#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4r1r s LEU 6 N 0.00 4.36 -0.07 -1.96 1.43 -1.26 -1.14 118.68 120.04 4r1r s LEU 6 Ca 0.00 1.68 0.05 0.00 -1.03 0.00 0.00 54.13 54.83 4r1r s LEU 6 Cb 0.00 -3.82 -0.01 0.00 0.03 0.00 0.00 46.19 42.39 4r1r s LEU 6 CO 0.00 -0.01 -0.23 -0.69 0.23 0.00 0.00 176.35 175.65 4r1r s VAL 7 N -1.55 2.23 -0.10 -1.59 1.01 0.71 0.25 120.40 121.36 4r1r s VAL 7 Ca 0.47 -1.00 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 4r1r s VAL 7 Cb -0.18 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.33 4r1r s VAL 7 CO 0.23 0.57 0.13 -0.89 0.00 0.00 0.00 175.10 175.14 4r1r s THR 8 N -0.09 5.36 0.32 3.92 2.01 -0.78 -0.59 115.64 125.79 4r1r s THR 8 Ca -0.05 0.10 0.04 0.00 0.31 0.00 0.00 61.69 62.09 4r1r s THR 8 Cb -0.14 -3.35 0.04 0.00 0.01 0.00 0.00 72.50 69.06 4r1r s THR 8 CO 0.04 0.57 0.34 0.29 -0.69 0.00 0.00 174.62 175.17 4r1r n LYS 9 N 1.84 0.91 -0.18 4.92 5.02 -0.19 -0.71 118.16 129.78 4r1r n LYS 9 Ca -0.19 -1.87 0.01 0.00 -2.02 0.00 0.00 58.31 54.25 4r1r n LYS 9 Cb 0.54 0.05 0.28 0.00 -0.02 0.00 0.00 35.03 35.88 4r1r n LYS 9 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 4r1r h ARG 10 N 0.00 0.91 0.00 1.97 2.47 -2.00 0.11 114.38 117.84 4r1r h ARG 10 Ca -0.18 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.49 4r1r h ARG 10 Cb 0.72 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 28.83 4r1r h ARG 10 CO 0.27 0.60 -0.10 -3.47 0.56 0.00 0.00 179.97 177.83 4r1r n ASP 11 N -4.43 0.29 -0.15 7.04 -0.08 -1.26 -4.90 116.55 113.06 4r1r n ASP 11 Ca 0.07 0.40 0.00 0.00 -1.51 0.00 0.00 54.79 53.75 4r1r n ASP 11 Cb 0.04 -0.43 0.00 0.00 2.34 0.00 0.00 41.12 43.07 4r1r n ASP 11 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 4r1r n GLY 12 N 1.45 1.08 3.48 0.27 0.00 0.03 -5.09 105.19 106.40 4r1r n GLY 12 Ca 0.06 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 4r1r n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 4r1r s SER 13 N -2.38 4.05 -0.11 1.61 0.01 -1.26 -4.80 113.70 110.83 4r1r s SER 13 Ca 0.00 -0.21 -0.23 0.00 1.31 0.00 0.00 55.95 56.82 4r1r s SER 13 Cb 0.00 -0.84 -0.03 0.00 0.21 0.00 0.00 66.02 65.36 4r1r s SER 13 CO 0.00 0.33 0.70 0.42 0.41 0.00 0.00 173.24 175.10 4r1r s THR 14 N -0.77 5.02 0.26 1.44 -4.23 -1.26 -1.02 115.64 115.09 4r1r s THR 14 Ca 0.12 1.40 0.05 0.00 -1.18 0.00 0.00 61.69 62.09 4r1r s THR 14 Cb -0.11 -4.03 -0.06 0.00 1.34 0.00 0.00 72.50 69.65 4r1r s THR 14 CO 0.01 0.19 -0.03 -0.70 -0.54 0.00 0.00 174.62 173.56 4r1r s GLU 15 N 1.22 1.47 0.28 3.99 2.12 0.25 -4.96 118.70 123.07 4r1r s GLU 15 Ca 0.35 -1.75 -0.18 0.00 0.36 0.00 0.00 54.97 53.75 4r1r s GLU 15 Cb -0.17 -0.92 -0.09 0.00 0.26 0.00 0.00 34.13 33.21 4r1r s GLU 15 CO 0.15 -0.03 0.74 1.03 -0.54 0.00 0.00 175.26 176.61 4r1r s ARG 16 N -3.79 4.15 0.39 4.30 0.52 -1.26 -0.20 118.95 123.05 4r1r s ARG 16 Ca 0.30 0.80 -0.28 0.00 -0.52 0.00 0.00 55.73 56.03 4r1r s ARG 16 Cb 0.05 -2.66 -0.11 0.00 0.52 0.00 0.00 34.95 32.76 4r1r s ARG 16 CO 0.11 0.27 1.48 1.51 0.02 0.00 0.00 175.30 178.69 4r1r n ILE 17 N 0.19 2.11 -3.73 1.52 0.00 -0.29 -4.76 119.36 114.40 4r1r n ILE 17 Ca 0.01 -0.50 -0.29 0.00 0.00 0.00 0.00 62.75 61.97 4r1r n ILE 17 Cb 0.52 -1.96 -0.13 0.00 0.00 0.00 0.00 39.64 38.08 4r1r n ILE 17 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 4r1r s ASN 18 N -0.18 3.65 0.52 9.51 3.84 -1.26 -4.98 114.94 126.04 4r1r s ASN 18 Ca 0.54 -2.97 0.25 0.00 0.21 0.00 0.00 52.86 50.89 4r1r s ASN 18 Cb -0.47 -1.13 1.45 0.00 -0.55 0.00 0.00 41.25 40.54 4r1r s ASN 18 CO 0.63 -0.21 2.11 -0.07 -2.79 0.00 0.00 177.10 176.76 4r1r h LEU 19 N 6.30 0.00 -0.52 3.21 3.38 -2.01 -2.60 115.31 123.06 4r1r h LEU 19 Ca 0.05 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.86 4r1r h LEU 19 Cb 0.89 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 4r1r h LEU 19 CO 0.53 0.10 -0.57 0.44 0.09 0.00 0.00 178.44 179.03 4r1r h ASP 20 N 0.00 0.57 -0.19 -0.43 3.32 -1.99 -2.60 116.42 115.09 4r1r h ASP 20 Ca -0.00 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 56.73 4r1r h ASP 20 Cb 0.23 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 4r1r h ASP 20 CO 0.01 1.02 0.10 0.11 -1.72 0.00 0.00 179.24 178.76 4r1r h LYS 21 N 0.39 0.27 -0.11 3.56 1.57 -1.90 -1.66 116.57 118.68 4r1r h LYS 21 Ca 0.00 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.79 4r1r h LYS 21 Cb 1.11 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.32 4r1r h LYS 21 CO 0.10 0.28 -0.21 0.82 -0.57 0.00 0.00 179.45 179.87 4r1r h ILE 22 N 0.19 0.48 -0.84 1.86 2.04 -1.50 -2.16 117.51 117.58 4r1r h ILE 22 Ca 0.07 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.05 4r1r h ILE 22 Cb 0.09 0.48 -0.08 0.00 -0.74 0.00 0.00 36.82 36.57 4r1r h ILE 22 CO -0.01 0.00 0.45 -0.74 0.00 0.00 0.00 178.15 177.86 4r1r h HIS 23 N -0.28 0.81 -0.21 1.37 2.76 -1.28 -1.46 115.15 116.86 4r1r h HIS 23 Ca 0.09 0.03 0.04 0.00 -2.20 0.00 0.00 60.37 58.34 4r1r h HIS 23 Cb 0.41 -0.24 -0.04 0.00 1.55 0.00 0.00 27.41 29.10 4r1r h HIS 23 CO -0.31 0.26 -0.05 0.00 -1.30 0.00 0.00 177.93 176.53 4r1r h ARG 24 N 0.70 -0.00 -0.66 5.26 -0.00 -0.66 0.23 114.38 119.25 4r1r h ARG 24 Ca 0.44 0.00 0.01 0.00 -0.50 0.00 0.00 59.98 59.92 4r1r h ARG 24 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 30.46 4r1r h ARG 24 CO -0.31 -0.00 0.44 0.28 0.00 0.00 0.00 179.97 180.37 4r1r h VAL 25 N -0.00 1.17 -0.41 2.04 2.07 -0.97 0.17 116.25 120.32 4r1r h VAL 25 Ca 0.10 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.31 4r1r h VAL 25 Cb 0.15 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 4r1r h VAL 25 CO -0.22 0.17 0.26 -0.07 0.02 0.00 0.00 177.57 177.73 4r1r h LEU 26 N 0.90 0.44 -0.12 2.57 3.38 -0.83 -0.63 115.31 121.02 4r1r h LEU 26 Ca 0.24 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.23 4r1r h LEU 26 Cb -0.10 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 4r1r h LEU 26 CO -0.05 0.32 -0.03 -0.78 0.09 0.00 0.00 178.44 177.98 4r1r h ASP 27 N 0.53 -0.12 -0.03 -0.43 1.82 0.14 -1.63 116.42 116.70 4r1r h ASP 27 Ca 0.15 0.04 0.03 0.00 -0.39 0.00 0.00 57.03 56.86 4r1r h ASP 27 Cb -0.04 0.08 -0.06 0.00 0.68 0.00 0.00 39.33 39.99 4r1r h ASP 27 CO -0.05 -0.04 -0.52 -0.25 -1.61 0.00 0.00 179.24 176.77 4r1r h TRP 28 N -0.00 -1.52 -0.93 0.28 7.01 -0.22 -1.98 115.95 118.58 4r1r h TRP 28 Ca 0.06 0.05 0.20 0.00 2.11 0.00 0.00 58.89 61.30 4r1r h TRP 28 Cb 0.09 0.67 -0.08 0.00 -2.10 0.00 0.00 29.16 27.74 4r1r h TRP 28 CO -0.16 -0.56 0.60 0.00 -2.79 0.00 0.00 178.44 175.53 4r1r h ALA 29 N -0.32 2.04 0.00 2.65 0.00 -0.92 -1.72 119.26 120.99 4r1r h ALA 29 Ca 0.02 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 4r1r h ALA 29 Cb 0.71 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 4r1r h ALA 29 CO -0.37 -0.35 -0.22 0.00 0.00 0.00 