#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r1r n LEU 6 N 0.00 -5.13 -4.68 2.23 4.77 -1.26 -4.43 117.00 108.50 2r1r n LEU 6 Ca 0.00 0.60 -0.28 0.00 -0.03 0.00 0.00 56.01 56.30 2r1r n LEU 6 Cb 0.00 -2.23 -0.08 0.00 -2.33 0.00 0.00 43.42 38.78 2r1r n LEU 6 CO 0.00 -1.54 -0.32 -0.69 -1.33 0.00 0.00 177.39 173.51 2r1r s VAL 7 N -1.17 3.87 -0.07 4.08 1.01 -0.30 0.12 120.40 127.94 2r1r s VAL 7 Ca 0.04 -1.27 0.05 0.00 0.00 0.00 0.00 61.98 60.80 2r1r s VAL 7 Cb -0.01 -2.92 -0.01 0.00 0.00 0.00 0.00 36.38 33.45 2r1r s VAL 7 CO 0.41 -0.04 -0.24 -0.89 0.00 0.00 0.00 175.10 174.34 2r1r s THR 8 N -1.60 1.97 0.00 3.92 2.01 -0.43 -1.52 115.64 119.99 2r1r s THR 8 Ca 0.27 -1.00 0.00 0.00 0.31 0.00 0.00 61.69 61.27 2r1r s THR 8 Cb -0.10 -1.68 0.00 0.00 0.01 0.00 0.00 72.50 70.72 2r1r s THR 8 CO 0.19 0.55 0.00 0.29 -0.69 0.00 0.00 174.62 174.96 2r1r n LYS 9 N 3.17 1.03 0.10 4.92 5.02 -1.01 -1.58 118.16 129.80 2r1r n LYS 9 Ca -0.18 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.12 2r1r n LYS 9 Cb 0.52 0.00 0.33 0.00 -0.02 0.00 0.00 35.03 35.87 2r1r n LYS 9 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2r1r h ARG 10 N 0.00 0.28 0.00 1.97 2.47 -2.01 0.10 114.38 117.18 2r1r h ARG 10 Ca 0.00 -0.08 0.00 0.00 -1.26 0.00 0.00 59.98 58.64 2r1r h ARG 10 Cb 0.00 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.29 2r1r h ARG 10 CO 0.00 0.47 -0.10 0.22 0.56 0.00 0.00 179.97 181.11 2r1r h ASP 11 N 0.26 0.00 -0.18 7.04 1.82 -2.06 -3.46 116.42 119.84 2r1r h ASP 11 Ca 0.05 -0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.67 2r1r h ASP 11 Cb 0.49 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.50 2r1r h ASP 11 CO 0.03 0.01 0.00 0.61 -1.61 0.00 0.00 179.24 178.28 2r1r n GLY 12 N 1.24 1.17 3.02 -0.78 0.00 0.02 -5.04 105.19 104.82 2r1r n GLY 12 Ca 0.05 -0.19 -0.26 0.00 0.00 0.00 0.00 46.02 45.62 2r1r n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2r1r s SER 13 N -2.25 2.04 0.20 1.61 0.01 -1.26 -4.81 113.70 109.24 2r1r s SER 13 Ca 0.00 -0.34 -0.32 0.00 1.31 0.00 0.00 55.95 56.60 2r1r s SER 13 Cb 0.00 -0.91 -0.12 0.00 0.21 0.00 0.00 66.02 65.20 2r1r s SER 13 CO 0.00 0.02 1.74 0.41 0.41 0.00 0.00 173.24 175.82 2r1r n THR 14 N 4.04 0.05 -4.06 1.44 -1.04 -1.26 -2.40 114.28 111.05 2r1r n THR 14 Ca -0.20 -0.01 -0.08 0.00 -2.04 0.00 0.00 64.05 61.71 2r1r n THR 14 Cb 0.51 -2.01 -0.10 0.00 -1.82 0.00 0.00 70.33 66.91 2r1r n THR 14 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 2r1r s GLU 15 N 1.39 0.53 0.52 -2.82 2.12 -0.57 -5.00 118.70 114.86 2r1r s GLU 15 Ca 0.76 -1.00 -0.18 0.00 0.36 0.00 0.00 54.97 54.91 2r1r s GLU 15 Cb -0.50 0.10 -0.07 0.00 0.26 0.00 0.00 34.13 33.92 2r1r s GLU 15 CO 0.33 -0.07 1.02 1.03 -0.54 0.00 0.00 175.26 177.03 2r1r s ARG 16 N -2.95 3.74 0.16 4.30 0.52 -1.26 -1.15 118.95 122.31 2r1r s ARG 16 Ca -0.01 1.17 -0.30 0.00 -0.52 0.00 0.00 55.73 56.06 2r1r s ARG 16 Cb 0.01 -2.10 -0.08 0.00 0.52 0.00 0.00 34.95 33.30 2r1r s ARG 16 CO -0.06 -0.46 1.28 0.42 0.02 0.00 0.00 175.30 176.51 2r1r s ILE 17 N -2.34 3.44 -0.45 1.52 1.01 -1.26 -4.80 121.20 118.33 2r1r s ILE 17 Ca 0.63 1.13 0.02 0.00 0.00 0.00 0.00 60.65 62.44 2r1r s ILE 17 Cb -0.13 -3.73 0.12 0.00 0.01 0.00 0.00 42.46 38.73 2r1r s ILE 17 CO 0.28 0.14 0.20 0.20 0.00 0.00 0.00 174.94 175.76 2r1r s ASN 18 N 0.56 4.69 0.00 3.58 0.01 -1.26 -4.25 114.94 118.27 2r1r s ASN 18 Ca 0.58 -2.58 0.08 0.00 -0.71 0.00 0.00 52.86 50.23 2r1r s ASN 18 Cb -0.35 -1.68 0.49 0.00 0.41 0.00 0.00 41.25 40.12 2r1r s ASN 18 CO 0.35 -0.34 0.92 0.18 -1.51 0.00 0.00 177.10 176.71 2r1r n LEU 19 N 3.73 0.00 0.01 0.60 4.77 -1.26 -1.94 117.00 122.91 2r1r n LEU 19 Ca 0.04 0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.13 2r1r n LEU 19 Cb 0.37 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.38 2r1r n LEU 19 CO 0.29 0.00 -0.28 0.47 -1.33 0.00 0.00 177.39 176.54 2r1r n ASP 20 N -0.95 0.52 0.10 -1.43 8.00 -1.26 -3.51 116.55 118.02 2r1r n ASP 20 Ca 0.06 -0.35 -0.13 0.00 0.71 0.00 0.00 54.79 55.08 2r1r n ASP 20 Cb 0.03 1.26 -0.08 0.00 -0.02 0.00 0.00 41.12 42.31 2r1r n ASP 20 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2r1r h LYS 21 N 0.00 -0.25 -0.34 -1.24 1.57 -1.83 -0.97 116.57 113.51 2r1r h LYS 21 Ca 0.00 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.87 2r1r h LYS 21 Cb 0.77 0.06 -0.09 0.00 0.08 0.00 0.00 32.23 33.05 2r1r h LYS 21 CO 0.00 0.05 -0.32 0.82 -0.57 0.00 0.00 179.45 179.43 2r1r h ILE 22 N -0.57 0.24 -0.53 1.86 2.04 -1.72 -1.05 117.51 117.79 2r1r h ILE 22 Ca -0.03 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.94 2r1r h ILE 22 Cb 0.42 0.24 -0.10 0.00 -0.74 0.00 0.00 36.82 36.65 2r1r h ILE 22 CO 0.04 0.00 -0.09 -0.74 0.00 0.00 0.00 178.15 177.36 2r1r h HIS 23 N -0.28 -0.20 0.01 1.37 2.76 -1.57 -1.15 115.15 116.08 2r1r h HIS 23 Ca 0.16 0.04 0.02 0.00 -2.20 0.00 0.00 60.37 58.39 2r1r h HIS 23 Cb 0.54 0.17 -0.03 0.00 1.55 0.00 0.00 27.41 29.64 2r1r h HIS 23 CO -0.51 -0.20 -0.17 0.00 -1.30 0.00 0.00 177.93 175.75 2r1r h ARG 24 N 0.03 -0.27 -0.43 5.26 3.08 -0.04 0.15 114.38 122.16 2r1r h ARG 24 Ca 0.26 0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.41 2r1r h ARG 24 Cb 0.40 0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.42 2r1r h ARG 24 CO -0.52 -0.18 -0.36 0.28 -1.07 0.00 0.00 179.97 178.12 2r1r h VAL 25 N -0.28 0.18 -0.08 2.04 2.07 -0.20 0.20 116.25 120.17 2r1r h VAL 25 Ca 0.05 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.61 2r1r h VAL 25 Cb 0.35 0.18 -0.05 0.00 -1.52 0.00 0.00 31.29 30.25 2r1r h VAL 25 CO -0.16 0.00 -0.18 -0.07 0.02 0.00 0.00 177.57 177.18 2r1r h LEU 26 N -0.26 -0.55 -0.69 2.57 3.38 -0.93 -1.71 115.31 117.11 2r1r h LEU 26 Ca 0.17 0.09 0.15 0.00 0.09 0.00 0.00 57.88 58.38 2r1r h LEU 26 Cb 0.56 0.25 -0.11 0.00 0.09 0.00 0.00 40.66 41.44 2r1r h LEU 26 CO -0.58 -0.24 0.07 -0.78 0.09 0.00 0.00 178.44 177.01 2r1r h ASP 27 N -0.25 -0.17 0.52 -0.43 3.58 0.10 -1.17 116.42 118.60 2r1r h ASP 27 Ca 0.08 0.16 -0.02 0.00 0.42 0.00 0.00 57.03 57.67 2r1r h ASP 27 Cb 0.37 0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.67 2r1r h ASP 27 CO -0.23 -0.10 -0.30 -0.25 -2.88 0.00 0.00 179.24 175.48 2r1r h TRP 28 N 0.17 -0.80 -0.99 0.28 7.01 -0.24 -3.07 115.95 118.30 2r1r h TRP 28 Ca 0.38 -0.01 0.15 0.00 2.11 0.00 0.00 58.89 61.52 2r1r h TRP 28 Cb 0.64 0.28 -0.09 0.00 -2.10 0.00 0.00 29.16 27.89 2r1r h TRP 28 CO -0.33 -0.47 0.62 0.00 -2.79 0.00 0.00 178.44 175.46 2r1r h ALA 29 N -0.34 1.63 0.00 2.65 0.00 -0.43 -0.88 119.26 121.89 2r1r h ALA 29 Ca -0.06 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2r1r h ALA 29 Cb 0.63 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2r1r h ALA 29 CO 0.07 0.07 -0.07 0.00 0.00 0.00 0.00 179.25 179.32 2r1r h ALA 30 N 1.59 1.05 -0.85 0.00 0.00 -1.21 -3.43 119.26 116.41 2r1r h ALA 30 Ca 0.53 -0.06 -0.73 0.00 0.00 0.00 0.00 54.91 54.64 2r1r h ALA 30 Cb 0.70 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.50 2r1r h ALA 30 CO -0.31 0.09 0.51 0.39 0.00 0.00 0.00 179.25 179.93 2r1r n GLU 31 N -3.25 0.00 -0.48 0.00 1.02 -0.34 -0.45 120.64 117.14 2r1r n GLU 31 Ca -0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2r1r n GLU 31 Cb 0.30 -1.27 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 2r1r n GLU 31 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2r1r n GLY 32 N 3.10 1.98 3.88 0.62 0.00 -1.26 -5.03 105.19 108.48 2r1r n GLY 32 Ca 0.25 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 2r1r n GLY 32 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r1r s LEU 33 N 0.00 4.09 -0.09 0.99 1.43 0.40 -5.09 118.68 120.41 2r1r s LEU 33 Ca 0.00 0.92 0.02 0.00 -1.03 0.00 0.00 54.13 54.04 2r1r s LEU 33 Cb 0.00 -3.71 -0.02 0.00 0.03 0.00 0.00 46.19 42.49 2r1r s LEU 33 CO 0.00 -0.15 -0.16 -1.00 0.23 0.00 0.00 176.35 175.27 2r1r s HIS 34 N -1.96 2.70 -0.12 0.29 3.76 -1.26 -4.70 115.29 114.00 2r1r s HIS 34 Ca 0.47 -0.51 0.00 0.00 -0.15 0.00 0.00 55.06 54.87 2r1r s HIS 34 Cb -0.11 -1.73 0.00 0.00 1.11 0.00 0.00 32.58 31.86 2r1r s HIS 34 CO 0.24 -0.09 0.00 0.09 -0.85 0.00 0.00 174.74 174.13 2r1r n ASN 35 N 3.02 -3.07 -4.78 1.40 4.13 -1.26 -4.53 115.26 110.18 2r1r n ASN 35 Ca -0.18 0.03 -0.34 0.00 1.68 0.00 0.00 54.58 55.77 2r1r n ASN 35 Cb 0.52 -0.74 -0.07 0.00 -1.54 0.00 0.00 39.78 37.95 2r1r n ASN 35 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 2r1r s VAL 36 N -2.04 4.78 -0.24 2.41 -7.23 -1.26 -4.89 120.40 111.93 2r1r s VAL 36 Ca 0.00 -0.22 0.01 0.00 -1.81 0.00 0.00 61.98 59.96 2r1r s VAL 36 Cb 0.00 -3.11 0.04 0.00 0.56 0.00 0.00 36.38 33.87 2r1r s VAL 36 CO 0.00 0.49 -0.12 -0.55 -0.31 0.00 0.00 175.10 174.61 2r1r s SER 37 N -1.33 4.09 0.17 4.85 0.15 -1.26 -5.00 113.70 115.36 2r1r s SER 37 Ca 0.18 -1.10 -0.15 0.00 0.70 0.00 0.00 55.95 55.58 2r1r s SER 37 Cb -0.12 -1.56 0.11 0.00 -1.71 0.00 0.00 66.02 62.75 2r1r s SER 37 CO 0.08 -0.13 1.71 0.40 1.20 0.00 0.00 173.24 176.50 2r1r h ILE 38 N 6.42 0.74 -0.41 6.45 1.08 -1.98 -2.24 117.51 127.56 2r1r h ILE 38 Ca -0.29 -0.05 0.08 0.00 -0.39 0.00 0.00 64.86 64.21 2r1r h ILE 38 Cb 1.08 0.57 -0.09 0.00 -3.07 0.00 0.00 36.82 35.31 2r1r h ILE 38 CO 0.53 0.03 -0.39 0.28 -0.69 0.00 0.00 178.15 177.91 2r1r h SER 39 N 0.15 -1.30 -0.74 1.72 0.02 -1.99 0.20 113.55 111.62 2r1r h SER 39 Ca 0.20 0.21 0.14 0.00 -0.84 0.00 0.00 61.79 61.50 2r1r h SER 39 Cb 0.26 0.58 -0.14 0.00 0.14 0.00 0.00 62.40 63.25 2r1r h SER 39 CO -0.30 -0.35 -0.24 1.56 -1.14 0.00 0.00 176.83 176.36 2r1r h GLN 40 N -0.29 -0.04 -0.27 3.45 1.08 -1.84 0.28 115.11 117.47 2r1r h GLN 40 Ca 0.16 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.35 2r1r h GLN 40 Cb 0.57 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.00 2r1r h GLN 40 CO -0.57 -0.03 0.14 0.28 -0.95 0.00 0.00 178.83 177.70 2r1r h VAL 41 N -0.04 1.13 -0.17 -0.54 2.07 -1.06 -2.39 116.25 115.25 2r1r h VAL 41 Ca 0.33 -0.37 0.02 0.00 0.82 0.00 0.00 66.70 67.51 2r1r h VAL 41 Cb 0.56 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2r1r h VAL 41 CO -0.77 0.13 0.02 -0.33 0.02 0.00 0.00 177.57 176.64 2r1r h GLU 42 N 0.32 0.09 -0.02 1.57 5.08 0.11 -2.36 114.58 119.36 2r1r h GLU 42 Ca 0.09 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.48 2r1r h GLU 42 Cb 0.09 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.26 2r1r h GLU 42 CO -0.01 0.06 -0.47 -0.07 -1.00 0.00 0.00 179.01 177.51 2r1r h LEU 43 N 0.09 -1.45 -2.27 1.33 3.38 -0.50 0.58 115.31 116.47 2r1r h LEU 43 Ca 0.08 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2r1r h LEU 43 Cb 0.08 0.56 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2r1r h LEU 43 CO -0.11 -0.48 0.00 0.03 0.09 0.00 0.00 178.44 177.96 2r1r h ARG 44 N -0.61 0.00 0.00 1.13 3.08 -1.27 -3.22 114.38 113.49 2r1r h ARG 44 Ca 0.04 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.84 2r1r h ARG 44 Cb 0.68 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.69 2r1r h ARG 44 CO -0.35 0.00 -1.92 -1.13 -1.07 0.00 0.00 179.97 175.50 2r1r n SER 45 N -2.93 1.68 -0.26 7.04 3.41 -0.88 -4.59 113.62 117.10 2r1r n SER 45 Ca -0.02 -0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.53 2r1r n SER 45 Cb 0.13 0.83 0.06 0.00 -0.26 0.00 0.00 64.21 64.98 2r1r n SER 45 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 2r1r h HIS 46 N 0.00 1.18 -0.65 7.33 3.86 -0.91 -2.57 115.15 123.39 2r1r h HIS 46 Ca -0.37 -0.13 0.19 0.00 -1.16 0.00 0.00 60.37 58.90 2r1r h HIS 46 Cb 1.83 -0.34 -0.03 0.00 1.06 0.00 0.00 27.41 29.93 2r1r h HIS 46 CO 0.00 0.94 0.47 0.97 0.86 0.00 0.00 177.93 181.17 2r1r h ILE 47 N 1.08 0.68 -0.11 2.45 6.09 -1.80 0.19 117.51 126.09 2r1r h ILE 47 Ca 0.23 -0.01 0.00 0.00 -1.37 0.00 0.00 64.86 63.71 2r1r h ILE 47 Cb 0.33 0.66 0.00 0.00 0.47 0.00 0.00 36.82 38.29 2r1r h ILE 47 CO -0.00 0.00 0.00 0.00 -3.07 0.00 0.00 178.15 175.08 2r1r n GLN 48 N -4.35 1.56 -2.76 2.19 6.02 -0.97 -4.92 117.38 114.15 2r1r n GLN 48 Ca 0.13 -0.84 -0.33 0.00 -0.01 0.00 0.00 57.00 55.95 2r1r n GLN 48 Cb 0.71 -1.39 -0.06 0.00 1.02 0.00 0.00 30.24 30.52 2r1r n GLN 48 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2r1r s PHE 49 N -1.86 3.36 0.02 1.08 0.08 0.65 -5.08 117.98 116.23 2r1r s PHE 49 Ca 0.33 1.50 -0.22 0.00 0.12 0.00 0.00 56.93 58.66 2r1r s PHE 49 Cb 0.17 -2.78 0.05 0.00 -0.57 0.00 0.00 43.02 39.89 2r1r s PHE 49 CO 0.27 -0.15 0.51 1.52 -0.10 0.00 0.00 175.22 177.27 2r1r s TYR 50 N -2.27 -0.41 -0.05 0.36 -0.85 -1.26 -5.10 117.35 107.77 2r1r s TYR 50 Ca 0.60 0.53 -0.33 0.00 -0.52 0.00 0.00 57.07 57.35 2r1r s TYR 50 Cb -0.09 0.30 -0.11 0.00 0.38 0.00 0.00 41.96 42.44 2r1r s TYR 50 CO 0.19 -0.59 1.91 -0.25 -1.52 0.00 0.00 175.55 175.29 2r1r n ASP 51 N 0.63 3.68 0.00 -0.18 9.92 -1.26 -0.96 116.55 128.39 2r1r n ASP 51 Ca -0.19 0.95 0.00 0.00 -0.53 0.00 0.00 54.79 55.02 2r1r n ASP 51 Cb 0.59 -1.42 0.00 0.00 -0.64 0.00 0.00 41.12 39.65 2r1r n ASP 51 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2r1r n GLY 52 N 4.45 1.01 3.65 0.44 0.00 0.32 -5.01 105.19 110.05 2r1r n GLY 52 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 2r1r n GLY 52 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2r1r s ILE 53 N -2.00 3.65 0.62 -0.61 2.07 -0.13 -4.53 121.20 120.27 2r1r s ILE 53 Ca 0.00 0.78 -0.19 0.00 -1.41 0.00 0.00 60.65 59.83 2r1r s ILE 53 Cb 0.00 -3.54 -0.02 0.00 0.13 0.00 0.00 42.46 39.03 2r1r s ILE 53 CO 0.00 -0.11 1.26 0.29 -1.91 0.00 0.00 174.94 174.47 2r1r n LYS 54 N 7.23 1.20 0.01 3.50 5.02 -1.26 -1.32 118.16 132.54 2r1r n LYS 54 Ca 0.18 0.46 -0.12 0.00 -2.02 0.00 0.00 58.31 56.81 2r1r n LYS 54 Cb 0.43 -2.49 -0.07 0.00 -0.02 0.00 0.00 35.03 32.88 2r1r n LYS 54 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 2r1r h THR 55 N 0.70 1.14 -0.61 -0.18 2.02 -1.61 -2.84 112.91 111.53 2r1r h THR 55 Ca -0.51 -0.42 0.11 0.00 0.77 0.00 0.00 66.41 66.36 2r1r h THR 55 Cb 1.34 1.36 -0.12 0.00 -1.74 0.00 0.00 68.15 68.99 2r1r h THR 55 CO 0.53 0.12 -0.29 0.77 0.37 0.00 0.00 175.52 177.02 2r1r h SER 56 N -0.11 -1.00 -0.74 4.18 4.64 -1.92 0.17 113.55 118.77 2r1r h SER 56 Ca 0.01 0.22 0.16 0.00 -0.47 0.00 0.00 61.79 61.71 2r1r h SER 56 Cb 0.18 0.53 -0.11 0.00 -0.31 0.00 0.00 62.40 62.68 2r1r h SER 56 CO -0.00 -0.28 0.18 0.44 -0.87 0.00 0.00 176.83 176.30 2r1r h ASP 57 N -0.12 0.02 -0.59 4.97 5.19 -1.93 -0.23 116.42 123.72 2r1r h ASP 57 Ca 0.26 0.15 0.12 0.00 -0.62 0.00 0.00 57.03 56.93 2r1r h ASP 57 Cb 0.54 0.20 -0.09 0.00 0.18 0.00 0.00 39.33 40.15 2r1r h ASP 57 CO -0.68 -0.04 0.08 0.40 -3.12 0.00 0.00 179.24 175.88 2r1r h ILE 58 N 0.27 0.60 0.31 0.35 1.08 -0.42 0.47 117.51 120.16 2r1r h ILE 58 Ca 0.42 -0.07 -0.02 0.00 -0.39 0.00 0.00 64.86 64.80 2r1r h ILE 58 Cb 0.72 0.38 0.00 0.00 -3.07 0.00 0.00 36.82 34.84 2r1r h ILE 58 CO -0.51 0.04 -0.15 0.45 -0.69 0.00 0.00 178.15 177.29 2r1r h HIS 59 N 0.20 -0.39 -0.74 1.37 3.86 -0.60 -2.83 115.15 116.02 2r1r h HIS 59 Ca 0.31 -0.01 0.17 0.00 -1.16 0.00 0.00 60.37 59.68 2r1r h HIS 59 Cb 0.48 0.13 -0.13 0.00 1.06 0.00 0.00 27.41 28.95 2r1r h HIS 59 CO -0.28 -0.14 0.01 0.93 0.86 0.00 0.00 177.93 179.30 2r1r h GLU 60 N -0.56 0.10 -0.48 2.45 4.39 -0.57 -0.26 114.58 119.64 2r1r h GLU 60 Ca -0.04 -0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.67 2r1r h GLU 60 Cb 0.41 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.01 2r1r h GLU 60 CO 0.07 0.07 0.30 1.15 -1.16 0.00 0.00 179.01 179.44 2r1r h THR 61 N 0.11 1.08 -0.07 1.13 2.02 -0.89 -0.56 112.91 115.73 2r1r h THR 61 Ca 0.40 -0.21 -0.22 0.00 0.77 0.00 0.00 66.41 67.15 2r1r h THR 61 Cb 0.71 0.42 0.01 0.00 -1.74 0.00 0.00 68.15 67.55 2r1r h THR 61 CO -0.65 0.11 -0.86 0.16 0.37 0.00 0.00 175.52 174.65 2r1r h ILE 62 N 0.60 1.33 0.27 3.11 3.07 -0.95 -1.35 117.51 123.60 2r1r h ILE 62 Ca 0.19 -2.17 0.01 0.00 1.55 0.00 0.00 64.86 64.43 2r1r h ILE 62 Cb -0.02 2.19 -0.03 0.00 -0.27 0.00 0.00 36.82 38.69 2r1r h ILE 62 CO -0.07 0.67 -0.35 0.40 -1.05 0.00 0.00 178.15 177.75 2r1r h ILE 63 N 0.38 0.28 -0.43 0.16 2.04 -0.98 -0.29 117.51 118.67 2r1r h ILE 63 Ca -0.07 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.86 2r1r h ILE 63 Cb 1.48 0.28 -0.06 0.00 -0.74 0.00 0.00 36.82 37.78 2r1r h ILE 63 CO 0.16 0.00 0.07 0.11 0.00 0.00 0.00 178.15 178.50 2r1r h LYS 64 N -0.67 0.19 -0.22 2.37 1.57 -1.06 0.13 116.57 118.89 2r1r h LYS 64 Ca -0.01 -0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.81 2r1r h LYS 64 Cb 0.63 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.85 2r1r h LYS 64 CO -0.11 0.13 -0.07 0.00 -0.57 0.00 0.00 179.45 178.83 2r1r h ALA 65 N 1.34 0.12 -0.14 3.86 0.00 -0.84 0.31 119.26 123.91 2r1r h ALA 65 Ca 0.21 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.22 2r1r h ALA 65 Cb 0.27 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2r1r h ALA 65 CO -0.29 -0.49 0.04 0.00 0.00 0.00 0.00 179.25 178.51 2r1r h ALA 66 N 1.18 0.15 -0.63 0.00 0.00 -0.48 -2.85 119.26 116.63 2r1r h ALA 66 Ca 0.11 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.07 2r1r h ALA 66 Cb 0.20 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2r1r h ALA 66 CO -0.24 -0.41 0.42 0.00 0.00 0.00 0.00 179.25 179.02 2r1r h ALA 67 N 1.09 1.62 0.00 0.00 0.00 0.06 -1.88 119.26 120.16 2r1r h ALA 67 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2r1r h ALA 67 Cb 0.04 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2r1r h ALA 67 CO -0.07 0.32 0.00 -0.25 0.00 0.00 0.00 179.25 179.25 2r1r n ASP 68 N -4.46 0.51 -0.85 0.00 8.00 0.10 -2.35 116.55 117.52 2r1r n ASP 68 Ca 0.07 0.63 0.12 0.00 0.71 0.00 0.00 54.79 56.32 2r1r n ASP 68 Cb 0.10 -0.74 0.27 0.00 -0.02 0.00 0.00 41.12 40.74 2r1r n ASP 68 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2r1r n LEU 69 N -2.07 2.58 -4.72 0.64 4.77 -0.70 -4.93 117.00 112.56 2r1r n LEU 69 Ca 0.02 -1.01 -0.42 0.00 -0.03 0.00 0.00 56.01 54.58 2r1r n LEU 69 Cb 0.21 -0.11 -0.03 0.00 -2.33 0.00 0.00 43.42 41.16 2r1r n LEU 69 CO 0.18 0.50 1.32 -0.63 -1.33 0.00 0.00 177.39 177.43 2r1r s ILE 70 N -1.78 2.26 0.38 -0.08 1.01 -0.99 -4.81 121.20 117.18 2r1r s ILE 70 Ca 0.34 0.19 -0.12 0.00 0.00 0.00 0.00 60.65 61.06 2r1r s ILE 70 Cb 0.20 -3.12 0.04 0.00 0.01 0.00 0.00 42.46 39.60 2r1r s ILE 70 CO 0.30 0.01 0.70 -0.94 0.00 0.00 0.00 174.94 175.02 2r1r s SER 71 N 1.17 0.27 0.29 3.58 1.04 -1.10 -5.01 113.70 113.94 2r1r s SER 71 Ca 0.73 -1.25 0.16 0.00 0.48 0.00 0.00 55.95 56.07 2r1r s SER 71 Cb -0.47 0.80 0.16 0.00 0.10 0.00 0.00 66.02 66.61 2r1r s SER 71 CO 0.32 -1.59 1.49 0.08 0.98 0.00 0.00 173.24 174.51 2r1r h ARG 72 N 2.03 0.00 0.00 4.02 0.11 -1.95 -2.93 114.38 115.66 2r1r h ARG 72 Ca -0.31 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.76 2r1r h ARG 72 Cb 1.25 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.32 2r1r h ARG 72 CO 0.40 0.49 -0.49 -0.44 0.10 0.00 0.00 179.97 180.03 2r1r h ASP 73 N 0.00 0.00 -2.06 0.08 3.32 -1.96 -3.40 116.42 112.41 2r1r h ASP 73 Ca -0.00 0.00 -0.46 0.00 0.02 0.00 0.00 57.03 56.59 2r1r h ASP 73 Cb 1.32 0.00 -0.33 0.00 0.22 0.00 0.00 39.33 40.54 2r1r h ASP 73 CO 0.06 0.05 -0.80 0.00 -1.72 0.00 0.00 179.24 176.84 2r1r s ALA 74 N -3.24 0.25 -0.37 3.45 0.00 -1.19 -4.99 121.76 115.66 2r1r s ALA 74 Ca 0.03 -1.62 0.21 0.00 0.00 0.00 0.00 51.96 50.58 2r1r s ALA 74 Cb 0.07 -1.90 0.27 0.00 0.00 0.00 0.00 23.12 21.55 2r1r s ALA 74 CO 0.73 -2.09 1.56 -1.00 0.00 0.00 0.00 175.76 174.96 2r1r h PRO 75 N 6.15 0.00 0.00 0.00 0.13 -1.73 -2.91 132.00 133.64 2r1r h PRO 75 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2r1r h PRO 75 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 2r1r h PRO 75 CO 0.25 0.13 0.00 -0.25 -0.23 0.00 0.00 178.00 177.89 2r1r n ASP 76 N -3.13 0.00 0.14 1.44 8.00 -1.26 -1.43 116.55 120.31 2r1r n ASP 76 Ca 0.03 -0.13 0.01 0.00 0.71 0.00 0.00 54.79 55.41 2r1r n ASP 76 Cb 0.58 -0.18 0.33 0.00 -0.02 0.00 0.00 41.12 41.83 2r1r n ASP 76 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 2r1r h TYR 77 N 0.00 0.16 -0.66 1.24 0.05 -1.90 -2.28 116.97 113.58 2r1r h TYR 77 Ca 0.00 -0.03 0.12 0.00 0.05 0.00 0.00 58.73 58.87 2r1r h TYR 77 Cb 0.09 -0.04 -0.12 0.00 1.01 0.00 0.00 36.73 37.66 2r1r h TYR 77 CO 0.00 0.45 -0.28 1.96 -1.05 0.00 0.00 178.16 179.23 2r1r h GLN 78 N 0.13 -0.09 0.00 4.88 4.20 -1.53 0.14 115.11 122.84 2r1r h GLN 78 Ca 0.02 0.01 -0.21 0.00 0.06 0.00 0.00 58.65 58.52 2r1r h GLN 78 Cb 0.62 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.42 2r1r h GLN 78 CO 0.05 -0.06 -0.91 1.88 -0.67 0.00 0.00 178.83 179.11 2r1r h TYR 79 N -0.10 0.45 -0.43 2.96 0.05 -1.64 -2.05 116.97 116.21 2r1r h TYR 79 Ca 0.28 -0.25 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 2r1r h TYR 79 Cb 0.55 -0.05 -0.02 0.00 1.01 0.00 0.00 36.73 38.22 2r1r h TYR 79 CO -0.63 1.06 0.20 1.25 -1.05 0.00 0.00 178.16 178.99 2r1r h LEU 80 N 0.17 0.57 -0.21 3.88 5.85 -0.80 -0.56 115.31 124.21 2r1r h LEU 80 Ca -0.06 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 2r1r h LEU 80 Cb 1.55 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.42 2r1r h LEU 80 CO 0.15 0.56 0.07 0.00 -0.34 0.00 0.00 178.44 178.87 2r1r h ALA 81 N 1.04 0.28 0.39 1.25 0.00 -0.83 -2.67 119.26 118.72 2r1r h ALA 81 Ca 0.15 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2r1r h ALA 81 Cb 0.14 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2r1r h ALA 81 CO -0.02 -0.10 -0.45 0.00 0.00 0.00 0.00 179.25 178.68 2r1r h ALA 82 N 0.90 -0.96 -0.36 0.00 0.00 -1.18 -0.87 119.26 116.79 2r1r h ALA 82 Ca 0.07 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.91 2r1r h ALA 82 Cb 0.22 0.66 -0.08 0.00 0.00 0.00 0.00 17.79 18.60 2r1r h ALA 82 CO -0.00 -1.08 -0.16 0.00 0.00 0.00 0.00 179.25 178.00 2r1r h ARG 83 N -0.87 -0.09 -0.71 0.00 3.08 -1.15 0.60 114.38 115.24 2r1r h ARG 83 Ca -0.04 0.01 0.13 0.00 0.07 0.00 0.00 59.98 60.15 2r1r h ARG 83 Cb 0.78 0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.76 2r1r h ARG 83 CO -0.10 -0.06 0.27 -0.07 -1.07 0.00 0.00 179.97 178.94 2r1r h LEU 84 N -0.10 0.24 -0.62 3.04 3.38 -1.23 0.13 115.31 120.15 2r1r h LEU 84 Ca 0.18 0.10 -0.10 0.00 0.09 0.00 0.00 57.88 58.15 2r1r h LEU 84 Cb 0.37 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2r1r h LEU 84 CO -0.42 0.10 -0.03 0.00 0.09 0.00 0.00 178.44 178.18 2r1r h ALA 85 N 1.52 0.83 0.16 1.53 0.00 0.44 -1.64 119.26 122.10 2r1r h ALA 85 Ca 0.38 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.98 2r1r h ALA 85 Cb 0.56 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2r1r h ALA 85 CO -0.38 0.67 -0.23 0.82 0.00 0.00 0.00 179.25 180.13 2r1r h ILE 86 N 0.95 0.50 -0.52 0.00 1.08 0.19 -1.33 117.51 118.39 2r1r h ILE 86 Ca 0.16 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.73 2r1r h ILE 86 Cb 0.59 0.50 -0.10 0.00 -3.07 0.00 0.00 36.82 34.73 2r1r h ILE 86 CO 0.04 0.00 -0.35 0.15 -0.69 0.00 0.00 178.15 177.30 2r1r h PHE 87 N -0.45 -0.98 -0.15 1.37 3.04 -0.65 0.15 116.94 119.27 2r1r h PHE 87 Ca 0.02 0.07 0.04 0.00 3.98 0.00 0.00 57.97 62.08 2r1r h PHE 87 Cb 0.45 0.50 -0.05 0.00 2.56 0.00 0.00 35.95 39.41 2r1r h PHE 87 CO -0.19 -0.39 -0.16 1.25 -2.02 0.00 0.00 178.31 176.80 2r1r h HIS 88 N -0.21 -0.40 -0.77 0.41 2.76 -1.08 -1.76 115.15 114.10 2r1r h HIS 88 Ca 0.20 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.43 2r1r h HIS 88 Cb 0.55 0.20 -0.05 0.00 1.55 0.00 0.00 27.41 29.66 2r1r h HIS 88 CO -0.61 -0.23 0.49 -0.07 -1.30 0.00 0.00 177.93 176.21 2r1r h LEU 89 N -0.19 0.81 -0.07 0.26 3.38 -0.57 0.35 115.31 119.28 2r1r h LEU 89 Ca 0.10 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.09 2r1r h LEU 89 Cb 0.33 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2r1r h LEU 89 CO -0.26 0.55 -0.38 0.03 0.09 0.00 0.00 178.44 178.48 2r1r h ARG 90 N 0.95 -0.41 -0.75 1.13 2.47 -0.27 0.12 114.38 117.63 2r1r h ARG 90 Ca 0.31 0.03 0.11 0.00 -1.26 0.00 0.00 59.98 59.17 2r1r h ARG 90 Cb 0.02 0.09 -0.08 0.00 -1.65 0.00 0.00 29.97 28.36 2r1r h ARG 90 CO -0.12 -0.27 0.36 -0.22 0.56 0.00 0.00 179.97 180.29 2r1r h LYS 91 N -0.42 0.57 -0.68 0.04 3.64 -0.75 -0.04 116.57 118.93 2r1r h LYS 91 Ca 0.02 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.42 2r1r h LYS 91 Cb 0.48 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.13 2r1r h LYS 91 CO -0.29 0.38 0.45 -0.22 -2.27 0.00 0.00 179.45 177.50 2r1r h LYS 92 N 0.59 0.71 0.09 1.90 3.64 0.55 0.14 116.57 124.19 2r1r h LYS 92 Ca 0.38 -0.04 -0.36 0.00 -1.27 0.00 0.00 60.65 59.36 2r1r h LYS 92 Cb 0.45 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 2r1r h LYS 92 CO -0.30 0.47 -2.04 0.00 -2.27 0.00 0.00 179.45 175.31 2r1r n ALA 93 N -2.45 0.97 -0.01 5.00 0.00 0.33 -4.62 120.51 119.73 2r1r n ALA 93 Ca 0.09 -0.68 0.07 0.00 0.00 0.00 0.00 53.44 52.93 2r1r n ALA 93 Cb 0.20 -0.56 -0.13 0.00 0.00 0.00 0.00 19.45 18.96 2r1r n ALA 93 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2r1r n TYR 94 N -3.54 0.00 -0.33 0.00 4.01 -0.15 -4.89 117.16 112.26 2r1r n TYR 94 Ca -0.35 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.39 2r1r n TYR 94 Cb 1.01 -0.40 0.00 0.00 -0.31 0.00 0.00 39.34 39.63 2r1r n TYR 94 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2r1r n GLY 95 N 1.62 0.79 3.49 2.72 0.00 0.48 -5.00 105.19 109.29 2r1r n GLY 95 Ca -0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 2r1r n GLY 95 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2r1r s GLN 96 N -0.60 1.33 0.14 1.61 -2.07 -1.26 -4.91 119.66 113.91 2r1r s GLN 96 Ca 0.00 -0.81 -0.14 0.00 -1.82 0.00 0.00 55.36 52.59 2r1r s GLN 96 Cb 0.00 0.52 0.01 0.00 -1.09 0.00 0.00 33.01 32.45 