.36 3l6r h LEU 116 N 0.17 1.02 -0.88 2.94 3.38 -0.98 -2.85 115.31 118.12 3l6r h LEU 116 Ca 0.13 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 3l6r h LEU 116 Cb 0.12 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 3l6r h LEU 116 CO -0.16 0.93 0.08 0.00 0.09 0.00 0.00 178.44 179.37 3l6r h ALA 117 N 1.21 1.07 -0.82 1.53 0.00 -1.28 -0.49 119.26 120.48 3l6r h ALA 117 Ca 0.24 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3l6r h ALA 117 Cb 0.25 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3l6r h ALA 117 CO -0.01 0.60 0.53 0.82 0.00 0.00 0.00 179.25 181.18 3l6r h ILE 118 N 0.86 1.22 -0.21 0.00 2.04 -1.33 -1.87 117.51 118.21 3l6r h ILE 118 Ca 0.17 -0.42 -0.17 0.00 1.00 0.00 0.00 64.86 65.44 3l6r h ILE 118 Cb 0.40 0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.50 3l6r h ILE 118 CO 0.01 0.22 -0.55 1.56 0.00 0.00 0.00 178.15 179.38 3l6r h GLN 119 N 1.12 0.65 -0.32 2.37 4.20 -1.24 -2.82 115.11 119.07 3l6r h GLN 119 Ca 0.30 -0.41 0.01 0.00 0.06 0.00 0.00 58.65 58.60 3l6r h GLN 119 Cb -0.10 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.71 3l6r h GLN 119 CO -0.06 1.03 0.21 0.00 -0.67 0.00 0.00 178.83 179.33 3l6r h ALA 120 N 0.89 1.79 -0.00 3.87 0.00 -0.66 -1.06 119.26 124.08 3l6r h ALA 120 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3l6r h ALA 120 Cb 1.12 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3l6r h ALA 120 CO 0.11 0.19 -0.01 0.66 0.00 0.00 0.00 179.25 180.21 3l6r n TYR 121 N -4.49 0.00 -0.23 0.00 4.02 -0.74 -4.91 117.16 110.81 3l6r n TYR 121 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.91 3l6r n TYR 121 Cb 0.07 -0.15 0.00 0.00 -0.02 0.00 0.00 39.34 39.25 3l6r n TYR 121 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3l6r n GLY 122 N 1.16 0.87 3.84 2.72 0.00 -0.40 -4.78 105.19 108.60 3l6r n GLY 122 Ca 0.19 -0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 3l6r n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3l6r s ALA 123 N -2.00 2.88 -0.37 4.61 0.00 -1.08 -4.76 121.76 121.05 3l6r s ALA 123 Ca 0.00 0.07 -0.25 0.00 0.00 0.00 0.00 51.96 51.78 3l6r s ALA 123 Cb 0.00 -3.14 0.01 0.00 0.00 0.00 0.00 23.12 19.99 3l6r s ALA 123 CO 0.00 -0.86 0.87 0.45 0.00 0.00 0.00 175.76 176.22 3l6r s SER 124 N -3.72 6.62 -0.07 0.00 0.15 -0.83 -4.64 113.70 111.21 3l6r s SER 124 Ca 0.58 0.46 -0.09 0.00 0.70 0.00 0.00 55.95 57.60 3l6r s SER 124 Cb -0.13 -2.44 -0.05 0.00 -1.71 0.00 0.00 66.02 61.70 3l6r s SER 124 CO 0.50 -0.83 0.23 -0.51 1.20 0.00 0.00 173.24 173.82 3l6r s ILE 125 N 3.36 5.36 -0.18 6.45 2.07 -1.26 -1.08 121.20 135.92 3l6r s ILE 125 Ca 0.36 0.37 -0.02 0.00 -1.41 0.00 0.00 60.65 59.94 3l6r s ILE 125 Cb -0.12 -3.51 0.06 0.00 0.13 0.00 0.00 42.46 39.02 3l6r s ILE 125 CO 0.19 0.57 0.03 -0.69 -1.91 0.00 0.00 174.94 173.12 3l6r s VAL 126 N -1.08 0.56 0.25 4.00 1.01 -0.09 -4.92 120.40 120.14 3l6r s VAL 126 Ca 0.19 -0.51 -0.30 0.00 0.00 0.00 0.00 61.98 61.36 3l6r s VAL 126 Cb -0.13 -1.01 -0.09 0.00 0.00 0.00 0.00 36.38 35.14 3l6r s VAL 126 CO 0.08 -0.14 0.99 -0.31 0.00 0.00 0.00 175.10 175.72 3l6r s TYR 127 N 1.85 3.86 0.46 5.22 4.12 -1.26 -1.45 117.35 130.15 3l6r s TYR 127 Ca -0.00 1.85 0.03 0.00 0.02 0.00 0.00 57.07 58.97 3l6r s TYR 127 Cb -0.17 -3.07 -0.01 0.00 -1.52 0.00 0.00 41.96 37.20 3l6r s TYR 127 CO -0.08 0.16 0.09 0.00 0.02 0.00 0.00 175.55 175.75 3l6r s GLU 129 N -3.74 3.26 -1.29 0.00 0.41 -1.26 -1.05 118.70 115.02 3l6r s GLU 129 Ca 0.15 0.97 -0.16 0.00 -0.41 0.00 0.00 54.97 55.52 3l6r s GLU 129 Cb 0.01 -2.03 0.10 0.00 -1.78 0.00 0.00 34.13 30.43 3l6r s GLU 129 CO 0.10 -0.85 1.71 -2.30 -0.49 0.00 0.00 175.26 173.43 3l6r n PRO 130 N -2.65 3.23 -3.61 0.39 -0.02 -1.26 -4.36 135.00 126.72 3l6r n PRO 130 Ca 0.07 -3.39 -0.13 0.00 -2.02 0.00 0.00 63.50 58.04 3l6r n PRO 130 Cb 0.54 -3.32 -0.05 0.00 -0.02 0.00 0.00 33.50 30.64 3l6r n PRO 130 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3l6r s SER 131 N 3.57 -0.34 0.22 2.55 1.04 -1.26 -4.78 113.70 114.70 3l6r s SER 131 Ca 0.50 -0.00 -0.09 0.00 0.48 0.00 0.00 55.95 56.83 3l6r s SER 131 Cb 0.03 0.47 0.19 0.00 0.10 0.00 0.00 66.02 66.81 3l6r s SER 131 CO 0.04 -0.74 1.88 0.44 0.98 0.00 0.00 173.24 175.84 3l6r h ASP 132 N 2.74 0.86 -0.59 7.02 3.32 -1.92 -2.12 116.42 125.74 3l6r h ASP 132 Ca -0.32 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.72 3l6r h ASP 132 Cb 1.22 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.54 3l6r h ASP 132 CO 0.43 0.61 0.38 -0.08 -1.72 0.00 0.00 179.24 178.86 3l6r h GLU 133 N 1.01 0.78 -0.31 3.56 4.81 -1.95 -1.19 114.58 121.28 3l6r h GLU 133 Ca 0.30 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.42 3l6r h GLU 133 Cb -0.06 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.13 3l6r h GLU 133 CO -0.08 0.52 -0.04 1.03 -0.73 0.00 0.00 179.01 179.71 3l6r h SER 134 N 0.79 0.57 -0.15 1.04 0.87 -1.81 -0.99 113.55 113.87 3l6r h SER 134 Ca 0.21 -0.34 0.04 0.00 -1.23 0.00 0.00 61.79 60.48 3l6r h SER 134 Cb -0.08 -0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 61.69 3l6r h SER 134 CO -0.04 0.78 -0.11 0.03 -0.53 0.00 0.00 176.83 176.95 3l6r h ARG 135 N 0.36 -0.12 -0.33 2.24 3.08 -1.23 -1.25 114.38 117.13 3l6r h ARG 135 Ca 0.08 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 3l6r h ARG 135 Cb 0.51 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 3l6r h ARG 135 CO 0.02 -0.08 0.05 0.93 -1.07 0.00 0.00 179.97 179.82 3l6r h GLU 136 N -0.12 0.55 -0.38 0.04 4.39 -1.12 -2.24 114.58 115.70 3l6r h GLU 136 Ca 0.10 -0.15 -0.10 0.00 0.34 0.00 0.00 59.36 59.54 3l6r h GLU 136 Cb 0.26 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 3l6r h GLU 136 CO -0.23 0.64 -0.15 -0.91 -1.16 0.00 0.00 179.01 177.20 3l6r h ASN 137 N 0.38 0.79 -0.50 1.42 2.35 -1.11 -1.79 115.58 117.12 3l6r h ASN 137 Ca 0.10 -0.39 -0.10 0.00 -0.55 0.00 0.00 56.30 55.36 3l6r h ASN 137 Cb 0.36 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 3l6r h ASN 137 CO 0.01 1.01 -0.07 0.58 -1.65 0.00 0.00 177.43 177.31 3l6r h VAL 138 N 0.57 1.27 -0.33 2.81 2.07 -1.26 -2.13 116.25 119.25 3l6r h VAL 138 Ca 0.09 -1.19 -0.04 0.00 0.82 0.00 0.00 66.70 66.38 3l6r h VAL 138 Cb 0.69 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 3l6r h VAL 138 CO 0.05 0.41 0.04 0.00 0.02 0.00 0.00 177.57 178.09 3l6r h ALA 139 N 0.91 1.46 -0.38 1.67 0.00 -1.34 -0.30 119.26 121.28 3l6r h ALA 139 Ca 0.13 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3l6r h ALA 139 Cb 0.61 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3l6r h ALA 139 CO 0.04 0.39 0.03 -0.22 0.00 0.00 0.00 179.25 179.49 3l6r h LYS 140 N 0.48 0.66 -0.45 0.00 3.64 -1.14 -0.81 116.57 118.95 3l6r h LYS 140 Ca 0.11 -0.19 -0.04 0.00 -1.27 0.00 0.00 60.65 59.26 3l6r h LYS 140 Cb 0.25 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 3l6r h LYS 140 CO 0.00 0.74 0.13 -0.09 -2.27 0.00 0.00 179.45 177.96 3l6r h ARG 141 N 0.49 0.71 -0.54 1.90 2.43 -0.82 -2.15 114.38 116.39 3l6r h ARG 141 Ca 0.11 -0.16 -0.05 0.00 -0.81 0.00 0.00 59.98 59.07 3l6r h ARG 141 Cb 0.42 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 3l6r h ARG 141 CO 0.01 0.69 0.12 0.28 -1.51 0.00 0.00 179.97 179.56 3l6r h VAL 142 N 0.59 1.23 -0.50 0.20 2.07 -1.00 -0.57 116.25 118.27 