0.00 179.25 178.31 4r1r h ALA 30 N 1.61 0.95 -1.05 0.00 0.00 -0.55 -3.43 119.26 116.79 4r1r h ALA 30 Ca 0.50 -0.20 -0.85 0.00 0.00 0.00 0.00 54.91 54.35 4r1r h ALA 30 Cb 1.07 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.84 4r1r h ALA 30 CO -0.23 0.28 0.61 -1.91 0.00 0.00 0.00 179.25 178.00 4r1r n GLU 31 N -3.29 0.10 -0.29 0.00 4.07 -0.65 -0.42 120.64 120.16 4r1r n GLU 31 Ca 0.01 0.04 0.00 0.00 -0.06 0.00 0.00 57.16 57.15 4r1r n GLU 31 Cb 0.48 -1.55 0.00 0.00 -0.06 0.00 0.00 31.44 30.31 4r1r n GLU 31 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 4r1r n GLY 32 N 3.64 1.99 3.89 8.31 0.00 -1.26 -5.03 105.19 116.72 4r1r n GLY 32 Ca 0.29 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.01 4r1r n GLY 32 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4r1r s LEU 33 N 0.00 3.98 0.03 0.99 1.43 0.44 -5.09 118.68 120.46 4r1r s LEU 33 Ca 0.00 0.91 0.07 0.00 -1.03 0.00 0.00 54.13 54.08 4r1r s LEU 33 Cb 0.00 -3.75 -0.03 0.00 0.03 0.00 0.00 46.19 42.44 4r1r s LEU 33 CO 0.00 -0.27 -0.19 -1.00 0.23 0.00 0.00 176.35 175.12 4r1r s HIS 34 N -2.17 2.53 -1.36 0.29 3.76 -1.26 -4.73 115.29 112.35 4r1r s HIS 34 Ca 0.47 -0.28 0.00 0.00 -0.15 0.00 0.00 55.06 55.11 4r1r s HIS 34 Cb -0.11 -1.47 0.00 0.00 1.11 0.00 0.00 32.58 32.11 4r1r s HIS 34 CO 0.29 0.22 0.00 0.09 -0.85 0.00 0.00 174.74 174.49 4r1r n ASN 35 N 1.69 -4.51 -4.52 1.40 4.13 -1.26 -4.50 115.26 107.69 4r1r n ASN 35 Ca -0.16 0.22 -0.34 0.00 1.68 0.00 0.00 54.58 55.98 4r1r n ASN 35 Cb 0.52 -3.38 -0.12 0.00 -1.54 0.00 0.00 39.78 35.27 4r1r n ASN 35 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 4r1r s VAL 36 N -2.57 3.96 -0.38 2.41 -7.23 -1.26 -4.89 120.40 110.44 4r1r s VAL 36 Ca 0.00 -0.34 -0.14 0.00 -1.81 0.00 0.00 61.98 59.69 4r1r s VAL 36 Cb 0.00 -2.73 0.00 0.00 0.56 0.00 0.00 36.38 34.22 4r1r s VAL 36 CO 0.00 0.51 0.27 -0.55 -0.31 0.00 0.00 175.10 175.01 4r1r s SER 37 N 0.21 6.06 0.18 4.85 0.15 -1.26 -4.96 113.70 118.93 4r1r s SER 37 Ca -0.02 -0.68 -0.11 0.00 0.70 0.00 0.00 55.95 55.84 4r1r s SER 37 Cb -0.14 -2.14 0.09 0.00 -1.71 0.00 0.00 66.02 62.13 4r1r s SER 37 CO 0.03 -0.35 1.74 0.40 1.20 0.00 0.00 173.24 176.26 4r1r h ILE 38 N 5.58 1.23 -0.28 6.45 2.04 -1.98 -2.30 117.51 128.25 4r1r h ILE 38 Ca -0.29 -0.72 0.02 0.00 1.00 0.00 0.00 64.86 64.87 4r1r h ILE 38 Cb 1.14 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.70 4r1r h ILE 38 CO 0.68 0.29 0.13 0.77 0.00 0.00 0.00 178.15 180.02 4r1r h SER 39 N 0.90 0.19 -0.37 1.72 4.64 -1.99 0.31 113.55 118.95 4r1r h SER 39 Ca 0.21 0.02 0.08 0.00 -0.47 0.00 0.00 61.79 61.63 4r1r h SER 39 Cb 0.19 -0.02 -0.08 0.00 -0.31 0.00 0.00 62.40 62.18 4r1r h SER 39 CO -0.02 0.14 -0.19 -0.61 -0.87 0.00 0.00 176.83 175.29 4r1r h GLN 40 N 0.28 -0.12 -0.73 4.77 5.75 -1.88 0.38 115.11 123.55 4r1r h GLN 40 Ca 0.12 0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.66 4r1r h GLN 40 Cb 0.05 0.03 -0.05 0.00 1.07 0.00 0.00 27.48 28.58 4r1r h GLN 40 CO -0.09 -0.08 0.46 0.28 -2.65 0.00 0.00 178.83 176.75 4r1r h VAL 41 N -0.12 1.09 -0.57 2.39 2.07 -0.93 -2.49 116.25 117.69 4r1r h VAL 41 Ca 0.19 -0.30 -0.09 0.00 0.82 0.00 0.00 66.70 67.31 4r1r h VAL 41 Cb 0.41 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 4r1r h VAL 41 CO -0.45 0.16 -0.00 -0.33 0.02 0.00 0.00 177.57 176.97 4r1r h GLU 42 N 0.89 1.01 0.06 1.57 5.08 0.85 -2.50 114.58 121.53 4r1r h GLU 42 Ca 0.30 -0.32 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 4r1r h GLU 42 Cb 0.04 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 4r1r h GLU 42 CO -0.12 1.00 -0.12 -0.07 -1.00 0.00 0.00 179.01 178.70 4r1r h LEU 43 N 0.89 -0.33 -1.80 1.33 3.38 0.03 -0.33 115.31 118.48 4r1r h LEU 43 Ca 0.16 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 4r1r h LEU 43 Cb 0.55 0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 4r1r h LEU 43 CO 0.03 -0.18 -0.08 0.03 0.09 0.00 0.00 178.44 178.34 4r1r h ARG 44 N -0.23 0.03 0.02 1.13 3.08 -1.40 -3.22 114.38 113.79 4r1r h ARG 44 Ca 0.03 -0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.72 4r1r h ARG 44 Cb 0.26 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.25 4r1r h ARG 44 CO -0.08 0.11 -2.17 -1.13 -1.07 0.00 0.00 179.97 175.63 4r1r n SER 45 N -4.43 1.11 -0.12 7.04 3.41 -0.95 -4.39 113.62 115.29 4r1r n SER 45 Ca -0.02 0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 4r1r n SER 45 Cb 0.16 0.04 0.28 0.00 -0.26 0.00 0.00 64.21 64.43 4r1r n SER 45 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 4r1r h HIS 46 N 0.01 0.78 0.00 7.33 3.86 -1.10 -2.49 115.15 123.54 4r1r h HIS 46 Ca -0.47 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 58.73 4r1r h HIS 46 Cb 2.07 -0.25 -0.00 0.00 1.06 0.00 0.00 27.41 30.28 4r1r h HIS 46 CO 0.02 0.56 -0.01 0.97 0.86 0.00 0.00 177.93 180.33 4r1r h ILE 47 N 0.80 0.09 -0.34 2.45 6.09 -1.76 -0.46 117.51 124.38 4r1r h ILE 47 Ca 0.20 -0.17 0.00 0.00 -1.37 0.00 0.00 64.86 63.53 4r1r h ILE 47 Cb 0.05 1.15 0.00 0.00 0.47 0.00 0.00 36.82 38.49 4r1r h ILE 47 CO -0.03 0.01 0.00 0.00 -3.07 0.00 0.00 178.15 175.06 4r1r n GLN 48 N -3.19 2.30 -1.92 2.19 6.02 -0.94 -4.95 117.38 116.89 4r1r n GLN 48 Ca -0.02 -1.96 -0.31 0.00 -0.01 0.00 0.00 57.00 54.69 4r1r n GLN 48 Cb 0.14 -1.48 0.01 0.00 1.02 0.00 0.00 30.24 29.93 4r1r n GLN 48 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 4r1r s PHE 49 N -1.57 3.44 0.11 1.08 0.08 -0.18 -5.08 117.98 115.86 4r1r s PHE 49 Ca 0.37 1.37 -0.22 0.00 0.12 0.00 0.00 56.93 58.57 4r1r s PHE 49 Cb 0.21 -2.79 0.06 0.00 -0.57 0.00 0.00 43.02 39.93 4r1r s PHE 49 CO 0.30 -0.77 0.54 1.52 -0.10 0.00 0.00 175.22 176.70 4r1r s TYR 50 N -2.99 -0.44 -0.01 0.36 -0.85 -1.26 -5.09 117.35 107.07 4r1r s TYR 50 Ca 0.57 0.31 -0.37 0.00 -0.52 0.00 0.00 57.07 57.06 4r1r s TYR 50 Cb -0.12 0.43 -0.15 0.00 0.38 0.00 0.00 41.96 42.50 4r1r s TYR 50 CO 0.48 -0.75 1.55 -0.25 -1.52 0.00 0.00 175.55 175.06 4r1r n ASP 51 N -0.07 2.31 -0.04 -0.18 9.92 -1.26 -2.14 116.55 125.09 4r1r n ASP 51 Ca -0.17 1.08 -0.00 0.00 -0.53 0.00 0.00 54.79 55.17 4r1r n ASP 51 Cb 0.63 -1.24 -0.00 0.00 -0.64 0.00 0.00 41.12 39.87 4r1r n ASP 51 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 4r1r n GLY 52 N 3.32 0.38 3.71 0.44 0.00 0.14 -4.88 105.19 108.30 4r1r n GLY 52 Ca 0.21 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.84 4r1r n GLY 52 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 4r1r s ILE 53 N -2.02 4.72 0.74 -0.61 2.07 -0.91 -4.38 121.20 120.82 4r1r s ILE 53 Ca 0.00 1.96 -0.15 0.00 -1.41 0.00 0.00 60.65 61.06 4r1r s ILE 53 Cb 0.00 -4.26 0.04 0.00 0.13 0.00 0.00 42.46 38.38 4r1r s ILE 53 CO 0.00 0.16 1.20 -1.59 -1.91 0.00 0.00 174.94 172.80 4r1r s LYS 54 N 0.98 2.10 0.21 3.50 -2.85 -1.26 -1.86 119.74 120.56 4r1r s LYS 54 Ca 0.53 1.72 -0.08 0.00 -1.00 0.00 0.00 55.97 57.14 4r1r s LYS 54 Cb -0.22 -1.83 0.16 0.00 -2.06 0.00 0.00 37.83 33.87 4r1r s LYS 54 CO 0.28 -1.85 1.78 1.15 0.10 0.00 0.00 175.35 176.81 4r1r h THR 55 N -0.39 1.26 -0.99 3.79 2.02 -1.25 -2.54 112.91 114.80 4r1r h THR 55 Ca -0.47 -0.82 0.04 0.00 0.77 0.00 0.00 66.41 65.93 4r1r h THR 55 Cb 1.29 0.31 -0.06 0.00 -1.74 0.00 0.00 68.15 67.95 4r1r h THR 55 CO 0.49 0.34 0.65 0.77 0.37 0.00 0.00 175.52 178.14 4r1r h SER 56 N 1.16 1.07 0.21 4.18 4.64 -1.91 -1.48 113.55 121.42 4r1r h SER 56 Ca 0.27 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.51 4r1r h SER 56 Cb 0.22 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 4r1r h SER 56 CO -0.02 0.72 -0.27 0.44 -0.87 0.00 0.00 176.83 176.83 4r1r h ASP 57 N 1.23 0.10 -0.40 4.97 5.19 -1.83 -1.21 116.42 124.47 4r1r h ASP 57 Ca 0.40 -0.03 -0.05 0.00 -0.62 0.00 0.00 57.03 56.74 4r1r h ASP 57 Cb 0.04 -0.03 -0.02 0.00 0.18 0.00 0.00 39.33 39.51 4r1r h ASP 57 CO -0.14 0.38 0.06 0.40 -3.12 0.00 0.00 179.24 176.82 4r1r h ILE 58 N 0.10 1.24 -0.24 0.35 2.04 -1.03 -1.61 117.51 118.35 4r1r h ILE 58 Ca 0.01 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 65.00 4r1r h ILE 58 Cb 0.53 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 4r1r h ILE 58 CO 0.04 0.30 0.15 0.45 0.00 0.00 0.00 178.15 179.09 4r1r h HIS 59 N 0.52 0.29 -0.59 1.37 3.86 -0.92 -1.75 115.15 117.93 4r1r h HIS 59 Ca 0.12 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 4r1r h HIS 59 Cb 0.37 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.72 4r1r h HIS 59 CO 0.03 0.18 0.38 0.93 0.86 0.00 0.00 177.93 180.31 4r1r h GLU 60 N 0.31 0.78 -0.12 2.45 4.39 -1.12 -0.78 114.58 120.49 4r1r h GLU 60 Ca 0.09 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.75 4r1r h GLU 60 Cb -0.03 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.44 4r1r h GLU 60 CO -0.03 0.52 0.04 1.15 -1.16 0.00 0.00 179.01 179.53 4r1r h THR 61 N 0.80 0.97 -0.49 1.13 2.02 -1.00 0.05 112.91 116.39 4r1r h THR 61 Ca 0.21 -0.03 -0.10 0.00 0.77 0.00 0.00 66.41 67.26 4r1r h THR 61 Cb -0.08 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 4r1r h THR 61 CO -0.05 0.02 -0.10 0.16 0.37 0.00 0.00 175.52 175.92 4r1r h ILE 62 N 0.09 1.27 0.10 3.11 3.07 -1.15 -0.24 117.51 123.76 4r1r h ILE 62 Ca 0.05 -1.23 0.02 0.00 1.55 0.00 0.00 64.86 65.25 4r1r h ILE 62 Cb 0.03 1.06 -0.04 0.00 -0.27 0.00 0.00 36.82 37.60 4r1r h ILE 62 CO -0.06 0.43 -0.36 0.40 -1.05 0.00 0.00 178.15 177.52 4r1r h ILE 63 N 0.78 0.26 -0.67 0.16 2.04 -0.87 -0.89 117.51 118.32 4r1r h ILE 63 Ca 0.13 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.05 4r1r h ILE 63 Cb 0.65 0.26 -0.06 0.00 -0.74 0.00 0.00 36.82 36.93 4r1r h ILE 63 CO 0.05 0.00 0.36 0.50 0.00 0.00 0.00 178.15 179.05 4r1r h LYS 64 N -0.57 0.62 -0.35 2.37 3.64 -0.86 0.61 116.57 122.04 4r1r h LYS 64 Ca 0.03 -0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.45 4r1r h LYS 64 Cb 0.61 -0.14 -0.09 0.00 -0.41 0.00 0.00 32.23 32.21 4r1r h LYS 64 CO -0.22 0.41 -0.30 0.00 -2.27 0.00 0.00 179.45 177.07 4r1r h ALA 65 N 1.37 -0.17 0.30 5.00 0.00 -0.22 0.34 119.26 125.88 4r1r h ALA 65 Ca 0.31 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.31 4r1r h ALA 65 Cb 0.24 0.65 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 4r1r h ALA 65 CO -0.21 -0.71 -0.28 0.00 0.00 0.00 0.00 179.25 178.05 4r1r h ALA 66 N 0.76 -0.60 -0.91 0.00 0.00 -0.35 -2.85 119.26 115.31 4r1r h ALA 66 Ca 0.16 -0.10 0.21 0.00 0.00 0.00 0.00 54.91 55.19 4r1r h ALA 66 Cb 0.52 0.40 -0.12 0.00 0.00 0.00 0.00 17.79 18.59 4r1r h ALA 66 CO -0.49 -0.87 0.43 0.00 0.00 0.00 0.00 179.25 178.32 4r1r h ALA 67 N -0.02 1.47 0.00 0.00 0.00 0.46 0.29 119.26 121.46 4r1r h ALA 67 Ca -0.01 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.04 4r1r h ALA 67 Cb 0.55 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.45 4r1r h ALA 67 CO -0.05 -0.30 0.00 -0.25 0.00 0.00 0.00 179.25 178.65 4r1r n ASP 68 N -5.00 0.31 -0.21 0.00 8.00 0.11 -2.01 116.55 117.75 4r1r n ASP 68 Ca 0.22 0.59 0.12 0.00 0.71 0.00 0.00 54.79 56.43 4r1r n ASP 68 Cb 0.64 -0.65 0.21 0.00 -0.02 0.00 0.00 41.12 41.30 4r1r n ASP 68 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 4r1r n LEU 69 N -1.86 1.10 -4.62 0.64 4.77 0.10 -4.94 117.00 112.19 4r1r n LEU 69 Ca 0.02 -0.33 -0.47 0.00 -0.03 0.00 0.00 56.01 55.20 4r1r n LEU 69 Cb 0.16 -0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 41.11 4r1r n LEU 69 CO 0.14 0.22 0.88 -0.38 -1.33 0.00 0.00 177.39 176.93 4r1r n ILE 70 N -0.83 0.79 -3.82 -0.08 5.41 -0.85 -4.82 119.36 115.17 4r1r n ILE 70 Ca 0.09 -0.20 -0.05 0.00 1.00 0.00 0.00 62.75 63.59 4r1r n ILE 70 Cb 0.37 -1.14 -0.00 0.00 -0.71 0.00 0.00 39.64 38.15 4r1r n ILE 70 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 4r1r s SER 71 N 0.21 -0.14 0.18 4.38 1.04 -1.23 -4.99 113.70 113.15 4r1r s SER 71 Ca 0.72 -0.64 -0.10 0.00 0.48 0.00 0.00 55.95 56.41 4r1r s SER 71 Cb -0.77 0.63 0.08 0.00 0.10 0.00 0.00 66.02 66.06 4r1r s SER 71 CO 0.50 -1.20 1.67 0.03 0.98 0.00 0.00 173.24 175.22 4r1r h ARG 72 N 2.00 1.04 0.00 4.02 3.08 -1.94 -2.32 114.38 120.26 4r1r h ARG 72 Ca -0.24 -0.28 0.00 0.00 0.07 0.00 0.00 59.98 59.53 4r1r h ARG 72 Cb 1.24 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.17 4r1r h ARG 72 CO 0.29 0.97 0.00 -0.44 -1.07 0.00 0.00 179.97 179.71 4r1r h ASP 73 N 0.95 0.00 -1.42 7.04 3.32 -1.96 -3.36 116.42 121.00 4r1r h ASP 73 Ca 0.19 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 56.81 4r1r h ASP 73 Cb 0.43 0.00 -0.30 0.00 0.22 0.00 0.00 39.33 39.69 4r1r h ASP 73 CO 0.01 0.00 -0.85 0.00 -1.72 0.00 0.00 179.24 176.68 4r1r n ALA 74 N -2.07 1.00 0.37 3.45 0.00 -1.03 -4.98 120.51 117.25 4r1r n ALA 74 Ca 0.01 -2.55 0.14 0.00 0.00 0.00 0.00 53.44 51.03 4r1r n ALA 74 Cb 0.30 -1.02 0.54 0.00 0.00 0.00 0.00 19.45 19.27 4r1r n ALA 74 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 4r1r h PRO 75 N 4.40 0.00 0.00 0.00 0.13 -1.57 -3.00 132.00 131.95 4r1r h PRO 75 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 4r1r h PRO 75 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 4r1r h PRO 75 CO 0.36 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.88 4r1r n ASP 76 N -2.50 0.00 0.08 1.44 9.92 -1.26 -1.78 116.55 122.45 4r1r n ASP 76 Ca 0.02 0.35 0.02 0.00 -0.53 0.00 0.00 54.79 54.65 4r1r n ASP 76 Cb 0.27 -0.44 0.36 0.00 -0.64 0.00 0.00 41.12 40.67 4r1r n ASP 76 CO 0.00 0.00 0.00 1.88 0.13 0.00 0.00 177.20 179.21 4r1r h TYR 77 N 0.00 0.35 -0.69 1.24 0.05 -1.84 -0.07 116.97 116.01 4r1r h TYR 77 Ca 0.00 -0.04 0.15 0.00 0.05 0.00 0.00 58.73 58.89 4r1r h TYR 77 Cb 0.28 -0.10 -0.12 0.00 1.01 0.00 0.00 36.73 37.79 4r1r h TYR 77 CO 0.00 0.42 -0.03 1.96 -1.05 0.00 0.00 178.16 179.46 4r1r h GLN 78 N 0.32 0.08 -0.01 4.88 4.20 -1.60 0.39 115.11 123.37 4r1r h GLN 78 Ca 0.07 -0.00 -0.23 0.00 0.06 0.00 0.00 58.65 58.54 4r1r h GLN 78 Cb 0.35 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.12 4r1r h GLN 78 CO 0.02 0.05 -0.94 1.88 -0.67 0.00 0.00 178.83 179.17 4r1r h TYR 79 N 0.08 0.69 -0.21 2.96 0.05 -1.43 0.18 116.97 119.30 4r1r h TYR 79 Ca 0.36 -0.37 0.02 0.00 0.05 0.00 0.00 58.73 58.79 4r1r h TYR 79 Cb 0.60 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 38.24 4r1r h TYR 79 CO -0.43 1.19 0.07 1.25 -1.05 0.00 0.00 178.16 179.19 4r1r h LEU 80 N 0.27 0.07 -0.13 3.88 5.85 0.77 0.28 115.31 126.29 4r1r h LEU 80 Ca -0.08 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 4r1r h LEU 80 Cb 1.58 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.62 4r1r h LEU 80 CO 0.17 0.07 0.08 0.00 -0.34 0.00 0.00 178.44 178.41 4r1r h ALA 81 N 1.14 0.17 -0.11 1.25 0.00 -0.41 -2.55 119.26 118.74 4r1r h ALA 81 Ca 0.09 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.00 4r1r h ALA 81 Cb 0.07 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.74 4r1r h ALA 81 CO -0.10 -0.31 -0.43 0.00 0.00 0.00 0.00 179.25 178.41 4r1r h ALA 82 N 1.00 -0.62 -0.34 0.00 0.00 -0.79 0.26 119.26 118.76 4r1r h ALA 82 Ca 0.05 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.98 4r1r h ALA 82 Cb 0.04 0.80 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 4r1r h ALA 82 CO -0.01 -0.94 0.11 0.00 0.00 0.00 0.00 179.25 178.41 4r1r h ARG 83 N -0.51 0.25 -0.35 0.00 3.08 -0.96 0.42 114.38 116.31 4r1r h ARG 83 Ca 0.07 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.18 4r1r h ARG 83 Cb 0.64 -0.06 -0.07 0.00 0.08 0.00 0.00 29.97 30.56 4r1r h ARG 83 CO -0.39 0.16 -0.10 -0.07 -1.07 0.00 0.00 179.97 178.50 4r1r h LEU 84 N 0.25 -0.37 -0.25 3.04 3.38 -1.00 0.23 115.31 120.60 4r1r h LEU 84 Ca 0.15 0.11 0.06 0.00 0.09 0.00 0.00 57.88 58.29 4r1r h LEU 84 Cb 0.13 0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.06 4r1r h LEU 84 CO -0.16 -0.13 -0.11 0.00 0.09 0.00 0.00 178.44 178.13 4r1r h ALA 85 N 1.33 0.10 -0.15 1.53 0.00 0.85 -1.04 119.26 121.88 4r1r h ALA 85 Ca 0.17 0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.22 4r1r h ALA 85 Cb 0.28 0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 4r1r h ALA 85 CO -0.38 -0.52 -0.14 0.82 0.00 0.00 0.00 179.25 179.04 4r1r h ILE 86 N -0.08 0.62 -0.46 0.00 1.08 0.12 -0.12 117.51 118.67 4r1r h ILE 86 Ca 0.13 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.69 4r1r h ILE 86 Cb 0.28 0.62 -0.10 0.00 -3.07 0.00 0.00 36.82 34.54 4r1r h ILE 86 CO -0.30 0.00 -0.32 0.15 -0.69 0.00 0.00 178.15 176.99 4r1r h PHE 87 N -0.16 -0.89 -0.95 1.37 3.57 0.04 0.10 116.94 120.02 4r1r h PHE 87 Ca 0.10 0.06 0.05 0.00 3.53 0.00 0.00 57.97 61.71 4r1r h PHE 87 Cb 0.30 0.46 -0.06 0.00 2.79 0.00 0.00 35.95 39.44 4r1r h PHE 87 CO -0.27 -0.38 0.61 1.25 -2.23 0.00 0.00 178.31 177.30 4r1r h HIS 88 N -0.22 1.14 -0.34 0.41 2.76 -0.44 -2.02 115.15 116.45 4r1r h HIS 88 Ca 0.19 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.28 4r1r h HIS 88 Cb 0.54 -0.38 -0.01 0.00 1.55 0.00 0.00 27.41 29.10 4r1r h HIS 88 CO -0.56 0.63 -0.26 -0.07 -1.30 0.00 0.00 177.93 176.37 4r1r h LEU 89 N 1.16 0.70 0.21 0.26 3.38 0.27 -0.40 115.31 120.89 4r1r h LEU 89 Ca 0.39 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 58.10 4r1r h LEU 89 Cb 0.07 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 4r1r h LEU 89 CO -0.14 0.94 -0.18 0.03 0.09 0.00 0.00 178.44 179.17 4r1r h ARG 90 N 0.60 -0.39 -0.90 1.13 2.47 -0.17 -0.57 114.38 116.54 4r1r h ARG 90 Ca 0.08 0.03 -0.02 0.00 -1.26 0.00 0.00 59.98 58.81 4r1r h ARG 90 Cb 0.76 0.09 -0.04 0.00 -1.65 0.00 0.00 29.97 29.12 4r1r h ARG 90 CO 0.06 -0.26 0.49 0.87 0.56 0.00 0.00 179.97 181.69 4r1r h LYS 91 N -0.41 1.26 -0.31 0.04 1.57 -1.29 0.73 116.57 118.16 4r1r h LYS 91 Ca -0.00 -0.15 0.04 0.00 -1.87 0.00 0.00 60.65 58.66 4r1r h LYS 91 Cb 0.37 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 4r1r h LYS 91 CO -0.03 0.93 0.21 -0.22 -0.57 0.00 0.00 179.45 179.77 4r1r h LYS 92 N 1.26 0.24 0.01 3.15 3.64 -0.57 0.25 116.57 124.56 4r1r h LYS 92 Ca 0.32 -0.01 -0.39 0.00 -1.27 0.00 0.00 60.65 59.29 4r1r h LYS 92 Cb 0.04 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 31.74 4r1r h LYS 92 CO -0.05 0.16 -2.42 0.00 -2.27 0.00 0.00 179.45 174.87 4r1r n ALA 93 N -2.53 1.36 0.58 5.00 0.00 -0.26 -4.67 120.51 119.99 4r1r n ALA 93 Ca 0.03 -1.04 0.06 0.00 0.00 0.00 0.00 53.44 52.49 4r1r n ALA 93 Cb 0.20 -0.16 -0.05 0.00 0.00 0.00 0.00 19.45 19.44 4r1r n ALA 93 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 4r1r n TYR 94 N -3.34 0.00 -1.04 0.00 4.01 0.19 -4.93 117.16 112.05 4r1r n TYR 94 Ca -0.45 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.28 4r1r n TYR 94 Cb 0.99 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 40.01 4r1r n TYR 94 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 4r1r n GLY 95 N 1.23 0.50 3.76 2.72 0.00 0.89 -4.95 105.19 109.34 4r1r n GLY 95 Ca 0.03 -0.34 -0.03 0.00 0.00 0.00 0.00 46.02 45.68 4r1r n GLY 95 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 4r1r s GLN 96 N -1.06 1.20 0.06 1.61 -2.07 -1.25 -4.94 119.66 113.20 4r1r s GLN 96 Ca 0.00 -0.66 -0.18 0.00 -1.82 0.00 0.00 55.36 52.70 4r1r s GLN 96 Cb 0.00 0.41 -0.13 0.00 -1.09 0.00 0.00 33.01 32.19 4r1r s GLN 96 CO 0.00 -0.55 1.34 0.35 -1.32 0.00 0.00 175.29 175.11 4r1r h PHE 97 N 2.00 0.63 -2.89 9.60 3.57 -1.89 -3.05 116.94 124.90 4r1r h PHE 97 Ca -0.24 -0.21 -0.56 0.00 3.53 0.00 0.00 57.97 60.49 4r1r h PHE 97 Cb 1.23 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.82 4r1r h PHE 97 CO 0.38 0.91 0.88 -1.21 -2.23 0.00 0.00 178.31 177.05 4r1r s GLU 98 N -4.15 4.26 0.56 1.11 0.41 -1.26 -4.79 118.70 114.84 4r1r s GLU 98 Ca -0.13 1.82 -0.20 0.00 -0.41 0.00 0.00 54.97 56.05 4r1r s GLU 98 Cb 0.06 -3.72 -0.05 0.00 -1.78 0.00 0.00 34.13 28.65 4r1r s GLU 98 CO 0.80 -0.65 1.19 -1.25 -0.49 0.00 0.00 175.26 174.86 4r1r s PRO 99 N 3.11 3.16 1.09 0.39 0.05 -1.26 -4.96 135.00 136.57 4r1r s PRO 99 Ca 0.60 1.80 -0.15 0.00 0.05 0.00 0.00 61.00 63.30 4r1r s PRO 99 Cb -0.26 -2.02 0.23 0.00 0.05 0.00 0.00 34.50 32.50 4r1r s PRO 99 CO 0.21 -1.05 1.09 -1.25 0.05 0.00 0.00 177.00 176.05 4r1r s PRO 100 N -3.22 -0.27 0.33 0.56 0.04 -1.26 -4.99 135.00 126.19 4r1r s PRO 100 Ca 0.75 0.35 -0.28 0.00 0.04 0.00 0.00 61.00 61.86 4r1r s PRO 100 Cb -0.29 -1.67 -0.10 0.00 0.04 0.00 0.00 34.50 32.48 4r1r s PRO 100 CO 0.33 -3.17 1.22 0.00 0.04 0.00 0.00 177.00 175.42 4r1r s ALA 101 N -2.92 3.40 0.21 8.56 0.00 -1.26 -4.85 121.76 124.90 4r1r s ALA 101 Ca 0.67 1.11 -0.16 0.00 0.00 0.00 0.00 51.96 53.58 4r1r s ALA 101 Cb -0.17 -3.42 0.23 0.00 0.00 0.00 0.00 23.12 19.76 4r1r s ALA 101 CO 0.58 -0.50 1.60 1.25 0.00 0.00 0.00 175.76 178.69 4r1r