2r1r s GLN 96 CO 0.00 -0.56 1.64 0.35 -1.32 0.00 0.00 175.29 175.40 2r1r h PHE 97 N 2.20 0.77 -2.78 9.60 3.57 -1.90 -3.28 116.94 125.13 2r1r h PHE 97 Ca -0.30 -0.09 -0.56 0.00 3.53 0.00 0.00 57.97 60.55 2r1r h PHE 97 Cb 1.27 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 2r1r h PHE 97 CO 0.34 0.71 1.04 -1.21 -2.23 0.00 0.00 178.31 176.96 2r1r s GLU 98 N -5.28 4.06 0.23 1.11 0.41 -1.26 -4.81 118.70 113.16 2r1r s GLU 98 Ca -0.13 1.81 -0.30 0.00 -0.41 0.00 0.00 54.97 55.94 2r1r s GLU 98 Cb 0.11 -3.93 -0.09 0.00 -1.78 0.00 0.00 34.13 28.43 2r1r s GLU 98 CO 0.78 -0.97 1.35 -1.25 -0.49 0.00 0.00 175.26 174.69 2r1r s PRO 99 N 4.09 4.35 1.20 0.39 0.05 -1.26 -4.98 135.00 138.83 2r1r s PRO 99 Ca 0.66 2.15 -0.17 0.00 0.05 0.00 0.00 61.00 63.70 2r1r s PRO 99 Cb -0.26 -3.15 0.24 0.00 0.05 0.00 0.00 34.50 31.38 2r1r s PRO 99 CO 0.25 -0.29 0.58 -0.35 0.05 0.00 0.00 177.00 177.24 2r1r n PRO 100 N 2.27 -2.57 -2.43 0.56 -0.04 -1.26 -4.94 135.00 126.59 2r1r n PRO 100 Ca 0.05 -0.74 -0.42 0.00 -0.04 0.00 0.00 63.50 62.36 2r1r n PRO 100 Cb 0.42 -1.91 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2r1r n PRO 100 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2r1r s ALA 101 N -2.27 3.39 0.13 0.55 0.00 -1.26 -4.90 121.76 117.39 2r1r s ALA 101 Ca 0.62 0.85 -0.21 0.00 0.00 0.00 0.00 51.96 53.22 2r1r s ALA 101 Cb -0.18 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.51 2r1r s ALA 101 CO 0.63 -0.39 1.13 -0.11 0.00 0.00 0.00 175.76 177.02 2r1r n LEU 102 N 3.47 -0.72 -0.01 0.00 7.94 -1.26 -1.13 117.00 125.30 2r1r n LEU 102 Ca 0.07 1.30 -0.09 0.00 -1.11 0.00 0.00 56.01 56.18 2r1r n LEU 102 Cb 0.46 -0.19 -0.03 0.00 0.53 0.00 0.00 43.42 44.19 2r1r n LEU 102 CO 0.55 -1.08 0.71 0.22 -1.11 0.00 0.00 177.39 176.68 2r1r h TYR 103 N 0.00 -0.61 -0.28 1.96 3.20 -1.92 -0.16 116.97 119.16 2r1r h TYR 103 Ca 0.14 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.11 2r1r h TYR 103 Cb 0.33 0.29 -0.06 0.00 1.54 0.00 0.00 36.73 38.83 2r1r h TYR 103 CO -0.73 -0.31 -0.12 -0.44 -1.64 0.00 0.00 178.16 174.92 2r1r h ASP 104 N -0.28 -0.40 0.13 -2.11 3.32 -1.52 -0.95 116.42 114.61 2r1r h ASP 104 Ca 0.11 0.10 0.01 0.00 0.02 0.00 0.00 57.03 57.27 2r1r h ASP 104 Cb 0.44 0.23 -0.04 0.00 0.22 0.00 0.00 39.33 40.19 2r1r h ASP 104 CO -0.32 -0.15 -0.42 -0.74 -1.72 0.00 0.00 179.24 175.89 2r1r h HIS 105 N -0.07 -1.22 -0.34 4.55 2.76 -0.95 -0.55 115.15 119.33 2r1r h HIS 105 Ca 0.15 0.03 0.05 0.00 -2.20 0.00 0.00 60.37 58.40 2r1r h HIS 105 Cb 0.29 0.52 -0.08 0.00 1.55 0.00 0.00 27.41 29.69 2r1r h HIS 105 CO -0.31 -0.49 -0.52 0.28 -1.30 0.00 0.00 177.93 175.58 2r1r h VAL 106 N -0.63 0.03 -0.78 5.26 2.07 -0.76 0.13 116.25 121.57 2r1r h VAL 106 Ca -0.01 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.58 2r1r h VAL 106 Cb 0.62 0.03 -0.10 0.00 -1.52 0.00 0.00 31.29 30.32 2r1r h VAL 106 CO -0.21 0.00 -0.52 0.58 0.02 0.00 0.00 177.57 177.44 2r1r h VAL 107 N -0.43 0.00 -0.23 2.57 2.07 -0.96 0.34 116.25 119.62 2r1r h VAL 107 Ca 0.08 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.65 2r1r h VAL 107 Cb 0.61 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.33 2r1r h VAL 107 CO -0.56 0.00 -0.14 0.50 0.02 0.00 0.00 177.57 177.40 2r1r h LYS 108 N -0.08 -0.12 -0.70 1.57 3.64 -0.36 -0.99 116.57 119.53 2r1r h LYS 108 Ca 0.13 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.55 2r1r h LYS 108 Cb 0.40 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.20 2r1r h LYS 108 CO -0.77 -0.08 0.43 0.52 -2.27 0.00 0.00 179.45 177.28 2r1r h MET 109 N -0.12 0.79 -0.59 1.90 2.86 0.85 -0.13 114.93 120.49 2r1r h MET 109 Ca 0.13 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.73 2r1r h MET 109 Cb 0.31 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.76 2r1r h MET 109 CO -0.30 0.53 0.38 0.28 1.06 0.00 0.00 176.91 178.86 2r1r h VAL 110 N 0.82 1.13 -0.55 -2.22 2.07 0.04 -1.06 116.25 116.48 2r1r h VAL 110 Ca 0.29 -0.27 -0.06 0.00 0.82 0.00 0.00 66.70 67.49 2r1r h VAL 110 Cb 0.08 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 2r1r h VAL 110 CO -0.13 0.14 0.11 -0.33 0.02 0.00 0.00 177.57 177.38 2r1r h GLU 111 N 0.78 0.86 0.00 1.57 5.08 -0.42 -1.58 114.58 120.88 2r1r h GLU 111 Ca 0.22 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2r1r h GLU 111 Cb -0.06 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.07 2r1r h GLU 111 CO -0.06 0.79 0.00 -1.33 -1.00 0.00 0.00 179.01 177.41 2r1r n MET 112 N -4.26 0.01 -2.11 2.33 2.81 -0.13 -4.91 117.12 110.86 2r1r n MET 112 Ca 0.04 0.12 -0.03 0.00 -1.81 0.00 0.00 57.70 56.02 2r1r n MET 112 Cb 0.25 -1.52 -0.00 0.00 -0.71 0.00 0.00 33.22 31.24 2r1r n MET 112 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2r1r n GLY 113 N 0.81 0.29 0.05 3.03 0.00 -0.52 -4.95 105.19 103.91 2r1r n GLY 113 Ca 0.05 -0.74 -0.00 0.00 0.00 0.00 0.00 46.02 45.33 2r1r n GLY 113 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2r1r n LYS 114 N -1.28 0.86 -4.18 1.61 4.76 -0.52 -4.87 118.16 114.54 2r1r n LYS 114 Ca -0.03 -0.09 -0.28 0.00 -2.87 0.00 0.00 58.31 55.04 2r1r n LYS 114 Cb 0.53 -1.45 -0.08 0.00 -1.84 0.00 0.00 35.03 32.18 2r1r n LYS 114 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2r1r s TYR 115 N -2.84 2.88 0.34 2.13 2.02 -1.20 -4.30 117.35 116.37 2r1r s TYR 115 Ca -0.08 -0.10 -0.29 0.00 -0.37 0.00 0.00 57.07 56.23 2r1r s TYR 115 Cb 0.08 -1.44 -0.11 0.00 -0.40 0.00 0.00 41.96 40.10 2r1r s TYR 115 CO 0.75 0.49 1.39 0.34 -1.57 0.00 0.00 175.55 176.95 2r1r s ASP 116 N -2.64 6.61 0.26 2.29 -1.08 -0.52 -4.53 116.67 117.07 2r1r s ASP 116 Ca 0.26 2.81 0.07 0.00 -0.52 0.00 0.00 52.55 55.17 2r1r s ASP 116 Cb -0.10 -2.65 0.31 0.00 -1.46 0.00 0.00 42.92 39.02 2r1r s ASP 116 CO 0.18 -0.67 1.59 -0.55 0.52 0.00 0.00 175.17 176.24 2r1r h ASN 117 N 3.44 0.16 -1.40 -0.34 -1.07 -1.92 -3.15 115.58 111.30 2r1r h ASN 117 Ca -0.49 -0.09 0.41 0.00 0.07 0.00 0.00 56.30 56.19 2r1r h ASN 117 Cb 1.23 -0.05 -0.06 0.00 -2.07 0.00 0.00 38.32 37.37 2r1r h ASN 117 CO 0.66 0.72 1.00 1.12 0.07 0.00 0.00 177.43 181.00 2r1r h HIS 118 N 0.11 0.06 -0.97 4.14 2.07 -1.99 0.11 115.15 118.68 2r1r h HIS 118 Ca -0.01 0.00 0.12 0.00 -2.85 0.00 0.00 60.37 57.64 2r1r h HIS 118 Cb 1.07 -0.02 -0.08 0.00 2.57 0.00 0.00 27.41 30.95 2r1r h HIS 118 CO 0.01 -0.01 0.60 -0.07 -3.07 0.00 0.00 177.93 175.39 2r1r h LEU 119 N 0.02 0.86 -0.27 6.12 3.38 -1.95 0.41 115.31 123.88 2r1r h LEU 119 Ca 0.68 0.05 -0.15 0.00 0.09 0.00 0.00 57.88 58.56 2r1r h LEU 119 Cb 2.65 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 43.26 2r1r h LEU 119 CO -0.04 0.45 -0.69 -0.07 0.09 0.00 0.00 178.44 178.18 2r1r h LEU 120 N 0.94 0.00 -0.14 1.67 3.38 -1.01 -1.91 115.31 118.23 2r1r h LEU 120 Ca 0.48 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.24 2r1r h LEU 120 Cb 0.50 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.26 2r1r h LEU 120 CO -0.27 0.69 -0.74 -0.33 0.09 0.00 0.00 178.44 177.88 2r1r h GLU 121 N 0.00 0.75 0.12 1.13 5.08 -1.30 -3.34 114.58 117.02 2r1r h GLU 121 Ca -0.01 -0.62 -0.28 0.00 -1.00 0.00 0.00 59.36 57.46 2r1r h GLU 121 Cb 1.41 0.13 0.01 0.00 0.50 0.00 0.00 28.75 30.80 2r1r h GLU 121 CO 0.09 1.23 -1.22 -0.44 -1.00 0.00 0.00 179.01 177.67 2r1r h ASP 122 N 0.47 0.53 -3.85 1.42 3.32 -0.21 -3.45 116.42 114.65 2r1r h ASP 122 Ca -0.05 -0.54 -0.69 0.00 0.02 0.00 0.00 57.03 55.77 2r1r h ASP 122 Cb 1.38 -0.17 -0.21 0.00 0.22 0.00 0.00 39.33 40.55 2r1r h ASP 122 CO 0.15 1.40 -0.73 -0.31 -1.72 0.00 0.00 179.24 178.03 2r1r s TYR 123 N -2.79 2.81 0.61 4.55 2.02 -0.72 -5.09 117.35 118.75 2r1r s TYR 123 Ca -0.05 -0.07 -0.07 0.00 -0.37 0.00 0.00 57.07 56.50 2r1r s TYR 123 Cb 0.07 -1.66 0.01 0.00 -0.40 0.00 0.00 41.96 39.98 2r1r s TYR 123 CO 0.89 0.26 0.94 0.95 -1.57 0.00 0.00 175.55 177.03 2r1r s THR 124 N -0.79 3.67 0.27 -0.71 -4.23 -1.26 -4.61 115.64 107.98 2r1r s THR 124 Ca 0.12 0.13 -0.00 0.00 -1.18 0.00 0.00 61.69 60.76 2r1r s THR 124 Cb -0.11 -3.48 0.27 0.00 1.34 0.00 0.00 72.50 70.52 2r1r s THR 124 CO 0.02 -0.52 1.84 -0.08 -0.54 0.00 0.00 174.62 175.33 2r1r h GLU 125 N -0.28 0.95 -0.62 3.99 4.81 -1.99 -0.12 114.58 121.33 2r1r h GLU 125 Ca -0.45 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 58.65 2r1r h GLU 125 Cb 1.25 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 2r1r h GLU 125 CO 0.61 0.63 0.10 0.93 -0.73 0.00 0.00 179.01 180.55 2r1r h GLU 126 N 0.98 1.02 -0.20 1.92 3.07 -1.98 -1.78 114.58 117.60 2r1r h GLU 126 Ca 0.47 -0.27 -0.00 0.00 -0.50 0.00 0.00 59.36 59.06 2r1r h GLU 126 Cb 0.42 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.20 2r1r h GLU 126 CO -0.25 0.95 0.12 0.93 -1.40 0.00 0.00 179.01 179.36 2r1r h GLU 127 N 0.93 0.27 -0.40 2.33 5.08 -1.43 -0.40 114.58 120.96 2r1r h GLU 127 Ca 0.19 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.55 2r1r h GLU 127 Cb 0.42 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2r1r h GLU 127 CO 0.01 0.23 0.20 0.74 -1.00 0.00 0.00 179.01 179.19 2r1r h PHE 128 N 0.25 0.38 -0.88 4.33 0.04 -1.20 0.38 116.94 120.24 2r1r h PHE 128 Ca 0.07 0.02 0.18 0.00 2.80 0.00 0.00 57.97 61.04 2r1r h PHE 128 Cb 0.02 -0.11 -0.07 0.00 2.20 0.00 0.00 35.95 37.99 2r1r h PHE 128 CO -0.05 0.20 0.58 0.87 -0.60 0.00 0.00 178.31 179.31 2r1r h LYS 129 N 0.41 0.46 -0.03 1.51 1.57 -0.91 0.17 116.57 119.74 2r1r h LYS 129 Ca 0.17 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.88 2r1r h LYS 129 Cb 0.06 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2r1r h LYS 129 CO -0.11 0.30 -0.14 0.37 -0.57 0.00 0.00 179.45 179.31 2r1r h GLN 130 N 0.47 0.15 -0.60 3.15 4.15 0.50 -3.25 115.11 119.69 2r1r h GLN 130 Ca 0.45 -0.12 0.11 0.00 0.77 0.00 0.00 58.65 59.87 2r1r h GLN 130 Cb 1.02 0.02 -0.09 0.00 0.21 0.00 0.00 27.48 28.64 2r1r h GLN 130 CO -0.18 0.77 0.10 0.52 -1.93 0.00 0.00 178.83 178.11 2r1r h MET 131 N -0.43 0.22 -0.95 1.69 2.86 0.85 -0.58 114.93 118.59 2r1r h MET 131 Ca -0.01 -0.01 0.26 0.00 -2.06 0.00 0.00 59.70 57.88 2r1r h MET 131 Cb 0.79 -0.05 -0.14 0.00 0.06 0.00 0.00 31.60 32.26 2r1r h MET 131 CO 0.03 0.15 0.45 0.22 1.06 0.00 0.00 176.91 178.81 2r1r h ASP 132 N 0.23 0.37 0.19 1.22 1.82 -1.11 0.44 116.42 119.58 2r1r h ASP 132 Ca 0.31 0.17 -0.03 0.00 -0.39 0.00 0.00 57.03 57.10 2r1r h ASP 132 Cb 0.48 0.15 -0.00 0.00 0.68 0.00 0.00 39.33 40.63 2r1r h ASP 132 CO -0.42 -0.07 -0.12 0.71 -1.61 0.00 0.00 179.24 177.73 2r1r h THR 133 N 0.36 0.86 -0.11 2.25 1.35 -1.13 -2.60 112.91 113.89 2r1r h THR 133 Ca 0.63 -0.46 -0.02 0.00 -0.55 0.00 0.00 66.41 66.01 2r1r h THR 133 Cb 1.31 1.26 -0.00 0.00 -1.73 0.00 0.00 68.15 68.99 2r1r h THR 133 CO -0.58 0.12 -0.02 -0.26 -0.25 0.00 0.00 175.52 174.53 2r1r h PHE 134 N 0.00 0.24 -2.01 4.73 0.04 -0.13 -3.45 116.94 116.36 2r1r h PHE 134 Ca -0.00 -0.05 -0.64 0.00 2.80 0.00 0.00 57.97 60.08 2r1r h PHE 134 Cb 0.25 -0.06 0.10 0.00 2.20 0.00 0.00 35.95 38.44 2r1r h PHE 134 CO 0.00 0.50 0.07 -0.89 -0.60 0.00 0.00 178.31 177.40 2r1r n ILE 135 N -4.76 1.54 -3.81 -0.55 5.41 -0.98 -4.98 119.36 111.23 2r1r n ILE 135 Ca -0.06 -0.38 -0.30 0.00 1.00 0.00 0.00 62.75 63.00 2r1r n ILE 135 Cb 0.23 -0.76 -0.14 0.00 -0.71 0.00 0.00 39.64 38.26 2r1r n ILE 135 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2r1r s ASP 136 N -0.41 4.09 0.63 4.38 -1.08 -1.26 -5.00 116.67 118.03 2r1r s ASP 136 Ca 0.66 -2.23 0.42 0.00 -0.52 0.00 0.00 52.55 50.87 2r1r s ASP 136 Cb -0.81 -1.17 2.17 0.00 -1.46 0.00 0.00 42.92 41.65 2r1r s ASP 136 CO 0.56 -0.34 2.27 0.45 0.52 0.00 0.00 175.17 178.64 2r1r h HIS 137 N 7.35 0.00 0.00 -5.34 3.86 -1.97 -1.71 115.15 117.34 2r1r h HIS 137 Ca -0.07 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.14 2r1r h HIS 137 Cb 0.97 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.44 2r1r h HIS 137 CO 0.44 0.00 0.00 -0.25 0.86 0.00 0.00 177.93 178.98 2r1r n ASP 138 N -3.07 0.00 0.21 2.45 8.00 -1.26 -2.51 116.55 120.37 2r1r n ASP 138 Ca -0.02 0.36 0.07 0.00 0.71 0.00 0.00 54.79 55.91 2r1r n ASP 138 Cb 0.13 -0.43 0.45 0.00 -0.02 0.00 0.00 41.12 41.25 2r1r n ASP 138 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2r1r h ARG 139 N 0.00 0.00 -0.84 -1.24 3.08 -1.71 -2.65 114.38 111.03 2r1r h ARG 139 Ca 0.00 0.00 0.24 0.00 0.07 0.00 0.00 59.98 60.29 2r1r h ARG 139 Cb 0.23 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 2r1r h ARG 139 CO 0.00 0.30 0.65 -0.44 -1.07 0.00 0.00 179.97 179.41 2r1r h ASP 140 N 0.00 0.00 0.34 7.04 3.32 -1.72 0.17 116.42 125.57 2r1r h ASP 140 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2r1r h ASP 140 Cb 0.69 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.24 2r1r h ASP 140 CO 0.04 0.00 0.00 0.23 -1.72 0.00 0.00 179.24 177.79 2r1r n MET 141 N -4.10 0.43 0.00 3.56 2.81 -1.00 -3.37 117.12 115.46 2r1r n MET 141 Ca 0.17 0.05 0.11 0.00 -1.81 0.00 0.00 57.70 56.22 2r1r n MET 141 Cb 0.95 -1.50 0.10 0.00 -0.71 0.00 0.00 33.22 32.06 2r1r n MET 141 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2r1r n THR 142 N -1.22 0.00 -1.78 2.03 -2.24 0.60 -4.89 114.28 106.79 2r1r n THR 142 Ca 0.13 -0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.56 2r1r n THR 142 Cb 0.16 0.54 0.06 0.00 -2.10 0.00 0.00 70.33 68.99 2r1r n THR 142 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2r1r s PHE 143 N -3.00 2.33 0.21 4.78 0.08 -1.22 -5.04 117.98 116.12 2r1r s PHE 143 Ca 0.10 1.55 0.03 0.00 0.12 0.00 0.00 56.93 58.73 2r1r s PHE 143 Cb 0.17 -3.41 -0.03 0.00 -0.57 0.00 0.00 43.02 39.17 2r1r s PHE 143 CO 0.77 -2.23 0.35 -1.54 -0.10 0.00 0.00 175.22 172.47 2r1r s SER 144 N -1.93 6.33 0.19 1.36 1.04 -1.26 -4.70 113.70 114.73 2r1r s SER 144 Ca 0.74 0.17 -0.14 0.00 0.48 0.00 0.00 55.95 57.20 2r1r s SER 144 Cb -0.28 -1.91 0.19 0.00 0.10 0.00 0.00 66.02 64.12 2r1r s SER 144 CO 0.38 -0.04 1.67 0.22 0.98 0.00 0.00 173.24 176.46 2r1r h TYR 145 N 1.57 -0.09 -0.31 5.02 3.20 -1.74 -0.71 116.97 123.91 2r1r h TYR 145 Ca -0.50 0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.46 2r1r h TYR 145 Cb 1.21 0.12 -0.05 0.00 1.54 0.00 0.00 36.73 39.56 2r1r h TYR 145 CO 0.49 -0.15 0.03 0.00 -1.64 0.00 0.00 178.16 176.89 2r1r h ALA 146 N 1.47 0.30 -0.08 1.82 0.00 -1.88 -1.84 119.26 119.04 2r1r h ALA 146 Ca 0.25 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.28 2r1r h ALA 146 Cb 0.39 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 2r1r h ALA 146 CO -0.45 -0.38 -0.42 0.00 0.00 0.00 0.00 179.25 178.00 2r1r h ALA 147 N 1.25 -0.61 -0.65 0.00 0.00 -1.43 -2.11 119.26 115.70 2r1r h ALA 147 Ca 0.15 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.17 2r1r h ALA 147 Cb 0.18 0.76 -0.10 0.00 0.00 0.00 0.00 17.79 18.64 2r1r h ALA 147 CO -0.22 -0.93 0.12 0.28 0.00 0.00 0.00 179.25 178.49 2r1r h VAL 148 N -0.52 0.56 -0.96 0.00 2.07 -0.65 0.24 116.25 116.99 2r1r h VAL 148 Ca 0.06 -0.08 0.13 0.00 0.82 0.00 0.00 66.70 67.64 2r1r h VAL 148 Cb 0.63 0.31 -0.08 0.00 -1.52 0.00 0.00 31.29 30.64 2r1r h VAL 148 CO -0.36 0.04 0.61 0.11 0.02 0.00 0.00 177.57 177.99 2r1r h LYS 149 N 0.23 0.84 -0.14 1.57 6.56 -0.98 0.11 116.57 124.76 2r1r h LYS 149 Ca 0.35 -0.05 -0.04 0.00 -1.06 0.00 0.00 60.65 59.85 2r1r h LYS 149 Cb 0.56 -0.19 -0.00 0.00 -0.57 0.00 0.00 32.23 32.03 2r1r h LYS 149 CO -0.47 0.56 -0.08 1.96 -2.06 0.00 0.00 179.45 179.36 2r1r h GLN 150 N 0.87 0.29 0.06 3.15 1.08 0.04 0.46 115.11 121.05 2r1r h GLN 150 Ca 0.48 -0.13 0.03 0.00 -1.45 0.00 0.00 58.65 57.58 2r1r h GLN 150 Cb 0.60 -0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.98 2r1r h GLN 150 CO -0.25 0.64 -0.40 -0.07 -0.95 0.00 0.00 178.83 177.80 2r1r h LEU 151 N -0.06 -1.20 -1.07 1.46 3.38 -0.18 0.12 115.31 117.77 2r1r h LEU 151 Ca 0.03 0.14 0.01 0.00 0.09 0.00 0.00 57.88 58.15 2r1r h LEU 151 Cb 0.56 0.46 -0.05 0.00 0.09 0.00 0.00 40.66 41.72 2r1r h LEU 151 CO 0.02 -0.46 0.61 -0.08 0.09 0.00 0.00 178.44 178.62 2r1r h GLU 152 N -0.59 1.23 -0.12 1.13 4.81 -0.84 -1.11 114.58 119.09 2r1r h GLU 152 Ca 0.04 -0.08 -0.08 0.00 -0.13 0.00 0.00 59.36 59.11 2r1r h GLU 152 Cb 0.65 -0.28 0.00 0.00 0.63 0.00 0.00 28.75 29.75 2r1r h GLU 152 CO -0.27 0.82 -0.23 0.78 -0.73 0.00 0.00 179.01 179.38 2r1r h GLY 153 N 1.27 0.41 0.00 1.92 0.00 -0.31 -3.44 103.07 102.92 2r1r h GLY 153 Ca 0.34 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 47.20 2r1r h GLY 153 CO -0.07 0.43 0.00 0.58 0.00 0.00 0.00 176.54 177.47 2r1r n LYS 154 N -4.48 0.79 -0.06 4.80 2.85 0.37 -4.96 118.16 117.47 2r1r n LYS 154 Ca -0.07 -0.03 -0.06 0.00 -1.05 0.00 0.00 58.31 57.11 2r1r n LYS 154 Cb 0.43 -0.23 -0.02 0.00 -0.65 0.00 0.00 35.03 34.56 2r1r n LYS 154 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2r1r n TYR 155 N -0.12 0.30 -1.49 5.58 4.02 -0.88 -4.63 117.16 119.94 2r1r n TYR 155 Ca 0.00 0.13 -0.39 0.00 -0.01 0.00 0.00 57.90 57.63 2r1r n TYR 155 Cb 0.06 -0.50 0.03 0.00 -0.02 0.00 0.00 39.34 38.92 2r1r n TYR 155 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2r1r n LEU 156 N -4.05 1.06 -4.67 7.72 4.77 -0.47 -4.44 117.00 116.92 2r1r n LEU 156 Ca -0.09 0.77 -0.43 0.00 -0.03 0.00 0.00 56.01 56.24 2r1r n LEU 156 Cb 0.32 -1.20 -0.02 0.00 -2.33 0.00 0.00 43.42 40.19 2r1r n LEU 156 CO 0.13 -2.85 0.93 -0.69 -1.33 0.00 0.00 177.39 173.58 2r1r s VAL 157 N -1.65 4.51 0.33 4.08 1.01 -1.26 -5.00 120.40 122.41 2r1r s VAL 157 Ca 0.69 1.82 -0.02 0.00 0.00 0.00 0.00 61.98 64.46 2r1r s VAL 157 Cb -0.46 -4.17 -0.00 0.00 0.00 0.00 0.00 36.38 31.74 2r1r s VAL 157 CO 0.54 -0.08 0.43 0.00 0.00 0.00 0.00 175.10 175.99 2r1r s GLN 158 N 2.74 1.83 -0.37 2.72 -2.07 -1.26 -1.13 119.66 122.12 2r1r s GLN 158 Ca 0.50 -1.75 -0.09 0.00 -1.82 0.00 0.00 55.36 52.20 2r1r s GLN 158 Cb -0.20 0.42 0.04 0.00 -1.09 0.00 0.00 33.01 32.19 2r1r s GLN 158 CO 0.15 -0.74 0.19 1.21 -1.32 0.00 0.00 175.29 174.77 2r1r s ASN 159 N -3.23 5.60 0.31 12.60 3.84 0.53 -4.97 114.94 129.62 2r1r s ASN 159 Ca 0.32 -1.14 0.12 0.00 0.21 0.00 0.00 52.86 52.36 2r1r s ASN 159 Cb 0.00 -1.97 0.51 0.00 -0.55 0.00 0.00 41.25 39.24 2r1r s ASN 159 CO 0.20 -0.40 1.70 0.03 -2.79 0.00 0.00 177.10 175.83 2r1r h ARG 160 N 8.37 0.00 0.58 0.43 2.47 -1.94 0.56 114.38 124.85 2r1r h ARG 160 Ca -0.24 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.45 2r1r h ARG 160 Cb 1.09 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.42 2r1r h ARG 160 CO 0.67 0.52 -0.28 0.28 0.56 0.00 0.00 179.97 181.72 2r1r h VAL 161 N 0.00 0.00 0.00 2.04 2.07 -1.98 -3.35 116.25 115.04 2r1r h VAL 161 Ca -0.01 -0.34 -0.12 0.00 0.82 0.00 0.00 66.70 67.05 2r1r h VAL 161 Cb 0.93 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 2r1r h VAL 161 CO 0.07 0.00 -0.59 0.71 0.02 0.00 0.00 177.57 177.78 2r1r h THR 162 N -1.11 1.19 0.00 2.57 1.35 -2.00 -3.47 112.91 111.44 2r1r h THR 162 Ca -0.08 -2.21 0.00 0.00 -0.55 0.00 0.00 66.41 63.57 2r1r h THR 162 Cb 0.59 2.27 0.00 0.00 -1.73 0.00 0.00 68.15 69.29 2r1r h THR 162 CO 0.13 0.58 0.00 0.61 -0.25 0.00 0.00 175.52 176.59 2r1r n GLY 163 N 0.67 0.75 3.73 5.82 0.00 0.20 -5.04 105.19 111.32 2r1r n GLY 163 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2r1r n GLY 163 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2r1r s GLU 164 N -0.49 4.30 -0.22 1.61 2.02 -1.13 -4.79 118.70 120.00 2r1r s GLU 164 Ca 0.00 2.21 -0.06 0.00 0.02 0.00 0.00 54.97 57.14 2r1r s GLU 164 Cb 0.00 -3.16 -0.02 0.00 0.10 0.00 0.00 34.13 31.05 2r1r s GLU 164 CO 0.00 -0.41 0.02 0.42 0.02 0.00 0.00 175.26 175.31 2r1r s ILE 165 N 0.37 4.04 -0.44 -1.63 1.01 -1.26 -0.35 121.20 122.93 2r1r s ILE 165 Ca 0.61 -0.28 0.22 0.00 0.00 0.00 0.00 60.65 61.21 2r1r s ILE 165 Cb -0.40 -2.85 -0.19 0.00 0.01 0.00 0.00 42.46 39.03 2r1r s ILE 165 CO 0.38 0.40 0.83 -1.22 0.00 0.00 0.00 174.94 175.33 2r1r n TYR 166 N 4.48 0.21 -4.29 3.97 4.01 -0.28 -4.04 117.16 121.21 2r1r n TYR 166 Ca -0.17 0.06 -0.20 0.00 -0.16 0.00 0.00 57.90 57.44 2r1r n TYR 166 Cb 0.52 -0.44 -0.08 0.00 -0.31 0.00 0.00 39.34 39.02 2r1r n TYR 166 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 2r1r s GLU 167 N -3.29 1.77 0.13 -0.72 -1.05 -1.25 -4.95 118.70 109.35 2r1r s GLU 167 Ca 0.00 -2.03 0.06 0.00 -0.15 0.00 0.00 54.97 52.86 2r1r s GLU 167 Cb 0.14 0.30 -0.04 0.00 -0.44 0.00 0.00 34.13 34.09 2r1r s GLU 167 CO 0.85 -0.65 -0.15 -1.54 0.95 0.00 0.00 175.26 174.72 2r1r s SER 168 N -3.38 2.14 0.10 0.83 1.04 -1.26 -4.85 113.70 108.31 2r1r s SER 168 Ca 0.40 -0.82 -0.19 0.00 0.48 0.00 0.00 55.95 55.82 2r1r s SER 168 Cb 0.02 -0.09 -0.04 0.00 0.10 0.00 0.00 66.02 66.01 2r1r s SER 168 CO 0.28 -0.12 1.00 0.00 0.98 0.00 0.00 173.24 175.37 2r1r n ALA 169 N 0.48 -0.39 -0.27 5.32 0.00 -1.26 -1.30 120.51 123.09 2r1r n ALA 169 Ca -0.15 0.51 0.11 0.00 0.00 0.00 0.00 53.44 53.91 2r1r n ALA 169 Cb 0.57 -0.05 0.36 0.00 0.00 0.00 0.00 19.45 20.33 2r1r n ALA 169 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2r1r h GLN 170 N 0.00 0.71 -0.67 0.00 1.08 -1.93 -0.50 115.11 113.79 2r1r h GLN 170 Ca 0.10 -0.04 -0.07 0.00 -1.45 0.00 0.00 58.65 57.18 2r1r h GLN 170 Cb 0.25 -0.16 -0.03 0.00 -0.05 0.00 0.00 27.48 27.49 2r1r h GLN 170 CO -0.57 0.47 0.14 0.74 -0.95 0.00 0.00 178.83 178.66 2r1r h PHE 171 N 0.73 1.16 0.15 2.96 0.04 -1.62 -1.91 116.94 118.44 2r1r h PHE 171 Ca 0.43 -0.15 0.01 0.00 2.80 0.00 0.00 57.97 61.07 2r1r h PHE 171 Cb 0.63 -0.32 -0.05 0.00 2.20 0.00 0.00 35.95 38.42 2r1r h PHE 171 CO -0.00 0.96 -0.49 1.25 -0.60 0.00 0.00 178.31 179.43 2r1r h LEU 172 N 1.02 -1.44 0.05 1.54 6.46 -0.93 -1.11 115.31 120.91 2r1r h LEU 172 Ca 0.21 0.15 0.02 0.00 -0.12 0.00 0.00 57.88 58.15 2r1r h LEU 172 Cb 0.40 0.53 -0.04 0.00 -0.73 0.00 0.00 40.66 40.82 2r1r h LEU 172 CO 0.01 -0.54 -0.24 1.88 -0.62 0.00 0.00 178.44 178.92 2r1r h TYR 173 N -0.73 -0.64 -0.81 1.25 0.05 -1.27 -0.18 116.97 114.63 2r1r h TYR 173 Ca 0.00 0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.81 2r1r h TYR 173 Cb 0.74 0.28 -0.04 0.00 1.01 0.00 0.00 36.73 38.72 2r1r h TYR 173 CO -0.41 -0.34 0.53 0.97 -1.05 0.00 0.00 178.16 177.87 2r1r h ILE 174 N -0.41 1.21 0.00 -2.88 6.09 -1.22 -1.85 117.51 118.46 2r1r h ILE 174 Ca 0.05 -0.40 -0.14 0.00 -1.37 0.00 0.00 64.86 63.00 2r1r h ILE 174 Cb 0.46 0.02 -0.02 0.00 0.47 0.00 0.00 36.82 37.75 2r1r h ILE 174 CO -0.18 0.21 -0.64 -0.07 -3.07 0.00 0.00 178.15 174.40 2r1r h LEU 175 N 1.11 0.00 -0.34 2.19 3.38 -0.97 -0.85 115.31 119.82 2r1r h LEU 175 Ca 0.30 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 2r1r h LEU 175 Cb -0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2r1r h LEU 175 CO -0.06 0.64 0.08 0.58 0.09 0.00 0.00 178.44 179.77 2r1r h VAL 176 N 0.00 1.22 0.68 1.22 2.07 -0.47 -1.53 116.25 119.44 2r1r h VAL 176 Ca -0.01 -0.75 -0.03 0.00 0.82 0.00 0.00 66.70 66.73 2r1r h VAL 176 Cb 1.33 1.07 -0.00 0.00 -1.52 0.00 0.00 31.29 32.17 2r1r h VAL 176 CO 0.08 0.25 -0.39 0.00 0.02 0.00 0.00 177.57 177.54 2r1r h ALA 177 N 0.92 -1.01 -0.75 1.67 0.00 -1.22 -2.38 119.26 116.49 2r1r h ALA 177 Ca 0.11 -0.21 0.14 0.00 0.00 0.00 0.00 54.91 54.95 2r1r h ALA 177 Cb 0.30 0.46 -0.14 0.00 0.00 0.00 0.00 17.79 18.41 2r1r h ALA 177 CO 0.00 -1.08 -0.25 0.00 0.00 0.00 0.00 179.25 177.92 2r1r h ALA 178 N -0.73 0.34 0.02 0.00 0.00 -1.02 -1.42 119.26 116.45 2r1r h ALA 178 Ca -0.09 0.27 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 2r1r h ALA 178 Cb 0.79 0.68 0.00 0.00 0.00 0.00 0.00 17.79 19.26 2r1r h ALA 178 CO 0.11 -0.50 -0.01 0.00 0.00 0.00 0.00 179.25 178.85 2r1r h LEU 180 N -0.16 0.74 -3.29 0.00 3.38 -0.80 -2.68 115.31 112.50 2r1r h LEU 180 Ca -0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2r1r h LEU 180 Cb 0.15 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2r1r h LEU 180 CO 0.00 0.58 0.00 0.49 0.09 0.00 0.00 178.44 179.60 2r1r n PHE 181 N -4.41 1.59 0.25 1.13 3.72 -0.61 -4.65 117.46 114.48 2r1r n PHE 181 Ca 0.06 -0.68 0.11 0.00 -0.05 0.00 0.00 57.45 56.89 2r1r n PHE 181 Cb 0.08 -0.34 0.67 0.00 -0.94 0.00 0.00 39.48 38.95 2r1r n PHE 181 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2r1r h SER 182 N 3.73 0.00 0.41 4.37 4.64 -0.91 -2.10 113.55 123.69 2r1r h SER 182 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2r1r h SER 182 Cb 1.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.70 2r1r h SER 182 CO 0.31 0.13 -0.22 0.59 -0.87 0.00 0.00 176.83 176.77 2r1r n ASN 183 N -3.84 0.61 -4.75 4.97 3.02 -1.26 -4.92 115.26 109.09 2r1r n ASN 183 Ca -0.02 -0.52 -0.36 0.00 -0.03 0.00 0.00 54.58 53.65 2r1r n ASN 183 Cb 0.23 0.02 0.04 0.00 -0.61 0.00 0.00 39.78 39.46 2r1r n ASN 183 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2r1r s TYR 184 N -2.63 2.35 0.54 3.10 1.51 -0.79 -4.95 117.35 116.48 2r1r s TYR 184 Ca 0.23 1.50 -0.21 0.00 -1.01 0.00 0.00 57.07 57.58 2r1r s TYR 184 Cb 0.19 -3.55 -0.06 0.00 -0.11 0.00 0.00 41.96 38.43 2r1r s TYR 184 CO 0.54 -2.38 1.05 -0.35 -1.11 0.00 0.00 175.55 173.29 2r1r n PRO 185 N -1.54 1.17 0.28 -1.71 -0.04 -1.26 -4.62 135.00 127.29 2r1r n PRO 185 Ca 0.13 0.44 0.14 0.00 -0.04 0.00 0.00 63.50 64.17 2r1r n PRO 185 Cb 0.49 -2.21 0.83 0.00 -0.04 0.00 0.00 33.50 32.57 2r1r n PRO 185 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2r1r h ARG 186 N 0.95 0.00 0.00 0.54 3.08 -1.97 -1.29 114.38 115.70 2r1r h ARG 186 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.57 2r1r h ARG 186 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.40 2r1r h ARG 186 CO 0.54 0.04 0.00 -0.85 -1.07 0.00 0.00 179.97 178.63 2r1r n GLU 187 N -3.83 0.23 0.00 0.04 0.00 -1.26 -4.07 120.64 111.75 2r1r n GLU 187 Ca -0.03 0.12 0.00 0.00 0.00 0.00 0.00 57.16 57.25 2r1r n GLU 187 Cb 0.14 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.08 2r1r n GLU 187 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 2r1r n THR 188 N -1.32 0.00 -0.05 3.84 -2.24 -0.68 -4.93 114.28 108.89 2r1r n THR 188 Ca 0.08 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.85 2r1r n THR 188 Cb 0.16 -0.20 -0.01 0.00 -2.10 0.00 0.00 70.33 68.18 2r1r n THR 188 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2r1r n ARG 189 N -1.38 -0.06 0.21 -0.78 0.63 -0.57 -0.04 116.66 114.67 2r1r n ARG 189 Ca 0.00 0.28 0.08 0.00 -0.92 0.00 0.00 57.85 57.29 2r1r n ARG 189 Cb 0.14 -0.41 0.46 0.00 0.45 0.00 0.00 32.46 33.09 2r1r n ARG 189 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 2r1r h LEU 190 N 0.00 0.00 -0.29 6.15 3.38 -1.87 -0.14 115.31 122.55 2r1r h LEU 190 Ca 0.02 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 2r1r h LEU 190 Cb 0.