3l6r h VAL 142 Ca 0.14 -0.85 0.01 0.00 0.82 0.00 0.00 66.70 66.83 3l6r h VAL 142 Cb 0.28 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 3l6r h VAL 142 CO -0.00 0.31 0.32 0.74 0.02 0.00 0.00 177.57 178.96 3l6r h THR 143 N 0.81 1.09 -0.20 2.57 2.02 -0.87 -1.36 112.91 116.97 3l6r h THR 143 Ca 0.17 -0.22 -0.03 0.00 0.77 0.00 0.00 66.41 67.10 3l6r h THR 143 Cb 0.32 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 3l6r h THR 143 CO 0.00 0.12 -0.01 -0.33 0.37 0.00 0.00 175.52 175.67 3l6r h GLU 144 N 0.64 0.36 -0.53 6.66 5.08 -0.95 -1.70 114.58 124.14 3l6r h GLU 144 Ca 0.19 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 3l6r h GLU 144 Cb -0.03 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 3l6r h GLU 144 CO -0.07 0.57 0.15 0.93 -1.00 0.00 0.00 179.01 179.58 3l6r h GLU 145 N 0.11 0.80 -0.00 2.33 5.08 -0.95 -2.91 114.58 119.04 3l6r h GLU 145 Ca 0.06 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3l6r h GLU 145 Cb 0.41 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3l6r h GLU 145 CO 0.01 0.71 -0.60 0.25 -1.00 0.00 0.00 179.01 178.38 3l6r n THR 146 N -4.29 0.00 -3.05 1.13 -2.24 -0.53 -4.93 114.28 100.37 3l6r n THR 146 Ca 0.04 -0.01 -0.22 0.00 -2.27 0.00 0.00 64.05 61.59 3l6r n THR 146 Cb 0.21 0.45 0.02 0.00 -2.10 0.00 0.00 70.33 68.91 3l6r n THR 146 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3l6r n GLU 147 N -1.42 -4.06 -2.55 -0.78 1.02 -0.68 -4.74 120.64 107.43 3l6r n GLU 147 Ca 0.06 0.75 -0.24 0.00 -0.02 0.00 0.00 57.16 57.71 3l6r n GLU 147 Cb 0.34 -5.54 0.12 0.00 -0.02 0.00 0.00 31.44 26.34 3l6r n GLU 147 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3l6r s GLY 148 N -2.62 1.76 0.00 0.62 0.00 -0.97 -4.50 107.32 101.60 3l6r s GLY 148 Ca 0.30 -1.76 0.00 0.00 0.00 0.00 0.00 44.72 43.26 3l6r s GLY 148 CO 0.37 -1.15 0.00 1.39 0.00 0.00 0.00 173.10 173.71 3l6r n ILE 149 N -2.94 0.00 0.00 0.90 2.08 -0.30 -4.84 119.36 114.26 3l6r n ILE 149 Ca 0.16 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.47 3l6r n ILE 149 Cb 0.61 -0.29 0.00 0.00 -0.75 0.00 0.00 39.64 39.20 3l6r n ILE 149 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 3l6r n VAL 151 N 0.00 0.00 -1.98 1.39 0.31 -0.32 -1.30 118.33 116.42 3l6r n VAL 151 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 63.94 3l6r n VAL 151 Cb 0.00 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 32.94 3l6r n VAL 151 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 3l6r s HIS 152 N 0.00 2.67 -0.16 3.52 2.46 -1.26 -4.61 115.29 117.91 3l6r s HIS 152 Ca 0.00 1.38 0.29 0.00 0.47 0.00 0.00 55.06 57.20 3l6r s HIS 152 Cb 0.00 -3.72 1.22 0.00 -0.13 0.00 0.00 32.58 29.95 3l6r s HIS 152 CO 0.00 -2.33 1.86 -1.00 -2.47 0.00 0.00 174.74 170.80 3l6r h PRO 153 N 2.38 0.00 0.00 2.88 0.13 -1.97 -3.37 132.00 132.05 3l6r h PRO 153 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3l6r h PRO 153 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3l6r h PRO 153 CO 0.61 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.65 3l6r n ASN 154 N -2.66 0.00 -0.05 1.44 0.23 -1.26 -4.87 115.26 108.09 3l6r n ASN 154 Ca 0.01 0.00 0.07 0.00 -0.53 0.00 0.00 54.58 54.13 3l6r n ASN 154 Cb 0.25 0.00 -0.07 0.00 -2.08 0.00 0.00 39.78 37.88 3l6r n ASN 154 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3l6r n GLN 155 N 0.00 2.03 -2.41 -3.83 1.13 -1.26 -3.99 117.38 109.05 3l6r n GLN 155 Ca 0.00 -0.12 -0.42 0.00 -1.94 0.00 0.00 57.00 54.51 3l6r n GLN 155 Cb 0.00 -1.21 -0.03 0.00 0.11 0.00 0.00 30.24 29.11 3l6r n GLN 155 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 3l6r s GLU 156 N -2.32 4.31 0.29 -1.09 2.56 -1.26 -4.84 118.70 116.35 3l6r s GLU 156 Ca 0.07 1.71 0.03 0.00 0.00 0.00 0.00 54.97 56.78 3l6r s GLU 156 Cb 0.11 -3.62 0.65 0.00 2.00 0.00 0.00 34.13 33.27 3l6r s GLU 156 CO 0.58 -0.53 1.78 -1.35 -0.56 0.00 0.00 175.26 175.17 3l6r h PRO 157 N 7.72 0.73 -0.10 4.30 0.11 -1.92 -0.54 132.00 142.31 3l6r h PRO 157 Ca -0.33 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.66 3l6r h PRO 157 Cb 1.15 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 3l6r h PRO 157 CO 0.91 0.48 -0.31 0.00 -0.21 0.00 0.00 178.00 178.87 3l6r h ALA 158 N 1.61 1.31 -0.09 -0.75 0.00 -1.93 -1.69 119.26 117.71 3l6r h ALA 158 Ca 0.53 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 3l6r h ALA 158 Cb 0.77 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3l6r h ALA 158 CO -0.36 0.48 -0.17 0.28 0.00 0.00 0.00 179.25 179.48 3l6r h VAL 159 N 0.16 1.40 -0.74 0.00 2.07 -1.30 -2.37 116.25 115.47 3l6r h VAL 159 Ca 0.02 -1.45 0.03 0.00 0.82 0.00 0.00 66.70 66.12 3l6r h VAL 159 Cb 0.63 2.13 -0.04 0.00 -1.52 0.00 0.00 31.29 32.49 3l6r h VAL 159 CO 0.05 0.41 0.47 0.40 0.02 0.00 0.00 177.57 178.92 3l6r h ILE 160 N -0.19 1.12 -0.53 4.57 2.04 -0.99 -1.25 117.51 122.28 3l6r h ILE 160 Ca 0.00 -0.32 -0.07 0.00 1.00 0.00 0.00 64.86 65.48 3l6r h ILE 160 Cb 0.74 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 3l6r h ILE 160 CO 0.04 0.17 0.05 0.00 0.00 0.00 0.00 178.15 178.40 3l6r h ALA 161 N 1.31 1.09 -0.20 1.87 0.00 -1.34 -2.05 119.26 119.95 3l6r h ALA 161 Ca 0.29 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3l6r h ALA 161 Cb -0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3l6r h ALA 161 CO -0.10 0.59 0.13 0.78 0.00 0.00 0.00 179.25 180.64 3l6r h GLY 162 N 0.99 0.28 1.72 0.00 0.00 -0.84 -2.98 103.07 102.24 3l6r h GLY 162 Ca 0.16 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.35 3l6r h GLY 162 CO 0.01 0.11 -0.00 1.46 0.00 0.00 0.00 176.54 178.12 3l6r h GLN 163 N 0.25 0.36 0.00 4.80 1.08 -0.79 -2.74 115.11 118.08 3l6r h GLN 163 Ca 0.07 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 3l6r h GLN 163 Cb -0.01 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.36 3l6r h GLN 163 CO -0.01 0.39 0.00 0.78 -0.95 0.00 0.00 178.83 179.04 3l6r h GLY 164 N 0.67 0.00 2.00 3.46 0.00 -1.22 -2.62 103.07 105.36 3l6r h GLY 164 Ca 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 3l6r h GLY 164 CO 0.01 0.00 -0.08 -0.91 0.00 0.00 0.00 176.54 175.56 3l6r h THR 165 N 0.00 0.39 -0.87 4.70 1.35 -1.55 -1.33 112.91 115.60 3l6r h THR 165 Ca 0.00 -0.42 0.18 0.00 -0.55 0.00 0.00 66.41 65.62 3l6r h THR 165 Cb 0.11 1.30 -0.11 0.00 -1.73 0.00 0.00 68.15 67.72 3l6r h THR 165 CO 0.00 0.08 0.41 0.40 -0.25 0.00 0.00 175.52 176.16 3l6r h ILE 166 N 0.00 0.60 -0.01 6.82 2.04 -1.68 -1.90 117.51 123.38 3l6r h ILE 166 Ca -0.00 -0.17 -0.11 0.00 1.00 0.00 0.00 64.86 65.57 3l6r h ILE 166 Cb 0.29 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 3l6r h ILE 166 CO 0.01 0.09 -0.53 0.00 0.00 0.00 0.00 178.15 177.72 3l6r h ALA 167 N 1.64 1.09 -0.78 1.87 0.00 -1.48 -1.59 119.26 120.00 3l6r h ALA 167 Ca 0.51 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3l6r h ALA 167 Cb 0.86 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 3l6r h ALA 167 CO -0.45 0.67 0.29 -0.07 0.00 0.00 0.00 179.25 179.69 3l6r h LEU 168 N 0.03 1.10 -0.08 0.00 3.38 -1.42 -1.94 115.31 116.37 3l6r h LEU 168 Ca -0.00 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 3l6r h LEU 168 Cb 0.95 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 3l6r h LEU 168 CO 0.07 0.98 -0.06 -0.33 0.09 0.00 0.00 178.44 