h LEU 102 N 3.32 -0.90 -0.19 0.00 5.85 -1.94 -1.24 115.31 120.21 4r1r h LEU 102 Ca -0.48 0.23 0.03 0.00 0.84 0.00 0.00 57.88 58.50 4r1r h LEU 102 Cb 1.22 0.51 -0.03 0.00 0.37 0.00 0.00 40.66 42.73 4r1r h LEU 102 CO 0.65 -0.27 -0.02 0.22 -0.34 0.00 0.00 178.44 178.69 4r1r h TYR 103 N -0.06 -0.04 -0.21 1.25 3.20 -1.91 0.27 116.97 119.46 4r1r h TYR 103 Ca 0.30 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.20 4r1r h TYR 103 Cb 0.54 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.84 4r1r h TYR 103 CO -0.62 -0.05 0.10 -0.44 -1.64 0.00 0.00 178.16 175.52 4r1r h ASP 104 N 0.04 0.15 0.14 -2.11 3.32 -1.72 -0.79 116.42 115.45 4r1r h ASP 104 Ca 0.09 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.17 4r1r h ASP 104 Cb 0.12 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.61 4r1r h ASP 104 CO -0.17 0.12 -0.43 -0.74 -1.72 0.00 0.00 179.24 176.30 4r1r h HIS 105 N 0.22 -1.21 -0.52 4.55 2.76 -0.81 -1.01 115.15 119.13 4r1r h HIS 105 Ca 0.09 0.03 0.07 0.00 -2.20 0.00 0.00 60.37 58.36 4r1r h HIS 105 Cb 0.02 0.51 -0.06 0.00 1.55 0.00 0.00 27.41 29.44 4r1r h HIS 105 CO -0.09 -0.53 0.19 0.28 -1.30 0.00 0.00 177.93 176.48 4r1r h VAL 106 N -0.68 0.83 -0.40 5.26 2.07 -0.70 -1.08 116.25 121.55 4r1r h VAL 106 Ca 0.01 -0.13 0.06 0.00 0.82 0.00 0.00 66.70 67.46 4r1r h VAL 106 Cb 0.70 0.42 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 4r1r h VAL 106 CO -0.24 0.07 0.09 0.58 0.02 0.00 0.00 177.57 178.09 4r1r h VAL 107 N 0.38 0.81 -0.31 2.57 2.07 -0.70 -0.32 116.25 120.74 4r1r h VAL 107 Ca 0.25 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 67.69 4r1r h VAL 107 Cb 0.27 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 4r1r h VAL 107 CO -0.25 0.04 0.18 0.50 0.02 0.00 0.00 177.57 178.06 4r1r h LYS 108 N 0.22 0.43 -0.54 1.57 3.64 -0.51 -2.31 116.57 119.07 4r1r h LYS 108 Ca 0.19 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.46 4r1r h LYS 108 Cb 0.22 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 4r1r h LYS 108 CO -0.24 0.34 0.06 0.52 -2.27 0.00 0.00 179.45 177.86 4r1r h MET 109 N 0.40 0.87 -0.59 1.90 2.86 -0.85 -2.29 114.93 117.23 4r1r h MET 109 Ca 0.11 -0.22 -0.08 0.00 -2.06 0.00 0.00 59.70 57.46 4r1r h MET 109 Cb 0.03 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 4r1r h MET 109 CO -0.02 0.83 0.06 0.28 1.06 0.00 0.00 176.91 179.12 4r1r h VAL 110 N 0.83 1.26 -0.02 -2.22 2.07 -0.90 -1.55 116.25 115.71 4r1r h VAL 110 Ca 0.17 -1.03 -0.07 0.00 0.82 0.00 0.00 66.70 66.58 4r1r h VAL 110 Cb 0.40 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 4r1r h VAL 110 CO 0.01 0.38 -0.33 -0.08 0.02 0.00 0.00 177.57 177.57 4r1r h GLU 111 N 0.91 0.03 -0.00 1.57 4.81 -1.12 -2.51 114.58 118.27 4r1r h GLU 111 Ca 0.18 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 4r1r h GLU 111 Cb 0.45 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.83 4r1r h GLU 111 CO 0.02 0.36 -0.13 -1.33 -0.73 0.00 0.00 179.01 177.20 4r1r n MET 112 N -4.14 0.77 -1.23 1.92 2.81 -0.89 -4.93 117.12 111.43 4r1r n MET 112 Ca -0.02 -0.31 -0.04 0.00 -1.81 0.00 0.00 57.70 55.53 4r1r n MET 112 Cb 0.38 -1.49 -0.01 0.00 -0.71 0.00 0.00 33.22 31.38 4r1r n MET 112 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 4r1r n GLY 113 N 1.28 0.61 0.05 3.03 0.00 -0.94 -4.92 105.19 104.30 4r1r n GLY 113 Ca 0.14 -0.88 0.08 0.00 0.00 0.00 0.00 46.02 45.36 4r1r n GLY 113 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 4r1r n LYS 114 N -2.70 0.65 -4.38 1.61 4.76 -0.63 -4.83 118.16 112.64 4r1r n LYS 114 Ca -0.04 -0.08 -0.27 0.00 -2.87 0.00 0.00 58.31 55.05 4r1r n LYS 114 Cb 0.17 -1.61 -0.13 0.00 -1.84 0.00 0.00 35.03 31.63 4r1r n LYS 114 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 4r1r s TYR 115 N -3.34 2.11 0.56 2.13 2.02 -1.18 -4.46 117.35 115.19 4r1r s TYR 115 Ca -0.06 -0.39 -0.21 0.00 -0.37 0.00 0.00 57.07 56.03 4r1r s TYR 115 Cb 0.12 -1.15 -0.04 0.00 -0.40 0.00 0.00 41.96 40.48 4r1r s TYR 115 CO 0.87 0.28 1.35 0.34 -1.57 0.00 0.00 175.55 176.82 4r1r s ASP 116 N -1.95 5.16 0.31 2.29 -1.08 0.12 -4.49 116.67 117.04 4r1r s ASP 116 Ca 0.11 2.75 0.24 0.00 -0.52 0.00 0.00 52.55 55.14 4r1r s ASP 116 Cb -0.10 -2.63 0.54 0.00 -1.46 0.00 0.00 42.92 39.26 4r1r s ASP 116 CO 0.05 -1.64 1.65 -0.55 0.52 0.00 0.00 175.17 175.20 4r1r h ASN 117 N 1.32 0.00 -0.48 -0.34 7.08 -1.91 -3.25 115.58 118.00 4r1r h ASN 117 Ca -0.51 -0.01 0.02 0.00 -3.08 0.00 0.00 56.30 52.73 4r1r h ASN 117 Cb 1.31 0.00 -0.03 0.00 -2.08 0.00 0.00 38.32 37.52 4r1r h ASN 117 CO 0.57 0.00 0.32 1.12 -2.08 0.00 0.00 177.43 177.36 4r1r h HIS 118 N 0.00 0.53 -0.72 4.14 2.07 -1.98 -2.35 115.15 116.85 4r1r h HIS 118 Ca 0.00 0.01 0.16 0.00 -2.85 0.00 0.00 60.37 57.69 4r1r h HIS 118 Cb 0.87 -0.18 -0.12 0.00 2.57 0.00 0.00 27.41 30.55 4r1r h HIS 118 CO 0.00 0.32 0.01 -0.07 -3.07 0.00 0.00 177.93 175.12 4r1r h LEU 119 N 0.56 -0.31 -0.99 6.12 3.38 -1.95 0.56 115.31 122.67 4r1r h LEU 119 Ca 0.19 0.18 -0.09 0.00 0.09 0.00 0.00 57.88 58.25 4r1r h LEU 119 Cb 0.06 0.32 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 4r1r h LEU 119 CO -0.05 -0.15 -0.45 -0.07 0.09 0.00 0.00 178.44 177.81 4r1r h LEU 120 N 0.12 0.00 0.20 1.67 3.38 -1.67 -2.37 115.31 116.64 4r1r h LEU 120 Ca 0.39 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 58.04 4r1r h LEU 120 Cb 0.67 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.45 4r1r h LEU 120 CO -0.62 0.45 -1.40 -0.33 0.09 0.00 0.00 178.44 176.63 4r1r h GLU 121 N 0.00 0.50 0.00 1.13 5.08 -0.82 -3.36 114.58 117.11 4r1r h GLU 121 Ca -0.00 -0.82 -0.14 0.00 -1.00 0.00 0.00 59.36 57.40 4r1r h GLU 121 Cb 0.89 0.30 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 4r1r h GLU 121 CO 0.06 1.39 -0.65 -0.44 -1.00 0.00 0.00 179.01 178.37 4r1r h ASP 122 N 0.15 0.00 -4.26 1.42 3.32 0.03 -3.45 116.42 113.64 4r1r h ASP 122 Ca -0.22 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.29 4r1r h ASP 122 Cb 2.09 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 41.40 4r1r h ASP 122 CO 0.26 0.65 -0.82 -0.31 -1.72 0.00 0.00 179.24 177.29 4r1r s TYR 123 N -3.41 1.68 0.63 4.55 2.02 -0.90 -5.07 117.35 116.85 4r1r s TYR 123 Ca -0.00 -0.39 -0.04 0.00 -0.37 0.00 0.00 57.07 56.26 4r1r s TYR 123 Cb 0.12 -0.96 0.04 0.00 -0.40 0.00 0.00 41.96 40.76 4r1r s TYR 123 CO 0.76 0.13 0.91 0.95 -1.57 0.00 0.00 175.55 176.73 4r1r s THR 124 N -0.98 2.61 0.30 -0.71 -4.23 -1.26 -4.66 115.64 106.71 4r1r s THR 124 Ca 0.06 -0.38 0.03 0.00 -1.18 0.00 0.00 61.69 60.22 4r1r s THR 124 Cb -0.09 -3.07 0.11 0.00 1.34 0.00 0.00 72.50 70.80 4r1r s THR 124 CO 0.03 -0.06 1.80 -0.08 -0.54 0.00 0.00 174.62 175.76 4r1r h GLU 125 N -0.30 0.53 -0.71 3.99 4.81 -1.99 -1.68 114.58 119.23 4r1r h GLU 125 Ca -0.44 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 58.62 