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 2r1r h LEU 190 CO -0.12 0.28 -0.26 -0.61 0.09 0.00 0.00 178.44 177.82 2r1r h GLN 191 N 0.00 0.68 0.29 1.13 4.15 -0.82 -1.95 115.11 118.59 2r1r h GLN 191 Ca -0.00 -0.35 -0.01 0.00 0.77 0.00 0.00 58.65 59.05 2r1r h GLN 191 Cb 0.70 0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.40 2r1r h GLN 191 CO 0.04 0.96 -0.14 1.88 -1.93 0.00 0.00 178.83 179.64 2r1r h TYR 192 N 0.42 -0.36 -0.72 3.99 0.05 -1.18 -1.79 116.97 117.39 2r1r h TYR 192 Ca 0.05 -0.01 0.09 0.00 0.05 0.00 0.00 58.73 58.91 2r1r h TYR 192 Cb 0.82 0.12 -0.11 0.00 1.01 0.00 0.00 36.73 38.57 2r1r h TYR 192 CO 0.07 -0.13 -0.50 0.28 -1.05 0.00 0.00 178.16 176.83 2r1r h VAL 193 N -0.51 0.03 -0.06 -2.88 2.07 -0.99 0.22 116.25 114.13 2r1r h VAL 193 Ca -0.04 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.51 2r1r h VAL 193 Cb 0.38 0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 30.15 2r1r h VAL 193 CO 0.06 0.00 -0.16 0.50 0.02 0.00 0.00 177.57 178.00 2r1r h LYS 194 N -0.17 -0.22 -0.28 1.57 3.64 -1.30 -0.92 116.57 118.89 2r1r h LYS 194 Ca 0.17 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.61 2r1r h LYS 194 Cb 0.53 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.36 2r1r h LYS 194 CO -0.78 -0.15 0.03 0.00 -2.27 0.00 0.00 179.45 176.28 2r1r h ARG 195 N -0.23 0.12 0.53 1.90 3.08 -0.14 -0.69 114.38 118.95 2r1r h ARG 195 Ca 0.07 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 2r1r h ARG 195 Cb 0.33 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 2r1r h ARG 195 CO -0.20 0.08 -0.40 0.35 -1.07 0.00 0.00 179.97 178.74 2r1r h PHE 196 N 0.12 -1.06 -0.85 3.04 3.57 -0.54 -1.93 116.94 119.28 2r1r h PHE 196 Ca 0.13 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.73 2r1r h PHE 196 Cb 0.16 0.40 -0.12 0.00 2.79 0.00 0.00 35.95 39.17 2r1r h PHE 196 CO -0.19 -0.58 -0.52 -0.92 -2.23 0.00 0.00 178.31 173.87 2r1r h TYR 197 N -0.90 -1.63 -0.58 0.41 3.20 -0.85 0.17 116.97 116.78 2r1r h TYR 197 Ca -0.06 0.11 0.11 0.00 3.14 0.00 0.00 58.73 62.04 2r1r h TYR 197 Cb 0.76 0.83 -0.09 0.00 1.54 0.00 0.00 36.73 39.77 2r1r h TYR 197 CO -0.16 -0.40 0.07 -0.44 -1.64 0.00 0.00 178.16 175.59 2r1r h ASP 198 N -0.09 -0.11 0.30 -2.11 3.32 -1.01 0.23 116.42 116.96 2r1r h ASP 198 Ca 0.19 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.36 2r1r h ASP 198 Cb 0.50 0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.21 2r1r h ASP 198 CO -0.86 -0.04 -0.36 0.00 -1.72 0.00 0.00 179.24 176.26 2r1r h ALA 199 N 1.49 -0.73 -0.12 3.45 0.00 0.08 -2.46 119.26 120.97 2r1r h ALA 199 Ca 0.30 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.98 2r1r h ALA 199 Cb 0.47 0.53 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2r1r h ALA 199 CO -0.44 -0.95 -0.49 -0.39 0.00 0.00 0.00 179.25 176.98 2r1r h VAL 200 N -0.70 1.34 0.00 0.00 -1.51 -0.76 -0.72 116.25 113.89 2r1r h VAL 200 Ca -0.01 -1.72 0.00 0.00 -1.23 0.00 0.00 66.70 63.74 2r1r h VAL 200 Cb 0.65 1.79 0.00 0.00 -2.13 0.00 0.00 31.29 31.60 2r1r h VAL 200 CO -0.09 0.52 0.00 -1.54 -1.23 0.00 0.00 177.57 175.22 2r1r n SER 201 N -3.96 0.64 -1.14 4.19 3.41 0.04 -2.62 113.62 114.17 2r1r n SER 201 Ca -0.02 0.56 0.01 0.00 -0.26 0.00 0.00 58.87 59.16 2r1r n SER 201 Cb 0.54 -0.73 0.24 0.00 -0.26 0.00 0.00 64.21 64.00 2r1r n SER 201 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2r1r n THR 202 N -2.10 2.48 -2.26 6.66 -2.24 -0.93 -4.98 114.28 110.92 2r1r n THR 202 Ca 0.06 -2.19 -0.15 0.00 -2.27 0.00 0.00 64.05 59.50 2r1r n THR 202 Cb 0.41 -0.30 -0.02 0.00 -2.10 0.00 0.00 70.33 68.32 2r1r n THR 202 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2r1r n PHE 203 N -0.75 -1.12 -0.03 4.78 3.72 -1.08 -4.89 117.46 118.09 2r1r n PHE 203 Ca 0.29 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.54 2r1r n PHE 203 Cb 1.02 -3.06 -0.12 0.00 -0.94 0.00 0.00 39.48 36.39 2r1r n PHE 203 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2r1r h LYS 204 N 0.00 0.13 -6.00 -1.08 6.56 -1.36 -3.41 116.57 111.41 2r1r h LYS 204 Ca -0.34 -0.15 -0.68 0.00 -1.06 0.00 0.00 60.65 58.42 2r1r h LYS 204 Cb 1.21 0.04 -0.15 0.00 -0.57 0.00 0.00 32.23 32.76 2r1r h LYS 204 CO 0.42 0.91 -0.63 0.42 -2.06 0.00 0.00 179.45 178.51 2r1r s ILE 205 N -3.05 4.25 -0.00 1.86 1.01 -1.21 -0.71 121.20 123.35 2r1r s ILE 205 Ca -0.16 -0.28 0.05 0.00 0.00 0.00 0.00 60.65 60.25 2r1r s ILE 205 Cb 0.00 -2.79 -0.03 0.00 0.01 0.00 0.00 42.46 39.65 2r1r s ILE 205 CO 0.73 0.59 -0.14 -0.44 0.00 0.00 0.00 174.94 175.68 2r1r s SER 206 N -0.91 4.05 0.07 3.58 0.01 0.56 -4.49 113.70 116.56 2r1r s SER 206 Ca 0.14 -0.28 0.08 0.00 1.31 0.00 0.00 55.95 57.20 2r1r s SER 206 Cb -0.11 -0.80 -0.03 0.00 0.21 0.00 0.00 66.02 65.29 2r1r s SER 206 CO 0.03 0.30 -0.23 -0.76 0.41 0.00 0.00 173.24 172.98 2r1r s LEU 207 N -1.14 2.21 0.89 2.44 1.43 -1.26 -1.96 118.68 121.29 2r1r s LEU 207 Ca 0.14 -0.60 -0.11 0.00 -1.03 0.00 0.00 54.13 52.53 2r1r s LEU 207 Cb -0.11 -1.07 0.13 0.00 0.03 0.00 0.00 46.19 45.17 2r1r s LEU 207 CO 0.04 0.17 1.16 -2.16 0.23 0.00 0.00 176.35 175.79 2r1r s PRO 208 N -1.46 1.17 0.12 1.29 0.04 -1.26 -4.79 135.00 130.11 2r1r s PRO 208 Ca 0.09 1.60 -0.21 0.00 0.04 0.00 0.00 61.00 62.53 2r1r s PRO 208 Cb -0.09 -1.74 -0.07 0.00 0.04 0.00 0.00 34.50 32.63 2r1r s PRO 208 CO 0.03 -2.53 1.74 1.15 0.04 0.00 0.00 177.00 177.43 2r1r h THR 209 N -1.63 0.95 -0.53 1.26 2.02 -1.98 -2.49 112.91 110.52 2r1r h THR 209 Ca -0.44 -0.04 0.11 0.00 0.77 0.00 0.00 66.41 66.81 2r1r h THR 209 Cb 1.28 0.84 -0.10 0.00 -1.74 0.00 0.00 68.15 68.42 2r1r h THR 209 CO 0.43 0.02 -0.15 1.55 0.37 0.00 0.00 175.52 177.74 2r1r h PRO 210 N 0.10 -0.02 1.00 6.66 0.13 -1.93 0.11 132.00 138.06 2r1r h PRO 210 Ca 0.06 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.15 2r1r h PRO 210 Cb 0.05 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.19 2r1r h PRO 210 CO -0.08 -0.01 -0.48 0.82 -0.23 0.00 0.00 178.00 178.02 2r1r h ILE 211 N -0.02 0.00 -0.85 -3.56 2.04 -1.78 0.01 117.51 113.35 2r1r h ILE 211 Ca 0.25 -0.01 0.14 0.00 1.00 0.00 0.00 64.86 66.24 2r1r h ILE 211 Cb 0.41 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.39 2r1r h ILE 211 CO -0.55 0.00 0.44 0.24 0.00 0.00 0.00 178.15 178.28 2r1r h MET 212 N -1.36 0.62 0.00 2.37 2.86 -1.06 -0.44 114.93 117.92 2r1r h MET 212 Ca -0.14 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.44 2r1r h MET 212 Cb 1.03 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 32.55 2r1r h MET 212 CO 0.23 0.41 -0.42 0.66 1.06 0.00 0.00 176.91 178.85 2r1r h SER 213 N 0.64 0.00 0.00 1.22 4.64 -0.79 -3.42 113.55 115.84 2r1r h SER 213 Ca 0.45 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.51 2r1r h SER 213 Cb 0.62 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.67 2r1r h SER 213 CO -0.35 0.10 -1.91 0.61 -0.87 0.00 0.00 176.83 174.41 2r1r n GLY 214 N 1.16 -0.25 3.52 -0.77 0.00 -0.01 -4.90 105.19 103.92 2r1r n GLY 214 Ca 0.02 -0.09 -0.47 0.00 0.00 0.00 0.00 46.02 45.49 2r1r n GLY 214 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2r1r n VAL 215 N -3.56 0.24 0.00 1.61 0.31 -0.24 -0.44 118.33 116.25 2r1r n VAL 215 Ca -0.31 -0.37 0.00 0.00 -0.01 0.00 0.00 64.34 63.65 2r1r n VAL 215 Cb 0.74 -2.08 0.00 0.00 -0.91 0.00 0.00 33.84 31.60 2r1r n VAL 215 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 2r1r n ARG 216 N 8.49 0.00 -3.89 5.55 1.85 -1.26 -4.42 116.66 122.98 2r1r n ARG 216 Ca 0.37 0.00 -0.22 0.00 -1.00 0.00 0.00 57.85 57.00 2r1r n ARG 216 Cb 0.33 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.70 2r1r n ARG 216 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2r1r s THR 217 N -1.24 3.50 0.52 8.89 -4.23 0.42 -1.43 115.64 122.06 2r1r s THR 217 Ca 0.00 -1.44 0.34 0.00 -1.18 0.00 0.00 61.69 59.41 2r1r s THR 217 Cb 0.00 -3.16 0.53 0.00 1.34 0.00 0.00 72.50 71.21 2r1r s THR 217 CO 0.00 -0.19 1.80 -0.65 -0.54 0.00 0.00 174.62 175.04 2r1r h PRO 218 N 1.33 0.05 -7.27 3.99 0.11 -1.81 -3.40 132.00 124.99 2r1r h PRO 218 Ca -0.45 -0.00 -0.50 0.00 0.11 0.00 0.00 66.00 65.15 2r1r h PRO 218 Cb 1.25 -0.01 0.18 0.00 0.11 0.00 0.00 31.00 32.53 2r1r h PRO 218 CO 0.59 0.03 0.22 -0.08 -0.21 0.00 0.00 178.00 178.56 2r1r s THR 219 N -5.02 2.42 0.00 -1.15 -1.32 -1.26 -4.99 115.64 104.31 2r1r s THR 219 Ca -0.06 0.14 0.00 0.00 -1.21 0.00 0.00 61.69 60.56 2r1r s THR 219 Cb 0.23 -2.32 0.00 0.00 -1.51 0.00 0.00 72.50 68.90 2r1r s THR 219 CO 0.80 -0.18 0.21 0.54 -2.21 0.00 0.00 174.62 173.79 2r1r n ARG 220 N -4.12 -0.18 -2.81 7.08 5.12 -1.26 -4.90 116.66 115.59 2r1r n ARG 220 Ca 0.10 -0.21 -0.43 0.00 -1.93 0.00 0.00 57.85 55.38 2r1r n ARG 220 Cb 0.53 -0.69 -0.04 0.00 -1.16 0.00 0.00 32.46 31.10 2r1r n ARG 220 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2r1r s GLN 221 N -0.03 3.74 0.00 5.56 -0.21 -1.26 -2.17 119.66 125.28 2r1r s GLN 221 Ca 0.00 0.44 0.00 0.00 0.02 0.00 0.00 55.36 55.82 2r1r s GLN 221 Cb 0.00 -3.84 0.00 0.00 1.00 0.00 0.00 33.01 30.17 2r1r s GLN 221 CO 0.00 -1.04 0.21 1.19 -2.12 0.00 0.00 175.29 173.53 2r1r n PHE 222 N 6.91 0.00 -3.08 0.91 3.72 -1.26 -4.95 117.46 119.72 2r1r n PHE 222 Ca 0.07 -0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.07 2r1r n PHE 222 Cb 0.48 -0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.97 2r1r n PHE 222 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2r1r s SER 223 N -0.00 7.15 -0.16 4.37 0.01 -1.26 -4.61 113.70 119.20 2r1r s SER 223 Ca 0.00 1.37 0.10 0.00 1.31 0.00 0.00 55.95 58.73 2r1r s SER 223 Cb 0.00 -2.43 -0.23 0.00 0.21 0.00 0.00 66.02 63.57 2r1r s SER 223 CO 0.00 0.09 0.20 -1.54 0.41 0.00 0.00 173.24 172.40 2r1r n SER 224 N 2.50 0.94 -4.07 2.44 3.41 -1.26 -4.69 113.62 112.89 2r1r n SER 224 Ca -0.05 0.11 -0.14 0.00 -0.26 0.00 0.00 58.87 58.53 2r1r n SER 224 Cb 0.50 0.17 -0.11 0.00 -0.26 0.00 0.00 64.21 64.51 2r1r n SER 224 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r1r s VAL 226 N -1.36 1.38 -0.19 0.00 1.01 -0.44 -2.30 120.40 118.51 2r1r s VAL 226 Ca -0.09 -1.72 0.01 0.00 0.00 0.00 0.00 61.98 60.17 2r1r s VAL 226 Cb -0.10 -1.55 0.04 0.00 0.00 0.00 0.00 36.38 34.77 2r1r s VAL 226 CO 0.01 -0.39 -0.09 -0.76 0.00 0.00 0.00 175.10 173.86 2r1r s LEU 227 N -2.44 2.12 -0.12 3.92 1.02 -0.85 -1.22 118.68 121.11 2r1r s LEU 227 Ca 0.09 -0.84 0.02 0.00 0.02 0.00 0.00 54.13 53.42 2r1r s LEU 227 Cb -0.05 -1.16 -0.01 0.00 0.02 0.00 0.00 46.19 44.99 2r1r s LEU 227 CO 0.03 -0.16 -0.18 -0.63 0.02 0.00 0.00 176.35 175.44 2r1r s ILE 228 N 1.45 2.62 -0.19 -0.59 1.01 -0.41 -2.69 121.20 122.40 2r1r s ILE 228 Ca -0.01 -0.82 -0.08 0.00 0.00 0.00 0.00 60.65 59.75 2r1r s ILE 228 Cb -0.16 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.21 2r1r s ILE 228 CO -0.08 0.54 0.07 -0.70 0.00 0.00 0.00 174.94 174.77 2r1r s GLU 229 N 0.34 3.94 -0.12 2.79 2.12 -1.26 -1.52 118.70 124.98 2r1r s GLU 229 Ca -0.14 -0.36 -0.06 0.00 0.36 0.00 0.00 54.97 54.77 2r1r s GLU 229 Cb -0.17 -3.24 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 2r1r s GLU 229 CO 0.07 0.21 0.09 0.00 -0.54 0.00 0.00 175.26 175.09 2r1r s GLY 231 N -0.81 1.66 -1.22 0.00 0.00 -1.26 -4.56 107.32 101.14 2r1r s GLY 231 Ca 0.13 -0.91 -0.06 0.00 0.00 0.00 0.00 44.72 43.88 2r1r s GLY 231 CO 0.03 -0.60 2.52 1.34 0.00 0.00 0.00 173.10 176.38 2r1r n ASP 232 N -2.60 7.87 -3.69 1.64 2.03 -1.26 -4.40 116.55 116.15 2r1r n ASP 232 Ca 0.06 -3.08 -0.14 0.00 0.52 0.00 0.00 54.79 52.14 2r1r n ASP 232 Cb 0.59 -1.36 -0.08 0.00 -0.72 0.00 0.00 41.12 39.54 2r1r n ASP 232 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2r1r s SER 233 N 0.57 -0.44 0.23 1.67 1.04 -1.26 -4.94 113.70 110.57 2r1r s SER 233 Ca 0.56 0.66 -0.06 0.00 0.48 0.00 0.00 55.95 57.60 2r1r s SER 233 Cb 0.21 0.70 0.36 0.00 0.10 0.00 0.00 66.02 67.40 2r1r s SER 233 CO -0.11 -0.34 1.79 -0.07 0.98 0.00 0.00 173.24 175.50 2r1r h LEU 234 N 4.46 0.56 -0.49 2.42 3.38 -1.99 0.83 115.31 124.47 2r1r h LEU 234 Ca -0.28 0.05 0.09 0.00 0.09 0.00 0.00 57.88 57.84 2r1r h LEU 234 Cb 1.17 -0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.79 2r1r h LEU 234 CO 0.30 0.32 0.04 0.44 0.09 0.00 0.00 178.44 179.63 2r1r h ASP 235 N 0.69 -0.12 0.10 -0.43 3.32 -1.96 -1.27 116.42 116.73 2r1r h ASP 235 Ca 0.37 0.11 -0.19 0.00 0.02 0.00 0.00 57.03 57.34 2r1r h ASP 235 Cb 0.36 0.17 -0.00 0.00 0.22 0.00 0.00 39.33 40.08 2r1r h ASP 235 CO -0.26 -0.03 -0.70 -1.28 -1.72 0.00 0.00 179.24 175.25 2r1r h SER 236 N 0.16 0.64 0.14 6.45 0.87 -1.42 -2.25 113.55 118.13 2r1r h SER 236 Ca 0.25 -0.40 0.01 0.00 -1.23 0.00 0.00 61.79 60.42 2r1r h SER 236 Cb 0.36 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.11 2r1r h SER 236 CO -0.38 1.15 -0.20 0.40 -0.53 0.00 0.00 176.83 177.27 2r1r h ILE 237 N 0.38 0.55 -0.34 2.23 2.04 -0.55 -0.27 117.51 121.55 2r1r h ILE 237 Ca -0.03 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.90 2r1r h ILE 237 Cb 1.28 0.55 -0.06 0.00 -0.74 0.00 0.00 36.82 37.84 2r1r h ILE 237 CO 0.13 0.00 -0.08 0.78 0.00 0.00 0.00 178.15 178.98 2r1r h ASN 238 N -0.40 -0.30 0.14 1.72 4.21 -1.24 0.01 115.58 119.73 2r1r h ASN 238 Ca 0.02 0.10 0.02 0.00 1.21 0.00 0.00 56.30 57.64 2r1r h ASN 238 Cb 0.40 0.20 -0.03 0.00 -1.12 0.00 0.00 38.32 37.78 2r1r h ASN 238 CO -0.09 -0.10 -0.26 0.00 -1.29 0.00 0.00 177.43 175.69 2r1r h ALA 239 N 1.34 -0.45 -0.18 -0.83 0.00 -1.10 0.33 119.26 118.37 2r1r h ALA 239 Ca 0.17 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.05 2r1r h ALA 239 Cb 0.25 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 2r1r h ALA 239 CO -0.35 -0.80 -0.34 1.15 0.00 0.00 0.00 179.25 178.92 2r1r h THR 240 N -0.48 0.00 -0.70 0.00 2.02 -0.51 0.46 112.91 113.70 2r1r h THR 240 Ca 0.02 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.36 2r1r h THR 240 Cb 0.49 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.78 2r1r h THR 240 CO -0.13 0.00 -0.01 -1.28 0.37 0.00 0.00 175.52 174.47 2r1r h SER 241 N -0.29 -0.35 -0.01 4.18 0.87 -0.84 0.41 113.55 117.52 2r1r h SER 241 Ca 0.03 0.18 0.03 0.00 -1.23 0.00 0.00 61.79 60.80 2r1r h SER 241 Cb 0.38 0.33 -0.03 0.00 -0.44 0.00 0.00 62.40 62.64 2r1r h SER 241 CO -0.32 -0.16 -0.16 0.28 -0.53 0.00 0.00 176.83 175.94 2r1r h SER 242 N 0.10 -0.48 -0.28 6.23 0.02 0.14 -2.24 113.55 117.04 2r1r h SER 242 Ca 0.37 0.07 0.07 0.00 -0.84 0.00 0.00 61.79 61.46 2r1r h SER 242 Cb 0.64 0.20 -0.08 0.00 0.14 0.00 0.00 62.40 63.30 2r1r h SER 242 CO -0.62 -0.22 -0.27 0.00 -1.14 0.00 0.00 176.83 174.57 2r1r h ALA 243 N 0.67 -0.15 -0.52 3.77 0.00 0.11 -1.91 119.26 121.24 2r1r h ALA 243 Ca 0.06 0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.15 2r1r h ALA 243 Cb 0.34 0.57 -0.10 0.00 0.00 0.00 0.00 17.79 18.59 2r1r h ALA 243 CO -0.17 -0.69 -0.25 0.82 0.00 0.00 0.00 179.25 178.97 2r1r h ILE 244 N -0.26 0.30 -0.48 0.00 2.04 -0.80 0.11 117.51 118.42 2r1r h ILE 244 Ca 0.15 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.07 2r1r h ILE 244 Cb 0.49 0.30 -0.05 0.00 -0.74 0.00 0.00 36.82 36.81 2r1r h ILE 244 CO -0.43 0.00 0.17 0.58 0.00 0.00 0.00 178.15 178.47 2r1r h VAL 245 N -0.13 0.84 0.26 1.67 2.07 -0.80 0.19 116.25 120.35 2r1r h VAL 245 Ca 0.23 -0.12 0.01 0.00 0.82 0.00 0.00 66.70 67.64 2r1r h VAL 245 Cb 0.50 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 2r1r h VAL 245 CO -0.59 0.06 -0.38 0.11 0.02 0.00 0.00 177.57 176.79 2r1r h LYS 246 N 0.35 -0.68 -0.43 1.57 1.79 -0.31 -2.94 116.57 115.92 2r1r h LYS 246 Ca 0.23 0.05 -0.08 0.00 -2.18 0.00 0.00 60.65 58.67 2r1r h LYS 246 Cb 0.23 0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 31.02 2r1r h LYS 246 CO -0.23 -0.45 -0.05 1.88 -1.08 0.00 0.00 179.45 179.52 2r1r h TYR 247 N -0.70 0.78 0.00 -1.35 0.05 -0.62 -2.92 116.97 112.20 2r1r h TYR 247 Ca -0.00 -0.12 -0.04 0.00 0.05 0.00 0.00 58.73 58.62 2r1r h TYR 247 Cb 0.67 -0.21 -0.01 0.00 1.01 0.00 0.00 36.73 38.20 2r1r h TYR 247 CO -0.27 0.76 -0.19 -0.39 -1.05 0.00 0.00 178.16 177.02 2r1r h VAL 248 N 0.67 0.60 0.00 -2.88 -1.51 -0.63 -1.75 116.25 110.76 2r1r h VAL 248 Ca 0.13 -0.88 0.00 0.00 -1.23 0.00 0.00 66.70 64.72 2r1r h VAL 248 Cb 0.49 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 31.23 2r1r h VAL 248 CO 0.03 0.19 0.00 0.77 -1.23 0.00 0.00 177.57 177.32 2r1r h SER 249 N 0.00 0.00 -0.63 4.19 4.64 -1.33 -1.36 113.55 119.07 2r1r h SER 249 Ca -0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 2r1r h SER 249 Cb 0.56 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.50 2r1r h SER 249 CO 0.03 0.00 0.23 0.00 -0.87 0.00 0.00 176.83 176.22 2r1r n GLN 250 N -3.00 2.68 -3.74 4.77 6.02 -0.68 -4.94 117.38 118.49 2r1r n GLN 250 Ca 0.00 -3.07 -0.26 0.00 -0.01 0.00 0.00 57.00 53.66 2r1r n GLN 250 Cb 0.26 -2.04 0.05 0.00 1.02 0.00 0.00 30.24 29.53 2r1r n GLN 250 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2r1r n ARG 251 N -0.75 -6.74 -4.03 -1.09 1.74 -0.51 -4.96 116.66 100.32 2r1r n ARG 251 Ca 0.41 0.72 -0.34 0.00 -0.77 0.00 0.00 57.85 57.87 2r1r n ARG 251 Cb 1.30 -5.68 -0.07 0.00 -1.02 0.00 0.00 32.46 26.99 2r1r n ARG 251 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2r1r s ALA 252 N -3.33 3.72 0.22 7.54 0.00 -1.11 -4.90 121.76 123.91 2r1r s ALA 252 Ca 0.58 -0.77 -0.29 0.00 0.00 0.00 0.00 51.96 51.48 2r1r s ALA 252 Cb -0.27 -1.75 -0.09 0.00 0.00 0.00 0.00 23.12 21.01 2r1r s ALA 252 CO 0.78 0.67 0.90 0.20 0.00 0.00 0.00 175.76 178.31 2r1r s GLY 253 N -1.46 3.07 0.07 0.00 0.00 0.31 -4.46 107.32 104.84 2r1r s GLY 253 Ca 0.20 0.56 0.06 0.00 0.00 0.00 0.00 44.72 45.53 2r1r s GLY 253 CO 0.11 1.12 -0.08 -0.42 0.00 0.00 0.00 173.10 173.83 2r1r s ILE 254 N -1.14 3.54 -0.18 0.90 -1.09 -0.38 -1.32 121.20 121.52 2r1r s ILE 254 Ca 0.40 -1.08 -0.01 0.00 -2.23 0.00 0.00 60.65 57.73 2r1r s ILE 254 Cb -0.25 -2.62 0.05 0.00 -1.58 0.00 0.00 42.46 38.05 2r1r s ILE 254 CO 0.31 0.20 -0.02 -0.83 -1.23 0.00 0.00 174.94 173.36 2r1r s GLY 255 N -1.99 0.93 -0.12 6.18 0.00 -0.36 -2.12 107.32 109.85 2r1r s GLY 255 Ca 0.21 -0.86 -0.02 0.00 0.00 0.00 0.00 44.72 44.05 2r1r s GLY 255 CO 0.13 1.10 -0.05 -0.42 0.00 0.00 0.00 173.10 173.85 2r1r s ILE 256 N 1.67 3.85 -0.39 0.90 1.01 -0.38 -1.29 121.20 126.56 2r1r s ILE 256 Ca -0.01 -0.40 -0.07 0.00 0.00 0.00 0.00 60.65 60.18 2r1r s ILE 256 Cb -0.16 -2.64 0.07 0.00 0.01 0.00 0.00 42.46 39.74 2r1r s ILE 256 CO -0.07 0.54 0.19 0.21 0.00 0.00 0.00 174.94 175.81 2r1r s ASN 257 N -0.20 5.42 -0.24 3.58 2.47 -0.58 -0.78 114.94 124.61 2r1r s ASN 257 Ca 0.03 -1.51 0.10 0.00 0.42 0.00 0.00 52.86 51.90 2r1r s ASN 257 Cb -0.13 -1.90 0.44 0.00 -1.45 0.00 0.00 41.25 38.21 2r1r s ASN 257 CO 0.02 -0.47 1.29 0.00 -3.72 0.00 0.00 177.10 174.22 2r1r n ALA 258 N 4.80 3.93 0.20 1.71 0.00 -1.00 -1.18 120.51 128.96 2r1r n ALA 258 Ca -0.09 -3.30 0.06 0.00 0.00 0.00 0.00 53.44 50.11 2r1r n ALA 258 Cb 0.43 -0.45 0.40 0.00 0.00 0.00 0.00 19.45 19.82 2r1r n ALA 258 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2r1r h GLY 259 N 1.06 0.00 2.00 0.00 0.00 -1.84 -3.19 103.07 101.11 2r1r h GLY 259 Ca 0.08 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.34 2r1r h GLY 259 CO 0.15 0.00 -0.33 3.21 0.00 0.00 0.00 176.54 179.56 2r1r h ARG 260 N 0.00 0.00 -6.31 4.80 3.08 -1.85 -3.45 114.38 110.64 2r1r h ARG 260 Ca -0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.42 2r1r h ARG 260 Cb 0.76 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.84 2r1r h ARG 260 CO 0.04 0.33 0.99 -0.89 -1.07 0.00 0.00 179.97 179.38 2r1r n ILE 261 N -3.23 0.41 -0.49 2.04 5.41 -1.21 -4.66 119.36 117.63 2r1r n ILE 261 Ca 0.02 -0.07 -0.29 0.00 1.00 0.00 0.00 62.75 63.41 2r1r n ILE 261 Cb 0.63 -1.70 0.25 0.00 -0.71 0.00 0.00 39.64 38.11 2r1r n ILE 261 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 2r1r n ARG 262 N 5.66 -2.40 -3.06 0.38 1.85 -1.26 -4.85 116.66 112.96 2r1r n ARG 262 Ca 0.22 -0.67 -0.30 0.00 -1.00 0.00 0.00 57.85 56.10 2r1r n ARG 262 Cb 0.27 -2.14 -0.03 0.00 -1.05 0.00 0.00 32.46 29.51 2r1r n ARG 262 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2r1r s ALA 263 N -2.40 3.45 0.32 2.89 0.00 -1.26 -4.41 121.76 120.35 2r1r s ALA 263 Ca 0.68 -0.30 -0.29 0.00 0.00 0.00 0.00 51.96 52.04 2r1r s ALA 263 Cb -0.25 -2.56 -0.11 0.00 0.00 0.00 0.00 23.12 20.20 2r1r s ALA 263 CO 0.65 0.13 1.56 -0.11 0.00 0.00 0.00 175.76 177.99 2r1r n LEU 264 N -1.05 4.51 0.00 0.00 7.94 -1.26 -1.52 117.00 125.62 2r1r n LEU 264 Ca 0.01 1.17 0.00 0.00 -1.11 0.00 0.00 56.01 56.08 2r1r n LEU 264 Cb 0.54 -1.60 0.00 0.00 0.53 0.00 0.00 43.42 42.88 2r1r n LEU 264 CO 0.47 0.16 0.00 0.61 -1.11 0.00 0.00 177.39 177.52 2r1r n GLY 265 N 1.61 2.98 3.71 -3.96 0.00 -1.10 -4.94 105.19 103.49 2r1r n GLY 265 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 2r1r n GLY 265 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2r1r n SER 266 N 0.00 3.05 -4.74 1.61 7.64 -0.57 -4.44 113.62 116.17 2r1r n SER 266 Ca 0.00 1.20 -0.41 0.00 1.01 0.00 0.00 58.87 60.66 2r1r n SER 266 Cb 0.00 -1.51 -0.03 0.00 -1.01 0.00 0.00 64.21 61.66 2r1r n SER 266 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2r1r s PRO 267 N -1.54 4.30 -0.13 1.43 0.04 -1.26 0.14 135.00 137.97 2r1r s PRO 267 Ca 0.58 2.21 0.02 0.00 0.04 0.00 0.00 61.00 63.85 2r1r s PRO 267 Cb -0.56 -3.15 -0.00 0.00 0.04 0.00 0.00 34.50 30.83 2r1r s PRO 267 CO 0.59 -0.39 -0.19 0.42 0.04 0.00 0.00 177.00 177.47 2r1r s ILE 268 N 0.28 2.42 0.00 0.56 1.01 0.26 -4.72 121.20 121.00 2r1r s ILE 268 Ca 0.60 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 60.38 2r1r s ILE 268 Cb -0.40 -1.98 0.00 0.00 0.01 0.00 0.00 42.46 40.09 2r1r s ILE 268 CO 0.39 0.54 0.00 -1.14 0.00 0.00 0.00 174.94 174.73 2r1r n ARG 269 N 3.82 0.00 0.00 2.79 0.63 -1.26 -2.76 116.66 119.87 2r1r n ARG 269 Ca -0.19 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.74 2r1r n ARG 269 Cb 0.52 -2.20 0.00 0.00 0.45 0.00 0.00 32.46 31.23 2r1r n ARG 269 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2r1r n GLY 270 N -1.97 0.11 0.04 5.14 0.00 -1.26 -4.75 105.19 102.50 2r1r n GLY 270 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2r1r n GLY 270 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r1r n GLY 271 N 0.00 -2.69 0.00 -0.02 0.00 -1.26 -4.82 105.19 96.39 2r1r n GLY 271 Ca 0.00 -0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 2r1r n GLY 271 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2r1r n GLU 272 N -0.01 0.06 -3.63 1.61 -0.58 -1.25 -4.84 120.64 112.00 2r1r n GLU 272 Ca 0.00 0.10 -0.07 0.00 -0.42 0.00 0.00 57.16 56.77 2r1r n GLU 272 Cb 0.51 -1.50 -0.07 0.00 -0.57 0.00 0.00 31.44 29.82 2r1r n GLU 272 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2r1r s ALA 273 N -2.93 -2.05 -0.12 0.62 0.00 -1.11 -5.03 121.76 111.14 2r1r s ALA 273 Ca 0.13 1.78 -0.00 0.00 0.00 0.00 0.00 51.96 53.86 2r1r s ALA 273 Cb 0.15 -1.44 -0.02 0.00 0.00 0.00 0.00 23.12 21.82 2r1r s ALA 273 CO 0.41 -0.21 -0.11 -0.06 0.00 0.00 0.00 175.76 175.80 2r1r s PHE 274 N -0.12 2.85 0.54 0.00 0.40 -1.26 0.89 117.98 121.27 2r1r s PHE 274 Ca 0.04 -0.46 -0.18 0.00 -0.60 0.00 0.00 56.93 55.73 2r1r s PHE 274 Cb -0.04 -1.83 -0.12 0.00 0.51 0.00 0.00 43.02 41.55 2r1r s PHE 274 CO -0.08 -0.08 0.23 1.58 0.70 0.00 0.00 175.22 177.58 2r1r n HIS 275 N 3.26 -1.67 -0.00 0.36 -0.00 0.37 -4.84 115.22 112.69 2r1r n HIS 275 Ca -0.18 0.45 0.00 0.00 0.46 0.00 0.00 57.72 58.46 2r1r n HIS 275 Cb 0.53 -1.84 -0.11 0.00 -0.12 0.00 0.00 29.99 28.45 2r1r n HIS 275 CO 0.00 0.00 0.00 -2.37 0.46 0.00 0.00 176.34 174.43 2r1r n THR 276 N -1.59 0.97 0.00 3.57 5.66 -1.26 -2.71 114.28 118.92 2r1r n THR 276 Ca 0.10 -0.68 0.00 0.00 -3.05 0.00 0.00 64.05 60.42 2r1r n THR 276 Cb 0.47 -0.51 0.00 0.00 -1.55 0.00 0.00 70.33 68.74 2r1r n THR 276 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2r1r n GLY 277 N 1.44 2.76 0.12 1.09 0.00 -1.26 -4.83 105.19 104.51 2r1r n GLY 277 Ca -0.13 -1.96 -0.18 0.00 0.00 0.00 0.00 46.02 43.75 2r1r n GLY 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r1r n ILE 279 N -3.38 -0.61 -0.32 0.00 2.08 -1.26 0.26 119.36 116.13 2r1r n ILE 279 Ca -0.27 2.27 0.18 0.00 0.56 0.00 0.00 62.75 65.50 2r1r n ILE 279 Cb 1.05 -2.81 0.38 0.00 -0.75 0.00 0.00 39.64 37.50 2r1r n ILE 279 CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 2r1r h PRO 280 N 0.00 0.25 -0.10 0.38 0.11 -1.90 0.19 132.00 130.93 2r1r h PRO 280 Ca 0.14 -0.02 -0.23 0.00 0.11 0.00 0.00 66.00 66.01 2r1r h PRO 280 Cb 0.37 -0.06 0.01 0.00 0.11 0.00 0.00 31.00 31.43 2r1r h PRO 280 CO -0.85 0.17 -0.83 0.74 -0.21 0.00 0.00 178.00 177.02 2r1r h PHE 281 N 0.26 0.95 -0.60 0.65 0.04 -0.43 -2.86 116.94 114.95 2r1r h PHE 281 Ca 0.64 -0.44 0.03 0.00 2.80 0.00 0.00 57.97 60.99 2r1r h PHE 281 Cb 1.38 