179.20 3l6r h GLU 169 N 1.15 0.19 -0.49 1.13 5.08 -1.22 -3.17 114.58 117.25 3l6r h GLU 169 Ca 0.26 -0.09 0.06 0.00 -1.00 0.00 0.00 59.36 58.59 3l6r h GLU 169 Cb 0.24 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.44 3l6r h GLU 169 CO -0.02 0.58 0.19 0.28 -1.00 0.00 0.00 179.01 179.05 3l6r h VAL 170 N -0.21 0.86 0.00 3.13 2.07 -1.16 0.38 116.25 121.33 3l6r h VAL 170 Ca 0.02 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.37 3l6r h VAL 170 Cb 0.53 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 3l6r h VAL 170 CO 0.02 0.07 -0.18 -0.07 0.02 0.00 0.00 177.57 177.43 3l6r h LEU 171 N 0.38 0.00 0.06 2.57 4.07 -1.44 0.45 115.31 121.40 3l6r h LEU 171 Ca 0.23 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 58.08 3l6r h LEU 171 Cb 0.22 0.00 0.01 0.00 1.08 0.00 0.00 40.66 41.97 3l6r h LEU 171 CO -0.22 0.18 -0.48 0.78 -1.08 0.00 0.00 178.44 177.62 3l6r h ASN 172 N 0.00 0.32 0.22 -0.43 2.35 -1.37 -3.33 115.58 113.34 3l6r h ASN 172 Ca -0.00 -0.90 -0.11 0.00 -0.55 0.00 0.00 56.30 54.74 3l6r h ASN 172 Cb 0.35 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 3l6r h ASN 172 CO 0.02 1.19 -0.41 1.56 -1.65 0.00 0.00 177.43 178.14 3l6r h GLN 173 N -0.51 0.25 -2.57 0.81 4.20 -0.65 -3.37 115.11 113.27 3l6r h GLN 173 Ca -0.08 -0.12 -0.60 0.00 0.06 0.00 0.00 58.65 57.91 3l6r h GLN 173 Cb 1.32 -0.00 -0.41 0.00 0.30 0.00 0.00 27.48 28.68 3l6r h GLN 173 CO 0.09 0.62 -0.70 0.28 -0.67 0.00 0.00 178.83 178.46 3l6r n VAL 174 N -4.03 1.22 0.29 -0.54 0.31 0.12 -4.96 118.33 110.75 3l6r n VAL 174 Ca -0.01 -4.69 0.17 0.00 -0.01 0.00 0.00 64.34 59.79 3l6r n VAL 174 Cb 0.48 -2.06 0.91 0.00 -0.91 0.00 0.00 33.84 32.26 3l6r n VAL 174 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 3l6r h PRO 175 N 4.86 0.00 -0.57 5.55 0.13 -1.73 -0.76 132.00 139.48 3l6r h PRO 175 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3l6r h PRO 175 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 3l6r h PRO 175 CO 0.68 0.04 0.00 1.28 -0.23 0.00 0.00 178.00 179.77 3l6r n LEU 176 N -3.48 3.15 -4.68 1.56 4.77 -1.26 -4.99 117.00 112.06 3l6r n LEU 176 Ca -0.02 -1.58 -0.44 0.00 -0.03 0.00 0.00 56.01 53.94 3l6r n LEU 176 Cb 0.16 -0.41 -0.02 0.00 -2.33 0.00 0.00 43.42 40.82 3l6r n LEU 176 CO 0.26 0.67 0.98 0.55 -1.33 0.00 0.00 177.39 178.52 3l6r n VAL 177 N 0.93 1.35 -0.02 4.08 3.14 -0.29 -4.72 118.33 122.80 3l6r n VAL 177 Ca 0.18 -0.34 0.04 0.00 -2.96 0.00 0.00 64.34 61.26 3l6r n VAL 177 Cb 0.54 -1.53 -0.10 0.00 -1.06 0.00 0.00 33.84 31.69 3l6r n VAL 177 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 3l6r n ASP 178 N 1.64 1.94 -3.53 6.55 8.00 0.64 -4.85 116.55 126.94 3l6r n ASP 178 Ca 0.09 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.41 3l6r n ASP 178 Cb 0.33 1.43 -0.06 0.00 -0.02 0.00 0.00 41.12 42.80 3l6r n ASP 178 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3l6r s ALA 179 N -2.79 -1.78 -0.05 2.24 0.00 -1.04 -1.14 121.76 117.20 3l6r s ALA 179 Ca -0.05 1.36 0.02 0.00 0.00 0.00 0.00 51.96 53.29 3l6r s ALA 179 Cb 0.07 -0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.09 3l6r s ALA 179 CO 0.55 -0.37 -0.10 -0.51 0.00 0.00 0.00 175.76 175.33 3l6r s LEU 180 N -1.13 2.99 -0.14 0.00 1.02 -0.04 -1.38 118.68 120.00 3l6r s LEU 180 Ca -0.10 -0.11 0.02 0.00 0.02 0.00 0.00 54.13 53.96 3l6r s LEU 180 Cb -0.00 -1.65 0.01 0.00 0.02 0.00 0.00 46.19 44.57 3l6r s LEU 180 CO 0.09 0.35 -0.20 -0.69 0.02 0.00 0.00 176.35 175.91 3l6r s VAL 181 N -0.80 2.20 -0.09 -1.59 1.01 -0.16 -1.07 120.40 119.90 3l6r s VAL 181 Ca 0.13 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.18 3l6r s VAL 181 Cb -0.11 -1.89 0.02 0.00 0.00 0.00 0.00 36.38 34.40 3l6r s VAL 181 CO 0.02 0.54 -0.10 -0.69 0.00 0.00 0.00 175.10 174.87 3l6r s VAL 182 N 0.81 1.06 0.37 2.92 1.01 -0.47 -2.00 120.40 124.10 3l6r s VAL 182 Ca -0.07 -0.38 -0.27 0.00 0.00 0.00 0.00 61.98 61.27 3l6r s VAL 182 Cb -0.15 -1.02 -0.09 0.00 0.00 0.00 0.00 36.38 35.11 3l6r s VAL 182 CO -0.01 0.35 1.27 -2.16 0.00 0.00 0.00 175.10 174.55 3l6r s PRO 183 N 1.14 4.15 -0.10 2.72 0.05 -1.26 -1.09 135.00 140.61 3l6r s PRO 183 Ca -0.06 2.09 0.03 0.00 0.05 0.00 0.00 61.00 63.12 3l6r s PRO 183 Cb -0.14 -2.87 0.01 0.00 0.05 0.00 0.00 34.50 31.55 3l6r s PRO 183 CO -0.02 -0.32 -0.21 0.54 0.05 0.00 0.00 177.00 177.04 3l6r s VAL 184 N -1.25 1.87 0.00 -0.36 0.11 -0.74 -4.68 120.40 115.35 3l6r s VAL 184 Ca 0.54 -0.89 0.00 0.00 -2.93 0.00 0.00 61.98 58.69 3l6r s VAL 184 Cb -0.37 -1.64 0.00 0.00 -1.53 0.00 0.00 36.38 32.84 3l6r s VAL 184 CO 0.48 0.52 0.00 0.61 -3.33 0.00 0.00 175.10 173.37 3l6r n GLY 185 N 3.76 0.96 0.16 6.54 0.00 -1.26 -4.81 105.19 110.54 3l6r n GLY 185 Ca -0.20 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 45.94 3l6r n GLY 185 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3l6r h GLY 186 N 0.00 0.00 0.00 -0.02 0.00 -1.75 -3.25 103.07 98.05 3l6r h GLY 186 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3l6r h GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 3l6r n GLY 187 N 0.42 0.74 0.07 4.60 0.00 -1.26 -3.61 105.19 106.15 3l6r n GLY 187 Ca 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3l6r n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3l6r n GLY 188 N -2.48 -0.26 0.64 -0.02 0.00 -1.26 -1.29 105.19 100.53 3l6r n GLY 188 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3l6r n GLY 188 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3l6r n LEU 190 N -0.39 0.00 -0.09 0.99 7.94 -1.26 -1.86 117.00 122.32 3l6r n LEU 190 Ca 0.00 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 54.79 3l6r n LEU 190 Cb 0.01 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.93 3l6r n LEU 190 CO 0.00 0.00 0.75 0.00 -1.11 0.00 0.00 177.39 177.03 3l6r h ALA 191 N 0.00 0.37 -0.75 1.96 0.00 -1.54 0.27 119.26 119.58 3l6r h ALA 191 Ca 0.00 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 3l6r h ALA 191 Cb 0.00 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3l6r h ALA 191 CO 0.00 0.13 0.32 0.78 0.00 0.00 0.00 179.25 180.48 3l6r h GLY 192 N 0.27 1.19 0.96 0.00 0.00 -1.56 -1.69 103.07 102.24 3l6r h GLY 192 Ca 0.08 -0.63 -0.08 0.00 0.00 0.00 0.00 47.33 46.70 3l6r h GLY 192 CO 0.02 0.59 -0.06 -2.22 0.00 0.00 0.00 176.54 174.88 3l6r h ILE 193 N 1.07 1.27 -0.70 2.60 2.04 -1.77 -2.74 117.51 119.28 3l6r h ILE 193 Ca 0.25 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 65.00 3l6r h ILE 193 Cb 0.18 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 3l6r h ILE 193 CO -0.02 0.37 0.45 0.00 0.00 0.00 0.00 178.15 178.95 3l6r h ALA 194 N 0.85 0.88 -0.68 1.87 0.00 -0.62 -0.66 119.26 120.91 3l6r h ALA 194 Ca 0.10 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.00 3l6r h ALA 194 Cb 0.56 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 3l6r h ALA 194 CO 0.03 0.32 0.41 0.82 0.00 0.00 0.00 179.25 180.83 3l6r h ILE 195 N 0.94 1.05 0.05 0.00 1.08 -1.31 -1.91 117.51 117.42 3l6r h ILE 195 Ca 0.25 -0.27 -0.00 0.00 -0.39 0.00 0.00 64.86 64.45 3l6r h ILE 195 Cb -0.09 0.19 0.00 0.00 -3.07 0.00 0.00 36.82 33.85 3l6r h ILE 195 CO -0.05 0.14 -0.03 0.74 -0.69 0.00 0.00 178.15 178.27 3l6r h THR 196 N 0.79 1.28 -0.47 -0.27 2.02 -1.11 -2.37 112.91 112.77 3l6r h THR 196 Ca 0.28 -1.23 -0.02 0.00 0.77 0.00 0.00 66.41 66.21 3l6r h THR 196 Cb 0.08 2.07 -0.02 0.00 -1.74 0.00 0.00 68.15 68.54 3l6r h THR 196 CO -0.13 0.30 0.21 0.58 0.37 0.00 0.00 175.52 176.85 3l6r h VAL 197 N -0.63 1.20 0.00 3.16 2.07 -1.14 -2.18 116.25 118.72 3l6r h VAL 197 Ca -0.01 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 3l6r h VAL 197 Cb 0.55 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3l6r h VAL 197 CO 0.01 0.22 -0.03 0.11 0.02 0.00 0.00 177.57 177.90 3l6r h LYS 198 N 0.62 0.00 0.18 1.57 1.79 -1.39 0.01 116.57 119.35 3l6r h LYS 198 Ca 0.16 0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 58.32 3l6r h LYS 198 Cb 0.15 0.00 0.03 0.00 -1.58 0.00 0.00 32.23 30.83 3l6r h LYS 198 CO -0.02 0.03 -1.35 0.00 -1.08 0.00 0.00 179.45 177.04 3l6r h ALA 199 N 1.97 -0.05 0.15 3.86 0.00 -1.12 -3.35 119.26 120.71 3l6r h ALA 199 Ca -0.00 -0.82 -0.29 0.00 0.00 0.00 0.00 54.91 53.79 3l6r h ALA 199 Cb 0.63 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3l6r h ALA 199 CO 0.00 0.73 -1.47 -0.07 0.00 0.00 0.00 179.25 178.44 3l6r h LEU 200 N 0.19 0.48 -5.04 0.00 3.38 -1.11 -3.45 115.31 109.77 3l6r h LEU 200 Ca -0.21 -0.89 -0.18 0.00 0.09 0.00 0.00 57.88 56.69 3l6r h LEU 200 Cb 2.03 -0.16 -0.16 0.00 0.09 0.00 0.00 40.66 42.46 3l6r h LEU 200 CO 0.25 1.66 -0.51 1.17 0.09 0.00 0.00 178.44 181.10 3l6r n LYS 201 N -3.83 0.59 0.02 1.13 4.81 -0.03 -5.02 118.16 115.82 3l6r n LYS 201 Ca -0.24 -2.00 0.05 0.00 -0.87 0.00 0.00 58.31 55.25 3l6r n LYS 201 Cb 0.96 -1.47 0.22 0.00 0.02 0.00 0.00 35.03 34.75 3l6r n LYS 201 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 3l6r n PRO 202 N 2.60 0.02 0.28 1.64 -0.04 -1.19 -1.67 135.00 136.64 3l6r n PRO 202 Ca 0.16 0.39 0.16 0.00 -0.04 0.00 0.00 63.50 64.16 3l6r n PRO 202 Cb 0.58 -1.56 0.77 0.00 -0.04 0.00 0.00 33.50 33.25 3l6r n PRO 202 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3l6r h SER 203 N 0.00 0.00 -3.22 3.54 4.64 -1.93 -3.43 113.55 113.15 3l6r h SER 203 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 3l6r h SER 203 Cb 0.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 3l6r h SER 203 CO 0.00 0.08 0.53 -0.69 -0.87 0.00 0.00 176.83 175.88 3l6r s VAL 204 N -3.97 4.15 0.34 0.95 1.01 -0.67 -4.95 120.40 117.26 3l6r s VAL 204 Ca -0.02 1.54 -0.23 0.00 0.00 0.00 0.00 61.98 63.28 3l6r s VAL 204 Cb 0.12 -3.99 -0.10 0.00 0.00 0.00 0.00 36.38 32.41 3l6r s VAL 204 CO 0.55 0.12 0.90 -0.54 0.00 0.00 0.00 175.10 176.13 3l6r s LYS 205 N 1.06 4.40 -0.23 2.72 -0.14 -0.30 -4.88 119.74 122.36 3l6r s LYS 205 Ca 0.58 1.16 0.02 0.00 -1.36 0.00 0.00 55.97 56.37 3l6r s LYS 205 Cb -0.28 -2.60 0.05 0.00 -1.68 0.00 0.00 37.83 33.31 3l6r s LYS 205 CO 0.29 0.19 -0.14 0.08 -0.76 0.00 0.00 175.35 175.02 3l6r s VAL 206 N -1.80 2.17 -0.08 3.17 1.01 -1.26 -0.86 120.40 122.75 3l6r s VAL 206 Ca 0.53 -1.38 0.03 0.00 0.00 0.00 0.00 61.98 61.16 3l6r s VAL 206 Cb -0.15 -2.15 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 3l6r s VAL 206 CO 0.20 0.17 -0.16 -0.31 0.00 0.00 0.00 175.10 175.00 3l6r s TYR 207 N 1.17 2.70 0.20 5.22 2.02 -0.23 -1.25 117.35 127.18 3l6r s TYR 207 Ca -0.04 -0.42 -0.07 0.00 -0.37 0.00 0.00 57.07 56.16 3l6r s TYR 207 Cb -0.17 -1.70 -0.06 0.00 -0.40 0.00 0.00 41.96 39.62 3l6r s TYR 207 CO -0.08 -0.02 0.48 0.00 -1.57 0.00 0.00 175.55 174.37 3l6r s ALA 208 N -0.25 3.66 -0.08 3.71 0.00 -0.61 -1.37 121.76 126.82 3l6r s ALA 208 Ca 0.01 -0.40 0.04 0.00 0.00 0.00 0.00 51.96 51.60 3l6r s ALA 208 Cb -0.13 -2.31 0.00 0.00 0.00 0.00 0.00 23.12 20.69 3l6r s ALA 208 CO 0.03 0.55 -0.19 0.00 0.00 0.00 0.00 175.76 176.15 3l6r s ALA 209 N -1.78 1.76 -0.05 0.00 0.00 -0.25 -0.92 121.76 120.52 3l6r s ALA 209 Ca 0.45 -0.74 -0.06 0.00 0.00 0.00 0.00 51.96 51.60 3l6r s ALA 209 Cb -0.11 -0.67 0.01 0.00 0.00 0.00 0.00 23.12 22.35 3l6r s ALA 209 CO 0.23 0.24 0.16 -2.00 0.00 0.00 0.00 175.76 174.39 3l6r s GLU 210 N 0.37 0.23 0.26 0.00 2.12 -0.18 -1.79 118.70 119.70 3l6r s GLU 210 Ca -0.14 0.15 -0.30 0.00 0.36 0.00 0.00 54.97 55.05 3l6r s GLU 210 Cb -0.16 0.11 -0.10 0.00 0.26 0.00 0.00 34.13 34.24 3l6r s GLU 210 CO 0.06 -0.03 1.36 -2.14 -0.54 0.00 0.00 175.26 173.96 3l6r s PRO 211 N -0.09 4.34 0.50 4.30 0.02 -1.26 -1.05 135.00 141.75 3l6r s PRO 211 Ca -0.02 2.19 0.19 0.00 0.02 0.00 0.00 61.00 63.39 3l6r s PRO 211 Cb -0.02 -3.13 1.26 0.00 0.02 0.00 0.00 34.50 32.63 3l6r s PRO 211 CO 0.00 -0.29 2.05 0.77 -0.33 0.00 0.00 177.00 179.20 3l6r h SER 212 N 4.65 0.10 0.00 2.53 0.02 -1.40 -0.58 113.55 118.86 3l6r h SER 212 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 3l6r h SER 212 Cb 1.22 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.74 3l6r h SER 212 CO 0.74 0.06 0.00 0.59 -1.14 0.00 0.00 176.83 177.08 3l6r n ASN 213 N -4.45 0.00 -2.80 3.07 3.02 -1.26 -3.81 115.26 109.02 3l6r n ASN 213 Ca 0.05 -1.34 -0.10 0.00 -0.03 0.00 0.00 54.58 53.16 3l6r n ASN 213 Cb 0.37 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.61 3l6r n ASN 213 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3l6r n ALA 214 N -0.76 0.78 -1.16 5.41 0.00 -0.24 -4.15 120.51 120.40 3l6r n ALA 214 Ca 0.11 -1.98 -0.25 0.00 0.00 0.00 0.00 53.44 51.32 3l6r n ALA 214 Cb 0.05 -1.05 0.15 0.00 0.00 0.00 0.00 19.45 18.61 3l6r n ALA 214 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3l6r n ASP 215 N 0.04 4.54 -0.32 0.00 5.75 -1.16 -4.54 116.55 120.86 3l6r n ASP 215 Ca 0.08 -3.57 0.11 0.00 -0.01 0.00 0.00 54.79 51.40 3l6r n ASP 215 Cb 0.75 -0.86 0.33 0.00 -1.03 0.00 0.00 41.12 40.31 3l6r n ASP 215 CO 0.00 0.00 0.00 -2.24 -0.11 0.00 0.00 177.20 174.85 3l6r h ASP 216 N 1.17 0.76 -0.21 -1.12 2.03 -1.93 -1.28 116.42 115.85 3l6r h ASP 216 Ca 0.60 0.06 -0.11 0.00 -0.73 0.00 0.00 57.03 56.86 3l6r h ASP 216 Cb 2.37 -0.09 -0.00 0.00 -0.83 0.00 0.00 39.33 40.78 3l6r h ASP 216 CO 1.16 0.35 -0.29 0.00 -1.03 0.00 0.00 179.24 179.43 3l6r h TYR 218 N 0.24 0.11 -0.57 0.00 3.20 -1.87 -1.79 116.97 116.28 3l6r h TYR 218 Ca 0.02 0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.81 3l6r h TYR 218 Cb 0.86 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 39.09 3l6r h TYR 218 CO 0.08 0.05 -0.00 1.96 -1.64 0.00 0.00 178.16 178.61 3l6r h GLN 219 N 0.15 1.00 -0.17 1.82 1.08 -1.09 -2.01 115.11 115.89 3l6r h GLN 219 Ca 0.09 -0.31 0.01 0.00 -1.45 0.00 0.00 58.65 57.00 3l6r h GLN 219 Cb 0.07 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.39 3l6r h GLN 219 CO -0.11 0.98 0.08 0.77 -0.95 0.00 0.00 178.83 179.60 3l6r h SER 220 N 0.92 0.12 -0.88 1.46 0.02 -0.56 -1.18 113.55 113.45 3l6r h SER 220 Ca 0.17 0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.17 3l6r h SER 220 Cb 0.54 -0.01 -0.06 0.00 0.14 0.00 0.00 62.40 63.01 3l6r h SER 220 CO 0.03 0.09 0.56 0.11 -1.14 0.00 0.00 176.83 176.49 3l6r h LYS 221 N 0.18 1.04 -0.53 3.45 1.79 -1.19 0.78 116.57 122.09 3l6r h LYS 221 Ca 0.07 -0.06 -0.04 0.00 -2.18 0.00 0.00 60.65 58.44 3l6r h LYS 221 Cb 0.02 -0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 30.41 3l6r h LYS 221 CO -0.05 0.69 0.18 1.25 -1.08 0.00 0.00 179.45 180.44 3l6r h LEU 222 N 1.07 0.75 0.00 2.94 5.85 -1.06 -3.13 115.31 121.72 3l6r h LEU 222 Ca 0.36 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3l6r h LEU 222 Cb 0.06 