4r1r h GLU 125 Cb 1.30 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.59 4r1r h GLU 125 CO 0.58 0.64 0.36 0.93 -0.73 0.00 0.00 179.01 180.78 4r1r h GLU 126 N 0.49 1.01 -0.57 1.92 3.07 -1.99 -0.81 114.58 117.71 4r1r h GLU 126 Ca 0.09 -0.14 -0.05 0.00 -0.50 0.00 0.00 59.36 58.76 4r1r h GLU 126 Cb 0.49 -0.19 -0.03 0.00 -0.84 0.00 0.00 28.75 28.19 4r1r h GLU 126 CO 0.03 0.79 0.16 0.93 -1.40 0.00 0.00 179.01 179.51 4r1r h GLU 127 N 0.99 0.87 -0.28 2.33 5.08 -1.78 -0.97 114.58 120.82 4r1r h GLU 127 Ca 0.25 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 58.31 4r1r h GLU 127 Cb 0.09 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 4r1r h GLU 127 CO -0.03 0.77 -0.32 0.74 -1.00 0.00 0.00 179.01 179.16 4r1r h PHE 128 N 0.84 0.70 -0.68 4.33 0.04 -0.94 -1.19 116.94 120.04 4r1r h PHE 128 Ca 0.19 -0.18 -0.00 0.00 2.80 0.00 0.00 57.97 60.78 4r1r h PHE 128 Cb 0.28 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.24 4r1r h PHE 128 CO 0.02 0.85 0.42 0.87 -0.60 0.00 0.00 178.31 179.87 4r1r h LYS 129 N 0.51 0.91 -0.74 1.51 1.57 -0.51 -0.98 116.57 118.85 4r1r h LYS 129 Ca 0.06 -0.08 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 4r1r h LYS 129 Cb 0.81 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.89 4r1r h LYS 129 CO 0.07 0.64 0.22 1.96 -0.57 0.00 0.00 179.45 181.77 4r1r h GLN 130 N 0.92 1.15 -0.66 3.15 4.20 -0.87 -2.78 115.11 120.22 4r1r h GLN 130 Ca 0.24 -0.25 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 4r1r h GLN 130 Cb -0.05 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.54 4r1r h GLN 130 CO -0.05 0.98 0.15 0.52 -0.67 0.00 0.00 178.83 179.77 4r1r h MET 131 N 1.10 1.06 -0.78 1.46 2.86 -0.84 -2.95 114.93 116.85 4r1r h MET 131 Ca 0.24 -0.26 0.10 0.00 -2.06 0.00 0.00 59.70 57.72 4r1r h MET 131 Cb 0.32 -0.14 -0.05 0.00 0.06 0.00 0.00 31.60 31.79 4r1r h MET 131 CO -0.01 0.95 0.51 0.22 1.06 0.00 0.00 176.91 179.64 4r1r h ASP 132 N 0.98 0.61 0.66 1.22 1.82 -0.90 0.47 116.42 121.27 4r1r h ASP 132 Ca 0.21 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.86 4r1r h ASP 132 Cb 0.37 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 40.28 4r1r h ASP 132 CO 0.00 0.35 0.00 0.71 -1.61 0.00 0.00 179.24 178.70 4r1r h THR 133 N 0.67 0.00 0.18 2.25 1.35 -1.45 -2.72 112.91 113.18 4r1r h THR 133 Ca 0.36 -0.27 -0.31 0.00 -0.55 0.00 0.00 66.41 65.64 4r1r h THR 133 Cb 0.51 1.10 0.01 0.00 -1.73 0.00 0.00 68.15 68.04 4r1r h THR 133 CO -0.14 0.00 -1.43 -0.26 -0.25 0.00 0.00 175.52 173.44 4r1r h PHE 134 N 0.00 0.67 -3.44 4.73 0.04 -0.96 -3.47 116.94 114.52 4r1r h PHE 134 Ca 0.00 -0.49 -0.57 0.00 2.80 0.00 0.00 57.97 59.71 4r1r h PHE 134 Cb 0.33 -0.03 0.12 0.00 2.20 0.00 0.00 35.95 38.58 4r1r h PHE 134 CO 0.00 1.44 0.45 -0.89 -0.60 0.00 0.00 178.31 178.70 4r1r n ILE 135 N -3.58 2.46 -3.80 -0.55 5.41 -1.03 -5.00 119.36 113.27 4r1r n ILE 135 Ca -0.15 -0.50 -0.30 0.00 1.00 0.00 0.00 62.75 62.81 4r1r n ILE 135 Cb 1.06 -1.51 -0.15 0.00 -0.71 0.00 0.00 39.64 38.33 4r1r n ILE 135 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 4r1r s ASP 136 N -0.53 4.12 0.46 4.38 -1.08 -1.26 -5.00 116.67 117.76 4r1r s ASP 136 Ca 0.60 -1.68 0.31 0.00 -0.52 0.00 0.00 52.55 51.26 4r1r s ASP 136 Cb -0.53 -1.02 1.21 0.00 -1.46 0.00 0.00 42.92 41.12 4r1r s ASP 136 CO 0.58 -0.39 1.89 0.45 0.52 0.00 0.00 175.17 178.23 4r1r h HIS 137 N 7.99 0.00 0.00 -5.34 3.86 -1.97 -2.36 115.15 117.33 4r1r h HIS 137 Ca -0.12 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.09 4r1r h HIS 137 Cb 1.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.49 4r1r h HIS 137 CO 0.38 0.00 0.00 -0.25 0.86 0.00 0.00 177.93 178.92 4r1r n ASP 138 N -2.85 0.09 0.23 2.45 8.00 -1.26 -1.00 116.55 122.20 4r1r n ASP 138 Ca 0.01 0.53 0.09 0.00 0.71 0.00 0.00 54.79 56.13 4r1r n ASP 138 Cb 0.30 -0.54 0.54 0.00 -0.02 0.00 0.00 41.12 41.40 4r1r n ASP 138 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 4r1r h ARG 139 N 0.00 0.00 -0.30 -1.24 3.08 -1.82 -2.27 114.38 111.84 4r1r h ARG 139 Ca 0.00 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.14 4r1r h ARG 139 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 4r1r h ARG 139 CO 0.00 0.23 0.24 -0.44 -1.07 0.00 0.00 179.97 178.93 4r1r h ASP 140 N 0.00 0.00 0.00 7.04 3.32 -1.28 0.51 116.42 126.01 4r1r h ASP 140 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 4r1r h ASP 140 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 4r1r h ASP 140 CO 0.03 0.00 0.00 0.23 -1.72 0.00 0.00 179.24 177.78 4r1r n MET 141 N -4.22 0.63 -0.02 3.56 2.81 -0.85 -3.26 117.12 115.76 4r1r n MET 141 Ca 0.04 0.00 0.09 0.00 -1.81 0.00 0.00 57.70 56.02 4r1r n MET 141 Cb 0.40 -1.42 0.09 0.00 -0.71 0.00 0.00 33.22 31.57 4r1r n MET 141 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 4r1r n THR 142 N -0.92 0.09 -1.83 2.03 -2.24 0.17 -4.88 114.28 106.70 4r1r n THR 142 Ca 0.13 -0.55 -0.31 0.00 -2.27 0.00 0.00 64.05 61.05 4r1r n THR 142 Cb 0.06 1.28 0.02 0.00 -2.10 0.00 0.00 70.33 69.59 4r1r n THR 142 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 4r1r s PHE 143 N -1.40 3.53 0.28 4.78 0.08 -1.20 -5.04 117.98 119.01 4r1r s PHE 143 Ca 0.22 1.28 0.06 0.00 0.12 0.00 0.00 56.93 58.61 4r1r s PHE 143 Cb 0.15 -2.78 -0.02 0.00 -0.57 0.00 0.00 43.02 39.80 4r1r s PHE 143 CO 0.22 -0.82 0.37 -1.54 -0.10 0.00 0.00 175.22 173.35 4r1r s SER 144 N -4.15 6.04 0.17 1.36 1.04 -1.26 -4.58 113.70 112.32 4r1r s SER 144 Ca 0.56 -0.09 -0.18 0.00 0.48 0.00 0.00 55.95 56.72 4r1r s SER 144 Cb -0.11 -1.54 0.09 0.00 0.10 0.00 0.00 66.02 64.56 4r1r s SER 144 CO 0.54 -0.20 1.65 0.22 0.98 0.00 0.00 173.24 176.43 4r1r h TYR 145 N 1.12 -0.36 -0.41 5.02 3.20 -1.01 -0.93 116.97 123.60 4r1r h TYR 145 Ca -0.49 0.04 0.09 0.00 3.14 0.00 0.00 58.73 61.50 4r1r h TYR 145 Cb 1.24 0.22 -0.09 0.00 1.54 0.00 0.00 36.73 39.64 4r1r h TYR 145 CO 0.46 -0.23 -0.26 0.00 -1.64 0.00 0.00 178.16 176.49 4r1r h ALA 146 N 1.26 -0.01 -0.53 1.82 0.00 -1.86 -0.91 119.26 119.01 4r1r h ALA 146 Ca 0.19 0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.33 4r1r h ALA 146 Cb 0.36 0.59 -0.08 0.00 0.00 0.00 0.00 17.79 18.66 4r1r h ALA 146 CO -0.44 -0.63 0.09 0.00 0.00 0.00 0.00 179.25 178.27 4r1r h ALA 147 N 0.99 0.59 -0.81 0.00 0.00 -1.27 -1.28 119.26 117.48 4r1r h ALA 147 Ca 0.19 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 4r1r h ALA 147 Cb 0.49 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 4r1r h ALA 147 CO -0.52 -0.32 0.35 0.28 0.00 0.00 0.00 179.25 179.04 4r1r h VAL 148 N 0.22 1.26 -0.41 0.00 2.07 -0.02 -0.69 116.25 118.68 4r1r h VAL 148 Ca 0.27 -0.78 0.06 0.00 0.82 0.00 0.00 66.70 67.07 4r1r h VAL 148 Cb 0.39 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.37 4r1r h VAL 148 CO -0.37 0.33 0.10 0.11 0.02 0.00 0.00 177.57 177.76 