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 39.35 2r1r h PHE 281 CO -0.15 1.26 0.37 1.88 -0.60 0.00 0.00 178.31 181.07 2r1r h TYR 282 N 0.45 0.69 -0.94 -0.55 -1.99 0.87 0.17 116.97 115.66 2r1r h TYR 282 Ca -0.06 0.02 0.06 0.00 2.00 0.00 0.00 58.73 60.75 2r1r h TYR 282 Cb 1.45 -0.22 -0.06 0.00 2.00 0.00 0.00 36.73 39.90 2r1r h TYR 282 CO 0.08 0.39 0.61 -0.22 -0.00 0.00 0.00 178.16 179.03 2r1r h LYS 283 N 0.73 1.05 -0.09 4.88 3.64 -1.11 0.57 116.57 126.24 2r1r h LYS 283 Ca 0.24 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.46 2r1r h LYS 283 Cb 0.02 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.59 2r1r h LYS 283 CO -0.10 0.70 -0.41 1.25 -2.27 0.00 0.00 179.45 178.61 2r1r h HIS 284 N 1.09 0.22 0.00 1.91 2.76 -0.59 -2.02 115.15 118.52 2r1r h HIS 284 Ca 0.41 -0.06 -0.12 0.00 -2.20 0.00 0.00 60.37 58.40 2r1r h HIS 284 Cb 0.19 -0.05 -0.02 0.00 1.55 0.00 0.00 27.41 29.08 2r1r h HIS 284 CO -0.00 0.57 -0.58 0.74 -1.30 0.00 0.00 177.93 177.37 2r1r h PHE 285 N 0.16 0.00 0.18 5.26 0.04 0.67 -2.25 116.94 121.00 2r1r h PHE 285 Ca 0.01 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.78 2r1r h PHE 285 Cb 0.80 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.95 2r1r h PHE 285 CO 0.01 0.58 -0.09 0.37 -0.60 0.00 0.00 178.31 178.58 2r1r h GLN 286 N 0.00 -0.23 -0.80 1.51 4.15 -0.48 -1.62 115.11 117.64 2r1r h GLN 286 Ca -0.01 0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.51 2r1r h GLN 286 Cb 1.19 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 28.88 2r1r h GLN 286 CO 0.07 0.10 0.52 1.79 -1.93 0.00 0.00 178.83 179.39 2r1r h THR 287 N -0.60 1.00 0.24 2.39 1.35 -1.41 0.62 112.91 116.51 2r1r h THR 287 Ca -0.02 -0.28 -0.01 0.00 -0.55 0.00 0.00 66.41 65.55 2r1r h THR 287 Cb 0.44 0.12 -0.00 0.00 -1.73 0.00 0.00 68.15 66.98 2r1r h THR 287 CO 0.04 0.15 -0.14 0.00 -0.25 0.00 0.00 175.52 175.32 2r1r h ALA 288 N 1.58 -0.36 -0.76 6.62 0.00 -1.25 -1.29 119.26 123.80 2r1r h ALA 288 Ca 0.35 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.24 2r1r h ALA 288 Cb 0.32 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.23 2r1r h ALA 288 CO -0.13 -0.71 0.46 0.28 0.00 0.00 0.00 179.25 179.16 2r1r h VAL 289 N -0.37 1.06 -0.18 0.00 2.07 -0.10 -2.19 116.25 116.54 2r1r h VAL 289 Ca -0.03 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.19 2r1r h VAL 289 Cb 0.30 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 2r1r h VAL 289 CO 0.03 0.16 0.00 0.29 0.02 0.00 0.00 177.57 178.07 2r1r n LYS 290 N -4.66 1.70 -0.26 1.57 4.01 0.05 -4.45 118.16 116.12 2r1r n LYS 290 Ca 0.09 -1.06 0.24 0.00 -0.51 0.00 0.00 58.31 57.07 2r1r n LYS 290 Cb 0.13 -1.37 0.59 0.00 -0.51 0.00 0.00 35.03 33.87 2r1r n LYS 290 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 2r1r h SER 291 N 2.08 0.27 -1.02 4.39 4.64 -0.56 -2.57 113.55 120.78 2r1r h SER 291 Ca 0.00 0.04 -0.59 0.00 -0.47 0.00 0.00 61.79 60.76 2r1r h SER 291 Cb 0.46 -0.01 -0.39 0.00 -0.31 0.00 0.00 62.40 62.15 2r1r h SER 291 CO 0.00 0.08 -0.38 0.00 -0.87 0.00 0.00 176.83 175.66 2r1r s SER 293 N -3.12 4.23 -0.62 0.00 0.01 -0.97 -4.98 113.70 108.26 2r1r s SER 293 Ca 0.53 -1.20 -0.28 0.00 1.31 0.00 0.00 55.95 56.31 2r1r s SER 293 Cb 0.43 -0.40 0.03 0.00 0.21 0.00 0.00 66.02 66.29 2r1r s SER 293 CO -0.04 -0.54 1.20 -1.10 0.41 0.00 0.00 173.24 173.17 2r1r s GLN 294 N -3.85 3.41 0.00 12.44 -1.52 -1.25 -4.27 119.66 124.62 2r1r s GLN 294 Ca 0.38 0.08 0.00 0.00 -1.95 0.00 0.00 55.36 53.86 2r1r s GLN 294 Cb 0.06 -4.06 0.00 0.00 -0.22 0.00 0.00 33.01 28.78 2r1r s GLN 294 CO 0.20 -1.79 0.00 0.41 -0.25 0.00 0.00 175.29 173.86 2r1r n GLY 295 N 5.15 2.02 0.00 3.09 0.00 -1.26 -2.83 105.19 111.36 2r1r n GLY 295 Ca 0.07 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2r1r n GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r1r n GLY 296 N 0.00 0.00 1.16 -0.02 0.00 -1.26 -5.06 105.19 100.01 2r1r n GLY 296 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2r1r n GLY 296 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2r1r n VAL 297 N 0.00 0.03 -1.77 1.61 0.31 -1.13 -5.04 118.33 112.34 2r1r n VAL 297 Ca 0.00 0.01 -0.39 0.00 -0.01 0.00 0.00 64.34 63.95 2r1r n VAL 297 Cb 0.00 -0.85 -0.03 0.00 -0.91 0.00 0.00 33.84 32.05 2r1r n VAL 297 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2r1r s ARG 298 N -1.02 2.55 0.00 5.55 1.81 -1.25 -4.85 118.95 121.73 2r1r s ARG 298 Ca 0.00 1.24 0.00 0.00 -1.72 0.00 0.00 55.73 55.25 2r1r s ARG 298 Cb 0.00 -4.45 0.00 0.00 -0.45 0.00 0.00 34.95 30.05 2r1r s ARG 298 CO 0.00 -2.78 0.00 0.41 -0.68 0.00 0.00 175.30 172.25 2r1r n GLY 299 N 5.80 -0.12 2.03 -3.53 0.00 -1.26 -3.87 105.19 104.24 2r1r n GLY 299 Ca 0.29 -1.88 -0.02 0.00 0.00 0.00 0.00 46.02 44.41 2r1r n GLY 299 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r1r n GLY 300 N -0.18 -3.83 3.58 -0.02 0.00 -1.26 -4.82 105.19 98.66 2r1r n GLY 300 Ca 0.00 0.41 -0.30 0.00 0.00 0.00 0.00 46.02 46.14 2r1r n GLY 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r1r s ALA 301 N -0.50 2.98 0.03 4.61 0.00 -1.26 -4.76 121.76 122.85 2r1r s ALA 301 Ca -0.08 -1.25 -0.13 0.00 0.00 0.00 0.00 51.96 50.50 2r1r s ALA 301 Cb 0.01 -0.91 0.02 0.00 0.00 0.00 0.00 23.12 22.24 2r1r s ALA 301 CO 0.37 0.64 0.29 0.00 0.00 0.00 0.00 175.76 177.06 2r1r s ALA 302 N -1.24 -0.66 -0.10 0.00 0.00 -1.26 -1.25 121.76 117.25 2r1r s ALA 302 Ca 0.22 0.02 -0.01 0.00 0.00 0.00 0.00 51.96 52.19 2r1r s ALA 302 Cb -0.11 0.28 0.03 0.00 0.00 0.00 0.00 23.12 23.31 2r1r s ALA 302 CO 0.14 -0.38 -0.06 0.99 0.00 0.00 0.00 175.76 176.45 2r1r s THR 303 N -2.35 0.90 -0.11 0.00 2.01 -0.90 -1.91 115.64 113.27 2r1r s THR 303 Ca -0.06 -0.21 -0.06 0.00 0.31 0.00 0.00 61.69 61.67 2r1r s THR 303 Cb -0.02 -0.94 -0.04 0.00 0.01 0.00 0.00 72.50 71.51 2r1r s THR 303 CO -0.02 0.35 0.10 -0.22 -0.69 0.00 0.00 174.62 174.14 2r1r s LEU 304 N 1.75 4.16 0.06 4.42 0.20 0.11 -1.25 118.68 128.13 2r1r s LEU 304 Ca 0.05 0.37 0.06 0.00 0.69 0.00 0.00 54.13 55.30 2r1r s LEU 304 Cb -0.12 -2.00 -0.04 0.00 -0.43 0.00 0.00 46.19 43.60 2r1r s LEU 304 CO -0.08 0.39 -0.13 -0.36 -0.29 0.00 0.00 176.35 175.89 2r1r s PHE 305 N -0.95 2.69 -0.03 5.38 0.40 0.04 0.64 117.98 126.15 2r1r s PHE 305 Ca 0.14 -0.18 -0.27 0.00 -0.60 0.00 0.00 56.93 56.03 2r1r s PHE 305 Cb -0.12 -1.48 0.06 0.00 0.51 0.00 0.00 43.02 41.99 2r1r s PHE 305 CO 0.03 0.34 0.59 1.52 0.70 0.00 0.00 175.22 178.40 2r1r s TYR 306 N -1.04 -0.54 0.66 0.36 -0.85 -0.97 -2.38 117.35 112.59 2r1r s TYR 306 Ca 0.17 0.89 -0.16 0.00 -0.52 0.00 0.00 57.07 57.46 2r1r s TYR 306 Cb -0.11 0.34 0.00 0.00 0.38 0.00 0.00 41.96 42.57 2r1r s TYR 306 CO 0.09 -0.57 1.15 -1.25 -1.52 0.00 0.00 175.55 173.45 2r1r s PRO 307 N -1.32 2.67 0.39 -3.49 0.04 -1.26 -1.72 135.00 130.31 2r1r s PRO 307 Ca -0.11 1.55 0.25 0.00 0.04 0.00 0.00 61.00 62.73 2r1r s PRO 307 Cb -0.01 -1.92 0.62 0.00 0.04 0.00 0.00 34.50 33.23 2r1r s PRO 307 CO 0.08 -1.38 1.70 1.98 0.04 0.00 0.00 177.00 179.42 2r1r h MET 308 N 0.11 0.00 -0.14 4.56 4.05 -1.78 -3.06 114.93 118.68 2r1r h MET 308 Ca -0.48 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.94 2r1r h MET 308 Cb 1.27 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.07 2r1r h MET 308 CO 0.53 0.00 0.00 -2.67 0.23 0.00 0.00 176.91 175.00 2r1r n TRP 309 N -2.85 0.17 -1.62 1.39 4.27 -1.26 -4.83 117.44 112.69 2r1r n TRP 309 Ca 0.04 -0.08 -0.38 0.00 -3.89 0.00 0.00 57.50 53.18 2r1r n TRP 309 Cb 0.46 0.00 0.05 0.00 -1.36 0.00 0.00 31.31 30.46 2r1r n TRP 309 CO 0.00 0.00 0.00 1.58 -2.29 0.00 0.00 177.69 176.98 2r1r n HIS 310 N 0.40 0.94 0.24 -2.67 -0.00 -1.16 -0.86 115.22 112.11 2r1r n HIS 310 Ca 0.17 0.45 0.11 0.00 0.46 0.00 0.00 57.72 58.91 2r1r n HIS 310 Cb 0.37 -2.16 0.61 0.00 -0.12 0.00 0.00 29.99 28.68 2r1r n HIS 310 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 2r1r h LEU 311 N 0.64 0.00 -1.91 0.27 5.85 -1.26 -2.73 115.31 116.17 2r1r h LEU 311 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2r1r h LEU 311 Cb 1.36 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.39 2r1r h LEU 311 CO 0.52 0.18 0.00 -0.62 -0.34 0.00 0.00 178.44 178.18 2r1r n GLU 312 N -3.58 2.25 -0.31 1.25 1.02 -1.26 -4.68 120.64 115.33 2r1r n GLU 312 Ca -0.01 -1.89 0.16 0.00 -0.02 0.00 0.00 57.16 55.40 2r1r n GLU 312 Cb 0.32 -1.47 0.33 0.00 -0.02 0.00 0.00 31.44 30.60 2r1r n GLU 312 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 2r1r h VAL 313 N 3.78 0.23 -0.04 2.62 3.04 -1.81 0.30 116.25 124.38 2r1r h VAL 313 Ca 0.00 -0.05 -0.04 0.00 -1.01 0.00 0.00 66.70 65.60 2r1r h VAL 313 Cb 0.83 0.06 -0.01 0.00 -2.01 0.00 0.00 31.29 30.16 2r1r h VAL 313 CO 0.00 0.03 -0.15 -0.33 -1.01 0.00 0.00 177.57 176.11 2r1r h GLU 314 N 0.16 0.06 0.00 4.17 5.08 -1.85 -0.69 114.58 121.50 2r1r h GLU 314 Ca 0.60 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.79 2r1r h GLU 314 Cb 1.27 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.49 2r1r h GLU 314 CO -0.71 0.21 -0.83 0.77 -1.00 0.00 0.00 179.01 177.45 2r1r h SER 315 N 0.05 0.00 0.02 1.42 0.02 -0.81 -3.36 113.55 110.90 2r1r h SER 315 Ca 0.01 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.82 2r1r h SER 315 Cb 0.30 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.85 2r1r h SER 315 CO 0.02 0.73 -0.55 -0.07 -1.14 0.00 0.00 176.83 175.82 2r1r h LEU 316 N 0.00 0.45 -1.27 5.07 3.38 -0.60 -3.33 115.31 119.02 2r1r h LEU 316 Ca -0.03 -0.79 0.24 0.00 0.09 0.00 0.00 57.88 57.38 2r1r h LEU 316 Cb 1.58 -0.14 -0.09 0.00 0.09 0.00 0.00 40.66 42.10 2r1r h LEU 316 CO 0.09 1.19 0.64 -0.07 0.09 0.00 0.00 178.44 180.37 2r1r h LEU 317 N -0.23 0.54 -3.99 1.67 4.07 -1.29 -1.82 115.31 114.26 2r1r h LEU 317 Ca -0.07 0.08 -0.53 0.00 0.08 0.00 0.00 57.88 57.44 2r1r h LEU 317 Cb 1.29 -0.01 -0.31 0.00 1.08 0.00 0.00 40.66 42.71 2r1r h LEU 317 CO 0.11 0.15 0.67 1.33 -1.08 0.00 0.00 178.44 179.61 2r1r n VAL 318 N -4.66 3.24 0.24 1.22 0.24 -1.25 -4.54 118.33 112.81 2r1r n VAL 318 Ca 0.24 -2.02 0.12 0.00 -2.04 0.00 0.00 64.34 60.64 2r1r n VAL 318 Cb 0.76 -0.53 0.50 0.00 -1.47 0.00 0.00 33.84 33.11 2r1r n VAL 318 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2r1r h LEU 319 N 1.09 0.00 0.00 1.34 3.38 -1.47 -2.94 115.31 116.71 2r1r h LEU 319 Ca 0.63 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.42 2r1r h LEU 319 Cb 2.68 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 43.40 2r1r h LEU 319 CO 1.14 0.16 -1.98 0.29 0.09 0.00 0.00 178.44 178.14 2r1r n LYS 320 N -3.30 0.66 -1.54 1.13 5.02 -1.26 -2.36 118.16 116.51 2r1r n LYS 320 Ca 0.00 -0.02 -0.59 0.00 -2.02 0.00 0.00 58.31 55.68 2r1r n LYS 320 Cb 0.40 -1.60 -0.09 0.00 -0.02 0.00 0.00 35.03 33.72 2r1r n LYS 320 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2r1r n ASN 321 N -2.60 1.60 -0.35 4.39 5.15 -1.11 -4.80 115.26 117.53 2r1r n ASN 321 Ca -0.16 0.86 -0.03 0.00 -0.60 0.00 0.00 54.58 54.65 2r1r n ASN 321 Cb 0.86 -1.03 0.10 0.00 -0.53 0.00 0.00 39.78 39.17 2r1r n ASN 321 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2r1r h ASN 322 N 8.18 1.11 -0.79 1.20 -1.07 -1.91 -3.38 115.58 118.93 2r1r h ASN 322 Ca -0.32 -0.06 -0.44 0.00 0.07 0.00 0.00 56.30 55.55 2r1r h ASN 322 Cb 1.36 -0.28 -0.06 0.00 -2.07 0.00 0.00 38.32 37.27 2r1r h ASN 322 CO 1.01 0.84 1.24 -0.60 0.07 0.00 0.00 177.43 180.00 2r1r s ARG 323 N -6.01 3.04 -0.11 4.14 3.52 -1.26 -4.86 118.95 117.40 2r1r s ARG 323 Ca -0.13 -0.98 -0.33 0.00 -0.13 0.00 0.00 55.73 54.16 2r1r s ARG 323 Cb 0.17 -5.26 0.14 0.00 -1.56 0.00 0.00 34.95 28.45 2r1r s ARG 323 CO 0.82 -3.03 1.40 0.20 -0.81 0.00 0.00 175.30 173.88 2r1r s GLY 324 N 6.29 -0.45 0.23 8.12 0.00 -1.26 -5.13 107.32 115.12 2r1r s GLY 324 Ca 0.61 1.06 -0.31 0.00 0.00 0.00 0.00 44.72 46.08 2r1r s GLY 324 CO 0.01 0.24 1.67 0.54 0.00 0.00 0.00 173.10 175.56 2r1r s VAL 325 N -2.10 2.09 0.26 1.40 0.11 -1.26 -4.90 120.40 116.01 2r1r s VAL 325 Ca 0.14 0.07 -0.01 0.00 -2.93 0.00 0.00 61.98 59.25 2r1r s VAL 325 Cb 0.06 -3.05 0.24 0.00 -1.53 0.00 0.00 36.38 32.11 2r1r s VAL 325 CO -0.06 0.01 1.74 -0.08 -3.33 0.00 0.00 175.10 173.38 2r1r h GLU 326 N 6.18 0.51 -1.07 1.54 4.81 -1.95 -1.17 114.58 123.44 2r1r h GLU 326 Ca -0.44 -0.03 0.32 0.00 -0.13 0.00 0.00 59.36 59.08 2r1r h GLU 326 Cb 1.21 -0.11 -0.13 0.00 0.63 0.00 0.00 28.75 30.34 2r1r h GLU 326 CO 0.90 0.34 0.65 0.78 -0.73 0.00 0.00 179.01 180.94 2r1r h GLY 327 N 0.52 1.72 -4.38 1.92 0.00 -2.05 -1.61 103.07 99.19 2r1r h GLY 327 Ca 0.46 -0.22 -0.65 0.00 0.00 0.00 0.00 47.33 46.92 2r1r h GLY 327 CO -0.40 -0.36 0.13 0.70 0.00 0.00 0.00 176.54 176.60 2r1r n ASN 328 N -4.87 6.25 -3.72 0.19 4.13 -0.44 -4.94 115.26 111.85 2r1r n ASN 328 Ca 0.31 -3.78 -0.15 0.00 1.68 0.00 0.00 54.58 52.63 2r1r n ASN 328 Cb 1.00 -0.73 -0.15 0.00 -1.54 0.00 0.00 39.78 38.36 2r1r n ASN 328 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2r1r s ARG 329 N -3.77 0.03 -0.69 3.52 1.81 -0.61 -4.74 118.95 114.50 2r1r s ARG 329 Ca 0.54 0.39 0.05 0.00 -1.72 0.00 0.00 55.73 54.98 2r1r s ARG 329 Cb 0.44 -0.26 0.17 0.00 -0.45 0.00 0.00 34.95 34.85 2r1r s ARG 329 CO -0.17 -0.22 0.48 0.08 -0.68 0.00 0.00 175.30 174.79 2r1r s VAL 330 N 1.57 2.77 0.29 3.52 1.01 -0.99 -4.98 120.40 123.58 2r1r s VAL 330 Ca -0.04 -4.19 0.14 0.00 0.00 0.00 0.00 61.98 57.89 2r1r s VAL 330 Cb -0.12 -2.82 0.06 0.00 0.00 0.00 0.00 36.38 33.50 2r1r s VAL 330 CO -0.05 -1.01 1.73 0.03 0.00 0.00 0.00 175.10 175.80 2r1r h ARG 331 N 5.43 0.00 -1.15 2.72 3.08 -1.91 -3.37 114.38 119.19 2r1r h ARG 331 Ca 0.15 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.67 2r1r h ARG 331 Cb 0.76 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 30.57 2r1r h ARG 331 CO 0.70 0.46 0.68 0.72 -1.07 0.00 0.00 179.97 181.46 2r1r n HIS 332 N -3.84 2.62 -3.86 3.04 8.25 -1.26 -4.87 115.22 115.30 2r1r n HIS 332 Ca -0.01 -2.46 -0.12 0.00 -0.26 0.00 0.00 57.72 54.87 2r1r n HIS 332 Cb 0.50 -1.19 -0.12 0.00 1.12 0.00 0.00 29.99 30.30 2r1r n HIS 332 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2r1r s MET 333 N -3.04 0.27 0.34 -0.41 -1.94 -1.26 -4.80 119.30 108.46 2r1r s MET 333 Ca 0.52 -0.09 -0.07 0.00 -1.71 0.00 0.00 55.69 54.34 2r1r s MET 333 Cb 0.41 0.12 -0.06 0.00 2.01 0.00 0.00 34.83 37.31 2r1r s MET 333 CO 0.01 -0.05 0.64 -0.51 -0.01 0.00 0.00 175.02 175.10 2r1r s ASP 334 N -0.55 6.47 0.11 3.03 1.01 -0.81 -4.95 116.67 120.99 2r1r s ASP 334 Ca -0.06 0.87 0.09 0.00 0.71 0.00 0.00 52.55 54.16 2r1r s ASP 334 Cb -0.04 -2.21 -0.04 0.00 1.01 0.00 0.00 42.92 41.64 2r1r s ASP 334 CO 0.00 -0.28 -0.22 -0.31 0.21 0.00 0.00 175.17 174.57 2r1r s TYR 335 N -2.20 1.93 -0.19 4.23 2.02 -1.20 -0.71 117.35 121.23 2r1r s TYR 335 Ca 0.47 -0.41 0.01 0.00 -0.37 0.00 0.00 57.07 56.76 2r1r s TYR 335 Cb -0.11 -1.05 0.04 0.00 -0.40 0.00 0.00 41.96 40.44 2r1r s TYR 335 CO 0.31 0.24 -0.10 0.20 -1.57 0.00 0.00 175.55 174.63 2r1r s GLY 336 N -1.94 1.20 -0.13 0.71 0.00 0.21 -0.44 107.32 106.92 2r1r s GLY 336 Ca 0.08 -1.10 -0.21 0.00 0.00 0.00 0.00 44.72 43.49 2r1r s GLY 336 CO 0.05 0.71 0.63 0.14 0.00 0.00 0.00 173.10 174.63 2r1r s VAL 337 N 1.45 5.06 -0.24 1.40 1.01 0.94 -2.30 120.40 127.72 2r1r s VAL 337 Ca -0.00 1.25 -0.19 0.00 0.00 0.00 0.00 61.98 63.04 2r1r s VAL 337 Cb -0.16 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.24 2r1r s VAL 337 CO -0.08 0.20 0.56 -1.10 0.00 0.00 0.00 175.10 174.68 2r1r s GLN 338 N 1.26 4.12 0.16 2.72 -0.21 -0.70 -1.57 119.66 125.43 2r1r s GLN 338 Ca 0.32 0.44 0.09 0.00 0.02 0.00 0.00 55.36 56.22 2r1r s GLN 338 Cb -0.16 -3.63 -0.04 0.00 1.00 0.00 0.00 33.01 30.18 2r1r s GLN 338 CO 0.13 -0.32 -0.20 0.42 -2.12 0.00 0.00 175.29 173.20 2r1r s ILE 339 N 2.21 1.90 0.31 1.08 1.01 -0.58 -2.10 121.20 125.04 2r1r s ILE 339 Ca 0.24 -1.86 0.04 0.00 0.00 0.00 0.00 60.65 59.07 2r1r s ILE 339 Cb -0.16 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 2r1r s ILE 339 CO 0.09 -0.22 0.17 0.54 0.00 0.00 0.00 174.94 175.52 2r1r s ASN 340 N -2.50 1.64 0.19 3.58 4.22 -1.26 -2.11 114.94 118.71 2r1r s ASN 340 Ca 0.15 -1.59 -0.14 0.00 -2.14 0.00 0.00 52.86 49.14 2r1r s ASN 340 Cb -0.07 0.42 0.20 0.00 1.28 0.00 0.00 41.25 43.07 2r1r s ASN 340 CO 0.07 -0.91 1.65 0.50 -2.04 0.00 0.00 177.10 176.37 2r1r h LYS 341 N 2.17 0.03 -0.44 3.55 3.11 -1.99 -2.19 116.57 120.81 2r1r h LYS 341 Ca -0.33 -0.00 0.08 0.00 -2.81 0.00 0.00 60.65 57.60 2r1r h LYS 341 Cb 1.25 -0.01 -0.08 0.00 -1.00 0.00 0.00 32.23 32.40 2r1r h LYS 341 CO 0.50 0.02 -0.04 1.25 -2.81 0.00 0.00 179.45 178.38 2r1r h LEU 342 N 0.03 -0.26 -0.43 5.20 5.85 -1.98 -1.55 115.31 122.18 2r1r h LEU 342 Ca 0.26 0.11 0.08 0.00 0.84 0.00 0.00 57.88 59.18 2r1r h LEU 342 Cb 0.41 0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.58 2r1r h LEU 342 CO -0.52 -0.09 0.01 0.24 -0.34 0.00 0.00 178.44 177.74 2r1r h MET 343 N 0.07 0.11 -0.83 1.25 2.86 -1.81 -1.21 114.93 115.37 2r1r h MET 343 Ca 0.22 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.82 2r1r h MET 343 Cb 0.32 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 31.92 2r1r h MET 343 CO -0.39 0.07 0.41 1.88 1.06 0.00 0.00 176.91 179.94 2r1r h TYR 344 N 0.12 1.18 -0.27 -0.22 0.05 -1.27 -2.88 116.97 113.68 2r1r h TYR 344 Ca 0.21 -0.05 0.02 0.00 0.05 0.00 0.00 58.73 58.96 2r1r h TYR 344 Cb 0.30 -0.37 -0.03 0.00 1.01 0.00 0.00 36.73 37.65 2r1r h TYR 344 CO -0.28 0.85 0.11 1.15 -1.05 0.00 0.00 178.16 178.94 2r1r h THR 345 N 1.17 0.96 -0.94 -2.88 2.02 -0.32 -1.17 112.91 111.75 2r1r h THR 345 Ca 0.29 -0.08 0.17 0.00 0.77 0.00 0.00 66.41 67.56 2r1r h THR 345 Cb 0.10 0.69 -0.10 0.00 -1.74 0.00 0.00 68.15 67.10 2r1r h THR 345 CO -0.04 0.04 0.53 0.03 0.37 0.00 0.00 175.52 176.46 2r1r h ARG 346 N 0.24 0.68 -0.61 6.66 2.47 -1.09 -0.91 114.38 121.82 2r1r h ARG 346 Ca 0.11 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.76 2r1r h ARG 346 Cb 0.06 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.20 2r1r h ARG 346 CO -0.10 0.45 0.26 1.25 0.56 0.00 0.00 179.97 182.39 2r1r h LEU 347 N 0.70 0.82 -0.31 3.04 5.85 -1.04 -0.87 115.31 123.51 2r1r h LEU 347 Ca 0.53 -0.15 -0.14 0.00 0.84 0.00 0.00 57.88 58.96 2r1r h LEU 347 Cb 0.80 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 2r1r h LEU 347 CO -0.38 0.74 -0.37 -0.07 -0.34 0.00 0.00 178.44 178.03 2r1r h LEU 348 N 0.84 0.86 0.00 2.25 3.38 -0.42 -2.91 115.31 119.30 2r1r h LEU 348 Ca 0.20 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2r1r h LEU 348 Cb 0.17 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2r1r h LEU 348 CO -0.02 1.17 0.00 0.29 0.09 0.00 0.00 178.44 179.97 2r1r n LYS 349 N -4.16 0.39 -1.70 1.13 5.02 -0.66 -4.89 118.16 113.28 2r1r n LYS 349 Ca -0.04 0.05 -0.12 0.00 -2.02 0.00 0.00 58.31 56.18 2r1r n LYS 349 Cb 0.52 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.00 2r1r n LYS 349 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2r1r n GLY 350 N 0.83 0.72 0.00 0.72 0.00 -0.82 -5.01 105.19 101.63 2r1r n GLY 350 Ca 0.12 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2r1r n GLY 350 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2r1r n GLU 351 N -2.44 1.13 -4.05 1.61 1.02 -0.39 -4.83 120.64 112.69 2r1r n GLU 351 Ca -0.13 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.80 2r1r n GLU 351 Cb 0.48 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.85 2r1r n GLU 351 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2r1r s ASP 352 N -1.00 5.49 -0.08 1.62 1.01 -1.26 -1.74 116.67 120.70 2r1r s ASP 352 Ca 0.00 -0.30 0.03 0.00 0.71 0.00 0.00 52.55 52.99 2r1r s ASP 352 Cb 0.00 -1.32 -0.02 0.00 1.01 0.00 0.00 42.92 42.59 2r1r s ASP 352 CO 0.00 -0.10 -0.17 -0.63 0.21 0.00 0.00 175.17 174.48 2r1r s ILE 353 N -2.17 2.74 -0.21 0.77 1.01 0.17 -4.74 121.20 118.76 2r1r s ILE 353 Ca 0.35 -0.81 -0.11 0.00 0.00 0.00 0.00 60.65 60.07 2r1r s ILE 353 Cb -0.07 -2.08 -0.05 0.00 0.01 0.00 0.00 42.46 40.26 2r1r s ILE 353 CO 0.25 0.56 0.19 -0.89 0.00 0.00 0.00 174.94 175.05 2r1r s THR 354 N -0.14 5.35 -0.14 2.92 2.01 -1.26 -1.06 115.64 123.32 2r1r s THR 354 Ca -0.02 0.28 -0.12 0.00 0.31 0.00 0.00 61.69 62.14 2r1r s THR 354 Cb -0.14 -3.53 -0.05 0.00 0.01 0.00 0.00 72.50 68.80 2r1r s THR 354 CO 0.04 0.37 0.25 -0.76 -0.69 0.00 0.00 174.62 173.82 2r1r s LEU 355 N 0.81 4.29 0.19 4.42 1.43 0.28 -4.86 118.68 125.23 2r1r s LEU 355 Ca 0.10 0.50 0.06 0.00 -1.03 0.00 0.00 54.13 53.76 2r1r s LEU 355 Cb -0.13 -2.29 -0.05 0.00 0.03 0.00 0.00 46.19 43.76 2r1r s LEU 355 CO 0.03 0.20 -0.11 -0.36 0.23 0.00 0.00 176.35 176.34 2r1r s PHE 356 N -0.02 1.53 -0.12 0.29 0.08 -0.04 -2.69 117.98 117.01 2r1r s PHE 356 Ca 0.15 -0.68 -0.19 0.00 0.12 0.00 0.00 56.93 56.33 2r1r s PHE 356 Cb -0.13 -0.76 -0.04 0.00 -0.57 0.00 0.00 43.02 41.53 2r1r s PHE 356 CO 0.04 0.21 0.53 0.45 -0.10 0.00 0.00 175.22 176.35 2r1r s SER 357 N -3.26 6.74 0.26 1.36 0.15 -1.26 -0.81 113.70 116.88 2r1r s SER 357 Ca 0.21 0.88 -0.03 0.00 0.70 0.00 0.00 55.95 57.71 2r1r s SER 357 Cb 0.01 -2.31 0.53 0.00 -1.71 0.00 0.00 66.02 62.54 2r1r s SER 357 CO 0.05 -0.04 1.66 -0.65 1.20 0.00 0.00 173.24 175.45 2r1r h PRO 358 N 6.80 0.19 -0.99 5.44 0.11 -1.89 -1.30 132.00 140.37 2r1r h PRO 358 Ca -0.40 -0.01 0.15 0.00 0.11 0.00 0.00 66.00 65.84 2r1r h PRO 358 Cb 1.18 -0.04 -0.09 0.00 0.11 0.00 0.00 31.00 32.16 2r1r h PRO 358 CO 0.76 0.13 0.62 0.66 -0.21 0.00 0.00 178.00 179.95 2r1r h SER 359 N 0.20 0.84 0.23 -2.05 4.64 -1.93 -2.77 113.55 112.70 2r1r h SER 359 Ca 0.46 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 2r1r h SER 359 Cb 0.84 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 2r1r h SER 359 CO -0.60 0.40 -0.06 0.47 -0.87 0.00 0.00 176.83 176.16 2r1r n ASP 360 N -4.65 0.52 -3.73 4.97 8.00 -0.49 -4.62 116.55 116.55 2r1r n ASP 360 Ca 0.20 -0.80 -0.29 0.00 0.71 0.00 0.00 54.79 54.61 2r1r n ASP 360 Cb 0.44 -0.05 -0.12 0.00 -0.02 0.00 0.00 41.12 41.37 2r1r n ASP 360 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2r1r s VAL 361 N -2.30 1.78 0.14 2.53 -7.23 -1.05 -4.96 120.40 109.31 2r1r s VAL 361 Ca 0.34 -3.17 -0.35 0.00 -1.81 0.00 0.00 61.98 57.00 2r1r s VAL 361 Cb 0.21 -2.21 -0.15 0.00 0.56 0.00 0.00 36.38 34.79 2r1r s VAL 361 CO 0.43 -0.98 1.49 -2.65 -0.31 0.00 0.00 175.10 173.08 2r1r n PRO 362 N 2.90 1.81 -0.73 4.82 -0.02 -1.26 -1.98 135.00 140.54 2r1r n PRO 362 Ca 0.15 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 2r1r n PRO 362 Cb 0.37 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 2r1r n PRO 362 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2r1r n GLY 363 N 3.06 1.14 0.07 -1.23 0.00 -1.26 -4.89 105.19 102.07 2r1r n GLY 363 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 2r1r n GLY 363 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2r1r h LEU 364 N 0.00 0.03 -0.18 0.99 6.46 -1.76 -2.82 115.31 118.03 2r1r h LEU 364 Ca 0.00 -0.68 0.04 0.00 -0.12 0.00 0.00 57.88 57.12 2r1r h LEU 364 Cb 0.00 -0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 39.88 2r1r h LEU 364 CO 0.00 0.70 -0.11 0.22 -0.62 0.00 0.00 178.44 178.64 2r1r h TYR 365 N -0.64 -0.26 -0.73 1.25 3.20 -1.90 -1.27 116.97 116.62 2r1r h TYR 365 Ca -0.00 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.91 2r1r h TYR 365 Cb 0.70 0.14 -0.04 0.00 1.54 0.00 0.00 36.73 39.07 2r1r h TYR 365 CO 0.16 -0.16 0.48 -0.44 -1.64 0.00 0.00 178.16 176.56 2r1r h ASP 366 N -0.10 0.81 -0.64 -2.11 3.32 -1.96 -2.65 116.42 113.10 2r1r h ASP 366 Ca 0.10 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.09 2r1r h ASP 366 Cb 0.25 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 2r1r h ASP 366 CO -0.24 0.58 0.22 0.00 -1.72 0.00 0.00 179.24 178.08 2r1r h ALA 367 N 1.28 0.83 -0.95 3.45 0.00 -1.17 -2.13 119.26 120.58 2r1r h ALA 367 Ca 0.28 -0.20 0.26 0.00 0.00 0.00 0.00 54.91 55.25 2r1r h ALA 367 Cb -0.06 -0.25 -0.17 0.00 0.00 0.00 0.00 17.79 17.31 2r1r h ALA 367 CO -0.08 0.49 0.07 0.35 0.00 0.00 0.00 179.25 180.08 2r1r h PHE 368 N 0.91 0.04 0.01 0.00 3.57 -0.86 0.82 116.94 121.42 2r1r h PHE 368 Ca 0.21 0.07 -0.19 0.00 3.53 0.00 0.00 57.97 61.58 2r1r h PHE 368 Cb 0.26 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.11 2r1r h PHE 368 CO 0.02 -0.38 -1.04 0.74 -2.23 0.00 0.00 178.31 175.41 2r1r h PHE 369 N 0.04 0.05 0.23 0.41 -1.00 -1.60 -3.42 116.94 111.66 2r1r h PHE 369 Ca 0.58 -0.04 -0.33 0.00 2.81 0.00 0.00 57.97 61.00 2r1r h PHE 369 Cb 1.20 -0.00 0.03 0.00 3.61 0.00 0.00 35.95 40.79 2r1r h PHE 369 CO -0.44 1.41 -1.46 0.00 -1.61 0.00 0.00 178.31 176.21 2r1r h ALA 370 N -0.34 -0.11 -2.78 2.45 0.00 -0.74 -3.44 119.26 114.30 2r1r h ALA 370 Ca -0.28 -0.88 -0.43 0.00 0.00 0.00 0.00 54.91 53.33 2r1r h ALA 370 Cb 1.30 0.16 -0.39 0.00 0.00 0.00 0.00 17.79 18.86 2r1r h ALA 370 CO -0.14 0.75 -0.71 0.34 0.00 0.00 0.00 179.25 179.49 2r1r s ASP 371 N -7.51 2.28 0.27 0.00 -1.08 0.22 -4.77 116.67 106.08 2r1r s ASP 371 Ca -0.08 -0.66 -0.01 0.00 -0.52 0.00 0.00 52.55 51.28 2r1r s ASP 371 Cb 0.05 -0.04 0.37 0.00 -1.46 0.00 0.00 42.92 41.84 2r1r s ASP 371 CO 0.93 -0.37 1.76 1.56 0.52 0.00 0.00 175.17 179.58 2r1r h GLN 372 N 8.38 0.72 0.27 4.34 1.08 -1.88 -0.03 115.11 127.99 2r1r h GLN 372 Ca -0.16 -0.20 0.01 0.00 -1.45 0.00 0.00 58.65 56.84 2r1r h GLN 372 Cb 1.12 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 28.44 2r1r h GLN 372 CO 0.32 0.76 -0.34 0.93 -0.95 0.00 0.00 178.83 179.55 2r1r h GLU 373 N 0.67 -0.65 -0.70 1.46 4.39 -1.95 -1.20 114.58 116.60 2r1r h GLU 373 Ca 0.13 0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.86 2r1r h GLU 373 Cb 0.47 0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 29.24 