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.89 3l6r h LEU 222 CO -0.14 0.74 -0.46 0.11 -0.34 0.00 0.00 178.44 178.35 3l6r h LYS 223 N 0.72 0.00 0.00 1.25 6.56 -0.96 -3.47 116.57 120.67 3l6r h LYS 223 Ca 0.17 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.76 3l6r h LYS 223 Cb 0.24 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.90 3l6r h LYS 223 CO -0.01 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.79 3l6r n GLY 224 N 1.23 0.54 3.34 3.86 0.00 0.24 -5.02 105.19 109.38 3l6r n GLY 224 Ca 0.03 -0.40 -0.12 0.00 0.00 0.00 0.00 46.02 45.54 3l6r n GLY 224 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3l6r s LYS 225 N -0.82 1.05 1.08 1.61 -2.85 -1.06 -5.02 119.74 113.73 3l6r s LYS 225 Ca 0.00 -0.54 -0.13 0.00 -1.00 0.00 0.00 55.97 54.30 3l6r s LYS 225 Cb 0.00 0.47 0.23 0.00 -2.06 0.00 0.00 37.83 36.47 3l6r s LYS 225 CO 0.00 -0.40 1.06 -1.17 0.10 0.00 0.00 175.35 174.94 3l6r s LEU 226 N -2.50 1.21 0.14 2.77 0.20 -1.26 -4.29 118.68 114.96 3l6r s LEU 226 Ca -0.00 1.32 -0.19 0.00 0.69 0.00 0.00 54.13 55.95 3l6r s LEU 226 Cb 0.01 -3.37 0.05 0.00 -0.43 0.00 0.00 46.19 42.45 3l6r s LEU 226 CO -0.08 -3.64 0.49 -2.84 -0.29 0.00 0.00 176.35 169.98 3l6r s PRO 228 N -4.74 1.17 0.15 0.98 0.02 -1.26 -5.02 135.00 126.30 3l6r s PRO 228 Ca 0.67 -0.63 -0.31 0.00 0.02 0.00 0.00 61.00 60.74 3l6r s PRO 228 Cb -0.21 0.52 -0.10 0.00 0.02 0.00 0.00 34.50 34.73 3l6r s PRO 228 CO 0.61 -0.48 1.60 -0.80 -0.33 0.00 0.00 177.00 177.59 3l6r s ASN 229 N -2.79 6.57 -0.00 2.53 0.01 -1.26 -4.91 114.94 115.08 3l6r s ASN 229 Ca 0.03 2.62 -0.22 0.00 -0.71 0.00 0.00 52.86 54.58 3l6r s ASN 229 Cb 0.01 -2.59 -0.19 0.00 0.41 0.00 0.00 41.25 38.88 3l6r s ASN 229 CO -0.12 -0.85 1.18 -0.07 -1.51 0.00 0.00 177.10 175.73 3l6r h LEU 230 N 7.11 0.35 -9.65 0.60 3.38 -2.02 -3.44 115.31 111.63 3l6r h LEU 230 Ca -0.43 -0.64 -0.61 0.00 0.09 0.00 0.00 57.88 56.29 3l6r h LEU 230 Cb 1.20 -0.10 -0.09 0.00 0.09 0.00 0.00 40.66 41.76 3l6r h LEU 230 CO 0.92 0.93 -0.60 -0.31 0.09 0.00 0.00 178.44 179.47 3l6r s TYR 231 N -3.67 3.11 0.13 1.13 1.51 -1.26 -5.06 117.35 113.24 3l6r s TYR 231 Ca -0.15 -0.00 -0.31 0.00 -1.01 0.00 0.00 57.07 55.60 3l6r s TYR 231 Cb 0.03 -1.54 -0.11 0.00 -0.11 0.00 0.00 41.96 40.24 3l6r s TYR 231 CO 0.76 0.51 1.84 -2.30 -1.11 0.00 0.00 175.55 175.26 3l6r n PRO 232 N 0.08 2.83 -1.74 -1.71 -0.02 -1.26 -4.92 135.00 128.26 3l6r n PRO 232 Ca -0.09 1.03 -0.39 0.00 -2.02 0.00 0.00 63.50 62.03 3l6r n PRO 232 Cb 0.53 -2.93 0.03 0.00 -0.02 0.00 0.00 33.50 31.12 3l6r n PRO 232 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3l6r n PRO 233 N 5.59 1.83 -3.74 0.52 -0.02 -1.26 -5.00 135.00 132.92 3l6r n PRO 233 Ca 0.18 0.67 -0.38 0.00 -2.02 0.00 0.00 63.50 61.95 3l6r n PRO 233 Cb 0.38 -2.56 -0.12 0.00 -0.02 0.00 0.00 33.50 31.17 3l6r n PRO 233 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3l6r s GLU 234 N -2.72 2.81 -0.05 -0.52 0.41 -1.26 -5.04 118.70 112.33 3l6r s GLU 234 Ca 0.68 -1.05 -0.26 0.00 -0.41 0.00 0.00 54.97 53.93 3l6r s GLU 234 Cb -0.43 -3.45 0.06 0.00 -1.78 0.00 0.00 34.13 28.52 3l6r s GLU 234 CO 0.52 -0.59 0.58 -0.08 -0.49 0.00 0.00 175.26 175.20 3l6r s THR 235 N 1.45 0.02 0.26 3.63 -1.32 -1.26 -4.84 115.64 113.58 3l6r s THR 235 Ca 0.00 -0.13 0.31 0.00 -1.21 0.00 0.00 61.69 60.66 3l6r s THR 235 Cb -0.19 -0.89 0.33 0.00 -1.51 0.00 0.00 72.50 70.25 3l6r s THR 235 CO 0.03 -0.07 2.01 -0.29 -2.21 0.00 0.00 174.62 174.09 3l6r h ILE 236 N 3.30 0.30 -0.60 5.08 2.10 -1.98 -3.36 117.51 122.36 3l6r h ILE 236 Ca -0.28 -0.62 -0.71 0.00 1.08 0.00 0.00 64.86 64.33 3l6r h ILE 236 Cb 1.15 1.47 -0.08 0.00 -1.09 0.00 0.00 36.82 38.27 3l6r h ILE 236 CO 0.38 0.09 2.61 0.00 -1.08 0.00 0.00 178.15 180.14 3l6r n ALA 237 N -2.18 4.97 0.29 0.18 0.00 -1.26 -4.49 120.51 118.02 3l6r n ALA 237 Ca -0.01 -3.98 0.16 0.00 0.00 0.00 0.00 53.44 49.61 3l6r n ALA 237 Cb 0.29 -3.42 0.78 0.00 0.00 0.00 0.00 19.45 17.11 3l6r n ALA 237 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 3l6r h ASP 238 N 6.37 0.00 -0.00 0.00 2.03 -1.93 -2.67 116.42 120.21 3l6r h ASP 238 Ca 0.49 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.79 3l6r h ASP 238 Cb 0.70 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.20 3l6r h ASP 238 CO 1.70 0.00 -0.03 0.61 -1.03 0.00 0.00 179.24 180.49 3l6r n GLY 239 N -0.68 0.25 2.08 7.15 0.00 -1.26 -4.16 105.19 108.57 3l6r n GLY 239 Ca -0.01 -0.52 -0.08 0.00 0.00 0.00 0.00 46.02 45.41 3l6r n GLY 239 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3l6r n VAL 240 N 0.45 1.74 0.18 1.61 0.24 -1.01 -4.77 118.33 116.77 3l6r n VAL 240 Ca 0.17 -3.26 0.11 0.00 -2.04 0.00 0.00 64.34 59.32 3l6r n VAL 240 Cb 0.43 0.11 0.11 0.00 -1.47 0.00 0.00 33.84 33.02 3l6r n VAL 240 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 3l6r h LYS 241 N 2.06 0.00 -7.03 7.34 1.57 -1.73 -3.42 116.57 115.35 3l6r h LYS 241 Ca 0.07 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.31 3l6r h LYS 241 Cb 1.42 0.00 0.11 0.00 0.08 0.00 0.00 32.23 33.84 3l6r h LYS 241 CO 0.38 0.04 0.57 -1.12 -0.57 0.00 0.00 179.45 178.76 3l6r s SER 242 N -5.98 5.62 0.53 0.86 0.01 -1.26 -4.66 113.70 108.81 3l6r s SER 242 Ca 0.04 2.62 -0.16 0.00 1.31 0.00 0.00 55.95 59.77 3l6r s SER 242 Cb 0.07 -2.63 -0.07 0.00 0.21 0.00 0.00 66.02 63.60 3l6r s SER 242 CO 0.71 -1.32 0.99 -0.44 0.41 0.00 0.00 173.24 173.59 3l6r s SER 243 N -1.06 6.58 0.80 2.44 0.01 -1.26 -4.00 113.70 117.20 3l6r s SER 243 Ca 0.68 1.55 -0.13 0.00 1.31 0.00 0.00 55.95 59.36 3l6r s SER 243 Cb -0.37 -2.50 0.08 0.00 0.21 0.00 0.00 66.02 63.44 3l6r s SER 243 CO 0.44 -0.62 1.20 0.27 0.41 0.00 0.00 173.24 174.93 3l6r s ILE 244 N -2.69 2.16 0.33 1.44 -4.36 -1.23 -4.30 121.20 112.55 3l6r s ILE 244 Ca 0.58 0.07 0.00 0.00 -0.26 0.00 0.00 60.65 61.04 3l6r s ILE 244 Cb -0.10 -2.48 -0.00 0.00 1.25 0.00 0.00 42.46 41.13 3l6r s ILE 244 CO 0.34 -0.05 0.00 0.61 0.24 0.00 0.00 174.94 176.08 3l6r n GLY 245 N 0.38 3.77 0.21 6.27 0.00 -1.24 -4.90 105.19 109.68 3l6r n GLY 245 Ca 0.13 -2.31 0.07 0.00 0.00 0.00 0.00 46.02 43.91 3l6r n GLY 245 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3l6r h LEU 246 N 0.00 0.00 0.04 0.99 3.38 -1.96 -1.29 115.31 116.48 3l6r h LEU 246 Ca -0.28 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.40 3l6r h LEU 246 Cb 0.84 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.55 3l6r h LEU 246 CO 0.46 0.30 -1.66 0.78 0.09 0.00 0.00 178.44 178.42 3l6r h ASN 247 N 0.00 0.14 0.70 -0.43 2.35 -1.95 -3.39 115.58 113.00 3l6r h ASN 247 Ca -0.00 -0.26 -0.24 0.00 -0.55 0.00 0.00 56.30 55.26 3l6r h ASN 247 Cb 0.73 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 39.02 3l6r h ASN 247 CO 0.04 1.22 -1.42 0.71 -1.65 0.00 0.00 177.43 176.33 3l6r h THR 248 N 0.02 0.94 -0.22 2.81 1.35 -1.85 -3.39 112.91 112.57 3l6r h THR 248 Ca -0.27 -2.65 0.04 0.00 -0.55 0.00 0.00 66.41 62.98 3l6r h THR 248 Cb 1.99 2.41 -0.04 0.00 -1.73 0.00 0.00 68.15 70.78 3l6r h THR 248 CO 0.10 0.53 -0.06 -0.25 -0.25 0.00 0.00 175.52 175.60 3l6r h TRP 249 N 0.00 -0.12 -0.94 4.73 2.91 -1.43 -1.65 115.95 119.45 3l6r h TRP 249 Ca -0.19 0.02 0.03 0.00 1.13 0.00 0.00 58.89 59.88 3l6r h TRP 249 Cb 1.83 0.09 -0.05 0.00 -0.51 0.00 0.00 29.16 30.51 3l6r h