2r1r h GLU 373 CO 0.02 -0.43 0.38 1.49 -1.16 0.00 0.00 179.01 179.31 2r1r h GLU 374 N -0.67 0.99 0.15 2.33 4.57 -1.87 -0.72 114.58 119.36 2r1r h GLU 374 Ca -0.01 -0.12 0.02 0.00 -1.18 0.00 0.00 59.36 58.07 2r1r h GLU 374 Cb 0.63 -0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 28.99 2r1r h GLU 374 CO -0.11 0.75 -0.42 0.35 -1.18 0.00 0.00 179.01 178.40 2r1r h PHE 375 N 0.97 -1.18 -0.45 0.92 3.57 -0.77 0.01 116.94 120.01 2r1r h PHE 375 Ca 0.25 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.86 2r1r h PHE 375 Cb 0.06 0.50 -0.10 0.00 2.79 0.00 0.00 35.95 39.19 2r1r h PHE 375 CO -0.00 -0.52 -0.27 1.49 -2.23 0.00 0.00 178.31 176.77 2r1r h GLU 376 N -0.68 -0.17 -0.09 1.11 4.81 -0.92 0.41 114.58 119.05 2r1r h GLU 376 Ca 0.01 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.29 2r1r h GLU 376 Cb 0.69 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 30.04 2r1r h GLU 376 CO -0.22 -0.11 -0.41 -0.09 -0.73 0.00 0.00 179.01 177.44 2r1r h ARG 377 N -0.17 -0.49 -0.51 1.92 2.43 -0.49 -0.96 114.38 116.10 2r1r h ARG 377 Ca 0.21 0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.36 2r1r h ARG 377 Cb 0.50 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.14 2r1r h ARG 377 CO -0.56 -0.33 0.14 -0.07 -1.51 0.00 0.00 179.97 177.64 2r1r h LEU 378 N -0.51 0.75 -0.51 3.80 3.38 -0.64 -2.35 115.31 119.24 2r1r h LEU 378 Ca 0.07 -0.22 0.06 0.00 0.09 0.00 0.00 57.88 57.87 2r1r h LEU 378 Cb 0.63 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 2r1r h LEU 378 CO -0.37 0.78 0.22 0.22 0.09 0.00 0.00 178.44 179.38 2r1r h TYR 379 N 0.69 0.40 0.49 1.13 3.20 0.12 0.98 116.97 123.98 2r1r h TYR 379 Ca 0.16 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.03 2r1r h TYR 379 Cb 0.31 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.48 2r1r h TYR 379 CO 0.02 0.16 -0.24 1.79 -1.64 0.00 0.00 178.16 178.26 2r1r h THR 380 N 0.43 0.49 -0.48 1.81 1.35 -1.15 -1.76 112.91 113.60 2r1r h THR 380 Ca 0.23 -0.22 0.08 0.00 -0.55 0.00 0.00 66.41 65.96 2r1r h THR 380 Cb 0.20 0.58 -0.10 0.00 -1.73 0.00 0.00 68.15 67.11 2r1r h THR 380 CO -0.20 0.04 -0.41 0.50 -0.25 0.00 0.00 175.52 175.20 2r1r h LYS 381 N -0.80 -0.26 -0.24 4.72 3.64 -0.96 0.44 116.57 123.11 2r1r h LYS 381 Ca -0.07 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 2r1r h LYS 381 Cb 0.57 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 2r1r h LYS 381 CO 0.11 -0.17 0.10 1.88 -2.27 0.00 0.00 179.45 179.10 2r1r h TYR 382 N -0.27 0.32 -0.57 1.91 0.05 -0.83 -1.84 116.97 115.75 2r1r h TYR 382 Ca 0.17 -0.00 0.08 0.00 0.05 0.00 0.00 58.73 59.03 2r1r h TYR 382 Cb 0.57 -0.11 -0.07 0.00 1.01 0.00 0.00 36.73 38.14 2r1r h TYR 382 CO -0.64 0.26 0.20 0.93 -1.05 0.00 0.00 178.16 177.86 2r1r h GLU 383 N 0.33 0.37 -0.05 4.88 5.08 0.03 -2.73 114.58 122.51 2r1r h GLU 383 Ca 0.09 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.36 2r1r h GLU 383 Cb 0.07 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2r1r h GLU 383 CO -0.01 0.25 -0.21 0.87 -1.00 0.00 0.00 179.01 178.91 2r1r h LYS 384 N 0.38 0.23 -6.00 2.33 6.56 -1.21 -3.45 116.57 115.41 2r1r h LYS 384 Ca 0.28 -0.18 -0.76 0.00 -1.06 0.00 0.00 60.65 58.92 2r1r h LYS 384 Cb 0.33 0.04 -0.03 0.00 -0.57 0.00 0.00 32.23 32.00 2r1r h LYS 384 CO -0.28 0.82 1.25 -3.47 -2.06 0.00 0.00 179.45 175.71 2r1r n ASP 385 N -4.54 1.11 0.17 0.86 -0.08 -0.74 -4.83 116.55 108.51 2r1r n ASP 385 Ca -0.08 0.70 0.04 0.00 -1.51 0.00 0.00 54.79 53.94 2r1r n ASP 385 Cb 0.44 -0.97 0.22 0.00 2.34 0.00 0.00 41.12 43.15 2r1r n ASP 385 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 2r1r h ASP 386 N 9.09 0.00 -0.77 1.67 5.19 -1.87 -3.18 116.42 126.56 2r1r h ASP 386 Ca -0.18 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.23 2r1r h ASP 386 Cb 1.39 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.86 2r1r h ASP 386 CO 1.06 0.46 0.50 0.77 -3.12 0.00 0.00 179.24 178.91 2r1r h SER 387 N 0.00 0.89 -2.77 6.45 4.64 -1.95 -3.42 113.55 117.38 2r1r h SER 387 Ca -0.00 -0.03 -0.53 0.00 -0.47 0.00 0.00 61.79 60.76 2r1r h SER 387 Cb 1.08 -0.22 0.04 0.00 -0.31 0.00 0.00 62.40 62.98 2r1r h SER 387 CO 0.06 0.65 0.92 -0.63 -0.87 0.00 0.00 176.83 176.96 2r1r s ILE 388 N -5.85 2.77 0.24 0.95 -1.09 -1.21 -4.98 121.20 112.03 2r1r s ILE 388 Ca -0.11 0.46 -0.30 0.00 -2.23 0.00 0.00 60.65 58.47 2r1r s ILE 388 Cb 0.18 -3.29 -0.09 0.00 -1.58 0.00 0.00 42.46 37.67 2r1r s ILE 388 CO 0.79 0.02 1.25 -0.60 -1.23 0.00 0.00 174.94 175.16 2r1r s ARG 389 N 1.67 4.45 0.31 2.79 3.52 -1.26 -5.00 118.95 125.42 2r1r s ARG 389 Ca 0.71 2.01 -0.20 0.00 -0.13 0.00 0.00 55.73 58.13 2r1r s ARG 389 Cb -0.42 -3.17 0.03 0.00 -1.56 0.00 0.00 34.95 29.83 2r1r s ARG 389 CO 0.32 -0.11 0.76 -1.59 -0.81 0.00 0.00 175.30 173.86 2r1r s LYS 390 N -0.79 1.89 -0.18 5.12 -2.85 -1.26 -4.64 119.74 117.03 2r1r s LYS 390 Ca 0.52 -1.11 -0.14 0.00 -1.00 0.00 0.00 55.97 54.23 2r1r s LYS 390 Cb -0.36 0.60 0.05 0.00 -2.06 0.00 0.00 37.83 36.07 2r1r s LYS 390 CO 0.42 -0.88 0.47 -1.14 0.10 0.00 0.00 175.35 174.33 2r1r s GLN 391 N -3.34 0.52 -0.09 1.78 0.74 -1.10 -4.98 119.66 113.19 2r1r s GLN 391 Ca 0.13 0.75 -0.08 0.00 0.05 0.00 0.00 55.36 56.21 2r1r s GLN 391 Cb -0.05 0.16 -0.04 0.00 1.10 0.00 0.00 33.01 34.18 2r1r s GLN 391 CO 0.08 -0.10 0.19 1.03 -0.55 0.00 0.00 175.29 175.94 2r1r s ARG 392 N 0.75 3.52 0.06 1.67 1.81 -1.26 -0.56 118.95 124.94 2r1r s ARG 392 Ca -0.04 -0.05 0.03 0.00 -1.72 0.00 0.00 55.73 53.95 2r1r s ARG 392 Cb -0.05 -3.19 -0.03 0.00 -0.45 0.00 0.00 34.95 31.23 2r1r s ARG 392 CO -0.06 0.76 -0.08 0.14 -0.68 0.00 0.00 175.30 175.38 2r1r s VAL 393 N -1.06 0.65 0.13 3.52 -7.23 -0.23 -4.96 120.40 111.23 2r1r s VAL 393 Ca 0.17 -1.26 -0.31 0.00 -1.81 0.00 0.00 61.98 58.77 2r1r s VAL 393 Cb -0.13 -0.86 -0.08 0.00 0.56 0.00 0.00 36.38 35.87 2r1r s VAL 393 CO 0.07 -0.45 1.41 -0.75 -0.31 0.00 0.00 175.10 175.07 2r1r s LYS 394 N -2.00 4.31 0.22 4.82 2.20 -1.26 0.41 119.74 128.43 2r1r s LYS 394 Ca -0.05 2.13 -0.10 0.00 -0.36 0.00 0.00 55.97 57.58 2r1r s LYS 394 Cb -0.07 -3.22 0.31 0.00 -1.51 0.00 0.00 37.83 33.33 2r1r s LYS 394 CO -0.00 -0.45 1.66 0.00 -0.36 0.00 0.00 175.35 176.20 2r1r h ALA 395 N 6.61 0.62 -0.85 3.13 0.00 -1.63 -1.06 119.26 126.08 2r1r h ALA 395 Ca -0.43 0.19 0.10 0.00 0.00 0.00 0.00 54.91 54.77 2r1r h ALA 395 Cb 1.21 0.33 -0.07 0.00 0.00 0.00 0.00 17.79 19.25 2r1r h ALA 395 CO 0.86 -0.39 0.50 0.28 0.00 0.00 0.00 179.25 180.50 2r1r h VAL 396 N 0.12 0.92 0.02 0.00 2.07 -1.87 -0.61 116.25 116.89 2r1r h VAL 396 Ca 0.33 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.56 2r1r h VAL 396 Cb 0.53 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 2r1r h VAL 396 CO -0.54 0.15 -0.01 -0.33 0.02 0.00 0.00 177.57 176.87 2r1r h GLU 397 N 0.83 -0.02 0.31 1.57 5.08 -1.60 -1.24 114.58 119.52 2r1r h GLU 397 Ca 0.41 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.77 2r1r h GLU 397 Cb 0.37 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 2r1r h GLU 397 CO -0.25 0.36 -0.52 1.25 -1.00 0.00 0.00 179.01 178.85 2r1r h LEU 398 N -0.41 -1.51 -0.40 1.33 5.85 -1.17 0.62 115.31 119.62 2r1r h LEU 398 Ca -0.00 0.14 0.08 0.00 0.84 0.00 0.00 57.88 58.94 2r1r h LEU 398 Cb 0.39 0.53 -0.08 0.00 0.37 0.00 0.00 40.66 41.88 2r1r h LEU 398 CO 0.00 -0.62 -0.13 -0.26 -0.34 0.00 0.00 178.44 177.09 2r1r h PHE 399 N -0.89 -0.30 -0.46 1.25 -1.00 -1.17 -1.77 116.94 112.60 2r1r h PHE 399 Ca -0.04 0.04 0.09 0.00 2.81 0.00 0.00 57.97 60.87 2r1r h PHE 399 Cb 0.83 0.19 -0.08 0.00 3.61 0.00 0.00 35.95 40.50 2r1r h PHE 399 CO -0.36 -0.21 -0.05 0.77 -1.61 0.00 0.00 178.31 176.85 2r1r h SER 400 N -0.04 -0.30 -0.80 2.17 0.02 -0.75 -0.42 113.55 113.43 2r1r h SER 400 Ca 0.19 0.12 0.05 0.00 -0.84 0.00 0.00 61.79 61.32 2r1r h SER 400 Cb 0.34 0.24 -0.06 0.00 0.14 0.00 0.00 62.40 63.06 2r1r h SER 400 CO -0.43 -0.11 0.49 0.25 -1.14 0.00 0.00 176.83 175.89 2r1r h LEU 401 N 0.06 0.78 0.03 5.07 5.85 -0.12 0.60 115.31 127.58 2r1r h LEU 401 Ca 0.23 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 2r1r h LEU 401 Cb 0.34 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2r1r h LEU 401 CO -0.43 0.51 -0.01 -0.03 -0.34 0.00 0.00 178.44 178.14 2r1r h MET 402 N 0.92 -0.04 -0.66 1.25 4.05 -0.48 -2.14 114.93 117.83 2r1r h MET 402 Ca 0.34 0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.77 2r1r h MET 402 Cb 0.12 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.90 2r1r h MET 402 CO -0.15 0.23 0.44 0.52 0.23 0.00 0.00 176.91 178.18 2r1r h MET 403 N -0.31 0.88 0.15 0.39 2.86 -0.89 0.25 114.93 118.26 2r1r h MET 403 Ca -0.00 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2r1r h MET 403 Cb 0.29 -0.20 -0.04 0.00 0.06 0.00 0.00 31.60 31.72 2r1r h MET 403 CO 0.01 0.58 -0.46 0.37 1.06 0.00 0.00 176.91 178.47 2r1r h GLN 404 N 0.90 -0.67 -0.88 1.72 4.15 -0.86 0.48 115.11 119.95 2r1r h GLN 404 Ca 0.24 0.05 0.07 0.00 0.77 0.00 0.00 58.65 59.78 2r1r h GLN 404 Cb -0.10 0.15 -0.06 0.00 0.21 0.00 0.00 27.48 27.69 2r1r h GLN 404 CO -0.05 -0.45 0.57 0.93 -1.93 0.00 0.00 178.83 177.91 2r1r h GLU 405 N -0.69 0.94 -0.05 1.69 4.39 -1.19 0.17 114.58 119.84 2r1r h GLU 405 Ca -0.01 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.63 2r1r h GLU 405 Cb 0.68 -0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 29.12 2r1r h GLU 405 CO -0.23 0.62 0.03 -0.09 -1.16 0.00 0.00 179.01 178.18 2r1r h ARG 406 N 0.96 0.06 0.09 2.33 2.43 0.43 -2.11 114.38 118.58 2r1r h ARG 406 Ca 0.39 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.54 2r1r h ARG 406 Cb 0.25 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2r1r h ARG 406 CO -0.15 0.09 -0.04 0.00 -1.51 0.00 0.00 179.97 178.36 2r1r h ALA 407 N 0.97 -0.12 -0.20 2.80 0.00 0.12 1.57 119.26 124.39 2r1r h ALA 407 Ca 0.02 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.92 2r1r h ALA 407 Cb 0.04 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 2r1r h ALA 407 CO -0.00 -0.54 -0.11 0.77 0.00 0.00 0.00 179.25 179.37 2r1r h SER 408 N -0.18 -0.36 0.17 0.00 0.02 -0.67 -3.29 113.55 109.25 2r1r h SER 408 Ca -0.01 0.08 -0.35 0.00 -0.84 0.00 0.00 61.79 60.67 2r1r h SER 408 Cb 0.14 0.19 -0.05 0.00 0.14 0.00 0.00 62.40 62.83 2r1r h SER 408 CO 0.02 -0.14 -2.12 0.35 -1.14 0.00 0.00 176.83 173.80 2r1r n THR 409 N -5.27 1.58 -0.86 -2.27 -2.24 -0.80 -5.00 114.28 99.43 2r1r n THR 409 Ca -0.02 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 2r1r n THR 409 Cb 0.18 -1.18 0.00 0.00 -2.10 0.00 0.00 70.33 67.24 2r1r n THR 409 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2r1r n GLY 410 N 1.87 0.80 0.62 3.38 0.00 0.54 -4.88 105.19 107.52 2r1r n GLY 410 Ca -0.31 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.77 2r1r n GLY 410 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r1r n ARG 411 N -2.31 1.32 -3.75 1.61 5.12 -1.25 -3.26 116.66 114.14 2r1r n ARG 411 Ca 0.00 -3.00 -0.37 0.00 -1.93 0.00 0.00 57.85 52.55 2r1r n ARG 411 Cb 0.00 -1.39 -0.12 0.00 -1.16 0.00 0.00 32.46 29.80 2r1r n ARG 411 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2r1r s ILE 412 N -2.74 3.56 0.26 0.55 -1.09 -1.26 -3.22 121.20 117.27 2r1r s ILE 412 Ca 0.36 -1.64 -0.02 0.00 -2.23 0.00 0.00 60.65 57.12 2r1r s ILE 412 Cb 0.35 -3.24 -0.04 0.00 -1.58 0.00 0.00 42.46 37.94 2r1r s ILE 412 CO -0.07 -0.48 0.48 -0.31 -1.23 0.00 0.00 174.94 173.34 2r1r s TYR 413 N 1.27 3.48 -0.03 3.97 2.02 0.41 -4.76 117.35 123.72 2r1r s TYR 413 Ca 0.03 0.43 0.06 0.00 -0.37 0.00 0.00 57.07 57.22 2r1r s TYR 413 Cb -0.22 -1.94 -0.02 0.00 -0.40 0.00 0.00 41.96 39.38 2r1r s TYR 413 CO -0.01 0.26 -0.21 0.42 -1.57 0.00 0.00 175.55 174.44 2r1r s ILE 414 N -2.04 2.49 -0.16 2.71 1.09 -0.96 -0.04 121.20 124.28 2r1r s ILE 414 Ca 0.40 -0.94 -0.02 0.00 -1.10 0.00 0.00 60.65 58.99 2r1r s ILE 414 Cb -0.11 -1.91 0.05 0.00 -1.06 0.00 0.00 42.46 39.43 2r1r s ILE 414 CO 0.31 0.59 0.02 -1.58 -0.10 0.00 0.00 174.94 174.17 2r1r s GLN 415 N -0.66 0.71 -0.90 2.79 0.74 -0.61 -0.11 119.66 121.61 2r1r s GLN 415 Ca 0.11 -0.31 -0.22 0.00 0.05 0.00 0.00 55.36 54.98 2r1r s GLN 415 Cb -0.10 -1.85 0.08 0.00 1.10 0.00 0.00 33.01 32.23 2r1r s GLN 415 CO -0.00 -0.55 1.25 -0.80 -0.55 0.00 0.00 175.29 174.64 2r1r s ASN 416 N 1.86 6.45 0.19 6.67 0.01 0.10 -1.53 114.94 128.70 2r1r s ASN 416 Ca 0.01 -1.45 -0.12 0.00 -0.71 0.00 0.00 52.86 50.58 2r1r s ASN 416 Cb -0.16 -2.49 0.18 0.00 0.41 0.00 0.00 41.25 39.20 2r1r s ASN 416 CO -0.07 -1.40 1.74 -0.37 -1.51 0.00 0.00 177.10 175.49 2r1r h VAL 417 N 6.26 0.81 0.32 1.60 -1.51 -1.70 -1.75 116.25 120.27 2r1r h VAL 417 Ca 0.05 -0.12 0.00 0.00 -1.23 0.00 0.00 66.70 65.41 2r1r h VAL 417 Cb 1.03 0.44 -0.03 0.00 -2.13 0.00 0.00 31.29 30.60 2r1r h VAL 417 CO 1.27 0.06 -0.39 -2.24 -1.23 0.00 0.00 177.57 175.04 2r1r h ASP 418 N 0.34 -1.09 -0.58 4.19 3.04 -1.81 -1.37 116.42 119.13 2r1r h ASP 418 Ca 0.25 0.10 0.12 0.00 -3.24 0.00 0.00 57.03 54.26 2r1r h ASP 418 Cb 0.28 0.38 -0.11 0.00 -1.04 0.00 0.00 39.33 38.84 2r1r h ASP 418 CO -0.26 -0.52 -0.09 0.45 -2.04 0.00 0.00 179.24 176.77 2r1r h HIS 419 N -0.76 -0.21 -0.89 4.15 3.86 -1.89 0.13 115.15 119.56 2r1r h HIS 419 Ca -0.02 0.05 0.25 0.00 -1.16 0.00 0.00 60.37 59.49 2r1r h HIS 419 Cb 0.70 0.18 -0.04 0.00 1.06 0.00 0.00 27.41 29.31 2r1r h HIS 419 CO -0.25 -0.22 0.63 0.00 0.86 0.00 0.00 177.93 178.95 2r1r n ASN 421 N -4.31 1.56 0.05 0.00 3.02 0.31 -4.36 115.26 111.53 2r1r n ASN 421 Ca 0.18 -0.15 -0.10 0.00 -0.03 0.00 0.00 54.58 54.48 2r1r n ASN 421 Cb 0.92 1.53 -0.13 0.00 -0.61 0.00 0.00 39.78 41.49 2r1r n ASN 421 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 2r1r h THR 422 N 0.00 1.38 -2.22 3.41 1.35 -0.75 -3.39 112.91 112.70 2r1r h THR 422 Ca 0.00 -3.10 -0.60 0.00 -0.55 0.00 0.00 66.41 62.16 2r1r h THR 422 Cb 0.59 2.74 -0.42 0.00 -1.73 0.00 0.00 68.15 69.33 2r1r h THR 422 CO 0.00 0.83 -0.58 1.57 -0.25 0.00 0.00 175.52 177.09 2r1r n HIS 423 N -3.32 3.64 -4.25 4.73 -0.00 -0.90 -4.92 115.22 110.21 2r1r n HIS 423 Ca -0.08 -4.15 -0.15 0.00 -0.00 0.00 0.00 57.72 53.34 2r1r n HIS 423 Cb 0.99 -0.57 -0.09 0.00 -0.00 0.00 0.00 29.99 30.32 2r1r n HIS 423 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 2r1r s SER 424 N -2.45 0.79 0.32 0.26 1.04 -1.26 -4.82 113.70 107.58 2r1r s SER 424 Ca 0.39 -1.50 0.25 0.00 0.48 0.00 0.00 55.95 55.57 2r1r s SER 424 Cb 0.14 0.41 0.56 0.00 0.10 0.00 0.00 66.02 67.23 2r1r s SER 424 CO -0.01 -0.89 1.68 1.55 0.98 0.00 0.00 173.24 176.54 2r1r h PRO 425 N 2.43 0.00 -6.17 4.02 0.14 -1.91 -3.44 132.00 127.07 2r1r h PRO 425 Ca -0.33 0.00 -0.56 0.00 0.14 0.00 0.00 66.00 65.25 2r1r h PRO 425 Cb 1.25 0.00 -0.06 0.00 0.14 0.00 0.00 31.00 32.33 2r1r h PRO 425 CO 0.50 0.00 -0.54 -0.06 0.14 0.00 0.00 178.00 178.04 2r1r s PHE 426 N -3.16 3.22 -0.31 1.56 0.08 -1.26 0.11 117.98 118.21 2r1r s PHE 426 Ca 0.09 0.00 -0.24 0.00 0.12 0.00 0.00 56.93 56.90 2r1r s PHE 426 Cb 0.09 -1.53 0.00 0.00 -0.57 0.00 0.00 43.02 41.01 2r1r s PHE 426 CO 0.64 0.52 0.81 0.34 -0.10 0.00 0.00 175.22 177.42 2r1r s ASP 427 N -3.23 6.67 0.41 1.36 -1.08 -0.62 -4.59 116.67 115.58 2r1r s ASP 427 Ca 0.32 0.65 0.09 0.00 -0.52 0.00 0.00 52.55 53.08 2r1r s ASP 427 Cb -0.10 -2.42 0.88 0.00 -1.46 0.00 0.00 42.92 39.83 2r1r s ASP 427 CO 0.25 -0.65 2.02 1.55 0.52 0.00 0.00 175.17 178.86 2r1r h PRO 428 N 8.16 0.54 -0.38 4.34 0.13 -1.84 0.43 132.00 143.38 2r1r h PRO 428 Ca -0.24 -0.03 -0.08 0.00 -0.87 0.00 0.00 66.00 64.78 2r1r h PRO 428 Cb 1.09 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.08 2r1r h PRO 428 CO 0.90 0.35 -0.09 0.00 -0.23 0.00 0.00 178.00 178.93 2r1r h ALA 429 N 1.71 1.13 0.03 -0.56 0.00 -1.92 -3.24 119.26 116.40 2r1r h ALA 429 Ca 0.21 -0.28 -0.35 0.00 0.00 0.00 0.00 54.91 54.48 2r1r h ALA 429 Cb 0.14 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 2r1r h ALA 429 CO -0.05 0.55 -1.96 -0.89 0.00 0.00 0.00 179.25 176.90 2r1r n ILE 430 N -4.19 1.58 -3.37 0.00 5.41 -0.34 -4.88 119.36 113.57 2r1r n ILE 430 Ca 0.01 -0.34 -0.19 0.00 1.00 0.00 0.00 62.75 63.23 2r1r n ILE 430 Cb 0.33 -1.84 -0.08 0.00 -0.71 0.00 0.00 39.64 37.34 2r1r n ILE 430 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2r1r s ALA 431 N -2.47 -0.19 0.44 -1.39 0.00 0.14 -5.06 121.76 113.23 2r1r s ALA 431 Ca -0.31 -1.17 -0.19 0.00 0.00 0.00 0.00 51.96 50.29 2r1r s ALA 431 Cb 0.09 -1.98 -0.10 0.00 0.00 0.00 0.00 23.12 21.13 2r1r s ALA 431 CO 0.60 -2.15 0.94 -1.25 0.00 0.00 0.00 175.76 173.91 2r1r s PRO 432 N 1.32 4.14 -0.24 0.00 0.04 -1.22 -4.35 135.00 134.68 2r1r s PRO 432 Ca 0.18 1.03 -0.17 0.00 0.04 0.00 0.00 61.00 62.08 2r1r s PRO 432 Cb -0.16 -2.20 -0.03 0.00 0.04 0.00 0.00 34.50 32.15 2r1r s PRO 432 CO -0.02 -0.07 0.46 0.08 0.04 0.00 0.00 177.00 177.49 2r1r s VAL 433 N -2.27 5.12 -0.17 -0.36 1.01 -1.26 -4.30 120.40 118.17 2r1r s VAL 433 Ca 0.60 0.79 0.17 0.00 0.00 0.00 0.00 61.98 63.54 2r1r s VAL 433 Cb -0.09 -3.78 0.44 0.00 0.00 0.00 0.00 36.38 32.94 2r1r s VAL 433 CO 0.18 0.14 1.18 0.54 0.00 0.00 0.00 175.10 177.15 2r1r n ARG 434 N 5.19 1.48 0.00 2.72 1.74 -1.26 -4.81 116.66 121.71 2r1r n ARG 434 Ca -0.06 -3.09 0.00 0.00 -0.77 0.00 0.00 57.85 53.93 2r1r n ARG 434 Cb 0.50 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 30.70 2r1r n ARG 434 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2r1r n GLN 435 N -0.48 -0.20 -1.05 5.56 10.64 -1.26 -4.95 117.38 125.63 2r1r n GLN 435 Ca 0.18 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.35 2r1r n GLN 435 Cb 0.89 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 30.27 2r1r n GLN 435 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2r1r n SER 436 N 0.00 0.77 -0.79 2.61 2.88 -1.26 -4.54 113.62 113.29 2r1r n SER 436 Ca 0.00 -0.52 0.00 0.00 -1.33 0.00 0.00 58.87 57.02 2r1r n SER 436 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2r1r n SER 436 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2r1r n ASN 437 N -1.17 0.42 0.11 -3.46 6.94 -1.23 -4.69 115.26 112.17 2r1r n ASN 437 Ca 0.00 -0.39 -0.12 0.00 -0.02 0.00 0.00 54.58 54.04 2r1r n ASN 437 Cb 0.00 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.36 2r1r n ASN 437 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 2r1r h LEU 438 N 0.00 -0.58 -2.84 -4.53 5.85 -1.88 -2.97 115.31 108.36 2r1r h LEU 438 Ca 0.00 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2r1r h LEU 438 Cb 0.00 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 2r1r h LEU 438 CO 0.00 -0.29 0.04 0.00 -0.34 0.00 0.00 178.44 177.85 2r1r n LEU 440 N 0.35 -2.31 0.00 0.00 7.99 -1.12 -4.58 117.00 117.32 2r1r n LEU 440 Ca 0.21 -0.66 0.00 0.00 -0.01 0.00 0.00 56.01 55.55 2r1r n LEU 440 Cb 0.95 -2.48 0.00 0.00 -0.11 0.00 0.00 43.42 41.78 2r1r n LEU 440 CO 0.24 0.37 -0.11 -1.84 -1.51 0.00 0.00 177.39 174.55 2r1r n GLU 441 N -4.41 5.19 -3.79 3.23 0.00 -1.26 -4.23 120.64 115.35 2r1r n GLU 441 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 57.16 56.81 2r1r n GLU 441 Cb 0.53 -0.59 -0.06 0.00 0.00 0.00 0.00 31.44 31.32 2r1r n GLU 441 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2r1r s ILE 442 N -1.18 5.43 -0.33 3.84 -1.09 -1.26 -1.99 121.20 124.61 2r1r s ILE 442 Ca 0.00 0.30 -0.01 0.00 -2.23 0.00 0.00 60.65 58.71 2r1r s ILE 442 Cb 0.00 -3.46 0.13 0.00 -1.58 0.00 0.00 42.46 37.55 2r1r s ILE 442 CO 0.00 0.58 0.18 0.00 -1.23 0.00 0.00 174.94 174.47 2r1r s ALA 443 N -0.78 0.84 0.12 9.38 0.00 -1.26 -3.55 121.76 126.51 2r1r s ALA 443 Ca 0.15 -1.62 0.04 0.00 0.00 0.00 0.00 51.96 50.53 2r1r s ALA 443 Cb -0.13 -1.54 -0.04 0.00 0.00 0.00 0.00 23.12 21.42 2r1r s ALA 443 CO 0.04 -1.96 -0.10 -0.51 0.00 0.00 0.00 175.76 173.24 2r1r s LEU 444 N 1.40 2.49 0.38 0.00 1.43 -1.26 -4.90 118.68 118.22 2r1r s LEU 444 Ca 0.15 -0.95 -0.25 0.00 -1.03 0.00 0.00 54.13 52.05 2r1r s LEU 444 Cb -0.21 -0.29 -0.09 0.00 0.03 0.00 0.00 46.19 45.64 2r1r s LEU 444 CO -0.11 -0.33 1.06 -2.16 0.23 0.00 0.00 176.35 175.03 2r1r s PRO 445 N -3.46 4.26 0.03 1.29 0.05 -1.26 -4.42 135.00 131.48 2r1r s PRO 445 Ca 0.12 1.56 -0.00 0.00 0.05 0.00 0.00 61.00 62.73 2r1r s PRO 445 Cb 0.01 -2.67 -0.03 0.00 0.05 0.00 0.00 34.50 31.87 2r1r s PRO 445 CO -0.01 -0.07 -0.03 0.95 0.05 0.00 0.00 177.00 177.90 2r1r s THR 446 N -1.56 0.15 -0.03 1.26 -4.23 -1.26 -4.48 115.64 105.49 2r1r s THR 446 Ca 0.55 -1.28 0.01 0.00 -1.18 0.00 0.00 61.69 59.80 2r1r s THR 446 Cb -0.24 -0.78 0.01 0.00 1.34 0.00 0.00 72.50 72.84 2r1r s THR 446 CO 0.30 -0.70 -0.05 -0.54 -0.54 0.00 0.00 174.62 173.08 2r1r s LYS 447 N -2.47 0.71 0.64 3.99 1.02 -0.98 -4.89 119.74 117.75 2r1r s LYS 447 Ca -0.07 -0.15 -0.18 0.00 0.02 0.00 0.00 55.97 55.60 2r1r s LYS 447 Cb -0.03 -0.71 -0.01 0.00 -0.52 0.00 0.00 37.83 36.56 2r1r s LYS 447 CO -0.05 -0.00 1.25 -1.25 -0.92 0.00 0.00 175.35 174.38 2r1r s PRO 448 N 0.53 2.65 0.21 -1.68 0.04 -1.25 -0.35 135.00 135.15 2r1r s PRO 448 Ca -0.07 1.93 0.02 0.00 0.04 0.00 0.00 61.00 62.92 2r1r s PRO 448 Cb -0.10 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.53 2r1r s PRO 448 CO 0.00 -1.49 0.36 -0.51 0.04 0.00 0.00 177.00 175.40 2r1r s LEU 449 N -4.37 4.28 0.00 -3.56 1.02 -1.26 -4.40 118.68 110.38 2r1r s LEU 449 Ca 0.79 0.22 0.07 0.00 0.02 0.00 0.00 54.13 55.23 2r1r s LEU 449 Cb -0.34 -2.99 0.12 0.00 0.02 0.00 0.00 46.19 43.00 2r1r s LEU 449 CO 0.38 -0.04 0.94 0.59 0.02 0.00 0.00 176.35 178.24 2r1r n ASN 450 N -0.97 2.08 -3.61 2.29 3.02 -1.26 -4.25 115.26 112.55 2r1r n ASN 450 Ca -0.07 -1.64 -0.05 0.00 -0.03 0.00 0.00 54.58 52.79 2r1r n ASN 450 Cb 0.55 -0.07 -0.04 0.00 -0.61 0.00 0.00 39.78 39.61 2r1r n ASN 450 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2r1r s ASP 451 N -0.79 -0.15 0.27 6.41 -1.08 -1.26 -4.54 116.67 115.52 2r1r s ASP 451 Ca 0.11 0.13 -0.00 0.00 -0.52 0.00 0.00 52.55 52.27 2r1r s ASP 451 Cb 0.07 0.14 0.59 0.00 -1.46 0.00 0.00 42.92 42.25 2r1r s ASP 451 CO 0.09 -0.17 1.71 0.58 0.52 0.00 0.00 175.17 177.90 2r1r h VAL 452 N 2.18 0.54 -0.25 1.11 2.07 -1.92 -0.66 116.25 119.32 2r1r h VAL 452 Ca -0.11 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.27 2r1r h VAL 452 Cb 1.17 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 2r1r h VAL 452 CO 0.25 0.07 0.00 0.59 0.02 0.00 0.00 177.57 178.50 2r1r n ASN 453 N -5.05 2.31 -4.66 0.57 3.02 -1.26 -4.60 115.26 105.59 2r1r n ASN 453 Ca 0.18 -1.82 -0.54 0.00 -0.03 0.00 0.00 54.58 52.37 2r1r n ASN 453 Cb 0.54 -0.16 -0.06 0.00 -0.61 0.00 0.00 39.78 39.49 2r1r n ASN 453 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2r1r n ASP 454 N 0.75 2.29 0.11 6.41 2.03 -0.26 -4.82 116.55 123.06 2r1r n ASP 454 Ca 0.17 1.08 0.13 0.00 0.52 0.00 0.00 54.79 56.69 2r1r n ASP 454 Cb 0.43 -1.21 0.40 0.00 -0.72 0.00 0.00 41.12 40.02 2r1r n ASP 454 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2r1r n GLU 455 N 4.29 0.27 -0.19 -0.67 -0.58 -1.26 -3.64 120.64 118.86 2r1r n GLU 455 Ca 0.22 0.22 0.12 0.00 -0.42 0.00 0.00 57.16 57.30 2r1r n GLU 455 Cb 0.18 -1.82 0.23 0.00 -0.57 0.00 0.00 31.44 29.47 2r1r n GLU 455 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2r1r n ASN 456 N -2.29 3.38 -4.93 1.62 4.13 -1.26 -4.84 115.26 111.07 2r1r n ASN 456 Ca 0.06 -1.98 -0.26 0.00 1.68 0.00 0.00 54.58 54.08 2r1r n ASN 456 Cb 0.43 -0.25 0.04 0.00 -1.54 0.00 0.00 39.78 38.46 2r1r n ASN 456 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2r1r s GLY 457 N -1.48 1.63 -0.03 7.41 0.00 -1.24 -4.91 107.32 108.71 2r1r s GLY 457 Ca 0.39 -0.82 0.01 0.00 0.00 0.00 0.00 44.72 44.31 2r1r s GLY 457 CO 0.32 -0.53 -0.05 1.85 0.00 0.00 0.00 173.10 174.69 2r1r s GLU 458 N -4.97 0.67 -0.13 2.90 2.12 0.53 -4.58 118.70 115.25 2r1r s GLU 458 Ca 0.54 -0.15 -0.00 0.00 0.36 0.00 0.00 54.97 55.73 2r1r s GLU 458 Cb -0.10 -0.68 0.02 0.00 0.26 0.00 0.00 34.13 33.63 2r1r s GLU 458 CO 0.44 0.01 -0.10 0.42 -0.54 0.00 0.00 175.26 175.48 2r1r s ILE 459 N 0.47 1.26 0.49 -3.70 1.01 -0.62 -2.32 121.20 117.78 2r1r s ILE 459 Ca -0.06 -0.44 -0.13 0.00 0.00 0.00 0.00 60.65 60.03 2r1r s ILE 459 Cb -0.10 -1.23 -0.06 0.00 0.01 0.00 0.00 42.46 41.08 2r1r s ILE 459 CO -0.00 0.41 0.90 0.00 0.00 0.00 0.00 174.94 176.25 2r1r s ALA 460 N 1.60 3.19 0.09 9.38 0.00 -1.09 -4.39 121.76 130.55 2r1r s ALA 460 Ca 0.05 -0.05 0.06 0.00 0.00 0.00 0.00 51.96 52.02 2r1r s ALA 460 Cb -0.13 -2.93 -0.03 0.00 0.00 0.00 0.00 23.12 20.03 2r1r s ALA 460 CO -0.09 -0.24 -0.15 -0.51 0.00 0.00 0.00 175.76 174.76 2r1r s LEU 461 N -4.23 2.32 -0.51 0.00 1.43 -1.26 -2.01 118.68 114.41 2r1r s LEU 461 Ca 0.55 -0.69 -0.17 0.00 -1.03 0.00 0.00 54.13 52.79 2r1r s LEU 461 Cb -0.10 -0.59 0.08 0.00 0.03 0.00 0.00 46.19 45.61 2r1r s LEU 461 CO 0.36 -0.07 0.53 0.00 0.23 0.00 0.00 176.35 177.40 2r1r s THR 463 N 2.10 4.13 0.35 0.00 2.01 -1.26 -4.27 115.64 118.70 2r1r s THR 463 Ca 0.08 -1.66 0.09 0.00 0.31 0.00 0.00 61.69 60.51 2r1r s THR 463 Cb -0.24 -3.66 -0.05 0.00 0.01 0.00 0.00 72.50 68.56 2r1r s THR 463 CO 0.08 -0.66 0.04 -0.76 -0.69 0.00 0.00 174.62 172.62 2r1r s LEU 464 N 1.37 3.01 0.08 4.42 1.43 -1.26 -0.72 118.68 127.00 2r1r s LEU 464 Ca 0.05 -1.00 -0.26 0.00 -1.03 0.00 0.00 54.13 51.89 2r1r s LEU 464 Cb -0.25 -1.37 0.09 0.00 0.03 0.00 0.00 46.19 44.69 2r1r s LEU 464 CO 0.00 -0.28 1.15 -0.44 0.23 0.00 0.00 176.35 177.02 2r1r s SER 465 N -3.74 -0.03 -0.03 2.29 0.01 -1.12 -4.48 113.70 106.59 2r1r s SER 465 Ca 0.36 -0.39 -0.29 0.00 1.31 0.00 0.00 55.95 56.94 2r1r s SER 465 Cb 0.01 0.32 0.06 0.00 0.21 0.00 0.00 66.02 66.62 2r1r s SER 465 CO 0.20 -0.63 0.63 0.00 0.41 0.00 0.00 173.24 173.85 2r1r s ALA 466 N -2.32 -1.64 0.04 1.44 0.00 -0.83 -1.73 121.76 116.71 2r1r s ALA 466 Ca 0.21 1.16 -0.16 0.00 0.00 0.00 0.00 51.96 53.16 2r1r s ALA 466 Cb -0.00 0.06 -0.06 0.00 0.00 0.00 0.00 23.12 23.11 2r1r s ALA 466 CO 0.01 -0.38 0.48 -0.06 0.00 0.00 0.00 175.76 175.81 2r1r s PHE 467 N -1.35 3.75 -0.55 0.00 0.08 0.85 -0.33 117.98 120.43 2r1r s PHE 467 Ca -0.11 1.11 -0.19 0.00 0.12 0.00 0.00 56.93 57.86 2r1r s PHE 467 Cb -0.01 -2.37 0.08 0.00 -0.57 0.00 0.00 43.02 40.15 2r1r s PHE 467 CO 0.08 0.61 0.67 1.21 -0.10 0.00 0.00 175.22 177.69 2r1r s ASN 468 N -1.13 6.20 0.28 1.36 3.84 0.11 -1.03 114.94 124.57 2r1r s ASN 468 Ca 0.27 -1.21 0.23 0.00 0.21 0.00 0.00 52.86 52.35 2r1r s ASN 468 Cb -0.18 -2.29 1.05 0.00 -0.55 0.00 0.00 41.25 39.28 2r1r s ASN 468 CO 0.16 -1.01 1.69 0.18 -2.79 0.00 0.00 177.10 175.32 2r1r n LEU 469 N 6.25 0.62 0.05 3.21 4.77 -0.85 -1.55 117.00 129.51 2r1r n LEU 469 Ca -0.08 0.70 0.12 0.00 -0.03 0.00 0.00 56.01 56.72 2r1r n LEU 469 Cb 0.44 -0.67 0.29 0.00 -2.33 0.00 0.00 43.42 41.14 2r1r n LEU 469 CO 0.56 -0.71 0.55 0.61 -1.33 0.00 0.00 177.39 177.07 2r1r n GLY 470 N -0.51 -1.44 0.17 -0.72 0.00 -1.26 -3.99 105.19 97.44 2r1r n GLY 470 Ca 0.01 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 45.92 2r1r n GLY 470 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r1r n ALA 471 N -1.71 4.23 -2.87 4.61 0.00 -0.59 -4.93 120.51 119.26 2r1r n ALA 471 Ca 0.05 -0.59 -0.33 0.00 0.00 0.00 0.00 53.44 52.56 2r1r n ALA 471 Cb 0.40 -0.81 -0.06 0.00 0.00 0.00 0.00 19.45 18.99 2r1r n ALA 471 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2r1r s ILE 472 N -2.81 5.22 -0.12 0.00 -4.36 -1.24 -4.95 121.20 112.94 2r1r s ILE 472 Ca 0.12 -0.23 -0.04 0.00 -0.26 0.00 0.00 60.65 60.25 2r1r s ILE 472 Cb 0.17 -3.42 -0.25 0.00 1.25 0.00 0.00 42.46 40.21 2r1r s ILE 472 CO 0.75 0.34 0.36 0.59 0.24 0.00 0.00 174.94 177.22 2r1r n ASN 473 N 1.05 1.96 -4.05 4.36 3.02 -1.26 -4.96 115.26 115.38 2r1r n ASN 473 Ca -0.12 0.21 -0.11 0.00 -0.03 0.00 0.00 54.58 54.53 2r1r n ASN 473 Cb 0.53 -0.73 -0.11 0.00 -0.61 0.00 0.00 39.78 38.86 2r1r n ASN 473 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2r1r s ASN 474 N -6.89 0.64 0.64 6.41 2.20 -1.26 -5.04 114.94 111.65 2r1r s ASN 474 Ca -0.21 -0.61 0.35 0.00 -0.94 0.00 0.00 52.86 51.44 2r1r s ASN 474 Cb 0.07 0.08 1.92 0.00 -2.00 0.00 0.00 41.25 41.31 2r1r s ASN 474 CO 0.77 -0.29 2.13 -0.07 -2.94 0.00 0.00 177.10 176.69 2r1r h LEU 475 N 4.30 0.00 0.00 3.54 3.38 -2.00 -1.52 115.31 123.00 2r1r h LEU 475 Ca -0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2r1r h LEU 475 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2r1r h LEU 475 CO 0.45 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.45 2r1r n ASP 476 N -3.22 0.00 0.18 -0.43 8.00 -1.26 -1.90 116.55 117.92 2r1r n ASP 476 Ca -0.01 0.02 0.13 0.00 0.71 0.00 0.00 54.79 55.64 2r1r n ASP 476 Cb 0.26 -0.29 0.35 0.00 -0.02 0.00 0.00 41.12 41.42 2r1r n ASP 476 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2r1r h GLU 477 N 0.00 0.00 -0.39 -1.24 5.08 -1.71 -3.21 114.58 113.12 2r1r h GLU 477 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 2r1r h GLU 477 Cb 0.19 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 2r1r h GLU 477 CO 0.00 0.00 0.10 -0.07 -1.00 0.00 0.00 179.01 178.04 2r1r h LEU 478 N 0.00 0.52 -0.64 1.33 3.38 -1.58 -2.95 115.31 115.36 2r1r h LEU 478 Ca 0.00 -0.07 0.11 0.00 0.09 0.00 0.00 57.88 58.01 2r1r h LEU 478 Cb 0.79 -0.13 -0.12 0.00 0.09 0.00 0.00 40.66 41.29 2r1r h LEU 478 CO 0.00 0.52 -0.37 -0.08 0.09 0.00 0.00 178.44 178.60 2r1r h GLU 479 N 0.56 -0.15 0.39 1.13 4.81 -1.76 0.56 114.58 120.11 2r1r h GLU 479 Ca 0.13 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 2r1r h GLU 479 Cb 0.20 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.62 2r1r h GLU 479 CO -0.01 -0.10 -0.19 0.93 -0.73 0.00 0.00 179.01 178.92 2r1r h GLU 480 N -0.16 -0.50 -0.67 1.92 3.07 -1.76 -2.70 114.58 113.78 2r1r h GLU 480 Ca 0.23 0.03 0.14 0.00 -0.50 0.00 0.00 59.36 59.27 2r1r h GLU 480 Cb 0.56 0.11 -0.11 0.00 -0.84 0.00 0.00 28.75 28.47 2r1r h GLU 480 CO -0.72 -0.22 0.05 -0.07 -1.40 0.00 0.00 179.01 176.65 2r1r h LEU 481 N -0.74 -0.20 -0.40 1.33 3.38 -1.21 0.81 115.31 118.28 2r1r h LEU 481 Ca -0.05 0.16 0.05 0.00 0.09 0.00 0.00 57.88 58.13 2r1r h LEU 481 Cb 0.51 0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.48 2r1r h LEU 481 CO 0.09 -0.10 0.12 0.00 0.09 0.00 0.00 178.44 178.64 2r1r h ALA 482 N 1.60 0.46 -0.36 1.53 0.00 0.09 0.16 119.26 122.74 2r1r h ALA 482 Ca 0.36 0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.41 2r1r h ALA 482 Cb 0.61 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.37 2r1r h ALA 482 CO -0.55 -0.27 -0.14 0.82 0.00 0.00 0.00 179.25 179.11 2r1r h ILE 483 N 0.27 0.53 -0.03 0.00 2.04 -0.53 0.91 117.51 120.71 2r1r h ILE 483 Ca 0.19 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.04 2r1r h ILE 483 Cb 0.19 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 2r1r h ILE 483 CO -0.21 0.00 -0.01 -0.07 0.00 0.00 0.00 178.15 177.86 2r1r h LEU 484 N -0.07 0.06 -0.05 1.44 -0.00 -0.64 -2.54 115.31 113.51 2r1r h LEU 484 Ca 0.18 -0.42 0.04 0.00 -0.00 0.00 0.00 57.88 57.67 2r1r h LEU 484 Cb 0.34 -0.02 -0.05 0.00 -0.00 0.00 0.00 40.66 40.94 2r1r h LEU 484 CO -0.41 0.47 -0.24 0.00 -0.00 0.00 0.00 178.44 178.26 2r1r h ALA 485 N 0.59 -0.28 -0.50 1.53 0.00 -0.48 0.38 119.26 120.51 2r1r h ALA 485 Ca 0.01 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2r1r h ALA 485 Cb 0.45 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2r1r h ALA 485 CO 0.00 -0.72 0.20 0.28 0.00 0.00 0.00 179.25 179.01 2r1r h VAL 486 N -0.35 1.21 -0.60 0.00 2.07 -0.92 -2.63 116.25 115.03 2r1r h VAL 486 Ca 0.08 -0.65 -0.07 0.00 0.82 0.00 0.00 66.70 66.88 2r1r h VAL 486 Cb 0.46 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 2r1r h VAL 486 CO -0.25 0.24 0.09 0.03 0.02 0.00 0.00 177.57 177.70 2r1r h ARG 487 N 0.66 0.97 -0.08 1.57 3.08 -1.13 -0.73 114.38 118.71 2r1r h ARG 487 Ca 0.17 -0.25 -0.20 0.00 0.07 0.00 0.00 59.98 59.77 2r1r h ARG 487 Cb 0.19 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 2r1r h ARG 487 CO -0.01 0.90 -0.77 0.00 -1.07 0.00 0.00 179.97 179.02 2r1r h ALA 488 N 1.18 0.51 -0.19 0.04 0.00 -0.87 -2.68 119.26 117.25 2r1r h ALA 488 Ca 0.18 -0.62 -0.20 0.00 0.00 0.00 0.00 54.91 54.27 2r1r h ALA 488 Cb 0.41 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2r1r h ALA 488 CO 0.01 0.76 -0.68 -0.07 0.00 0.00 0.00 179.25 179.27 2r1r h LEU 489 N 0.32 0.85 -0.87 0.00 3.38 -1.35 -1.84 115.31 115.79 2r1r h LEU 489 Ca -0.04 -0.51 -0.02 0.00 0.09 0.00 0.00 57.88 57.39 2r1r h LEU 489 Cb 1.37 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.83 2r1r h LEU 489 CO 0.14 1.30 0.47 -0.78 0.09 0.00 0.00 178.44 179.65 2r1r h ASP 490 N 0.53 1.10 0.08 -0.43 3.58 -1.15 -1.82 116.42 118.30 2r1r h ASP 490 Ca -0.02 -0.11 -0.10 0.00 0.42 0.00 0.00 57.03 57.22 2r1r h ASP 490 Cb 1.28 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 42.04 2r1r h ASP 490 CO 0.14 0.89 -0.33 0.00 -2.88 0.00 0.00 179.24 177.06 2r1r h ALA 491 N 1.25 1.11 -0.80 -0.78 0.00 -1.40 -2.93 119.26 115.72 2r1r h ALA 491 Ca 0.31 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2r1r h ALA 491 Cb 0.05 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2r1r h ALA 491 CO -0.05 0.56 0.48 1.25 0.00 0.00 0.00 179.25 181.50 2r1r h LEU 492 N 0.31 0.96 -1.35 0.00 5.85 -0.48 -2.22 115.31 118.39 2r1r h LEU 492 Ca 0.04 -0.07 0.13 0.00 0.84 0.00 0.00 57.88 58.82 2r1r h LEU 492 Cb 0.73 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 41.46 2r1r h LEU 492 CO 0.06 0.74 0.55 -0.07 -0.34 0.00 0.00 178.44 179.38 2r1r h LEU 493 N 1.09 0.62 0.00 2.25 3.38 -1.28 0.17 115.31 121.54 2r1r h LEU 493 Ca 0.29 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2r1r h LEU 493 Cb -0.04 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2r1r h LEU 493 CO -0.05 0.33 -0.23 0.47 0.09 0.00 0.00 178.44 179.05 2r1r n ASP 494 N -4.53 0.42 0.00 -0.43 8.00 -1.02 -4.03 116.55 114.95 2r1r n ASP 494 Ca 0.16 0.28 -0.20 0.00 0.71 0.00 0.00 54.79 55.73 2r1r n ASP 494 Cb 0.43 -0.28 -0.14 0.00 -0.02 0.00 0.00 41.12 41.12 2r1r n ASP 494 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2r1r n TYR 495 N -1.78 1.23 -1.97 1.24 9.36 0.46 -4.99 117.16 120.71 2r1r n TYR 495 Ca 0.06 0.27 -0.30 0.00 3.32 0.00 0.00 57.90 61.25 2r1r n TYR 495 Cb 0.38 -1.16 0.04 0.00 -0.63 0.00 0.00 39.34 37.97 2r1r n TYR 495 CO 0.00 0.00 0.00 1.14 0.22 0.00 0.00 176.86 178.22 2r1r s GLN 496 N -2.56 2.89 0.14 2.98 -2.07 -0.36 -5.01 119.66 115.67 2r1r s GLN 496 Ca -0.21 0.39 -0.00 0.00 -1.82 0.00 0.00 55.36 53.71 2r1r s GLN 496 Cb 0.07 -2.07 -0.04 0.00 -1.09 0.00 0.00 33.01 29.88 2r1r s GLN 496 CO 0.77 -0.96 0.31 -0.51 -1.32 0.00 0.00 175.29 173.58 2r1r s ASP 497 N -4.34 6.38 -0.28 12.60 1.01 -0.92 -4.99 116.67 126.13 2r1r s ASP 497 Ca 0.57 0.34 0.03 0.00 0.71 0.00 0.00 52.55 54.20 2r1r s ASP 497 Cb -0.11 -1.98 0.07 0.00 1.01 0.00 0.00 42.92 41.91 2r1r s ASP 497 CO 0.51 0.06 -0.05 -0.31 0.21 0.00 0.00 175.17 175.58 2r1r s TYR 498 N -1.69 3.23 0.14 4.23 2.02 -1.26 -4.84 117.35 119.19 2r1r s TYR 498 Ca 0.37 -2.41 -0.15 0.00 -0.37 0.00 0.00 57.07 54.50 2r1r s TYR 498 Cb -0.12 -2.14 0.02 0.00 -0.40 0.00 0.00 41.96 39.32 2r1r s TYR 498 CO 0.28 -0.88 1.71 -1.00 -1.57 0.00 0.00 175.55 174.08 2r1r h PRO 499 N 7.76 0.65 -5.70 -1.71 0.13 -2.00 -3.43 132.00 127.71 2r1r h PRO 499 Ca -0.15 -0.11 -0.66 0.00 -0.87 0.00 0.00 66.00 64.22 2r1r h PRO 499 Cb 1.04 -0.11 -0.18 0.00 0.13 0.00 0.00 31.00 31.88 2r1r h PRO 499 CO 0.47 0.58 -0.64 0.42 -0.23 0.00 0.00 178.00 178.59 2r1r s ILE 500 N -5.63 4.13 0.25 -3.56 1.09 -1.26 -5.02 121.20 111.19 2r1r s ILE 500 Ca -0.13 -0.30 -0.03 0.00 -1.10 0.00 0.00 60.65 59.09 2r1r s ILE 500 Cb 0.11 -2.77 0.22 0.00 -1.06 0.00 0.00 42.46 38.96 2r1r s ILE 500 CO 0.76 0.55 1.74 -0.65 -0.10 0.00 0.00 174.94 177.23 2r1r h PRO 501 N 5.85 0.46 -0.07 2.79 0.11 -1.82 -1.47 132.00 137.85 2r1r h PRO 501 Ca -0.42 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.68 2r1r h PRO 501 Cb 1.19 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 2r1r h PRO 501 CO 0.59 0.31 0.08 0.00 -0.21 0.00 0.00 178.00 178.76 2r1r h ALA 502 N 1.55 1.64 0.10 -0.75 0.00 -1.81 -1.13 119.26 118.87 2r1r h ALA 502 Ca 0.42 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 55.05 2r1r h ALA 502 Cb 0.64 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2r1r h ALA 502 CO -0.40 -0.11 -1.34 0.00 0.00 0.00 0.00 179.25 177.40 2r1r h ALA 503 N 1.91 0.21 -0.39 0.00 0.00 -1.47 -1.64 119.26 117.88 2r1r h ALA 503 Ca 0.03 -0.99 -0.12 0.00 0.00 0.00 0.00 54.91 53.83 2r1r h ALA 503 Cb 0.19 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2r1r h ALA 503 CO -0.00 1.09 -0.25 -0.22 0.00 0.00 0.00 179.25 179.87 2r1r h LYS 504 N 0.06 0.80 0.09 0.00 3.64 -1.20 -2.15 116.57 117.82 2r1r h LYS 504 Ca -0.16 -0.34 0.02 0.00 -1.27 0.00 0.00 60.65 58.89 2r1r h LYS 504 Cb 1.97 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.72 2r1r h LYS 504 CO 0.18 0.97 -0.25 0.00 -2.27 0.00 0.00 179.45 178.07 2r1r h ARG 505 N 0.69 -0.43 -0.32 1.90 3.08 -1.30 -0.10 114.38 117.91 2r1r h ARG 505 Ca 0.09 0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 2r1r h ARG 505 Cb 0.78 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 2r1r h ARG 505 CO 0.06 -0.29 0.07 0.78 -1.07 0.00 0.00 179.97 179.53 2r1r h GLY 506 N -0.44 0.56 0.69 0.04 0.00 -1.57 0.28 103.07 102.63 2r1r h GLY 506 Ca 0.04 -0.35 0.02 0.00 0.00 0.00 0.00 47.33 47.04 2r1r h GLY 506 CO -0.16 0.33 -0.09 0.00 0.00 0.00 0.00 176.54 176.61 2r1r h ALA 507 N 0.91 -0.06 -0.12 3.60 0.00 -1.17 -0.93 119.26 121.49 2r1r h ALA 507 Ca 0.10 0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.87 2r1r h ALA 507 Cb 0.30 0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.28 2r1r h ALA 507 CO 0.00 -0.57 -0.59 0.52 0.00 0.00 0.00 179.25 178.62 2r1r h MET 508 N -0.14 0.60 0.25 0.00 2.86 -1.01 0.33 114.93 117.83 2r1r h MET 508 Ca 0.05 -0.49 0.01 0.00 -2.06 0.00 0.00 59.70 57.21 2r1r h MET 508 Cb 0.21 0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.93 2r1r h MET 508 CO -0.13 1.11 -0.48 0.78 1.06 0.00 0.00 176.91 179.25 2r1r h GLY 509 N 0.24 -1.07 0.00 8.32 0.00 -0.31 -3.35 103.07 106.91 2r1r h GLY 509 Ca -0.04 0.57 0.00 0.00 0.00 0.00 0.00 47.33 47.86 2r1r h GLY 509 CO 0.12 -0.30 -0.70 0.54 0.00 0.00 0.00 176.54 176.20 2r1r n ARG 510 N -5.50 2.63 -3.98 4.80 1.74 -0.37 -1.16 116.66 114.82 2r1r n ARG 510 Ca -0.09 -0.01 -0.40 0.00 -0.77 0.00 0.00 57.85 56.57 2r1r n ARG 510 Cb 0.42 -1.11 0.02 0.00 -1.02 0.00 0.00 32.46 30.77 2r1r n ARG 510 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2r1r n ARG 511 N -1.36 -0.63 -3.15 5.56 1.74 0.11 -2.15 116.66 116.78 2r1r n ARG 511 Ca 0.02 0.28 -0.39 0.00 -0.77 0.00 0.00 57.85 56.99 2r1r n ARG 511 Cb 0.21 -2.57 -0.06 0.00 -1.02 0.00 0.00 32.46 29.02 2r1r n ARG 511 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2r1r s THR 512 N -3.38 4.61 0.29 0.55 -4.23 -1.26 -3.78 115.64 108.44 2r1r s THR 512 Ca 0.36 1.42 0.10 0.00 -1.18 0.00 0.00 61.69 62.40 2r1r s THR 512 Cb -0.20 -4.00 -0.06 0.00 1.34 0.00 0.00 72.50 69.59 2r1r s THR 512 CO 0.95 0.53 -0.14 -0.76 -0.54 0.00 0.00 174.62 174.65 2r1r s LEU 513 N -1.02 2.62 -0.39 4.79 1.43 -0.29 -4.46 118.68 121.36 2r1r s LEU 513 Ca 0.32 -1.10 0.02 0.00 -1.03 0.00 0.00 54.13 52.34 2r1r s LEU 513 Cb -0.21 -0.97 0.15 0.00 0.03 0.00 0.00 46.19 45.19 2r1r s LEU 513 CO 0.22 -0.10 0.28 -0.83 0.23 0.00 0.00 176.35 176.14 2r1r s GLY 514 N -3.52 1.07 -0.17 -3.19 0.00 0.10 -3.55 107.32 98.06 2r1r s GLY 514 Ca 0.30 -2.20 -0.07 0.00 0.00 0.00 0.00 44.72 42.75 2r1r s GLY 514 CO 0.14 2.08 0.07 -0.42 0.00 0.00 0.00 173.10 174.98 2r1r s ILE 515 N 0.52 4.92 0.00 0.90 1.01 0.95 -2.80 121.20 126.70 2r1r s ILE 515 Ca 0.25 0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.91 2r1r s ILE 515 Cb -0.10 -3.20 0.00 0.00 0.01 0.00 0.00 42.46 39.18 2r1r s ILE 515 CO -0.10 0.49 0.00 0.61 0.00 0.00 0.00 174.94 175.94 2r1r n GLY 516 N 3.24 5.77 3.26 6.18 0.00 -0.70 -1.09 105.19 121.84 2r1r n GLY 516 Ca -0.17 -1.53 -0.15 0.00 0.00 0.00 0.00 46.02 44.17 2r1r n GLY 516 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2r1r s VAL 517 N 0.51 1.13 0.12 1.61 -7.23 -1.26 -0.11 120.40 115.17 2r1r s VAL 517 Ca 0.00 -2.05 0.04 0.00 -1.81 0.00 0.00 61.98 58.15 2r1r s VAL 517 Cb 0.00 -1.94 -0.04 0.00 0.56 0.00 0.00 36.38 34.96 2r1r s VAL 517 CO 0.00 -0.67 -0.10 0.27 -0.31 0.00 0.00 175.10 174.29 2r1r s ILE 518 N -3.35 1.03 -0.38 -0.62 -4.36 -0.20 -4.25 121.20 109.07 2r1r s ILE 518 Ca 0.19 -1.83 0.00 0.00 -0.26 0.00 0.00 60.65 58.74 2r1r s ILE 518 Cb 0.03 -1.59 0.00 0.00 1.25 0.00 0.00 42.46 42.15 2r1r s ILE 518 CO 0.02 -0.65 0.00 -3.20 0.24 0.00 0.00 174.94 171.35 2r1r n ASN 519 N 0.21 -2.54 -0.06 4.36 2.85 -0.62 -2.00 115.26 117.46 2r1r n ASN 519 Ca -0.13 0.04 -0.11 0.00 -0.11 0.00 0.00 54.58 54.26 2r1r n ASN 519 Cb 0.59 -1.36 -0.04 0.00 1.24 0.00 0.00 39.78 40.21 2r1r n ASN 519 CO 0.00 0.00 0.00 0.15 -2.11 0.00 0.00 177.26 175.30 2r1r h PHE 520 N 0.00 0.32 -0.18 1.20 3.57 -1.73 -1.61 116.94 118.51 2r1r h PHE 520 Ca -0.09 -0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.41 2r1r h PHE 520 Cb 0.76 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.38 2r1r h PHE 520 CO 0.11 0.38 -0.03 0.00 -2.23 0.00 0.00 178.31 176.54 2r1r h ALA 521 N 0.90 0.13 -0.55 2.41 0.00 -1.78 -0.43 119.26 119.95 2r1r h ALA 521 Ca 0.07 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.08 2r1r h ALA 521 Cb 0.20 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 2r1r h ALA 521 CO -0.00 -0.47 0.30 -0.92 0.00 0.00 0.00 179.25 178.16 2r1r h TYR 522 N 0.02 0.55 -0.20 0.00 3.20 -1.92 0.27 116.97 118.89 2r1r h TYR 522 Ca 0.08 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.02 2r1r h TYR 522 Cb 0.12 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.19 2r1r h TYR 522 CO -0.19 0.28 -0.07 -0.92 -1.64 0.00 0.00 178.16 175.62 2r1r h TYR 523 N 0.57 -0.15 -0.28 -3.82 3.20 -0.39 -0.30 116.97 115.80 2r1r h TYR 523 Ca 0.24 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.16 2r1r h TYR 523 Cb 0.11 0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 2r1r h TYR 523 CO -0.09 -0.11 0.07 -0.07 -1.64 0.00 0.00 178.16 176.32 2r1r h LEU 524 N -0.03 0.04 -0.88 2.82 3.38 -0.59 -2.58 115.31 117.47 2r1r h LEU 524 Ca 0.10 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.20 2r1r h LEU 524 Cb 0.18 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 40.91 2r1r h LEU 524 CO -0.22 0.06 0.53 0.00 0.09 0.00 0.00 178.44 178.90 2r1r h ALA 525 N 1.20 1.26 -0.75 1.53 0.00 -0.30 0.86 119.26 123.05 2r1r h ALA 525 Ca 0.13 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.07 2r1r h ALA 525 Cb 0.12 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2r1r h ALA 525 CO -0.16 0.19 0.50 0.87 0.00 0.00 0.00 179.25 180.65 2r1r h LYS 526 N 0.91 0.97 -0.29 0.00 1.57 -0.70 -1.93 116.57 117.10 2r1r h LYS 526 Ca 0.41 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 2r1r h LYS 526 Cb 0.32 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.41 2r1r h LYS 526 CO -0.23 0.64 0.00 0.72 -0.57 0.00 0.00 179.45 180.01 2r1r n HIS 527 N -4.43 0.38 -3.23 -1.35 8.25 0.21 -4.92 115.22 110.13 2r1r n HIS 527 Ca 0.08 -0.19 -0.22 0.00 -0.26 0.00 0.00 57.72 57.13 2r1r n HIS 527 Cb 0.05 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.21 2r1r n HIS 527 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2r1r n GLY 528 N 0.97 -0.47 3.71 -1.41 0.00 -0.69 -5.02 105.19 102.28 2r1r n GLY 528 Ca 0.10 0.14 -0.24 0.00 0.00 0.00 0.00 46.02 46.02 2r1r n GLY 528 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r1r s LYS 529 N -5.91 2.26 0.29 1.61 -0.14 -0.96 -5.02 119.74 111.87 2r1r s LYS 529 Ca 0.41 -1.68 0.02 0.00 -1.36 0.00 0.00 55.97 53.36 2r1r s LYS 529 Cb -0.18 -2.06 -0.06 0.00 -1.68 0.00 0.00 37.83 33.85 2r1r s LYS 529 CO 0.50 0.04 0.08 1.03 -0.76 0.00 0.00 175.35 176.24 2r1r s ARG 530 N -3.84 1.52 -0.13 1.68 0.52 -1.26 -4.28 118.95 113.15 2r1r s ARG 530 Ca 0.38 -1.83 -0.17 0.00 -0.52 0.00 0.00 55.73 53.59 2r1r s ARG 530 Cb -0.00 -0.55 -0.15 0.00 0.52 0.00 0.00 34.95 34.77 2r1r s ARG 530 CO 0.22 -0.24 0.39 1.88 0.02 0.00 0.00 175.30 177.57 2r1r h TYR 531 N 2.27 0.00 0.00 -0.53 -1.99 -1.95 -3.32 116.97 111.44 2r1r h TYR 531 Ca -0.39 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.34 2r1r h TYR 531 Cb 1.24 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.97 2r1r h TYR 531 CO 0.52 0.63 0.00 0.66 -0.00 0.00 0.00 178.16 179.96 2r1r h SER 532 N -1.00 0.00 -0.00 3.88 4.64 -1.92 -3.32 113.55 115.83 2r1r h SER 532 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2r1r h SER 532 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 2r1r h SER 532 CO -0.02 0.00 -0.80 -0.90 -0.87 0.00 0.00 176.83 174.24 2r1r n ASP 533 N -2.47 1.30 0.00 4.97 5.68 -1.26 -3.98 116.55 120.79 2r1r n ASP 533 Ca 0.02 -1.15 0.00 0.00 -0.50 0.00 0.00 54.79 53.15 2r1r n ASP 533 Cb 0.24 0.83 0.00 0.00 -1.14 0.00 0.00 41.12 41.05 2r1r n ASP 533 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2r1r n GLY 534 N 1.45 0.67 0.17 6.12 0.00 -1.25 -4.93 105.19 107.42 2r1r n GLY 534 Ca 0.06 -0.19 0.04 0.00 0.00 0.00 0.00 46.02 45.92 2r1r n GLY 534 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2r1r h SER 535 N 0.00 0.00 0.73 1.61 4.64 -1.87 -3.18 113.55 115.48 2r1r h SER 535 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2r1r h SER 535 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2r1r h SER 535 CO 0.00 0.44 -0.46 0.00 -0.87 0.00 0.00 176.83 175.94 2r1r n ALA 536 N -2.28 3.12 -0.22 5.18 0.00 -1.25 -4.51 120.51 120.56 2r1r n ALA 536 Ca 0.00 -0.27 -0.08 0.00 0.00 0.00 0.00 53.44 53.10 2r1r n ALA 536 Cb 0.59 -1.20 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 2r1r n ALA 536 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2r1r h ASN 537 N 0.00 -1.47 0.27 0.00 4.21 -1.89 0.28 115.58 116.97 2r1r h ASN 537 Ca 0.00 0.25 -0.11 0.00 1.21 0.00 0.00 56.30 57.65 2r1r h ASN 537 Cb 0.60 0.68 -0.01 0.00 -1.12 0.00 0.00 38.32 38.46 2r1r h ASN 537 CO 0.00 -0.33 -0.45 0.78 -1.29 0.00 0.00 177.43 176.15 2r1r h ASN 538 N -0.21 0.24 -0.22 5.81 2.35 -1.84 -1.68 115.58 120.03 2r1r h ASN 538 Ca 0.19 -0.11 -0.12 0.00 -0.55 0.00 0.00 56.30 55.72 2r1r h ASN 538 Cb 0.56 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 2r1r h ASN 538 CO -0.70 0.66 -0.28 0.25 -1.65 0.00 0.00 177.43 175.71 2r1r h LEU 539 N 0.19 0.73 -0.64 1.61 5.85 -1.57 -2.01 115.31 119.47 2r1r h LEU 539 Ca 0.01 -0.28 -0.12 0.00 0.84 0.00 0.00 57.88 58.33 2r1r h LEU 539 Cb 0.86 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 2r1r h LEU 539 CO 0.07 0.97 -0.25 0.74 -0.34 0.00 0.00 178.44 179.63 2r1r h THR 540 N 0.61 1.27 -0.39 1.05 2.02 -0.78 -0.27 112.91 116.42 2r1r h THR 540 Ca 0.08 -1.39 -0.03 0.00 0.77 0.00 0.00 66.41 65.84 2r1r h THR 540 Cb 0.78 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 2r1r h THR 540 CO 0.06 0.46 0.12 -0.74 0.37 0.00 0.00 175.52 175.79 2r1r h HIS 541 N 0.69 0.64 -0.74 3.16 -0.00 -1.07 -1.83 115.15 116.00 2r1r h HIS 541 Ca 0.09 -0.07 -0.04 0.00 -0.00 0.00 0.00 60.37 60.35 2r1r h HIS 541 Cb 0.78 -0.18 -0.03 0.00 -0.00 0.00 0.00 27.41 27.97 2r1r h HIS 541 CO 0.04 0.60 0.30 -0.22 -0.00 0.00 0.00 177.93 178.65 2r1r h LYS 542 N 0.49 1.10 0.03 5.26 3.64 -1.25 -1.18 116.57 124.66 2r1r h LYS 542 Ca 0.13 -0.20 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 2r1r h LYS 542 Cb 0.27 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2r1r h LYS 542 CO -0.00 0.90 -0.01 1.15 -2.27 0.00 0.00 179.45 179.21 2r1r h THR 543 N 1.06 1.20 0.00 1.00 2.02 -0.91 -2.94 112.91 114.33 2r1r h THR 543 Ca 0.25 -0.75 -0.05 0.00 0.77 0.00 0.00 66.41 66.63 2r1r h THR 543 Cb 0.21 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 2r1r h THR 543 CO -0.02 0.19 -0.24 -0.26 0.37 0.00 0.00 175.52 175.56 2r1r h PHE 544 N -0.37 0.00 0.40 3.16 0.04 -1.33 -1.79 116.94 117.05 2r1r h PHE 544 Ca -0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 2r1r h PHE 544 Cb 0.34 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.50 2r1r h PHE 544 CO 0.04 0.24 -0.19 1.49 -0.60 0.00 0.00 178.31 179.29 2r1r h GLU 545 N 0.00 -0.52 -0.11 1.51 4.81 -1.19 -2.21 114.58 116.87 2r1r h GLU 545 Ca -0.00 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.30 2r1r h GLU 545 Cb 0.77 0.12 -0.06 0.00 0.63 0.00 0.00 28.75 30.20 2r1r h GLU 545 CO 0.03 -0.29 -0.39 0.00 -0.73 0.00 0.00 179.01 177.63 2r1r h ALA 546 N -0.07 -0.55 -0.25 2.92 0.00 -1.27 -0.08 119.26 119.96 2r1r h ALA 546 Ca -0.05 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.88 2r1r h ALA 546 Cb 0.47 0.73 -0.07 0.00 0.00 0.00 0.00 17.79 18.92 2r1r h ALA 546 CO 0.09 -0.90 -0.50 0.82 0.00 0.00 0.00 179.25 178.76 2r1r h ILE 547 N -0.48 0.00 -0.81 0.00 2.04 -1.27 -1.16 117.51 115.82 2r1r h ILE 547 Ca 0.08 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.93 2r1r h ILE 547 Cb 0.61 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.65 2r1r h ILE 547 CO -0.37 0.00 0.47 -0.61 0.00 0.00 0.00 178.15 177.64 2r1r h GLN 548 N -0.44 1.11 0.48 2.37 5.75 -1.16 -1.55 115.11 121.68 2r1r h GLN 548 Ca 0.05 -0.11 -0.01 0.00 -0.15 0.00 0.00 58.65 58.42 2r1r h GLN 548 Cb 0.58 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 28.87 2r1r h GLN 548 CO -0.47 0.80 -0.51 -0.92 -2.65 0.00 0.00 178.83 175.08 2r1r h TYR 549 N 1.12 -1.43 -0.16 3.99 3.20 -0.61 -1.43 116.97 121.66 2r1r h TYR 549 Ca 0.29 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.16 2r1r h TYR 549 Cb -0.01 0.56 -0.01 0.00 1.54 0.00 0.00 36.73 38.81 2r1r h TYR 549 CO -0.00 -0.68 0.06 1.88 -1.64 0.00 0.00 178.16 177.78 2r1r h TYR 550 N -1.00 0.21 0.12 -3.82 0.05 -1.11 0.22 116.97 111.63 2r1r h TYR 550 Ca -0.06 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.71 2r1r h TYR 550 Cb 0.88 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.55 2r1r h TYR 550 CO -0.27 0.17 -0.06 -0.07 -1.05 0.00 0.00 178.16 176.88 2r1r h LEU 551 N 0.22 -0.14 -0.53 3.88 3.38 -1.12 -1.45 115.31 119.55 2r1r h LEU 551 Ca 0.06 -0.24 0.08 0.00 0.09 0.00 0.00 57.88 57.86 2r1r h LEU 551 Cb 0.06 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 40.78 2r1r h LEU 551 CO -0.01 0.17 0.19 -0.07 0.09 0.00 0.00 178.44 178.82 2r1r h LEU 552 N -0.47 0.19 -0.02 1.67 3.38 -0.78 -0.63 115.31 118.66 2r1r h LEU 552 Ca -0.02 0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.05 2r1r h LEU 552 Cb 0.38 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 2r1r h LEU 552 CO 0.03 0.13 -0.21 0.50 0.09 0.00 0.00 178.44 178.99 2r1r h LYS 553 N 0.37 -0.31 -0.71 1.13 3.64 -0.93 -0.13 116.57 119.63 2r1r h LYS 553 Ca 0.26 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.70 2r1r h LYS 553 Cb 0.29 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.13 2r1r h LYS 553 CO -0.26 -0.21 0.43 0.00 -2.27 0.00 0.00 179.45 177.14 2r1r h ALA 554 N 0.58 0.95 -0.77 5.00 0.00 -0.42 0.38 119.26 124.97 2r1r h ALA 554 Ca 0.06 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2r1r h ALA 554 Cb 0.41 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2r1r h ALA 554 CO -0.20 0.18 0.34 1.03 0.00 0.00 0.00 179.25 180.60 2r1r h SER 555 N 0.83 1.04 -0.45 0.00 0.87 -0.85 -1.10 113.55 113.88 2r1r h SER 555 Ca 0.30 -0.15 -0.04 0.00 -1.23 0.00 0.00 61.79 60.67 2r1r h SER 555 Cb 0.08 