TRP 249 CO 0.00 -0.10 0.62 -1.35 -1.03 0.00 0.00 178.44 176.58 3l6r h PRO 250 N -0.00 1.18 -0.50 2.65 0.11 -1.78 0.17 132.00 133.82 3l6r h PRO 250 Ca 0.11 -0.07 0.01 0.00 0.11 0.00 0.00 66.00 66.15 3l6r h PRO 250 Cb 0.16 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 30.98 3l6r h PRO 250 CO -0.23 0.78 0.33 0.82 -0.21 0.00 0.00 178.00 179.49 3l6r h ILE 251 N 1.21 1.12 -0.49 4.15 2.04 -1.68 -2.57 117.51 121.29 3l6r h ILE 251 Ca 0.37 -0.23 -0.05 0.00 1.00 0.00 0.00 64.86 65.95 3l6r h ILE 251 Cb -0.03 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 3l6r h ILE 251 CO -0.11 0.12 0.10 0.40 0.00 0.00 0.00 178.15 178.66 3l6r h ILE 252 N 0.67 1.24 -0.51 -0.67 2.04 -0.37 -1.05 117.51 118.85 3l6r h ILE 252 Ca 0.18 -0.89 0.09 0.00 1.00 0.00 0.00 64.86 65.25 3l6r h ILE 252 Cb -0.07 0.87 -0.08 0.00 -0.74 0.00 0.00 36.82 36.80 3l6r h ILE 252 CO -0.04 0.32 0.07 -0.09 0.00 0.00 0.00 178.15 178.40 3l6r h ARG 253 N 0.69 0.19 0.00 2.37 2.43 -0.59 -2.88 114.38 116.58 3l6r h ARG 253 Ca 0.15 -0.01 -0.21 0.00 -0.81 0.00 0.00 59.98 59.11 3l6r h ARG 253 Cb 0.36 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.83 3l6r h ARG 253 CO 0.01 0.13 -1.68 -0.25 -1.51 0.00 0.00 179.97 176.66 3l6r n ASP 254 N -5.16 0.63 -0.00 -3.80 8.00 -0.98 -4.60 116.55 110.64 3l6r n ASP 254 Ca 0.06 0.28 0.02 0.00 0.71 0.00 0.00 54.79 55.86 3l6r n ASP 254 Cb 0.27 0.45 -0.02 0.00 -0.02 0.00 0.00 41.12 41.79 3l6r n ASP 254 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3l6r n LEU 255 N -2.83 0.11 -4.80 0.64 4.77 -0.41 -4.99 117.00 109.48 3l6r n LEU 255 Ca -0.14 -0.34 -0.38 0.00 -0.03 0.00 0.00 56.01 55.12 3l6r n LEU 255 Cb 0.90 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.93 3l6r n LEU 255 CO 0.44 0.03 0.07 -0.69 -1.33 0.00 0.00 177.39 175.91 3l6r s VAL 256 N -1.63 5.13 0.06 4.08 1.01 -1.09 -4.77 120.40 123.19 3l6r s VAL 256 Ca 0.00 0.76 -0.13 0.00 0.00 0.00 0.00 61.98 62.62 3l6r s VAL 256 Cb 0.03 -3.69 -0.28 0.00 0.00 0.00 0.00 36.38 32.43 3l6r s VAL 256 CO 0.15 0.51 1.12 0.44 0.00 0.00 0.00 175.10 177.32 3l6r h ASP 257 N 5.36 0.82 -5.04 3.32 3.32 -1.51 -3.47 116.42 119.22 3l6r h ASP 257 Ca -0.49 -0.76 0.15 0.00 0.02 0.00 0.00 57.03 55.96 3l6r h ASP 257 Cb 1.21 -0.26 -0.11 0.00 0.22 0.00 0.00 39.33 40.38 3l6r h ASP 257 CO 0.66 1.57 0.50 -0.62 -1.72 0.00 0.00 179.24 179.63 3l6r s ASP 258 N -7.39 -0.26 -0.05 6.45 -1.08 -1.25 -5.05 116.67 108.04 3l6r s ASP 258 Ca -0.09 -0.22 0.01 0.00 -0.52 0.00 0.00 52.55 51.74 3l6r s ASP 258 Cb 0.06 0.43 0.02 0.00 -1.46 0.00 0.00 42.92 41.97 3l6r s ASP 258 CO 0.93 -0.76 -0.07 -0.63 0.52 0.00 0.00 175.17 175.16 3l6r s ILE 259 N -3.18 0.74 -0.15 4.11 1.01 -1.26 -1.57 121.20 120.89 3l6r s ILE 259 Ca 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.50 3l6r s ILE 259 Cb -0.01 -0.73 -0.01 0.00 0.01 0.00 0.00 42.46 41.72 3l6r s ILE 259 CO -0.03 0.27 -0.12 -0.36 0.00 0.00 0.00 174.94 174.70 3l6r s PHE 260 N 0.89 2.83 0.02 3.97 0.08 -0.10 -4.96 117.98 120.70 3l6r s PHE 260 Ca -0.11 -0.79 -0.04 0.00 0.12 0.00 0.00 56.93 56.10 3l6r s PHE 260 Cb -0.15 -1.89 -0.04 0.00 -0.57 0.00 0.00 43.02 40.37 3l6r s PHE 260 CO 0.01 -0.33 0.24 0.95 -0.10 0.00 0.00 175.22 175.99 3l6r s THR 261 N 0.63 5.35 -0.02 0.64 -4.23 -1.26 -1.02 115.64 115.73 3l6r s THR 261 Ca -0.07 -0.01 0.02 0.00 -1.18 0.00 0.00 61.69 60.45 3l6r s THR 261 Cb -0.15 -3.57 0.00 0.00 1.34 0.00 0.00 72.50 70.12 3l6r s THR 261 CO 0.03 0.30 -0.06 0.68 -0.54 0.00 0.00 174.62 175.03 3l6r s VAL 262 N -1.36 0.54 0.77 2.29 -7.23 -0.22 -4.84 120.40 110.36 3l6r s VAL 262 Ca 0.29 -0.25 -0.11 0.00 -1.81 0.00 0.00 61.98 60.11 3l6r s VAL 262 Cb -0.13 -0.49 0.05 0.00 0.56 0.00 0.00 36.38 36.38 3l6r s VAL 262 CO 0.19 0.17 1.08 0.42 -0.31 0.00 0.00 175.10 176.66 3l6r s THR 263 N 0.14 3.37 0.26 5.32 -4.23 -1.26 -1.03 115.64 118.21 3l6r s THR 263 Ca -0.02 0.44 -0.02 0.00 -1.18 0.00 0.00 61.69 60.92 3l6r s THR 263 Cb -0.06 -3.13 0.24 0.00 1.34 0.00 0.00 72.50 70.89 3l6r s THR 263 CO -0.00 -0.58 1.80 -0.33 -0.54 0.00 0.00 174.62 174.97 3l6r h GLU 264 N -1.03 0.78 -0.63 3.99 4.39 -1.99 -1.00 114.58 119.09 3l6r h GLU 264 Ca -0.46 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.18 3l6r h GLU 264 Cb 1.25 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 29.69 3l6r h GLU 264 CO 0.57 0.51 0.33 0.22 -1.16 0.00 0.00 179.01 179.48 3l6r h ASP 265 N 0.80 0.81 -0.62 1.42 3.58 -1.99 -1.45 116.42 118.97 3l6r h ASP 265 Ca 0.44 -0.11 -0.05 0.00 0.42 0.00 0.00 57.03 57.73 3l6r h ASP 265 Cb 0.48 -0.21 -0.03 0.00 1.72 0.00 0.00 39.33 41.29 3l6r h ASP 265 CO -0.28 0.69 0.19 -0.33 -2.88 0.00 0.00 179.24 176.63 3l6r h GLU 266 N 0.87 1.00 -0.31 0.28 5.08 -1.60 -0.73 114.58 119.16 3l6r h GLU 266 Ca 0.22 -0.21 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 3l6r h GLU 266 Cb 0.07 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 3l6r h GLU 266 CO -0.03 0.87 0.02 0.82 -1.00 0.00 0.00 179.01 179.68 3l6r h ILE 267 N 0.96 1.25 -0.39 3.13 2.04 -0.89 -0.90 117.51 122.72 3l6r h ILE 267 Ca 0.21 -0.91 -0.03 0.00 1.00 0.00 0.00 64.86 65.13 3l6r h ILE 267 Cb 0.29 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.58 3l6r h ILE 267 CO -0.01 0.30 0.12 0.11 0.00 0.00 0.00 178.15 178.67 3l6r h LYS 268 N 0.35 0.60 -0.61 2.37 1.57 -0.99 -1.79 116.57 118.07 3l6r h LYS 268 Ca 0.09 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3l6r h LYS 268 Cb 0.41 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.61 3l6r h LYS 268 CO 0.01 0.61 0.32 0.00 -0.57 0.00 0.00 179.45 179.82 3l6r h ALA 270 N 1.14 0.75 -0.05 0.00 0.00 -1.06 -1.85 119.26 118.19 3l6r h ALA 270 Ca 0.21 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 3l6r h ALA 270 Cb 0.07 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3l6r h ALA 270 CO -0.03 0.66 0.02 1.15 0.00 0.00 0.00 179.25 181.04 3l6r h THR 271 N 0.66 1.14 -0.82 0.00 2.02 -1.21 -2.28 112.91 112.42 3l6r h THR 271 Ca 0.07 -0.41 0.04 0.00 0.77 0.00 0.00 66.41 66.88 3l6r h THR 271 Cb 0.87 1.32 -0.05 0.00 -1.74 0.00 0.00 68.15 68.56 3l6r h THR 271 CO 0.08 0.11 0.54 -0.61 0.37 0.00 0.00 175.52 176.01 3l6r h GLN 272 N -0.08 0.97 -0.45 6.66 4.15 -1.31 -1.85 115.11 123.19 3l6r h GLN 272 Ca 0.02 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.36 3l6r h GLN 272 Cb 0.17 -0.22 -0.02 0.00 0.21 0.00 0.00 27.48 27.62 3l6r h GLN 272 CO -0.00 0.64 0.21 1.25 -1.93 0.00 0.00 178.83 179.00 3l6r h LEU 273 N 1.00 0.60 -0.68 -2.39 5.85 -1.09 -0.97 115.31 117.63 3l6r h LEU 273 Ca 0.33 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 3l6r h LEU 273 Cb 0.06 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 3l6r h LEU 273 CO -0.10 0.57 0.33 0.58 -0.34 0.00 0.00 178.44 179.48 3l6r h VAL 274 N 0.59 1.23 0.06 1.05 2.07 -1.03 0.62 116.25 120.84 3l6r h VAL 274 Ca 0.15 -0.65 -0.00 0.00 0.82 0.00 0.00 66.70 67.03 3l6r h VAL 274 Cb 0.14 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 3l6r h VAL 274 CO -0.02 0.27 -0.03 -0.50 0.02 0.00 0.00 177.57 177.31 3l6r h TRP 275 N 0.95 -0.08 -0.16 1.57 6.55 -1.08 -2.40 115.95 121.31 3l6r h TRP 275 Ca 0.23 -0.00 -0.19 0.00 0.95 0.00 0.00 58.89 59.88 3l6r h TRP 275 Cb 0.12 0.03 0.00 0.00 -0.86 0.00 0.00 29.16 28.45 3l6r h TRP 275 CO 0.01 -0.01 -0.68 