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 61.76 2r1r h SER 555 CO -0.14 0.90 0.13 -1.13 -0.53 0.00 0.00 176.83 176.06 2r1r h ASN 556 N 1.10 0.67 -0.44 6.23 -0.00 -0.13 0.01 115.58 123.02 2r1r h ASN 556 Ca 0.26 -0.22 0.01 0.00 -0.00 0.00 0.00 56.30 56.35 2r1r h ASN 556 Cb 0.16 -0.18 -0.02 0.00 -0.00 0.00 0.00 38.32 38.28 2r1r h ASN 556 CO -0.03 0.71 0.29 -0.33 -0.00 0.00 0.00 177.43 178.08 2r1r h GLU 557 N 0.60 0.58 -0.97 6.67 4.39 -0.68 -1.55 114.58 123.62 2r1r h GLU 557 Ca 0.14 -0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.82 2r1r h GLU 557 Cb 0.29 -0.13 -0.05 0.00 -0.10 0.00 0.00 28.75 28.76 2r1r h GLU 557 CO -0.00 0.38 0.64 1.25 -1.16 0.00 0.00 179.01 180.12 2r1r h LEU 558 N 0.60 1.12 -0.34 1.33 5.85 -0.96 -1.86 115.31 121.05 2r1r h LEU 558 Ca 0.16 -0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.89 2r1r h LEU 558 Cb -0.06 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.65 2r1r h LEU 558 CO -0.04 0.82 0.12 0.00 -0.34 0.00 0.00 178.44 179.00 2r1r h ALA 559 N 1.38 0.40 0.07 1.25 0.00 -0.04 0.46 119.26 122.77 2r1r h ALA 559 Ca 0.36 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.32 2r1r h ALA 559 Cb -0.14 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2r1r h ALA 559 CO -0.08 -0.27 -0.16 0.87 0.00 0.00 0.00 179.25 179.61 2r1r h LYS 560 N 0.27 -0.30 0.03 0.00 1.57 -0.89 1.01 116.57 118.27 2r1r h LYS 560 Ca 0.15 0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2r1r h LYS 560 Cb 0.12 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2r1r h LYS 560 CO -0.15 -0.20 -0.01 1.49 -0.57 0.00 0.00 179.45 180.01 2r1r h GLU 561 N -0.31 -0.04 -0.00 3.15 4.81 -0.80 -3.37 114.58 118.02 2r1r h GLU 561 Ca 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2r1r h GLU 561 Cb 0.34 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.73 2r1r h GLU 561 CO -0.11 0.03 -0.02 1.04 -0.73 0.00 0.00 179.01 179.22 2r1r n GLN 562 N -5.08 0.56 0.00 1.92 6.02 0.16 -5.10 117.38 115.86 2r1r n GLN 562 Ca -0.07 -0.53 0.00 0.00 -0.01 0.00 0.00 57.00 56.38 2r1r n GLN 562 Cb 0.07 -0.97 0.00 0.00 1.02 0.00 0.00 30.24 30.36 2r1r n GLN 562 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2r1r n GLY 563 N 0.30 1.40 3.69 1.08 0.00 0.35 -5.00 105.19 107.02 2r1r n GLY 563 Ca 0.01 -1.45 -0.32 0.00 0.00 0.00 0.00 46.02 44.26 2r1r n GLY 563 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r1r s ALA 564 N -0.70 1.76 0.42 4.61 0.00 -1.25 -4.68 121.76 121.91 2r1r s ALA 564 Ca 0.00 0.73 -0.26 0.00 0.00 0.00 0.00 51.96 52.43 2r1r s ALA 564 Cb 0.00 -3.46 -0.09 0.00 0.00 0.00 0.00 23.12 19.57 2r1r s ALA 564 CO 0.00 -2.39 1.39 0.00 0.00 0.00 0.00 175.76 174.76 2r1r h PRO 566 N 2.57 -0.01 -1.28 0.00 0.11 -1.77 -0.88 132.00 130.75 2r1r h PRO 566 Ca -0.50 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 65.22 2r1r h PRO 566 Cb 1.25 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.19 2r1r h PRO 566 CO 0.62 -0.01 0.50 0.91 -0.21 0.00 0.00 178.00 179.82 2r1r n TRP 567 N -5.49 1.96 0.20 0.65 8.01 -0.31 -4.47 117.44 117.99 2r1r n TRP 567 Ca 0.10 -1.99 0.04 0.00 -1.31 0.00 0.00 57.50 54.34 2r1r n TRP 567 Cb 0.38 -0.97 0.41 0.00 -2.01 0.00 0.00 31.31 29.11 2r1r n TRP 567 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.69 177.03 2r1r h PHE 568 N 1.33 0.00 0.00 -5.99 3.57 -1.40 -2.56 116.94 111.88 2r1r h PHE 568 Ca 0.38 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.88 2r1r h PHE 568 Cb 1.25 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.99 2r1r h PHE 568 CO 0.98 0.32 0.00 0.27 -2.23 0.00 0.00 178.31 177.65 2r1r n ASN 569 N -4.09 0.00 -0.16 0.41 0.23 -1.26 -1.67 115.26 108.71 2r1r n ASN 569 Ca -0.02 0.25 0.11 0.00 -0.53 0.00 0.00 54.58 54.40 2r1r n ASN 569 Cb 0.37 -0.35 0.04 0.00 -2.08 0.00 0.00 39.78 37.76 2r1r n ASN 569 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2r1r n GLU 570 N -1.35 0.43 -2.03 -3.83 1.02 -0.96 -4.95 120.64 108.96 2r1r n GLU 570 Ca 0.04 -0.33 -0.31 0.00 -0.02 0.00 0.00 57.16 56.54 2r1r n GLU 570 Cb 0.08 -1.49 -0.00 0.00 -0.02 0.00 0.00 31.44 30.01 2r1r n GLU 570 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2r1r s THR 571 N -2.80 4.67 0.08 2.62 -4.23 -0.67 -1.60 115.64 113.72 2r1r s THR 571 Ca 0.13 0.94 0.16 0.00 -1.18 0.00 0.00 61.69 61.74 2r1r s THR 571 Cb 0.17 -3.83 0.07 0.00 1.34 0.00 0.00 72.50 70.25 2r1r s THR 571 CO 0.72 -1.02 1.60 0.71 -0.54 0.00 0.00 174.62 176.08 2r1r h THR 572 N 0.01 1.01 -0.71 3.99 1.35 0.49 -3.10 112.91 115.95 2r1r h THR 572 Ca -0.45 -1.96 0.06 0.00 -0.55 0.00 0.00 66.41 63.51 2r1r h THR 572 Cb 1.19 2.18 -0.06 0.00 -1.73 0.00 0.00 68.15 69.73 2r1r h THR 572 CO 0.62 0.48 0.41 1.88 -0.25 0.00 0.00 175.52 178.66 2r1r h TYR 573 N 0.00 0.76 0.00 4.73 0.05 -1.68 -1.18 116.97 119.65 2r1r h TYR 573 Ca -0.00 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.80 2r1r h TYR 573 Cb 1.14 -0.24 -0.00 0.00 1.01 0.00 0.00 36.73 38.64 2r1r h TYR 573 CO 0.00 0.37 -0.02 0.00 -1.05 0.00 0.00 178.16 177.46 2r1r h ALA 574 N 1.36 1.75 -0.42 3.88 0.00 -1.75 -1.42 119.26 122.67 2r1r h ALA 574 Ca 0.31 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2r1r h ALA 574 Cb 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2r1r h ALA 574 CO -0.18 0.03 0.00 1.63 0.00 0.00 0.00 179.25 180.73 2r1r n LYS 575 N -4.20 3.11 -1.77 0.00 5.02 -0.61 -4.84 118.16 114.87 2r1r n LYS 575 Ca -0.03 -1.98 -0.08 0.00 -2.02 0.00 0.00 58.31 54.20 2r1r n LYS 575 Cb 0.11 -1.80 -0.02 0.00 -0.02 0.00 0.00 35.03 33.30 2r1r n LYS 575 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2r1r n GLY 576 N 0.70 0.45 3.59 0.72 0.00 -0.53 -5.02 105.19 105.09 2r1r n GLY 576 Ca 0.18 -0.59 -0.35 0.00 0.00 0.00 0.00 46.02 45.25 2r1r n GLY 576 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2r1r s ILE 577 N -2.37 4.72 0.35 -0.61 1.01 -0.55 -5.01 121.20 118.75 2r1r s ILE 577 Ca 0.00 -0.05 0.08 0.00 0.00 0.00 0.00 60.65 60.68 2r1r s ILE 577 Cb 0.00 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.28 2r1r s ILE 577 CO 0.00 0.42 0.20 -0.76 0.00 0.00 0.00 174.94 174.80 2r1r s LEU 578 N 0.74 3.33 0.30 2.97 1.43 -1.26 -3.53 118.68 122.66 2r1r s LEU 578 Ca 0.04 -0.74 0.03 0.00 -1.03 0.00 0.00 54.13 52.44 2r1r s LEU 578 Cb -0.13 -1.84 0.63 0.00 0.03 0.00 0.00 46.19 44.87 2r1r s LEU 578 CO 0.02 -0.36 1.83 -0.65 0.23 0.00 0.00 176.35 177.42 2r1r h PRO 579 N 1.43 0.89 0.00 1.29 0.11 -1.93 0.17 132.00 133.96 2r1r h PRO 579 Ca -0.44 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2r1r h PRO 579 Cb 1.25 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2r1r h PRO 579 CO 0.62 0.59 0.00 0.44 -0.21 0.00 0.00 178.00 179.44 2r1r n ILE 580 N -4.63 1.03 0.05 4.15 -5.35 -1.26 -2.58 119.36 110.78 2r1r n ILE 580 Ca 0.19 0.44 0.08 0.00 -0.27 0.00 0.00 62.75 63.19 2r1r n ILE 580 Cb 0.41 -1.38 -0.07 0.00 -1.74 0.00 0.00 39.64 36.86 2r1r n ILE 580 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2r1r n ASP 581 N -2.10 0.61 -0.03 7.28 8.00 0.58 -4.55 116.55 126.34 2r1r n ASP 581 Ca 0.01 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.76 2r1r n ASP 581 Cb 0.13 0.77 0.01 0.00 -0.02 0.00 0.00 41.12 42.02 2r1r n ASP 581 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2r1r n THR 582 N -2.63 0.87 -1.12 -3.53 -2.24 -1.06 -5.02 114.28 99.54 2r1r n THR 582 Ca -0.05 -0.93 -0.30 0.00 -2.27 0.00 0.00 64.05 60.50 2r1r n THR 582 Cb 0.65 0.57 0.14 0.00 -2.10 0.00 0.00 70.33 69.58 2r1r n THR 582 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2r1r s TYR 583 N -0.87 2.25 -0.24 4.78 1.13 -1.17 -4.47 117.35 118.76 2r1r s TYR 583 Ca 0.01 1.39 -0.29 0.00 -1.41 0.00 0.00 57.07 56.77 2r1r s TYR 583 Cb 0.01 -3.15 -0.02 0.00 -1.10 0.00 0.00 41.96 37.70 2r1r s TYR 583 CO 0.01 -2.37 1.56 0.21 -2.51 0.00 0.00 175.55 172.45 2r1r s LYS 584 N -4.87 3.81 0.60 -3.49 2.47 -1.26 -4.90 119.74 112.10 2r1r s LYS 584 Ca 0.63 1.58 0.28 0.00 -1.56 0.00 0.00 55.97 56.91 2r1r s LYS 584 Cb -0.19 -4.01 1.35 0.00 -1.46 0.00 0.00 37.83 33.52 2r1r s LYS 584 CO 0.57 -1.27 1.75 1.57 0.16 0.00 0.00 175.35 178.13 2r1r h LYS 585 N 10.51 0.00 0.00 4.03 -0.00 -1.93 -1.57 116.57 127.61 2r1r h LYS 585 Ca -0.32 0.00 -0.02 0.00 -0.00 0.00 0.00 60.65 60.31 2r1r h LYS 585 Cb 1.14 0.00 -0.00 0.00 -0.00 0.00 0.00 32.23 33.37 2r1r h LYS 585 CO 1.01 0.00 -0.08 -0.44 -0.00 0.00 0.00 179.45 179.94 2r1r h ASP 586 N 0.00 0.00 -0.49 7.07 5.19 -1.91 -2.66 116.42 123.62 2r1r h ASP 586 Ca 0.27 0.00 0.14 0.00 -0.62 0.00 0.00 57.03 56.82 2r1r h ASP 586 Cb 1.58 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 41.07 2r1r h ASP 586 CO -0.00 0.08 0.37 -0.07 -3.12 0.00 0.00 179.24 176.50 2r1r h LEU 587 N 0.00 0.00 -2.07 1.55 3.38 -1.59 -0.88 115.31 115.70 2r1r h LEU 587 Ca -0.00 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.03 2r1r h LEU 587 Cb 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2r1r h LEU 587 CO 0.01 0.00 0.18 0.44 0.09 0.00 0.00 178.44 179.16 2r1r h ASP 588 N 0.00 0.00 1.34 -0.43 3.32 -1.71 -1.23 116.42 117.71 2r1r h ASP 588 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2r1r h ASP 588 Cb 0.98 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.53 2r1r h ASP 588 CO -0.00 0.00 0.00 0.35 -1.72 0.00 0.00 179.24 177.87 2r1r n THR 589 N -4.30 0.47 -0.04 0.35 -2.24 -0.34 -3.91 114.28 104.28 2r1r n THR 589 Ca 0.02 -0.20 0.04 0.00 -2.27 0.00 0.00 64.05 61.65 2r1r n THR 589 Cb 0.32 -0.59 0.11 0.00 -2.10 0.00 0.00 70.33 68.07 2r1r n THR 589 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 2r1r n ILE 590 N -2.08 0.81 -3.64 2.28 -5.35 -0.48 -5.00 119.36 105.90 2r1r n ILE 590 Ca 0.06 -0.90 -0.05 0.00 -0.27 0.00 0.00 62.75 61.58 2r1r n ILE 590 Cb 0.40 0.63 -0.07 0.00 -1.74 0.00 0.00 39.64 38.87 2r1r n ILE 590 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2r1r s ALA 591 N -0.95 -2.07 -0.94 -1.28 0.00 -1.16 -4.83 121.76 110.53 2r1r s ALA 591 Ca 0.17 2.24 0.08 0.00 0.00 0.00 0.00 51.96 54.45 2r1r s ALA 591 Cb 0.09 -1.55 0.10 0.00 0.00 0.00 0.00 23.12 21.76 2r1r s ALA 591 CO 0.12 -0.35 0.84 0.27 0.00 0.00 0.00 175.76 176.65 2r1r n ASN 592 N 3.70 1.87 -4.64 0.00 6.94 -1.26 -4.67 115.26 117.21 2r1r n ASN 592 Ca -0.18 -1.47 -0.49 0.00 -0.02 0.00 0.00 54.58 52.41 2r1r n ASN 592 Cb 0.58 -0.03 -0.05 0.00 -2.36 0.00 0.00 39.78 37.91 2r1r n ASN 592 CO 0.00 0.00 0.00 1.21 -1.03 0.00 0.00 177.26 177.44 2r1r n GLU 593 N 0.41 1.66 -1.95 -3.83 4.07 -1.26 -4.95 120.64 114.79 2r1r n GLU 593 Ca 0.05 0.60 -0.30 0.00 -0.06 0.00 0.00 57.16 57.45 2r1r n GLU 593 Cb 0.24 -2.31 0.03 0.00 -0.06 0.00 0.00 31.44 29.33 2r1r n GLU 593 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 2r1r s PRO 594 N 1.05 3.23 -0.09 5.31 0.04 -1.26 -4.99 135.00 138.29 2r1r s PRO 594 Ca 0.83 0.55 -0.30 0.00 0.04 0.00 0.00 61.00 62.12 2r1r s PRO 594 Cb -0.82 -2.08 -0.02 0.00 0.04 0.00 0.00 34.50 31.62 2r1r s PRO 594 CO 0.44 -0.76 1.07 -0.51 0.04 0.00 0.00 177.00 177.28 2r1r s LEU 595 N -5.23 4.26 0.00 -3.56 1.43 -1.26 -4.93 118.68 109.39 2r1r s LEU 595 Ca 0.56 1.63 0.25 0.00 -1.03 0.00 0.00 54.13 55.54 2r1r s LEU 595 Cb -0.11 -3.56 0.53 0.00 0.03 0.00 0.00 46.19 43.08 2r1r s LEU 595 CO 0.52 -0.50 1.42 1.41 0.23 0.00 0.00 176.35 179.44 2r1r n HIS 596 N 5.08 0.00 -4.33 0.29 8.25 -1.26 -4.96 115.22 118.29 2r1r n HIS 596 Ca 0.10 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.32 2r1r n HIS 596 Cb 0.48 -0.10 -0.08 0.00 1.12 0.00 0.00 29.99 31.41 2r1r n HIS 596 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2r1r s TYR 597 N -2.55 2.62 -1.02 4.41 2.02 -1.26 -5.06 117.35 116.51 2r1r s TYR 597 Ca 0.21 -0.24 -0.22 0.00 -0.37 0.00 0.00 57.07 56.45 2r1r s TYR 597 Cb 0.19 -1.17 0.07 0.00 -0.40 0.00 0.00 41.96 40.65 2r1r s TYR 597 CO 0.56 0.63 1.40 0.34 -1.57 0.00 0.00 175.55 176.91 2r1r s ASP 598 N -3.56 6.54 0.15 2.29 -1.08 -1.26 -4.79 116.67 114.96 2r1r s ASP 598 Ca 0.30 -1.61 0.08 0.00 -0.52 0.00 0.00 52.55 50.81 2r1r s ASP 598 Cb -0.06 -2.54 -0.11 0.00 -1.46 0.00 0.00 42.92 38.75 2r1r s ASP 598 CO 0.19 -1.41 1.34 -0.50 0.52 0.00 0.00 175.17 175.30 2r1r h TRP 599 N 9.52 0.00 -0.46 -5.34 4.06 -1.98 -3.02 115.95 118.73 2r1r h TRP 599 Ca 0.20 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 61.03 2r1r h TRP 599 Cb 1.01 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.15 2r1r h TRP 599 CO 1.26 0.92 -0.21 0.93 -3.56 0.00 0.00 178.44 177.79 2r1r h GLU 600 N 0.00 0.94 -0.19 0.49 4.39 -1.99 0.28 114.58 118.51 2r1r h GLU 600 Ca -0.01 -0.39 -0.08 0.00 0.34 0.00 0.00 59.36 59.22 2r1r h GLU 600 Cb 1.65 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 30.25 2r1r h GLU 600 CO 0.12 1.06 -0.24 0.00 -1.16 0.00 0.00 179.01 178.79 2r1r h ALA 601 N 0.93 1.25 -0.05 3.43 0.00 -1.97 -2.46 119.26 120.39 2r1r h ALA 601 Ca 0.11 -0.31 -0.25 0.00 0.00 0.00 0.00 54.91 54.46 2r1r h ALA 601 Cb 0.77 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 18.48 2r1r h ALA 601 CO 0.06 0.50 -0.94 1.25 0.00 0.00 0.00 179.25 180.12 2r1r h LEU 602 N 0.31 0.92 -0.38 0.00 5.85 -1.36 -2.95 115.31 117.69 2r1r h LEU 602 Ca 0.05 -0.70 0.08 0.00 0.84 0.00 0.00 57.88 58.15 2r1r h LEU 602 Cb 0.59 -0.28 -0.08 0.00 0.37 0.00 0.00 40.66 41.26 2r1r h LEU 602 CO 0.04 1.49 -0.19 -0.09 -0.34 0.00 0.00 178.44 179.35 2r1r h ARG 603 N 0.43 -0.12 0.34 1.25 2.43 0.01 0.79 114.38 119.51 2r1r h ARG 603 Ca -0.10 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 2r1r h ARG 603 Cb 1.58 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 31.14 2r1r h ARG 603 CO 0.19 -0.08 -0.37 0.93 -1.51 0.00 0.00 179.97 179.13 2r1r h GLU 604 N -0.13 -0.69 -0.78 0.20 4.39 -1.56 -1.63 114.58 114.39 2r1r h GLU 604 Ca 0.19 0.05 0.18 0.00 0.34 0.00 0.00 59.36 60.12 2r1r h GLU 604 Cb 0.42 0.16 -0.13 0.00 -0.10 0.00 0.00 28.75 29.09 2r1r h GLU 604 CO -0.46 -0.46 0.05 1.03 -1.16 0.00 0.00 179.01 178.01 2r1r h SER 605 N -0.71 -0.28 0.28 1.42 0.87 -1.18 0.22 113.55 114.17 2r1r h SER 605 Ca -0.04 0.20 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 2r1r h SER 605 Cb 0.62 0.33 -0.01 0.00 -0.44 0.00 0.00 62.40 62.90 2r1r h SER 605 CO -0.06 -0.17 -0.18 0.40 -0.53 0.00 0.00 176.83 176.29 2r1r h ILE 606 N 0.13 0.62 -0.52 2.23 2.04 -0.83 0.70 117.51 121.87 2r1r h ILE 606 Ca 0.44 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.40 2r1r h ILE 606 Cb 0.80 0.62 -0.10 0.00 -0.74 0.00 0.00 36.82 37.39 2r1r h ILE 606 CO -0.66 0.00 -0.21 0.50 0.00 0.00 0.00 178.15 177.78 2r1r h LYS 607 N -0.45 -0.08 0.71 2.37 3.64 0.34 1.12 116.57 124.22 2r1r h LYS 607 Ca -0.03 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 2r1r h LYS 607 Cb 0.38 0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2r1r h LYS 607 CO 0.02 -0.05 -0.34 1.15 -2.27 0.00 0.00 179.45 177.96 2r1r h THR 608 N -0.08 0.10 -0.01 1.00 2.02 -0.82 -3.38 112.91 111.73 2r1r h THR 608 Ca 0.24 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 67.15 2r1r h THR 608 Cb 0.46 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 2r1r h THR 608 CO -0.58 0.01 -0.49 1.41 0.37 0.00 0.00 175.52 176.24 2r1r n HIS 609 N -5.42 0.00 -3.53 3.16 8.25 0.23 -5.09 115.22 112.82 2r1r n HIS 609 Ca -0.12 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.36 2r1r n HIS 609 Cb 0.39 -0.01 -0.01 0.00 1.12 0.00 0.00 29.99 31.48 2r1r n HIS 609 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2r1r n GLY 610 N 1.42 -1.63 3.38 -1.41 0.00 0.39 -4.47 105.19 102.87 2r1r n GLY 610 Ca 0.09 -1.23 -0.29 0.00 0.00 0.00 0.00 46.02 44.59 2r1r n GLY 610 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r1r s LEU 611 N 0.00 2.30 0.13 0.99 1.43 -1.26 -4.53 118.68 117.74 2r1r s LEU 611 Ca 0.00 -0.68 -0.10 0.00 -1.03 0.00 0.00 54.13 52.32 2r1r s LEU 611 Cb 0.00 -1.27 -0.08 0.00 0.03 0.00 0.00 46.19 44.87 2r1r s LEU 611 CO 0.00 0.21 1.38 -0.09 0.23 0.00 0.00 176.35 178.07 2r1r h ARG 612 N 4.16 0.76 -6.26 1.70 9.65 -1.81 -2.23 114.38 120.35 2r1r h ARG 612 Ca -0.50 -0.56 -0.69 0.00 -1.10 0.00 0.00 59.98 57.14 2r1r h ARG 612 Cb 1.16 0.09 -0.28 0.00 -1.39 0.00 0.00 29.97 29.56 2r1r h ARG 612 CO 0.41 1.18 -0.83 -0.80 2.80 0.00 0.00 179.97 182.72 2r1r s ASN 613 N -7.02 3.50 0.15 -3.80 -0.87 -1.26 -3.24 114.94 102.39 2r1r s ASN 613 Ca -0.10 -0.37 -0.02 0.00 -1.57 0.00 0.00 52.86 50.81 2r1r s ASN 613 Cb 0.10 -0.75 -0.04 0.00 -0.02 0.00 0.00 41.25 40.54 2r1r s ASN 613 CO 0.89 0.30 1.35 0.28 -2.57 0.00 0.00 177.10 177.34 2r1r h SER 614 N 5.66 0.44 -4.29 -1.22 0.02 -1.52 -3.45 113.55 109.19 2r1r h SER 614 Ca -0.40 -0.34 -0.52 0.00 -0.84 0.00 0.00 61.79 59.68 2r1r h SER 614 Cb 1.15 -0.13 -0.25 0.00 0.14 0.00 0.00 62.40 63.31 2r1r h SER 614 CO 0.49 1.13 -0.82 0.42 -1.14 0.00 0.00 176.83 176.91 2r1r s THR 615 N -3.30 1.45 0.00 -2.27 -4.23 -1.26 -4.90 115.64 101.12 2r1r s THR 615 Ca -0.05 -1.15 0.00 0.00 -1.18 0.00 0.00 61.69 59.31 2r1r s THR 615 Cb 0.09 -1.28 0.00 0.00 1.34 0.00 0.00 72.50 72.65 2r1r s THR 615 CO 0.85 0.10 0.00 0.18 -0.54 0.00 0.00 174.62 175.21 2r1r n LEU 616 N 1.80 1.79 -4.61 4.79 4.77 -1.23 -1.14 117.00 123.17 2r1r n LEU 616 Ca -0.18 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.51 2r1r n LEU 616 Cb 0.54 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.54 2r1r n LEU 616 CO 0.23 0.30 -0.39 -0.94 -1.33 0.00 0.00 177.39 175.26 2r1r s SER 617 N -3.52 4.56 -0.28 -1.43 1.04 -1.26 -0.03 113.70 112.78 2r1r s SER 617 Ca 0.00 -0.36 -0.22 0.00 0.48 0.00 0.00 55.95 55.85 2r1r s SER 617 Cb 0.00 -0.92 0.11 0.00 0.10 0.00 0.00 66.02 65.31 2r1r s SER 617 CO 0.00 0.16 0.91 0.00 0.98 0.00 0.00 173.24 175.29 2r1r s ALA 618 N -1.33 -1.97 -0.69 5.32 0.00 -0.25 -2.36 121.76 120.48 2r1r s ALA 618 Ca 0.23 2.04 -0.10 0.00 0.00 0.00 0.00 51.96 54.13 2r1r s ALA 618 Cb -0.11 -1.43 0.18 0.00 0.00 0.00 0.00 23.12 21.76 2r1r s ALA 618 CO 0.15 -0.30 0.57 -0.51 0.00 0.00 0.00 175.76 175.68 2r1r s LEU 619 N 0.63 6.04 0.33 0.00 1.43 -0.78 -2.34 118.68 123.99 2r1r s LEU 619 Ca -0.01 -2.57 -0.07 0.00 -1.03 0.00 0.00 54.13 50.44 2r1r s LEU 619 Cb -0.05 -2.06 -0.06 0.00 0.03 0.00 0.00 46.19 44.06 2r1r s LEU 619 CO -0.08 -0.54 0.63 0.00 0.23 0.00 0.00 176.35 176.59 2r1r s MET 620 N 0.36 3.69 0.76 1.70 0.23 -1.26 -1.97 119.30 122.81 2r1r s MET 620 Ca 0.15 0.18 -0.11 0.00 -1.03 0.00 0.00 55.69 54.88 2r1r s MET 620 Cb -0.17 -2.56 0.05 0.00 -1.53 0.00 0.00 34.83 30.62 2r1r s MET 620 CO -0.05 0.13 1.08 -1.25 -2.03 0.00 0.00 175.02 172.91 2r1r s PRO 621 N -3.61 2.35 -0.29 3.16 0.04 -1.26 -4.70 135.00 130.69 2r1r s PRO 621 Ca 0.47 1.07 0.03 0.00 0.04 0.00 0.00 61.00 62.60 2r1r s PRO 621 Cb -0.11 -1.92 0.19 0.00 0.04 0.00 0.00 34.50 32.71 2r1r s PRO 621 CO 0.30 -1.55 0.58 -1.54 0.04 0.00 0.00 177.00 174.83 2r1r s SER 622 N -3.52 -1.42 -0.07 6.66 1.04 -1.26 -4.94 113.70 110.19 2r1r s SER 622 Ca 0.60 0.44 -0.01 0.00 0.48 0.00 0.00 55.95 57.46 2r1r s SER 622 Cb -0.16 2.03 -0.00 0.00 0.10 0.00 0.00 66.02 67.99 2r1r s SER 622 CO 0.56 -0.29 -0.02 -0.08 0.98 0.00 0.00 173.24 174.39 2r1r h GLU 623 N 8.01 0.00 0.47 4.02 4.57 -1.99 -3.32 114.58 126.34 2r1r h GLU 623 Ca -0.10 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.06 2r1r h GLU 623 Cb 1.17 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.74 2r1r h GLU 623 CO 0.20 0.00 -0.50 1.15 -1.18 0.00 0.00 179.01 178.68 2r1r h THR 624 N -0.67 0.00 -0.76 0.32 2.02 -2.00 -2.74 112.91 109.07 2r1r h THR 624 Ca 0.00 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.36 2r1r h THR 624 Cb 0.06 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.34 2r1r h THR 624 CO 0.00 0.00 0.09 0.28 0.37 0.00 0.00 175.52 176.26 2r1r h SER 625 N -0.97 -0.18 -0.68 4.18 0.02 -1.88 0.74 113.55 114.77 2r1r h SER 625 Ca -0.06 0.18 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 2r1r h SER 625 Cb 0.85 0.29 -0.03 0.00 0.14 0.00 0.00 62.40 63.64 2r1r h SER 625 CO -0.08 -0.13 0.32 0.28 -1.14 0.00 0.00 176.83 176.08 2r1r h SER 626 N 0.17 0.91 -0.09 3.07 0.02 -1.64 -3.18 113.55 112.82 2r1r h SER 626 Ca 0.43 -0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2r1r h SER 626 Cb 0.78 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 63.08 2r1r h SER 626 CO -0.61 0.78 0.04 1.56 -1.14 0.00 0.00 176.83 177.46 2r1r h GLN 627 N 0.99 0.12 -0.74 3.45 4.20 -0.55 -1.00 115.11 121.59 2r1r h GLN 627 Ca 0.24 -0.02 0.14 0.00 0.06 0.00 0.00 58.65 59.07 2r1r h GLN 627 Cb 0.13 -0.02 -0.09 0.00 0.30 0.00 0.00 27.48 27.79 2r1r h GLN 627 CO -0.03 0.21 0.28 0.82 -0.67 0.00 0.00 178.83 179.44 2r1r h ILE 628 N 0.01 0.65 -0.26 2.54 1.08 -1.47 0.62 117.51 120.69 2r1r h ILE 628 Ca 0.03 -0.14 0.00 0.00 -0.39 0.00 0.00 64.86 64.36 2r1r h ILE 628 Cb 0.13 0.20 0.00 0.00 -3.07 0.00 0.00 36.82 34.07 2r1r h ILE 628 CO -0.00 0.08 0.00 -1.20 -0.69 0.00 0.00 178.15 176.33 2r1r n SER 629 N -5.02 2.11 -3.40 1.72 7.64 -1.11 -4.67 113.62 110.89 2r1r n SER 629 Ca 0.14 -2.16 -0.24 0.00 1.01 0.00 0.00 58.87 57.61 2r1r n SER 629 Cb 0.40 -0.36 0.01 0.00 -1.01 0.00 0.00 64.21 63.25 2r1r n SER 629 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2r1r n ASN 630 N 0.30 -4.08 -4.07 6.43 5.15 0.21 -4.97 115.26 114.23 2r1r n ASN 630 Ca 0.10 -0.59 -0.08 0.00 -0.60 0.00 0.00 54.58 53.41 2r1r n ASN 630 Cb 0.41 -1.30 -0.09 0.00 -0.53 0.00 0.00 39.78 38.27 2r1r n ASN 630 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2r1r s ALA 631 N -2.27 0.48 0.48 5.20 0.00 -0.44 -4.68 121.76 120.53 2r1r s ALA 631 Ca 0.10 -1.18 -0.20 0.00 0.00 0.00 0.00 51.96 50.68 2r1r s ALA 631 Cb -0.01 0.50 -0.09 0.00 0.00 0.00 0.00 23.12 23.53 2r1r s ALA 631 CO 0.73 -0.44 1.03 0.95 0.00 0.00 0.00 175.76 178.03 2r1r s THR 632 N -3.95 3.87 0.02 0.00 -4.23 -1.26 -4.55 115.64 105.54 2r1r s THR 632 Ca 0.12 1.15 -0.30 0.00 -1.18 0.00 0.00 61.69 61.47 2r1r s THR 632 Cb 0.07 -3.47 -0.05 0.00 1.34 0.00 0.00 72.50 70.39 2r1r s THR 632 CO -0.06 -0.27 1.30 0.20 -0.54 0.00 0.00 174.62 175.25 2r1r s ASN 633 N -2.05 6.95 0.00 3.99 -0.87 -1.26 -1.59 114.94 120.10 2r1r s ASN 633 Ca 0.66 2.05 0.00 0.00 -1.57 0.00 0.00 52.86 54.01 2r1r s ASN 633 Cb -0.15 -2.57 0.00 0.00 -0.02 0.00 0.00 41.25 38.51 2r1r s ASN 633 CO 0.20 -0.61 0.00 0.61 -2.57 0.00 0.00 177.10 174.73 2r1r n GLY 634 N 3.45 1.49 0.07 0.66 0.00 -1.26 -1.38 105.19 108.21 2r1r n GLY 634 Ca 0.11 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.20 2r1r n GLY 634 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2r1r n ILE 635 N 0.00 0.37 -1.98 -0.61 -5.35 -1.26 -2.55 119.36 107.98 2r1r n ILE 635 Ca 0.00 -0.25 -0.39 0.00 -0.27 0.00 0.00 62.75 61.84 2r1r n ILE 635 Cb 0.00 -0.22 0.00 0.00 -1.74 0.00 0.00 39.64 37.69 2r1r n ILE 635 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2r1r s GLU 636 N -3.13 3.84 0.47 6.28 0.41 -0.48 -4.46 118.70 121.62 2r1r s GLU 636 Ca 0.08 2.22 -0.21 0.00 -0.41 0.00 0.00 54.97 56.64 2r1r s GLU 636 Cb 0.14 -2.69 -0.08 0.00 -1.78 0.00 0.00 34.13 29.71 2r1r s GLU 636 CO 0.68 -0.62 1.05 -1.25 -0.49 0.00 0.00 175.26 174.63 2r1r s PRO 637 N -2.35 3.86 0.44 0.39 0.04 -1.26 -4.34 135.00 131.77 2r1r s PRO 637 Ca 0.59 1.42 -0.23 0.00 0.04 0.00 0.00 61.00 62.82 2r1r s PRO 637 Cb -0.39 -2.20 -0.08 0.00 0.04 0.00 0.00 34.50 31.87 2r1r s PRO 637 CO 0.50 -0.39 1.09 -1.25 0.04 0.00 0.00 177.00 176.99 2r1r s PRO 638 N -3.06 3.94 0.22 0.56 0.04 -1.26 -4.58 135.00 130.86 2r1r s PRO 638 Ca 0.65 1.58 0.06 0.00 0.04 0.00 0.00 61.00 63.33 2r1r s PRO 638 Cb -0.18 -2.41 0.18 0.00 0.04 0.00 0.00 34.50 32.12 2r1r s PRO 638 CO 0.22 -0.35 1.50 0.00 0.04 0.00 0.00 177.00 178.42 2r1r h ARG 639 N 2.16 0.14 -2.93 4.56 3.08 -1.95 -1.22 114.38 118.22 2r1r h ARG 639 Ca -0.49 -0.12 0.02 0.00 0.07 0.00 0.00 59.98 59.46 2r1r h ARG 639 Cb 1.23 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.29 2r1r h ARG 639 CO 0.61 0.79 0.31 0.20 -1.07 0.00 0.00 179.97 180.81 2r1r s GLY 640 N -4.44 0.24 0.40 0.04 0.00 -1.26 -4.51 107.32 97.78 2r1r s GLY 640 Ca -0.03 -0.59 0.22 0.00 0.00 0.00 0.00 44.72 44.31 2r1r s GLY 640 CO 0.80 0.02 1.64 -0.97 0.00 0.00 0.00 173.10 174.59 2r1r h TYR 641 N 2.00 0.00 -3.28 1.90 0.05 -1.94 -3.43 116.97 112.27 2r1r h TYR 641 Ca -0.29 0.00 -0.57 0.00 0.05 0.00 0.00 58.73 57.92 2r1r h TYR 641 Cb 1.25 0.00 -0.35 0.00 1.01 0.00 0.00 36.73 38.64 2r1r h TYR 641 CO 1.16 0.22 -0.83 0.08 -1.05 0.00 0.00 178.16 177.74 2r1r s VAL 642 N -3.26 1.37 -0.02 -2.88 1.01 -1.26 -1.69 120.40 113.67 2r1r s VAL 642 Ca 0.04 -0.57 -0.14 0.00 0.00 0.00 0.00 61.98 61.32 2r1r s VAL 642 Cb 0.07 -1.27 -0.05 0.00 0.00 0.00 0.00 36.38 35.13 2r1r s VAL 642 CO 0.68 0.42 0.38 -0.55 0.00 0.00 0.00 175.10 176.02 2r1r s SER 643 N 1.05 6.76 -0.04 3.32 0.15 0.34 -4.91 113.70 120.37 2r1r s SER 643 Ca -0.06 0.90 0.06 0.00 0.70 0.00 0.00 55.95 57.56 2r1r s SER 643 Cb -0.15 -2.23 -0.02 0.00 -1.71 0.00 0.00 66.02 61.92 2r1r s SER 643 CO -0.02 0.33 -0.23 -0.63 1.20 0.00 0.00 173.24 173.89 2r1r s ILE 644 N -1.04 2.27 -0.02 6.45 1.01 -1.26 -1.82 121.20 126.80 2r1r s ILE 644 Ca 0.23 -1.01 -0.02 0.00 0.00 0.00 0.00 60.65 59.85 2r1r s ILE 644 Cb -0.16 -1.83 0.00 0.00 0.01 0.00 0.00 42.46 40.49 2r1r s ILE 644 CO 0.12 0.58 0.05 -0.75 0.00 0.00 0.00 174.94 174.93 2r1r s LYS 645 N -0.43 0.06 0.13 2.79 2.20 0.39 -4.98 119.74 119.90 2r1r s LYS 645 Ca 0.04 0.06 -0.12 0.00 -0.36 0.00 0.00 55.97 55.60 2r1r s LYS 645 Cb -0.12 0.03 -0.06 0.00 -1.51 0.00 0.00 37.83 36.17 2r1r s LYS 645 CO 0.01 -0.01 0.49 0.00 -0.36 0.00 0.00 175.35 175.48 2r1r s ALA 646 N 0.01 3.64 0.21 3.13 0.00 -1.26 0.17 121.76 127.66 2r1r s ALA 646 Ca -0.00 -0.25 -0.09 0.00 0.00 0.00 0.00 51.96 51.62 2r1r s ALA 646 Cb -0.00 -2.41 -0.01 0.00 0.00 0.00 0.00 23.12 20.69 2r1r s ALA 646 CO 0.00 0.51 0.34 0.45 0.00 0.00 0.00 175.76 177.05 2r1r s SER 647 N -1.82 0.00 0.25 0.00 0.15 -0.43 -4.88 113.70 106.98 2r1r s SER 647 Ca 0.37 -1.02 0.01 0.00 0.70 0.00 0.00 55.95 56.01 2r1r s SER 647 Cb -0.14 0.49 0.32 0.00 -1.71 0.00 0.00 66.02 64.98 2r1r s SER 647 CO 0.19 -0.99 1.65 0.07 1.20 0.00 0.00 173.24 175.36 2r1r h LYS 648 N 2.43 0.50 0.00 5.44 2.10 -2.03 -2.81 116.57 122.19 2r1r h LYS 648 Ca -0.30 -0.22 0.00 0.00 -2.00 0.00 0.00 60.65 58.13 2r1r h LYS 648 Cb 1.24 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 2r1r h LYS 648 CO 0.43 0.78 0.00 -0.25 -2.00 0.00 0.00 179.45 178.41 2r1r n ASP 649 N -4.06 0.00 0.00 7.07 8.00 -1.26 -5.00 116.55 121.30 2r1r n ASP 649 Ca -0.01 -0.95 0.00 0.00 0.71 0.00 0.00 54.79 54.54 2r1r n ASP 649 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.57 2r1r n ASP 649 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2r1r n GLY 650 N 0.83 0.78 3.70 0.44 0.00 -1.06 -4.99 105.19 104.89 2r1r n GLY 650 Ca 0.21 -2.06 -0.40 0.00 0.00 0.00 0.00 46.02 43.78 2r1r n GLY 650 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2r1r s ILE 651 N -1.24 5.03 -0.21 -0.61 1.01 -1.26 -1.31 121.20 122.61 2r1r s ILE 651 Ca 0.00 1.38 -0.15 0.00 0.00 0.00 0.00 60.65 61.88 2r1r s ILE 651 Cb 0.00 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 2r1r s ILE 651 CO 0.00 0.20 0.34 -0.76 0.00 0.00 0.00 174.94 174.72 2r1r s LEU 652 N 1.20 4.15 -0.07 2.97 1.43 0.45 -4.91 118.68 123.91 2r1r s LEU 652 Ca 0.35 0.43 0.05 0.00 -1.03 0.00 0.00 54.13 53.93 2r1r s LEU 652 Cb -0.17 -2.42 -0.01 0.00 0.03 0.00 0.00 46.19 43.62 2r1r s LEU 652 CO 0.15 -0.03 -0.23 -0.13 0.23 0.00 0.00 176.35 176.34 2r1r s ARG 653 N 1.20 2.70 -0.06 1.70 0.52 -1.26 -0.46 118.95 123.29 2r1r s ARG 653 Ca 0.16 -0.86 -0.00 0.00 -0.52 0.00 0.00 55.73 54.51 2r1r s ARG 653 Cb -0.14 -2.25 0.03 0.00 0.52 0.00 0.00 34.95 33.10 2r1r s ARG 653 CO 0.07 0.36 -0.02 -1.14 0.02 0.00 0.00 175.30 174.59 2r1r s GLN 654 N -0.10 0.72 -0.04 3.54 0.74 -0.75 -4.57 119.66 119.20 2r1r s GLN 654 Ca -0.05 0.00 -0.14 0.00 0.05 0.00 0.00 55.36 55.22 2r1r s GLN 654 Cb -0.14 -0.91 -0.05 0.00 1.10 0.00 0.00 33.01 33.01 2r1r s GLN 654 CO 0.04 -0.20 0.37 0.08 -0.55 0.00 0.00 175.29 175.04 2r1r s VAL 655 N 1.45 5.13 0.43 1.34 1.01 -1.26 -0.50 120.40 128.00 2r1r s VAL 655 Ca -0.03 0.74 -0.24 0.00 0.00 0.00 0.00 61.98 62.46 2r1r s VAL 655 Cb -0.13 -3.68 -0.10 0.00 0.00 0.00 0.00 36.38 32.47 2r1r s VAL 655 CO -0.03 0.54 1.02 1.33 0.00 0.00 0.00 175.10 177.97 2r1r n VAL 656 N 2.19 2.51 -1.68 2.92 0.24 -0.68 -4.83 118.33 119.00 2r1r n VAL 656 Ca -0.14 -0.50 -0.46 0.00 -2.04 0.00 0.00 64.34 61.20 2r1r n VAL 656 Cb 0.53 -1.18 -0.04 0.00 -1.47 0.00 0.00 33.84 31.67 2r1r n VAL 656 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2r1r n PRO 657 N 0.08 2.30 -3.63 7.34 -0.04 -1.26 -2.62 135.00 137.16 2r1r n PRO 657 Ca 0.09 0.84 -0.23 0.00 -0.04 0.00 0.00 63.50 64.16 2r1r n PRO 657 Cb 0.40 -2.66 0.06 0.00 -0.04 0.00 0.00 33.50 31.26 2r1r n PRO 657 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2r1r n ASP 658 N 5.08 -3.82 -0.22 3.54 2.03 -1.26 -4.89 116.55 117.01 2r1r n ASP 658 Ca 0.19 -0.66 -0.04 0.00 0.52 0.00 0.00 54.79 54.80 2r1r n ASP 658 Cb 0.31 -4.65 0.07 0.00 -0.72 0.00 0.00 41.12 36.13 2r1r n ASP 658 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 2r1r h TYR 659 N -2.20 0.74 -1.20 -0.67 3.20 -1.86 -0.01 116.97 114.98 2r1r h TYR 659 Ca -0.59 0.02 0.34 0.00 3.14 0.00 0.00 58.73 61.65 2r1r h TYR 659 Cb 1.36 -0.24 -0.07 0.00 1.54 0.00 0.00 36.73 39.31 2r1r h TYR 659 CO 0.49 0.42 0.82 1.49 -1.64 0.00 0.00 178.16 179.74 2r1r h GLU 660 N 0.78 0.14 0.00 1.82 4.81 -1.90 0.24 114.58 120.46 2r1r h GLU 660 Ca 0.26 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 2r1r h GLU 660 Cb 0.03 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2r1r h GLU 660 CO -0.11 0.09 -0.75 0.72 -0.73 0.00 0.00 179.01 178.24 2r1r n HIS 661 N -4.38 0.00 -0.02 0.92 8.25 -1.03 -4.80 115.22 114.16 2r1r n HIS 661 Ca 0.28 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.74 2r1r n HIS 661 Cb 1.19 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 32.25 2r1r n HIS 661 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2r1r n LEU 662 N -1.39 1.59 -0.31 2.41 4.77 -0.05 -4.78 117.00 119.24 2r1r n LEU 662 Ca -0.00 -1.59 0.15 0.00 -0.03 0.00 0.00 56.01 54.54 2r1r n LEU 662 Cb 0.06 0.00 0.34 0.00 -2.33 0.00 0.00 43.42 41.49 2r1r n LEU 662 CO 0.06 0.40 1.06 1.12 -1.33 0.00 0.00 177.39 178.70 2r1r h HIS 663 N 0.00 0.72 0.00 -1.77 2.07 -0.75 0.43 115.15 115.84 2r1r h HIS 663 Ca 0.00 0.04 0.00 0.00 -2.85 0.00 0.00 60.37 57.56 2r1r h HIS 663 Cb 0.32 -0.17 0.00 0.00 2.57 0.00 0.00 27.41 30.13 2r1r h HIS 663 CO 0.00 -0.06 0.00 -0.44 -3.07 0.00 0.00 177.93 174.36 2r1r h ASP 664 N 0.41 0.00 1.07 3.10 3.32 -1.86 -3.27 116.42 119.18 2r1r h ASP 664 Ca 0.59 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.49 2r1r h ASP 664 Cb 1.16 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 2r1r h ASP 664 CO -0.54 0.00 -0.99 0.00 -1.72 0.00 0.00 179.24 175.99 2r1r h ALA 665 N 2.31 0.63 -2.85 3.45 0.00 -0.48 -3.46 119.26 118.85 2r1r h ALA 665 Ca 0.00 -0.72 -0.53 0.00 0.00 0.00 0.00 54.91 53.65 2r1r h ALA 665 Cb 0.77 0.08 0.12 0.00 0.00 0.00 0.00 17.79 18.76 2r1r h ALA 665 CO 0.00 0.88 0.47 0.71 0.00 0.00 0.00 179.25 181.31 2r1r s TYR 666 N -2.89 2.31 -0.26 0.00 2.02 -0.88 -4.72 117.35 112.94 2r1r s TYR 666 Ca 0.00 1.52 0.02 0.00 -0.37 0.00 0.00 57.07 58.25 2r1r s TYR 666 Cb 0.08 -3.51 0.06 0.00 -0.40 0.00 0.00 41.96 38.20 2r1r s TYR 666 CO 0.79 -2.36 -0.09 -2.00 -1.57 0.00 0.00 175.55 170.32 2r1r s GLU 667 N -3.42 2.07 0.55 -0.62 2.12 -1.26 -5.04 118.70 113.09 2r1r s GLU 667 Ca 0.78 -1.28 -0.16 0.00 0.36 0.00 0.00 54.97 54.67 2r1r s GLU 667 Cb -0.31 -2.82 -0.06 0.00 0.26 0.00 0.00 34.13 31.19 2r1r s GLU 667 CO 0.36 -0.59 1.01 -0.51 -0.54 0.00 0.00 175.26 174.99 2r1r s LEU 668 N 1.17 3.58 0.25 2.70 1.43 -1.26 -4.56 118.68 121.98 2r1r s LEU 668 Ca -0.08 1.67 -0.10 0.00 -1.03 0.00 0.00 54.13 54.59 2r1r s LEU 668 Cb -0.20 -4.52 0.36 0.00 0.03 0.00 0.00 46.19 41.87 2r1r s LEU 668 CO -0.05 -0.81 1.59 0.25 0.23 0.00 0.00 176.35 177.55 2r1r h LEU 669 N 0.73 -0.77 -1.55 1.79 5.85 -1.45 0.28 115.31 120.20 2r1r h LEU 669 Ca -0.47 0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.50 2r1r h LEU 669 Cb 1.20 0.52 0.00 0.00 0.37 0.00 0.00 40.66 42.75 2r1r h LEU 669 CO 0.60 -0.28 0.00 0.79 -0.34 0.00 0.00 178.44 179.21 2r1r n TRP 670 N -5.54 0.57 0.11 1.25 7.02 -1.26 -3.43 117.44 116.17 2r1r n TRP 670 Ca 0.12 -0.28 0.09 0.00 -1.02 0.00 0.00 57.50 56.41 2r1r n TRP 670 Cb 0.43 -0.01 0.02 0.00 -2.42 0.00 0.00 31.31 29.32 2r1r n TRP 670 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 2r1r h GLU 671 N 2.40 0.00 -6.66 -0.99 5.08 -0.80 -3.45 114.58 110.16 2r1r h GLU 671 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 2r1r h GLU 671 Cb 0.58 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.87 2r1r h GLU 671 CO 0.01 0.10 0.72 -1.64 -1.00 0.00 0.00 179.01 177.20 2r1r s MET 672 N -3.22 4.32 0.29 2.33 -1.94 -1.21 -4.92 119.30 114.96 2r1r s MET 672 Ca 0.01 2.16 0.08 0.00 -1.71 0.00 0.00 55.69 56.23 2r1r s MET 672 Cb 0.08 -3.18 0.45 0.00 2.01 0.00 0.00 34.83 34.19 2r1r s MET 672 CO 0.77 -0.38 1.68 -1.00 -0.01 0.00 0.00 175.02 176.08 2r1r h PRO 673 N 5.76 0.13 0.00 2.03 0.14 -1.92 -3.48 132.00 134.65 2r1r h PRO 673 Ca -0.44 -0.07 0.00 0.00 0.14 0.00 0.00 66.00 65.63 2r1r h PRO 673 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.36 2r1r h PRO 673 CO 0.81 0.59 0.00 0.41 0.14 0.00 0.00 178.00 179.95 2r1r n GLY 674 N -0.05 2.28 0.40 1.56 0.00 -1.26 -5.06 105.19 103.06 2r1r n GLY 674 Ca -0.02 -0.94 0.11 0.00 0.00 0.00 0.00 46.02 45.18 2r1r n GLY 674 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2r1r n ASN 675 N -0.71 1.69 0.35 1.61 3.02 -1.26 -4.63 115.26 115.33 2r1r n ASN 675 Ca 0.00 -1.31 -0.18 0.00 -0.03 0.00 0.00 54.58 53.07 2r1r n ASN 675 Cb 0.00 0.42 -0.09 0.00 -0.61 0.00 0.00 39.78 39.50 2r1r n ASN 675 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2r1r h ASP 676 N 1.94 -0.77 -0.41 6.41 3.32 -1.97 -1.38 116.42 123.56 2r1r h ASP 676 Ca 0.00 0.03 0.09 0.00 0.02 0.00 0.00 57.03 57.17 2r1r h ASP 676 Cb 0.67 0.21 -0.09 0.00 0.22 0.00 0.00 39.33 40.34 2r1r h ASP 676 CO 0.00 -0.53 -0.23 1.23 -1.72 0.00 0.00 179.24 177.99 2r1r h GLY 677 N -0.87 0.03 0.99 2.75 0.00 -1.77 -1.02 103.07 103.17 2r1r h GLY 677 Ca -0.08 0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.53 2r1r h GLY 677 CO 0.13 -0.20 0.30 -1.82 0.00 0.00 0.00 176.54 174.94 2r1r h TYR 678 N -0.15 0.68 -0.29 5.60 5.03 -1.65 -2.41 116.97 123.77 2r1r h TYR 678 Ca 0.20 -0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.47 2r1r h TYR 678 Cb 0.46 -0.22 -0.02 0.00 1.55 0.00 0.00 36.73 38.50 2r1r h TYR 678 CO -0.46 0.48 0.06 -0.07 -1.32 0.00 0.00 178.16 176.85 2r1r h LEU 679 N 0.68 0.38 -0.19 2.82 3.38 -0.19 -0.31 115.31 121.89 2r1r h LEU 679 Ca 0.18 -0.05 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 2r1r h LEU 679 Cb 0.01 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 2r1r h LEU 679 CO -0.03 0.41 -0.27 1.56 0.09 0.00 0.00 178.44 180.19 2r1r h GLN 680 N 0.42 0.52 -0.50 1.13 4.20 -0.92 -2.17 115.11 117.78 2r1r h GLN 680 Ca 0.10 -0.31 0.00 0.00 0.06 0.00 0.00 58.65 58.51 2r1r h GLN 680 Cb 0.19 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 2r1r h GLN 680 CO -0.00 0.90 0.33 -0.07 -0.67 0.00 0.00 178.83 179.32 2r1r h LEU 681 N 0.18 0.57 -0.43 1.46 3.38 -0.97 -0.53 115.31 118.97 2r1r h LEU 681 Ca 0.02 -0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2r1r h LEU 681 Cb 0.85 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 2r1r h LEU 681 CO 0.06 0.42 0.06 0.58 0.09 0.00 0.00 178.44 179.65 2r1r h VAL 682 N 0.68 0.75 -0.78 1.22 2.07 -1.08 -0.49 116.25 118.61 2r1r h VAL 682 Ca 0.18 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.60 2r1r h VAL 682 Cb -0.08 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 2r1r h VAL 682 CO -0.04 0.03 0.32 1.23 0.02 0.00 0.00 177.57 179.13 2r1r h GLY 683 N 0.18 1.23 1.01 2.17 0.00 -0.64 -1.79 103.07 105.23 2r1r h GLY 683 Ca 0.21 -0.66 -0.04 0.00 0.00 0.00 0.00 47.33 46.85 2r1r h GLY 683 CO -0.29 0.62 0.26 -2.22 0.00 0.00 0.00 176.54 174.91 2r1r h ILE 684 N 1.12 1.24 -0.63 2.60 2.04 -0.78 -2.65 117.51 120.45 2r1r h ILE 684 Ca 0.26 -0.74 0.01 0.00 1.00 0.00 0.00 64.86 65.38 2r1r h ILE 684 Cb 0.20 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 2r1r h ILE 684 CO -0.02 0.29 0.42 0.24 0.00 0.00 0.00 178.15 179.08 2r1r h MET 685 N 0.92 0.83 0.00 2.37 2.86 -0.64 -2.85 114.93 118.42 2r1r h MET 685 Ca 0.22 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.80 2r1r h MET 685 Cb 0.21 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 2r1r h MET 685 CO -0.02 0.55 -0.01 0.37 1.06 0.00 0.00 176.91 178.86 2r1r h GLN 686 N 0.85 0.00 -0.74 1.72 5.75 -1.00 -2.18 115.11 119.51 2r1r h GLN 686 Ca 0.23 0.00 0.08 0.00 -0.15 0.00 0.00 58.65 58.81 2r1r h GLN 686 Cb -0.10 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.39 2r1r h GLN 686 CO -0.05 0.01 0.41 -0.22 -2.65 0.00 0.00 178.83 176.34 2r1r h LYS 687 N 0.00 0.71 0.00 1.69 3.64 -1.27 -3.18 116.57 118.17 2r1r h LYS 687 Ca -0.00 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.26 2r1r h LYS 687 Cb 0.17 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 2r1r h LYS 687 CO 0.00 0.47 -2.00 1.19 -2.27 0.00 0.00 179.45 176.84 2r1r n PHE 688 N -4.77 0.00 -2.09 1.91 3.01 -0.87 -4.44 117.46 110.21 2r1r n PHE 688 Ca 0.11 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.15 2r1r n PHE 688 Cb 0.22 -0.56 -0.03 0.00 -0.01 0.00 0.00 39.48 39.10 2r1r n PHE 688 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2r1r s ILE 689 N -3.19 3.01 0.26 4.37 -1.09 -0.90 -4.88 121.20 118.78 2r1r s ILE 689 Ca -0.08 0.75 -0.03 0.00 -2.23 0.00 0.00 60.65 59.07 2r1r s ILE 689 Cb 0.11 -3.48 0.15 0.00 -1.58 0.00 0.00 42.46 37.66 2r1r s ILE 689 CO 0.82 0.07 1.80 0.44 -1.23 0.00 0.00 174.94 176.85 2r1r h ASP 690 N 6.38 0.85 0.00 3.58 3.32 -1.88 -3.45 116.42 125.22 2r1r h ASP 690 Ca -0.43 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.46 2r1r h ASP 690 Cb 1.21 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.54 2r1r h ASP 690 CO 0.86 0.82 0.00 0.00 -1.72 0.00 0.00 179.24 179.20 2r1r n GLN 691 N -4.26 0.00 -4.34 3.56 6.02 -1.00 -4.35 117.38 113.01 2r1r n GLN 691 Ca 0.04 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.84 2r1r n GLN 691 Cb 0.23 0.00 -0.09 0.00 1.02 0.00 0.00 30.24 31.40 2r1r n GLN 691 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2r1r s SER 692 N -0.08 1.61 0.04 1.08 0.15 -0.84 -4.93 113.70 110.74 2r1r s SER 692 Ca 0.00 -1.60 0.08 0.00 0.70 0.00 0.00 55.95 55.13 2r1r s SER 692 Cb 0.00 0.43 -0.03 0.00 -1.71 0.00 0.00 66.02 64.72 2r1r s SER 692 CO 0.00 -0.92 -0.22 -0.63 1.20 0.00 0.00 173.24 172.67 2r1r s ILE 693 N -3.57 1.76 -1.29 6.45 1.01 -1.26 -1.86 121.20 122.45 2r1r s ILE 693 Ca 0.36 -1.23 -0.12 0.00 0.00 0.00 0.00 60.65 59.66 2r1r s ILE 693 Cb 0.04 -1.53 0.15 0.00 0.01 0.00 0.00 42.46 41.13 2r1r s ILE 693 CO 0.19 0.24 1.81 -1.20 0.00 0.00 0.00 174.94 175.98 2r1r n SER 694 N 1.84 4.96 -4.75 3.58 7.64 -0.83 -4.65 113.62 121.41 2r1r n SER 694 Ca -0.17 -3.03 -0.40 0.00 1.01 0.00 0.00 58.87 56.27 2r1r n SER 694 Cb 0.53 -1.54 -0.05 0.00 -1.01 0.00 0.00 64.21 62.14 2r1r n SER 694 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2r1r s ALA 695 N 1.26 3.36 0.30 -0.43 0.00 -1.26 -4.84 121.76 120.15 2r1r s ALA 695 Ca 0.42 0.75 0.09 0.00 0.00 0.00 0.00 51.96 53.22 2r1r s ALA 695 Cb 0.07 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.87 2r1r s ALA 695 CO -0.00 -0.01 0.10 -0.80 0.00 0.00 0.00 175.76 175.05 2r1r s ASN 696 N -0.82 4.79 -0.09 0.00 0.02 -1.26 -0.21 114.94 117.36 2r1r s ASN 696 Ca 0.44 -0.63 0.02 0.00 -1.02 0.00 0.00 52.86 51.68 2r1r s ASN 696 Cb -0.29 -0.89 0.01 0.00 0.02 0.00 0.00 41.25 40.10 2r1r s ASN 696 CO 0.36 -0.14 -0.16 0.42 0.02 0.00 0.00 177.10 177.59 2r1r s THR 697 N -2.33 1.51 -0.09 1.60 -4.23 -0.91 -4.98 115.64 106.20 2r1r s THR 697 Ca 0.35 -0.67 0.03 0.00 -1.18 0.00 0.00 61.69 60.22 2r1r s THR 697 Cb -0.05 -1.36 -0.01 0.00 1.34 0.00 0.00 72.50 72.42 2r1r s THR 697 CO 0.22 0.44 -0.20 0.20 -0.54 0.00 0.00 174.62 174.75 2r1r s ASN 698 N 0.75 3.50 -0.03 3.99 0.01 -1.26 -0.31 114.94 121.60 2r1r s ASN 698 Ca -0.12 -0.42 0.04 0.00 -0.71 0.00 0.00 52.86 51.65 2r1r s ASN 698 Cb -0.16 -1.20 -0.00 0.00 0.41 0.00 0.00 41.25 40.30 2r1r s ASN 698 CO 0.02 0.22 -0.13 -0.31 -1.51 0.00 0.00 177.10 175.39 2r1r s TYR 699 N 0.01 1.28 -0.28 2.20 2.02 0.12 -4.73 117.35 117.98 2r1r s TYR 699 Ca -0.07 -0.32 -0.02 0.00 -0.37 0.00 0.00 57.07 56.29 2r1r s TYR 699 Cb -0.15 -0.87 0.04 0.00 -0.40 0.00 0.00 41.96 40.58 2r1r s TYR 699 CO 0.05 -0.10 -0.03 0.34 -1.57 0.00 0.00 175.55 174.24 2r1r s ASP 700 N 0.02 4.66 0.49 2.29 -1.08 -1.26 -2.33 116.67 119.46 2r1r s ASP 700 Ca -0.01 -1.11 0.15 0.00 -0.52 0.00 0.00 52.55 51.06 2r1r s ASP 700 Cb -0.09 -1.69 1.19 0.00 -1.46 0.00 0.00 42.92 40.87 2r1r s ASP 700 CO 0.01 -0.20 2.10 -0.65 0.52 0.00 0.00 175.17 176.94 2r1r h PRO 701 N 8.00 0.13 -0.26 4.34 0.11 -1.91 -2.11 132.00 140.30 2r1r h PRO 701 Ca -0.26 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.89 2r1r h PRO 701 Cb 1.08 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2r1r h PRO 701 CO 0.55 0.09 0.18 0.77 -0.21 0.00 0.00 178.00 179.37 2r1r h SER 702 N 0.13 0.14 0.39 -2.05 0.02 -1.91 -1.66 113.55 108.62 2r1r h SER 702 Ca 0.08 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2r1r h SER 702 Cb 0.16 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.67 2r1r h SER 702 CO -0.01 0.10 0.00 0.54 -1.14 0.00 0.00 176.83 176.31 2r1r n ARG 703 N -4.49 0.47 -4.26 3.45 1.74 -0.79 -4.84 116.66 107.94 2r1r n ARG 703 Ca 0.02 0.03 -0.30 0.00 -0.77 0.00 0.00 57.85 56.83 2r1r n ARG 703 Cb 0.22 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.06 2r1r n ARG 703 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2r1r s PHE 704 N -2.45 2.80 0.08 -1.55 0.08 -0.62 -5.07 117.98 111.24 2r1r s PHE 704 Ca 0.28 -0.12 -0.31 0.00 0.12 0.00 0.00 56.93 56.91 2r1r s PHE 704 Cb 0.18 -1.48 -0.09 0.00 -0.57 0.00 0.00 43.02 41.06 2r1r s PHE 704 CO 0.38 0.42 1.85 -2.14 -0.10 0.00 0.00 175.22 175.64 2r1r s PRO 705 N -2.08 4.15 -0.44 0.24 0.02 -1.26 -1.60 135.00 134.02 2r1r s PRO 705 Ca 0.21 2.56 0.00 0.00 0.02 0.00 0.00 61.00 63.79 2r1r s PRO 705 Cb -0.11 -3.81 0.00 0.00 0.02 0.00 0.00 34.50 30.60 2r1r s PRO 705 CO 0.13 -0.87 0.00 0.43 -0.33 0.00 0.00 177.00 176.36 2r1r n SER 706 N 6.38 -4.00 -3.70 2.53 7.64 -1.26 -3.60 113.62 117.60 2r1r n SER 706 Ca 0.18 0.10 -0.23 0.00 1.01 0.00 0.00 58.87 59.94 2r1r n SER 706 Cb 0.40 -1.87 0.04 0.00 -1.01 0.00 0.00 64.21 61.77 2r1r n SER 706 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2r1r n GLY 707 N -1.82 -0.37 2.74 0.23 0.00 -0.62 -4.99 105.19 100.36 2r1r n GLY 707 Ca -0.04 0.15 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 2r1r n GLY 707 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r1r s LYS 708 N -6.07 0.01 -0.06 1.61 -2.85 -1.24 -4.90 119.74 106.25 2r1r s LYS 708 Ca 0.20 0.40 -0.30 0.00 -1.00 0.00 0.00 55.97 55.28 2r1r s LYS 708 Cb -0.10 -0.60 -0.07 0.00 -2.06 0.00 0.00 37.83 35.01 2r1r s LYS 708 CO 0.80 -0.38 1.85 0.08 0.10 0.00 0.00 175.35 177.79 2r1r s VAL 709 N 2.23 3.29 0.29 1.79 1.01 -1.26 -4.70 120.40 123.06 2r1r s VAL 709 Ca 0.04 0.35 -0.29 0.00 0.00 0.00 0.00 61.98 62.07 2r1r s VAL 709 Cb -0.13 -3.25 -0.10 0.00 0.00 0.00 0.00 36.38 32.90 2r1r s VAL 709 CO -0.06 -0.06 1.39 -2.16 0.00 0.00 0.00 175.10 174.22 2r1r s PRO 710 N 4.56 4.29 0.27 2.72 0.04 -1.26 -4.92 135.00 140.70 2r1r s PRO 710 Ca 0.83 2.29 -0.01 0.00 0.04 0.00 0.00 61.00 64.15 2r1r s PRO 710 Cb -0.36 -3.08 0.38 0.00 0.04 0.00 0.00 34.50 31.47 2r1r s PRO 710 CO 0.35 -0.34 1.79 1.98 0.04 0.00 0.00 177.00 180.82 2r1r h MET 711 N 4.23 0.77 -0.94 4.56 4.05 -2.01 -1.57 114.93 124.02 2r1r h MET 711 Ca -0.47 -0.19 0.15 0.00 -0.28 0.00 0.00 59.70 58.90 2r1r h MET 711 Cb 1.22 -0.10 -0.09 0.00 -0.80 0.00 0.00 31.60 31.83 2r1r h MET 711 CO 0.72 0.76 0.55 0.37 0.23 0.00 0.00 176.91 179.54 2r1r h GLN 712 N 0.72 0.77 0.00 0.39 5.75 -2.01 -1.69 115.11 119.04 2r1r h GLN 712 Ca 0.15 -0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.53 2r1r h GLN 712 Cb 0.40 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.77 2r1r h GLN 712 CO 0.01 0.51 -0.33 0.37 -2.65 0.00 0.00 178.83 176.75 2r1r h GLN 713 N 0.79 0.00 0.04 1.69 5.75 -1.68 -2.26 115.11 119.45 2r1r h GLN 713 Ca 0.50 0.00 -0.23 0.00 -0.15 0.00 0.00 58.65 58.77 2r1r h GLN 713 Cb 0.66 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.20 2r1r h GLN 713 CO -0.33 0.33 -1.01 -0.07 -2.65 0.00 0.00 178.83 175.10 2r1r h LEU 714 N 0.00 0.43 -0.10 -2.39 3.38 -1.06 -2.73 115.31 112.84 2r1r h LEU 714 Ca -0.00 -0.38 -0.24 0.00 0.09 0.00 0.00 57.88 57.35 2r1r h LEU 714 Cb 1.02 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.64 2r1r h LEU 714 CO 0.04 1.21 -1.00 -0.07 0.09 0.00 0.00 178.44 178.71 2r1r h LEU 715 N 0.15 0.67 0.17 1.67 3.38 -1.51 -2.48 115.31 117.37 2r1r h LEU 715 Ca -0.09 -0.55 0.01 0.00 0.09 0.00 0.00 57.88 57.35 2r1r h LEU 715 Cb 1.67 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 42.19 2r1r h LEU 715 CO 0.17 1.35 -0.28 0.50 0.09 0.00 0.00 178.44 180.27 2r1r h LYS 716 N 0.29 -0.51 -0.66 1.13 1.63 -1.41 -0.16 116.57 116.88 2r1r h LYS 716 Ca -0.10 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 2r1r h LYS 716 Cb 1.64 0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 33.35 2r1r h LYS 716 CO 0.18 -0.34 0.42 -0.44 -3.45 0.00 0.00 179.45 175.82 2r1r h ASP 717 N -0.52 0.77 -0.52 4.20 3.32 -1.53 -1.19 116.42 120.95 2r1r h ASP 717 Ca 0.02 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 2r1r h ASP 717 Cb 0.53 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.86 2r1r h ASP 717 CO -0.12 0.58 0.32 0.25 -1.72 0.00 0.00 179.24 178.54 2r1r h LEU 718 N 0.90 0.61 -0.29 1.55 5.85 -0.88 -2.21 115.31 120.84 2r1r h LEU 718 Ca 0.24 -0.04 -0.13 0.00 0.84 0.00 0.00 57.88 58.79 2r1r h LEU 718 Cb -0.07 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 40.80 2r1r h LEU 718 CO -0.05 0.47 -0.31 -0.07 -0.34 0.00 0.00 178.44 178.14 2r1r h LEU 719 N 0.70 0.78 -0.13 2.25 3.38 -0.46 -2.78 115.31 119.05 2r1r h LEU 719 Ca 0.19 -0.48 0.04 0.00 0.09 0.00 0.00 57.88 57.72 2r1r h LEU 719 Cb -0.04 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 40.43 2r1r h LEU 719 CO -0.04 1.10 -0.43 0.74 0.09 0.00 0.00 178.44 179.90 2r1r h THR 720 N 0.48 0.13 -0.57 0.22 2.02 -1.06 0.28 112.91 114.41 2r1r h THR 720 Ca 0.04 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.32 2r1r h THR 720 Cb 0.89 0.13 -0.11 0.00 -1.74 0.00 0.00 68.15 67.32 2r1r h THR 720 CO 0.08 0.00 -0.34 0.00 0.37 0.00 0.00 175.52 175.63 2r1r h ALA 721 N 0.08 -0.08 -0.47 6.16 0.00 -1.38 0.04 119.26 123.60 2r1r h ALA 721 Ca 0.07 0.15 0.05 0.00 0.00 0.00 0.00 54.91 55.18 2r1r h ALA 721 Cb 0.63 0.79 -0.05 0.00 0.00 0.00 0.00 17.79 19.17 2r1r h ALA 721 CO -0.40 -0.69 0.21 -0.92 0.00 0.00 0.00 179.25 177.45 2r1r h TYR 722 N -0.18 0.39 -0.91 0.00 3.20 -1.02 -1.93 116.97 116.52 2r1r h TYR 722 Ca 0.22 0.02 0.16 0.00 3.14 0.00 0.00 58.73 62.28 2r1r h TYR 722 Cb 0.55 -0.10 -0.07 0.00 1.54 0.00 0.00 36.73 38.64 2r1r h TYR 722 CO -0.63 0.17 0.58 -0.22 -1.64 0.00 0.00 178.16 176.43 2r1r h LYS 723 N 0.42 0.61 -0.63 1.82 3.64 1.00 -0.49 116.57 122.94 2r1r h LYS 723 Ca 0.21 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 2r1r h LYS 723 Cb 0.16 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2r1r h LYS 723 CO -0.18 0.40 0.00 1.19 -2.27 0.00 0.00 179.45 178.60 2r1r n PHE 724 N -4.57 1.18 -1.03 1.91 3.72 -0.88 -4.67 117.46 113.13 2r1r n PHE 724 Ca 0.19 -0.46 -0.01 0.00 -0.05 0.00 0.00 57.45 57.12 2r1r n PHE 724 Cb 0.54 -0.23 -0.00 0.00 -0.94 0.00 0.00 39.48 38.84 2r1r n PHE 724 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2r1r n GLY 725 N 0.84 0.46 3.73 1.37 0.00 -0.19 -4.61 105.19 106.78 2r1r n GLY 725 Ca 0.19 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.82 2r1r n GLY 725 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r1r s VAL 726 N -2.03 2.62 -0.10 1.61 1.01 -0.76 -4.92 120.40 117.83 2r1r s VAL 726 Ca 0.00 0.48 -0.20 0.00 0.00 0.00 0.00 61.98 62.26 2r1r s VAL 726 Cb 0.00 -3.31 -0.28 0.00 0.00 0.00 0.00 36.38 32.80 2r1r s VAL 726 CO 0.00 0.05 0.67 0.11 0.00 0.00 0.00 175.10 175.93 2r1r h LYS 727 N 6.04 0.22 -4.96 2.72 1.57 -1.90 -3.43 116.57 116.83 2r1r h LYS 727 Ca -0.44 -0.37 -0.34 0.00 -1.87 0.00 0.00 60.65 57.63 2r1r h LYS 727 Cb 1.21 0.14 -0.14 0.00 0.08 0.00 0.00 32.23 33.51 2r1r h LYS 727 CO 0.86 1.18 -0.65 0.95 -0.57 0.00 0.00 179.45 181.21 2r1r s THR 728 N -2.42 0.84 -0.09 -0.16 -4.23 -1.26 0.00 115.64 108.32 2r1r s THR 728 Ca -0.18 -2.01 -0.02 0.00 -1.18 0.00 0.00 61.69 58.30 2r1r s THR 728 Cb 0.02 -2.30 0.04 0.00 1.34 0.00 0.00 72.50 71.60 2r1r s THR 728 CO 0.77 -0.34 0.03 -0.76 -0.54 0.00 0.00 174.62 173.78 2r1r s LEU 729 N -3.26 0.50 0.00 4.79 1.43 0.84 -4.54 118.68 118.44 2r1r s LEU 729 Ca 0.28 -0.19 0.00 0.00 -1.03 0.00 0.00 54.13 53.19 2r1r s LEU 729 Cb 0.06 -0.34 0.00 0.00 0.03 0.00 0.00 46.19 45.94 2r1r s LEU 729 CO 0.08 -0.24 0.00 0.00 0.23 0.00 0.00 176.35 176.41 2r1r n TYR 730 N 5.20 0.00 -0.73 0.29 9.36 0.70 -2.28 117.16 129.70 2r1r n TYR 730 Ca -0.06 0.00 -0.33 0.00 3.32 0.00 0.00 57.90 60.83 2r1r n TYR 730 Cb 0.50 0.00 0.15 0.00 -0.63 0.00 0.00 39.34 39.35 2r1r n TYR 730 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2r1r n TYR 731 N 0.00 -1.52 -3.58 2.98 4.01 -1.26 -4.77 117.16 113.02 2r1r n TYR 731 Ca 0.00 0.19 -0.29 0.00 -0.16 0.00 0.00 57.90 57.63 2r1r n TYR 731 Cb 0.00 -1.60 -0.14 0.00 -0.31 0.00 0.00 39.34 37.29 2r1r n TYR 731 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 2r1r s GLN 732 N -3.37 0.57 -0.14 -0.72 0.74 -1.20 -2.14 119.66 113.40 2r1r s GLN 732 Ca 0.55 -1.12 -0.29 0.00 0.05 0.00 0.00 55.36 54.54 2r1r s GLN 732 Cb -0.13 -1.54 -0.01 0.00 1.10 0.00 0.00 33.01 32.43 2r1r s GLN 732 CO 0.67 -1.10 1.01 -0.80 -0.55 0.00 0.00 175.29 174.52 2r1r s ASN 733 N 1.41 7.20 -0.59 6.67 0.01 0.58 -4.65 114.94 125.57 2r1r s ASN 733 Ca 0.13 1.48 0.04 0.00 -0.71 0.00 0.00 52.86 53.80 2r1r s ASN 733 Cb -0.20 -2.55 0.15 0.00 0.41 0.00 0.00 41.25 39.07 2r1r s ASN 733 CO -0.16 -0.50 0.38 -0.89 -1.51 0.00 0.00 177.10 174.41 2r1r s THR 734 N 2.33 2.37 -0.03 1.60 2.01 -1.26 0.17 115.64 122.83 2r1r s THR 734 Ca 0.47 -3.64 -0.40 0.00 0.31 0.00 0.00 61.69 58.43 2r1r s THR 734 Cb -0.17 -2.59 -0.20 0.00 0.01 0.00 0.00 72.50 69.54 2r1r s THR 734 CO 0.15 -0.96 1.11 -1.14 -0.69 0.00 0.00 174.62 173.09 2r1r n ARG 735 N 2.57 0.02 -3.40 4.92 0.63 -0.99 -4.98 116.66 115.45 2r1r n ARG 735 Ca 0.15 0.01 -0.26 0.00 -0.92 0.00 0.00 57.85 56.83 2r1r n ARG 735 Cb 0.35 -1.51 -0.10 0.00 0.45 0.00 0.00 32.46 31.65 2r1r n ARG 735 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2r1r s ASP 736 N 0.23 1.99 0.00 6.15 1.01 -1.26 -4.53 116.67 120.25 2r1r s ASP 736 Ca 0.92 -2.44 0.29 0.00 0.71 0.00 0.00 52.55 52.03 2r1r s ASP 736 Cb -1.28 -0.21 1.75 0.00 1.01 0.00 0.00 42.92 44.19 2r1r s ASP 736 CO 0.59 -0.24 2.09 0.61 0.21 0.00 0.00 175.17 178.42