0.93 -1.05 0.00 0.00 178.44 177.63 3l6r h GLU 276 N -0.12 0.63 -0.60 0.49 5.08 -1.00 -2.62 114.58 116.45 3l6r h GLU 276 Ca -0.01 -0.47 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 3l6r h GLU 276 Cb 0.10 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3l6r h GLU 276 CO 0.01 1.09 0.00 0.54 -1.00 0.00 0.00 179.01 179.66 3l6r n ARG 277 N -3.92 4.46 0.00 2.33 5.12 0.19 -5.04 116.66 119.80 3l6r n ARG 277 Ca -0.05 -3.07 0.00 0.00 -1.93 0.00 0.00 57.85 52.80 3l6r n ARG 277 Cb 0.69 -2.13 0.00 0.00 -1.16 0.00 0.00 32.46 29.86 3l6r n ARG 277 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 3l6r n LYS 279 N 0.78 0.00 -3.94 5.56 4.76 -0.91 -5.04 118.16 119.37 3l6r n LYS 279 Ca 0.27 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.36 3l6r n LYS 279 Cb 1.09 0.00 -0.14 0.00 -1.84 0.00 0.00 35.03 34.13 3l6r n LYS 279 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3l6r s LEU 280 N 0.00 2.81 -1.35 -0.35 1.43 -1.23 -5.01 118.68 114.99 3l6r s LEU 280 Ca 0.00 -0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 52.51 3l6r s LEU 280 Cb 0.00 -1.70 0.11 0.00 0.03 0.00 0.00 46.19 44.63 3l6r s LEU 280 CO 0.00 -0.03 1.99 -0.11 0.23 0.00 0.00 176.35 178.43 3l6r n LEU 281 N 4.76 6.55 -4.79 1.79 7.94 -1.26 -3.98 117.00 128.02 3l6r n LEU 281 Ca -0.18 -4.39 -0.35 0.00 -1.11 0.00 0.00 56.01 49.98 3l6r n LEU 281 Cb 0.50 -1.58 -0.02 0.00 0.53 0.00 0.00 43.42 42.86 3l6r n LEU 281 CO 0.28 1.16 0.75 0.27 -1.11 0.00 0.00 177.39 178.74 3l6r s ILE 282 N 1.83 3.54 0.59 1.96 -4.36 -1.26 -4.39 121.20 119.11 3l6r s ILE 282 Ca 0.44 0.98 -0.09 0.00 -0.26 0.00 0.00 60.65 61.72 3l6r s ILE 282 Cb 0.10 -3.41 -0.03 0.00 1.25 0.00 0.00 42.46 40.38 3l6r s ILE 282 CO -0.03 -0.18 0.96 -1.83 0.24 0.00 0.00 174.94 174.09 3l6r s GLU 283 N -3.17 3.42 0.44 0.37 -1.05 -0.22 -4.86 118.70 113.62 3l6r s GLU 283 Ca 0.68 0.48 0.09 0.00 -0.15 0.00 0.00 54.97 56.08 3l6r s GLU 283 Cb -0.20 -2.18 0.96 0.00 -0.44 0.00 0.00 34.13 32.27 3l6r s GLU 283 CO 0.23 -0.54 2.07 -1.35 0.95 0.00 0.00 175.26 176.63 3l6r h PRO 284 N -0.19 0.42 -0.98 -4.83 0.11 -1.89 -1.16 132.00 123.46 3l6r h PRO 284 Ca -0.45 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 65.73 3l6r h PRO 284 Cb 1.21 -0.09 -0.07 0.00 0.11 0.00 0.00 31.00 32.15 3l6r h PRO 284 CO 0.62 0.27 0.63 1.15 -0.21 0.00 0.00 178.00 180.46 3l6r h THR 285 N 0.43 1.00 0.00 -1.15 2.02 -1.88 0.09 112.91 113.42 3l6r h THR 285 Ca 0.13 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.95 3l6r h THR 285 Cb -0.01 -0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.25 3l6r h THR 285 CO -0.03 0.19 0.00 0.00 0.37 0.00 0.00 175.52 176.05 3l6r h ALA 286 N 1.51 1.00 0.00 6.16 0.00 -1.47 -2.49 119.26 123.96 3l6r h ALA 286 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.37 3l6r h ALA 286 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3l6r h ALA 286 CO -0.21 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.45 3l6r n GLY 287 N 0.20 -1.19 0.15 0.00 0.00 0.01 -3.75 105.19 100.61 3l6r n GLY 287 Ca 0.02 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 3l6r n GLY 287 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3l6r h VAL 288 N 0.00 1.30 -0.14 1.61 2.07 -1.40 -1.40 116.25 118.30 3l6r h VAL 288 Ca 0.00 -1.12 -0.09 0.00 0.82 0.00 0.00 66.70 66.31 3l6r h VAL 288 Cb 0.25 1.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 3l6r h VAL 288 CO 0.00 0.34 -0.31 1.23 0.02 0.00 0.00 177.57 178.85 3l6r h GLY 289 N 0.12 0.29 0.73 2.17 0.00 -1.78 -1.70 103.07 102.91 3l6r h GLY 289 Ca 0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 47.10 3l6r h GLY 289 CO 0.03 0.22 -0.05 -2.08 0.00 0.00 0.00 176.54 174.66 3l6r h VAL 290 N 0.24 1.30 -0.97 4.60 2.07 -1.71 -2.81 116.25 118.97 3l6r h VAL 290 Ca 0.03 -1.04 0.12 0.00 0.82 0.00 0.00 66.70 66.63 3l6r h VAL 290 Cb 0.67 1.73 -0.08 0.00 -1.52 0.00 0.00 31.29 32.08 3l6r h VAL 290 CO 0.05 0.30 0.60 0.00 0.02 0.00 0.00 177.57 178.54 3l6r h ALA 291 N 0.68 1.45 -0.50 1.67 0.00 -1.10 -1.93 119.26 119.52 3l6r h ALA 291 Ca 0.03 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.98 3l6r h ALA 291 Cb 0.49 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3l6r h ALA 291 CO 0.02 0.19 0.32 0.00 0.00 0.00 0.00 179.25 179.78 3l6r h ALA 292 N 1.52 0.63 0.00 0.00 0.00 -1.11 -1.71 119.26 118.60 3l6r h ALA 292 Ca 0.48 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.28 3l6r h ALA 292 Cb 0.47 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3l6r h ALA 292 CO -0.27 0.04 -0.42 0.28 0.00 0.00 0.00 179.25 178.89 3l6r h VAL 293 N 0.64 1.07 -0.00 0.00 2.07 -1.20 -2.45 116.25 116.37 3l6r h VAL 293 Ca 0.19 -1.56 0.00 0.00 0.82 0.00 0.00 66.70 66.15 3l6r h VAL 293 Cb -0.04 1.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 3l6r h VAL 293 CO -0.06 0.41 -0.05 0.18 0.02 0.00 0.00 177.57 178.07 3l6r n LEU 294 N -3.70 0.06 -4.84 2.57 4.77 -0.77 -4.84 117.00 110.25 3l6r n LEU 294 Ca -0.01 0.40 -0.31 0.00 -0.03 0.00 0.00 56.01 56.06 3l6r n LEU 294 Cb 0.50 -0.43 0.03 0.00 -2.33 0.00 0.00 43.42 41.19 3l6r n LEU 294 CO 0.38 0.01 0.71 -0.94 -1.33 0.00 0.00 177.39 176.23 3l6r s SER 295 N -2.90 5.73 0.13 -1.43 1.04 -0.70 -4.97 113.70 110.61 3l6r s SER 295 Ca 0.17 1.55 -0.18 0.00 0.48 0.00 0.00 55.95 57.96 3l6r s SER 295 Cb 0.19 -2.49 -0.03 0.00 0.10 0.00 0.00 66.02 63.79 3l6r s SER 295 CO 0.53 -1.20 1.79 1.56 0.98 0.00 0.00 173.24 176.89 3l6r h GLN 296 N -0.51 0.35 -0.63 4.02 1.08 -1.91 -2.89 115.11 114.62 3l6r h GLN 296 Ca -0.44 -0.02 0.06 0.00 -1.45 0.00 0.00 58.65 56.80 3l6r h GLN 296 Cb 1.20 -0.08 -0.04 0.00 -0.05 0.00 0.00 27.48 28.52 3l6r h GLN 296 CO 0.59 0.23 0.42 1.25 -0.95 0.00 0.00 178.83 180.37 3l6r h HIS 297 N 0.36 0.65 0.00 2.96 2.76 -1.93 -1.59 115.15 118.36 3l6r h HIS 297 Ca 0.10 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.29 3l6r h HIS 297 Cb -0.03 -0.21 -0.00 0.00 1.55 0.00 0.00 27.41 28.72 3l6r h HIS 297 CO -0.06 0.35 -0.01 0.35 -1.30 0.00 0.00 177.93 177.26 3l6r h PHE 298 N 0.65 0.00 0.00 5.26 3.57 -1.72 -1.01 116.94 123.68 3l6r h PHE 298 Ca 0.27 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.77 3l6r h PHE 298 Cb 0.23 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.97 3l6r h PHE 298 CO -0.00 0.01 0.00 1.96 -2.23 0.00 0.00 178.31 178.05 3l6r h GLN 299 N 0.00 0.00 -0.00 1.11 4.20 -1.35 -1.76 115.11 117.30 3l6r h GLN 299 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3l6r h GLN 299 Cb 0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.87 3l6r h GLN 299 CO 0.00 0.00 -0.02 0.25 -0.67 0.00 0.00 178.83 178.39 3l6r n THR 300 N -3.04 0.00 -2.09 -0.54 -2.24 -0.38 -4.81 114.28 101.17 3l6r n THR 300 Ca -0.02 -0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.35 3l6r n THR 300 Cb 0.15 -0.46 -0.02 0.00 -2.10 0.00 0.00 70.33 67.89 3l6r n THR 300 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3l6r s VAL 301 N -2.92 2.74 0.41 2.28 1.01 -0.67 -4.94 120.40 118.31 3l6r s VAL 301 Ca 0.17 0.70 -0.26 0.00 0.00 0.00 0.00 61.98 62.59 3l6r s VAL 301 Cb 0.19 -3.44 -0.10 0.00 0.00 0.00 0.00 36.38 33.03 3l6r s VAL 301 CO 0.52 0.15 1.21 -0.24 0.00 0.00 0.00 175.10 176.74 3l6r n SER 302 N 1.35 2.25 0.13 3.32 2.88 -1.26 -4.86 113.62 117.43 3l6r n SER 302 Ca 0.02 1.11 0.10 0.00 -1.33 0.00 0.00 58.87 58.77 3l6r n SER 302 Cb 0.41 -1.46 0.49 0.00 -0.75 0.00 0.00 64.21 62.91 3l6r n SER 302 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3l6r n PRO 303 N 0.14 0.15 0.25 -1.46 -0.04 -1.26 -0.89 135.00 131.89 3l6r n PRO 303 Ca 0.07 0.52 0.13 0.00 -0.04 0.00 0.00 63.50 64.17 3l6r n PRO 303 Cb 0.39 -1.87 0.61 0.00 -0.04 0.00 0.00 33.50 32.59 3l6r n PRO 303 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3l6r h GLU 304 N 0.00 0.00 -5.52 0.54 4.39 -2.03 -3.36 114.58 108.61 3l6r h GLU 304 Ca 0.00 0.00 -0.68 0.00 0.34 0.00 0.00 59.36 59.02 3l6r h GLU 304 Cb 0.17 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 28.69 3l6r h GLU 304 CO 0.00 0.15 1.60 0.08 -1.16 0.00 0.00 179.01 179.68 3l6r s VAL 305 N -3.85 4.39 -0.26 3.13 1.01 -0.07 -4.75 120.40 120.00 3l6r s VAL 305 Ca -0.01 -1.75 -0.06 0.00 0.00 0.00 0.00 61.98 60.16 3l6r s VAL 305 Cb 0.11 -5.03 -0.14 0.00 0.00 0.00 0.00 36.38 31.32 3l6r s VAL 305 CO 0.59 -1.82 -0.29 1.17 0.00 0.00 0.00 175.10 174.75 3l6r n LYS 306 N 7.55 0.60 -3.29 2.72 4.81 -1.26 -4.86 118.16 124.44 3l6r n LYS 306 Ca 0.38 0.20 -0.43 0.00 -0.87 0.00 0.00 58.31 57.59 3l6r n LYS 306 Cb 0.47 -1.48 -0.08 0.00 0.02 0.00 0.00 35.03 33.95 3l6r n LYS 306 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 3l6r s ASN 307 N -6.98 6.20 -0.13 3.14 0.01 -1.26 -1.24 114.94 114.69 3l6r s ASN 307 Ca -0.36 -0.73 0.02 0.00 -0.71 0.00 0.00 52.86 51.08 3l6r s ASN 307 Cb 0.12 -2.24 0.01 0.00 0.41 0.00 0.00 41.25 39.56 3l6r s ASN 307 CO 0.53 -0.64 -0.19 -0.63 -1.51 0.00 0.00 177.10 174.66 3l6r s ILE 308 N 2.20 1.83 -0.23 0.60 -1.09 -0.26 -0.26 121.20 123.99 3l6r s ILE 308 Ca 0.13 -0.84 -0.08 0.00 -2.23 0.00 0.00 60.65 57.63 3l6r s ILE 308 Cb -0.18 -1.63 -0.04 0.00 -1.58 0.00 0.00 42.46 39.03 3l6r s ILE 308 CO 0.13 0.50 0.09 0.00 -1.23 0.00 0.00 174.94 174.44 3l6r s ILE 310 N 1.23 5.32 -0.36 0.00 1.09 0.27 -0.99 121.20 127.76 3l6r s ILE 310 Ca 0.05 0.16 -0.26 0.00 -1.10 0.00 0.00 60.65 59.50 3l6r s ILE 310 Cb -0.14 -3.46 0.02 0.00 -1.06 0.00 0.00 42.46 37.81 3l6r s ILE 310 CO 0.04 0.38 0.96 -0.69 -0.10 0.00 0.00 174.94 175.53 3l6r s VAL 311 N 0.81 4.57 -0.78 2.92 1.01 -0.85 -1.79 120.40 126.29 3l6r s VAL 311 Ca 0.07 1.30 -0.21 0.00 0.00 0.00 0.00 61.98 63.14 3l6r s VAL 311 Cb -0.13 -4.35 0.10 0.00 0.00 0.00 0.00 36.38 32.00 3l6r s VAL 311 CO 0.02 -0.53 1.04 -0.76 0.00 0.00 0.00 175.10 174.87 3l6r s LEU 312 N 3.52 4.67 0.33 3.92 1.43 -0.46 -4.72 118.68 127.37 3l6r s LEU 312 Ca 0.40 -1.46 0.17 0.00 -1.03 0.00 0.00 54.13 52.21 3l6r s LEU 312 Cb -0.12 -2.41 0.47 0.00 0.03 0.00 0.00 46.19 44.16 3l6r s LEU 312 CO 0.18 -1.28 1.63 0.77 0.23 0.00 0.00 176.35 177.89 3l6r h SER 313 N 9.26 0.00 -4.66 2.29 4.64 -1.83 -1.69 113.55 121.56 3l6r h SER 313 Ca -0.09 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.33 3l6r h SER 313 Cb 1.05 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.99 3l6r h SER 313 CO 1.16 0.45 0.46 -0.83 -0.87 0.00 0.00 176.83 177.20 3l6r s GLY 314 N -4.40 -0.48 -0.09 -0.77 0.00 -1.26 -2.40 107.32 97.91 3l6r s GLY 314 Ca 0.01 1.00 0.14 0.00 0.00 0.00 0.00 44.72 45.87 3l6r s GLY 314 CO 0.71 0.35 1.14 0.61 0.00 0.00 0.00 173.10 175.90 3l6r n GLY 315 N -0.21 3.11 3.49 0.20 0.00 0.08 -1.06 105.19 110.80 3l6r n GLY 315 Ca -0.10 -0.85 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 3l6r n GLY 315 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3l6r s ASN 316 N -2.34 6.83 0.03 1.61 0.01 -1.26 -4.58 114.94 115.23 3l6r s ASN 316 Ca 0.26 -2.42 0.07 0.00 -0.71 0.00 0.00 52.86 50.06 3l6r s ASN 316 Cb 0.26 -2.45 -0.02 0.00 0.41 0.00 0.00 41.25 39.44 3l6r s ASN 316 CO -0.04 -1.01 -0.20 0.54 -1.51 0.00 0.00 177.10 174.87 3l6r s VAL 317 N 2.80 1.63 -0.56 1.60 0.11 -1.26 -4.82 120.40 119.90 3l6r s VAL 317 Ca 0.42 -1.10 -0.28 0.00 -2.93 0.00 0.00 61.98 58.10 3l6r s VAL 317 Cb -0.02 -1.40 0.03 0.00 -1.53 0.00 0.00 36.38 33.46 3l6r s VAL 317 CO -0.03 0.27 1.15 -1.81 -3.33 0.00 0.00 175.10 171.35 3l6r s ASP 318 N -0.98 6.46 0.22 3.54 1.01 -1.26 -4.93 116.67 120.72 3l6r s ASP 318 Ca 0.07 0.10 -0.08 0.00 0.71 0.00 0.00 52.55 53.35 3l6r s ASP 318 Cb -0.08 -2.54 0.32 0.00 1.01 0.00 0.00 42.92 41.63 3l6r s ASP 318 CO 0.01 -1.41 1.74 -0.07 0.21 0.00 0.00 175.17 175.65 3l6r h LEU 319 N 11.69 0.25 -0.61 1.23 3.38 -2.00 -2.56 115.31 126.69 3l6r h LEU 319 Ca -0.25 0.08 -0.15 0.00 0.09 0.00 0.00 57.88 57.66 3l6r h LEU 319 Cb 1.06 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 3l6r h LEU 319 CO 1.16 0.13 -0.68 0.71 0.09 0.00 0.00 178.44 179.85 3l6r h THR 320 N 0.43 1.47 -0.56 0.22 1.35 -2.02 -3.10 112.91 110.68 3l6r h THR 320 Ca 0.33 -2.28 -0.03 0.00 -0.55 0.00 0.00 66.41 63.88 3l6r h THR 320 Cb 0.43 2.22 -0.02 0.00 -1.73 0.00 0.00 68.15 69.04 3l6r h THR 320 CO -0.33 0.66 0.22 0.28 -0.25 0.00 0.00 175.52 176.10 3l6r h SER 321 N 0.05 0.78 0.05 5.36 0.02 -1.92 -3.12 113.55 114.76 3l6r h SER 321 Ca -0.01 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 60.76 3l6r h SER 321 Cb 1.21 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 63.55 3l6r h SER 321 CO 0.09 0.74 -0.04 0.28 -1.14 0.00 0.00 176.83 176.77 3l6r h SER 322 N 0.77 0.00 -0.32 3.07 0.02 -1.39 -1.51 113.55 114.20 3l6r h SER 322 Ca 0.19 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 61.23 3l6r h SER 322 Cb 0.20 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 3l6r h SER 322 CO -0.02 0.04 0.24 0.40 -1.14 0.00 0.00 176.83 176.35 3l6r h ILE 323 N 0.00 0.81 -0.66 3.27 2.04 -1.56 -1.71 117.51 119.71 3l6r h ILE 323 Ca -0.00 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.00 3l6r h ILE 323 Cb 0.07 0.83 -0.11 0.00 -0.74 0.00 0.00 36.82 36.88 3l6r h ILE 323 CO 0.00 0.00 0.04 0.74 0.00 0.00 0.00 178.15 178.94 3l6r h THR 324 N 0.00 0.48 0.00 -0.27 2.02 -1.45 -3.22 112.91 110.48 3l6r h THR 324 Ca 0.15 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.28 3l6r h THR 324 Cb 0.62 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 3l6r h THR 324 CO -0.00 0.03 -0.99 -2.67 0.37 0.00 0.00 175.52 172.25 3l6r n TRP 325 N -5.26 0.00 -1.72 3.16 4.27 -0.69 -4.97 117.44 112.23 3l6r n TRP 325 Ca 0.11 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.30 3l6r n TRP 325 Cb 0.39 -0.02 -0.03 0.00 -1.36 0.00 0.00 31.31 30.29 3l6r n TRP 325 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 3l6r s VAL 326 N -2.92 2.03 -0.23 -1.67 1.01 -0.92 -4.91 120.40 112.79 3l6r s VAL 326 Ca 0.07 0.01 -0.22 0.00 0.00 0.00 0.00 61.98 61.84 3l6r s VAL 326 Cb 0.15 -3.00 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 3l6r s VAL 326 CO 0.83 0.00 0.68 -0.75 0.00 0.00 0.00 175.10 175.86 3l6r s LYS 327 N 1.24 4.17 0.74 2.72 2.20 -1.26 -5.02 119.74 124.53 3l6r s LYS 327 Ca 0.75 0.67 -0.14 0.00 -0.36 0.00 0.00 55.97 56.90 3l6r s LYS 327 Cb -0.50 -3.62 0.05 0.00 -1.51 0.00 0.00 37.83 32.25 3l6r s LYS 327 CO 0.32 -0.36 1.15 -0.65 -0.36 0.00 0.00 175.35 175.45 3l6r s GLN 328 N 2.33 2.19 0.00 4.03 1.11 -1.26 -5.19 119.66 122.87 3l6r s GLN 328 Ca 0.29 1.53 0.16 0.00 0.01 0.00 0.00 55.36 57.35 3l6r s GLN 328 Cb -0.16 -1.86 0.94 0.00 -1.01 0.00 0.00 33.01 30.92 3l6r s GLN 328 CO 0.09 -1.75 1.35 0.00 0.01 0.00 0.00 175.29 174.99