4r1r h LYS 149 N 1.17 0.24 -0.19 1.57 6.56 -0.35 0.42 116.57 125.99 4r1r h LYS 149 Ca 0.27 -0.01 -0.00 0.00 -1.06 0.00 0.00 60.65 59.85 4r1r h LYS 149 Cb 0.18 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 31.78 4r1r h LYS 149 CO -0.03 0.16 0.12 1.96 -2.06 0.00 0.00 179.45 179.60 4r1r h GLN 150 N 0.24 0.25 -0.46 3.15 1.08 -0.60 0.97 115.11 119.75 4r1r h GLN 150 Ca 0.20 -0.02 0.09 0.00 -1.45 0.00 0.00 58.65 57.47 4r1r h GLN 150 Cb 0.23 -0.05 -0.08 0.00 -0.05 0.00 0.00 27.48 27.52 4r1r h GLN 150 CO -0.24 0.20 -0.08 -0.07 -0.95 0.00 0.00 178.83 177.69 4r1r h LEU 151 N 0.23 -0.35 -0.71 1.46 3.38 -0.38 0.20 115.31 119.13 4r1r h LEU 151 Ca 0.07 0.13 -0.13 0.00 0.09 0.00 0.00 57.88 58.03 4r1r h LEU 151 Cb 0.01 0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 4r1r h LEU 151 CO -0.01 -0.13 -0.49 -0.08 0.09 0.00 0.00 178.44 177.82 4r1r h GLU 152 N 0.03 0.38 -0.05 1.13 4.81 -0.76 0.14 114.58 120.26 4r1r h GLU 152 Ca 0.23 -0.21 -0.19 0.00 -0.13 0.00 0.00 59.36 59.05 4r1r h GLU 152 Cb 0.34 0.02 0.01 0.00 0.63 0.00 0.00 28.75 29.75 4r1r h GLU 152 CO -0.45 0.79 -0.72 0.78 -0.73 0.00 0.00 179.01 178.68 4r1r h GLY 153 N 1.22 0.64 -0.46 1.92 0.00 0.67 -3.43 103.07 103.64 4r1r h GLY 153 Ca 0.01 -1.03 0.00 0.00 0.00 0.00 0.00 47.33 46.32 4r1r h GLY 153 CO 0.08 0.91 -0.19 0.58 0.00 0.00 0.00 176.54 177.92 4r1r n LYS 154 N -4.08 0.00 0.01 4.80 2.85 0.54 -4.97 118.16 117.31 4r1r n LYS 154 Ca -0.09 -0.61 0.00 0.00 -1.05 0.00 0.00 58.31 56.56 4r1r n LYS 154 Cb 0.72 -0.42 0.00 0.00 -0.65 0.00 0.00 35.03 34.68 4r1r n LYS 154 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 4r1r n TYR 155 N 0.00 -0.03 -1.92 5.58 4.02 -0.84 -4.66 117.16 119.32 4r1r n TYR 155 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.48 4r1r n TYR 155 Cb 0.58 0.02 -0.02 0.00 -0.02 0.00 0.00 39.34 39.90 4r1r n TYR 155 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 4r1r s LEU 156 N -6.19 4.37 0.16 7.72 1.43 -0.02 -4.43 118.68 121.71 4r1r s LEU 156 Ca 0.00 2.76 -0.33 0.00 -1.03 0.00 0.00 54.13 55.52 4r1r s LEU 156 Cb 0.00 -3.62 -0.13 0.00 0.03 0.00 0.00 46.19 42.47 4r1r s LEU 156 CO 0.00 -0.79 1.67 0.52 0.23 0.00 0.00 176.35 177.97 4r1r n VAL 157 N 2.57 0.07 -3.83 -1.59 0.31 -1.26 -4.89 118.33 109.71 4r1r n VAL 157 Ca 0.08 -0.01 -0.08 0.00 -0.01 0.00 0.00 64.34 64.32 4r1r n VAL 157 Cb 0.39 -1.75 -0.03 0.00 -0.91 0.00 0.00 33.84 31.54 4r1r n VAL 157 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 4r1r s GLN 158 N 1.35 1.61 -0.45 5.55 -2.07 -1.26 -1.23 119.66 123.17 4r1r s GLN 158 Ca 0.79 -0.97 -0.17 0.00 -1.82 0.00 0.00 55.36 53.18 4r1r s GLN 158 Cb -0.61 0.56 0.04 0.00 -1.09 0.00 0.00 33.01 31.91 4r1r s GLN 158 CO 0.37 -0.71 0.47 1.21 -1.32 0.00 0.00 175.29 175.30 4r1r s ASN 159 N -2.92 6.19 0.43 12.60 3.84 0.69 -4.95 114.94 130.83 4r1r s ASN 159 Ca 0.12 -0.82 0.14 0.00 0.21 0.00 0.00 52.86 52.52 4r1r s ASN 159 Cb -0.03 -2.23 0.94 0.00 -0.55 0.00 0.00 41.25 39.38 4r1r s ASN 159 CO 0.04 -0.65 1.96 0.03 -2.79 0.00 0.00 177.10 175.68 4r1r h ARG 160 N 8.79 0.00 0.22 0.43 3.08 -1.96 0.20 114.38 125.13 4r1r h ARG 160 Ca -0.27 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.77 4r1r h ARG 160 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.16 4r1r h ARG 160 CO 0.84 0.22 -0.10 0.28 -1.07 0.00 0.00 179.97 180.14 4r1r h VAL 161 N 0.00 0.42 0.00 2.04 2.07 -1.98 -3.36 116.25 115.44 4r1r h VAL 161 Ca -0.00 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.55 4r1r h VAL 161 Cb 0.39 0.73 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 4r1r h VAL 161 CO 0.03 0.12 0.00 0.71 0.02 0.00 0.00 177.57 178.45 4r1r h THR 162 N -1.00 0.00 0.00 2.57 1.35 -1.98 -3.47 112.91 110.38 4r1r h THR 162 Ca -0.03 -0.84 0.00 0.00 -0.55 0.00 0.00 66.41 64.99 4r1r h THR 162 Cb 0.42 1.84 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 4r1r h THR 162 CO 0.05 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.93 4r1r n GLY 163 N 1.14 0.42 3.74 5.82 0.00 0.68 -5.04 105.19 111.95 4r1r n GLY 163 Ca 0.04 -1.02 -0.39 0.00 0.00 0.00 0.00 46.02 44.65 4r1r n GLY 163 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4r1r s GLU 164 N -1.94 4.41 -0.20 1.61 2.02 -1.16 -4.88 118.70 118.56 4r1r s GLU 164 Ca 0.00 0.85 -0.09 0.00 0.02 0.00 0.00 54.97 55.75 4r1r s GLU 164 Cb 0.00 -3.40 -0.05 0.00 0.10 0.00 0.00 34.13 30.78 4r1r s GLU 164 CO 0.00 0.20 0.11 0.42 0.02 0.00 0.00 175.26 176.01 4r1r s ILE 165 N 0.33 5.12 -0.69 -1.63 1.09 -1.26 -0.22 121.20 123.93 4r1r s ILE 165 Ca 0.35 0.09 0.21 0.00 -1.10 0.00 0.00 60.65 60.20 4r1r s ILE 165 Cb -0.18 -3.34 -0.26 0.00 -1.06 0.00 0.00 42.46 37.63 4r1r s ILE 165 CO 0.18 0.43 0.76 -1.22 -0.10 0.00 0.00 174.94 174.99 4r1r n TYR 166 N 3.71 0.00 -4.21 3.97 4.01 -0.37 -4.05 117.16 120.23 4r1r n TYR 166 Ca -0.16 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.43 4r1r n TYR 166 Cb 0.52 -0.15 -0.08 0.00 -0.31 0.00 0.00 39.34 39.32 4r1r n TYR 166 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 4r1r s GLU 167 N -3.12 1.53 0.23 -0.72 -1.05 -1.25 -4.92 118.70 109.41 4r1r s GLU 167 Ca 0.03 -1.78 0.11 0.00 -0.15 0.00 0.00 54.97 53.18 4r1r s GLU 167 Cb 0.15 0.33 -0.05 0.00 -0.44 0.00 0.00 34.13 34.12 4r1r s GLU 167 CO 0.86 -0.56 -0.19 -1.54 0.95 0.00 0.00 175.26 174.78 4r1r s SER 168 N -3.24 3.23 0.15 0.83 1.04 -1.26 -4.83 113.70 109.62 4r1r s SER 168 Ca 0.38 -0.98 -0.23 0.00 0.48 0.00 0.00 55.95 55.60 4r1r s SER 168 Cb 0.04 -0.24 0.02 0.00 0.10 0.00 0.00 66.02 65.94 4r1r s SER 168 CO 0.19 -0.00 1.29 0.00 0.98 0.00 0.00 173.24 175.70 4r1r n ALA 169 N -0.30 -0.41 0.11 5.32 0.00 -1.26 -1.16 120.51 122.82 4r1r n ALA 169 Ca -0.08 0.74 0.15 0.00 0.00 0.00 0.00 53.44 54.25 4r1r n ALA 169 Cb 0.59 -0.19 0.66 0.00 0.00 0.00 0.00 19.45 20.51 4r1r n ALA 169 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 4r1r h GLN 170 N 0.00 0.02 -0.05 0.00 1.08 -1.93 -0.09 115.11 114.14 4r1r h GLN 170 Ca 0.18 -0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.20 4r1r h GLN 170 Cb 0.39 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.80 4r1r h GLN 170 CO -0.80 0.01 -0.75 0.74 -0.95 0.00 0.00 178.83 177.09 4r1r h PHE 171 N 0.02 0.41 0.51 2.96 0.04 -1.56 -1.95 116.94 117.38 4r1r h PHE 171 Ca 0.15 -0.19 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 4r1r h PHE 171 Cb 0.56 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.64 4r1r h PHE 171 CO -0.00 0.94 -0.31 1.25 -0.60 0.00 0.00 178.31 179.58 4r1r h LEU 172 N 0.20 -0.79 -0.02 1.54 6.46 -0.81 -0.75 115.31 121.14 4r1r h LEU 172 Ca -0.03 0.05 0.02 0.00 -0.12 0.00 0.00 57.88 57.80 4r1r h LEU 172 Cb 1.32 0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 41.46 4r1r h LEU 172 CO 0.12 -0.49 -0.10 1.88 -0.62 0.00 0.00 178.44 179.23 4r1r h TYR 173 N -0.78 -0.25 -0.52 1.25 0.05 -1.28 -0.38 116.97 115.06 4r1r h TYR 173 Ca -0.06 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.73 4r1r h TYR 173 Cb 0.64 0.11 -0.03 0.00 1.01 0.00 0.00 36.73 38.47 4r1r h TYR 173 CO -0.10 -0.15 0.34 0.97 -1.05 0.00 0.00 178.16 178.17 4r1r h ILE 174 N -0.16 1.14 -0.06 -2.88 6.09 -1.25 -2.52 117.51 117.86 4r1r h ILE 174 Ca 0.04 -0.25 -0.13 0.00 -1.37 0.00 0.00 64.86 63.15 4r1r h ILE 174 Cb 0.22 0.38 -0.01 0.00 0.47 0.00 0.00 36.82 37.88 4r1r h ILE 174 CO -0.11 0.13 -0.53 -0.07 -3.07 0.00 0.00 178.15 174.50 4r1r h LEU 175 N 0.70 0.20 -0.24 2.19 3.38 -1.00 0.57 115.31 121.10 4r1r h LEU 175 Ca 0.19 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.08 4r1r h LEU 175 Cb -0.07 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 4r1r h LEU 175 CO -0.04 0.69 0.11 0.58 0.09 0.00 0.00 178.44 179.87 4r1r h VAL 176 N 0.14 0.98 -0.35 1.22 2.07 -0.76 0.19 116.25 119.74 4r1r h VAL 176 Ca 0.00 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 67.47 4r1r h VAL 176 Cb 0.98 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 4r1r h VAL 176 CO 0.08 0.04 0.18 0.00 0.02 0.00 0.00 177.57 177.89 4r1r h ALA 177 N 1.13 0.43 -0.32 1.67 0.00 -1.06 -1.13 119.26 119.98 4r1r h ALA 177 Ca 0.10 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.09 4r1r h ALA 177 Cb 0.04 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 4r1r h ALA 177 CO -0.08 -0.19 -0.14 0.00 0.00 0.00 0.00 179.25 178.83 4r1r h ALA 178 N 1.18 0.12 0.60 0.00 0.00 0.12 -1.96 119.26 119.32 4r1r h ALA 178 Ca 0.15 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 4r1r h ALA 178 Cb 0.05 0.35 0.01 0.00 0.00 0.00 0.00 17.79 18.20 4r1r h ALA 178 CO -0.10 -0.53 -0.29 0.00 0.00 0.00 0.00 179.25 178.33 4r1r h LEU 180 N -0.91 0.33 -3.47 0.00 3.38 -1.05 -1.59 115.31 112.00 4r1r h LEU 180 Ca -0.08 0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.68 4r1r h LEU 180 Cb 0.66 -0.06 -0.13 0.00 0.09 0.00 0.00 40.66 41.22 4r1r h LEU 180 CO 0.14 0.20 0.08 0.49 0.09 0.00 0.00 178.44 179.43 4r1r n PHE 181 N -4.46 1.49 0.17 1.13 3.01 -0.75 -4.66 117.46 113.38 4r1r n PHE 181 Ca 0.10 -1.53 0.01 0.00 1.01 0.00 0.00 57.45 57.04 4r1r n PHE 181 Cb 0.40 -0.56 0.30 0.00 -0.01 0.00 0.00 39.48 39.61 4r1r n PHE 181 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 4r1r h SER 182 N 1.19 0.00 -0.31 4.37 4.64 -0.59 -2.95 113.55 119.91 4r1r h SER 182 Ca 0.27 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 4r1r h SER 182 Cb 1.88 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.97 4r1r h SER 182 CO 0.51 0.45 0.00 0.59 -0.87 0.00 0.00 176.83 177.51 4r1r n ASN 183 N -4.01 2.80 -4.85 4.97 5.03 -1.26 -4.92 115.26 113.03 4r1r n ASN 183 Ca -0.02 -2.29 -0.33 0.00 0.87 0.00 0.00 54.58 52.82 4r1r n ASN 183 Cb 0.47 -0.46 -0.06 0.00 -1.02 0.00 0.00 39.78 38.71 4r1r n ASN 183 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 4r1r s TYR 184 N -1.73 3.39 0.47 3.10 1.51 -1.12 -5.02 117.35 117.95 4r1r s TYR 184 Ca 0.26 1.22 -0.23 0.00 -1.01 0.00 0.00 57.07 57.31 4r1r s TYR 184 Cb 0.17 -2.54 -0.09 0.00 -0.11 0.00 0.00 41.96 39.40 4r1r s TYR 184 CO 0.11 0.11 1.04 -0.35 -1.11 0.00 0.00 175.55 175.35 4r1r n PRO 185 N -0.30 1.34 0.26 -1.71 -0.04 -1.26 -4.60 135.00 128.68 4r1r n PRO 185 Ca 0.03 0.49 0.10 0.00 -0.04 0.00 0.00 63.50 64.08 4r1r n PRO 185 Cb 0.53 -2.13 0.69 0.00 -0.04 0.00 0.00 33.50 32.55 4r1r n PRO 185 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 4r1r h ARG 186 N 1.37 0.00 -0.72 0.54 2.47 -1.97 0.96 114.38 117.03 4r1r h ARG 186 Ca -0.46 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.23 4r1r h ARG 186 Cb 1.34 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.62 4r1r h ARG 186 CO 0.56 0.09 0.33 1.05 0.56 0.00 0.00 179.97 182.56 4r1r h GLU 187 N 0.00 1.03 0.00 0.04 9.09 -2.05 -3.30 114.58 119.39 4r1r h GLU 187 Ca -0.00 -0.15 0.00 0.00 0.05 0.00 0.00 59.36 59.26 4r1r h GLU 187 Cb 0.19 -0.19 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 4r1r h GLU 187 CO 0.01 0.81 -0.42 0.25 0.05 0.00 0.00 179.01 179.71 4r1r n THR 188 N -4.32 0.00 -0.09 -1.06 -2.24 -0.97 -4.84 114.28 100.76 4r1r n THR 188 Ca 0.07 -0.32 -0.07 0.00 -2.27 0.00 0.00 64.05 61.46 4r1r n THR 188 Cb 0.15 0.95 -0.05 0.00 -2.10 0.00 0.00 70.33 69.27 4r1r n THR 188 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 4r1r h ARG 189 N 0.00 -0.16 0.00 -0.78 2.43 -0.90 -2.60 114.38 112.36 4r1r h ARG 189 Ca 0.00 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 4r1r h ARG 189 Cb 0.18 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.77 4r1r h ARG 189 CO 0.00 -0.11 -0.15 -0.07 -1.51 0.00 0.00 179.97 178.13 4r1r h LEU 190 N -0.17 0.00 -0.21 3.80 3.38 -1.86 -1.85 115.31 118.40 4r1r h LEU 190 Ca 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 4r1r h LEU 190 Cb 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 4r1r h LEU 190 CO -0.32 0.15 0.12 -0.61 0.09 0.00 0.00 178.44 177.87 4r1r h GLN 191 N 0.00 0.29 -0.41 1.13 4.15 -1.80 -0.91 115.11 117.57 4r1r h GLN 191 Ca -0.00 -0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.35 4r1r h GLN 191 Cb 0.36 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.97 4r1r h GLN 191 CO 0.02 0.27 0.11 1.88 -1.93 0.00 0.00 178.83 179.17 4r1r h TYR 192 N 0.24 0.67 0.18 3.99 0.05 -1.10 -1.66 116.97 119.36 4r1r h TYR 192 Ca 0.08 -0.08 0.01 0.00 0.05 0.00 0.00 58.73 58.79 4r1r h TYR 192 Cb 0.06 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 37.57 4r1r h TYR 192 CO -0.04 0.64 -0.33 0.28 -1.05 0.00 0.00 178.16 177.66 4r1r h VAL 193 N 0.51 0.31 -0.32 -2.88 2.07 -1.19 -0.10 116.25 114.66 4r1r h VAL 193 Ca 0.13 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.70 4r1r h VAL 193 Cb 0.29 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.33 4r1r h VAL 193 CO -0.00 0.00 0.04 0.50 0.02 0.00 0.00 177.57 178.13 4r1r h LYS 194 N -0.59 0.14 -0.63 1.57 3.64 -0.99 -0.53 116.57 119.17 4r1r h LYS 194 Ca 0.02 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.41 4r1r h LYS 194 Cb 0.59 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.34 4r1r h LYS 194 CO -0.15 0.09 0.40 0.00 -2.27 0.00 0.00 179.45 177.52 4r1r h ARG 195 N 0.14 0.78 -0.42 1.90 3.08 -1.04 -0.44 114.38 118.38 4r1r h ARG 195 Ca 0.15 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.10 4r1r h ARG 195 Cb 0.18 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 4r1r h ARG 195 CO -0.22 0.51 0.04 0.35 -1.07 0.00 0.00 179.97 179.59 4r1r h PHE 196 N 0.80 0.76 -0.29 3.04 3.57 -0.66 -1.42 116.94 122.73 4r1r h PHE 196 Ca 0.25 -0.12 0.02 0.00 3.53 0.00 0.00 57.97 61.65 4r1r h PHE 196 Cb -0.02 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 4r1r h PHE 196 CO -0.04 0.75 0.14 -0.92 -2.23 0.00 0.00 178.31 176.00 4r1r h TYR 197 N 0.55 0.26 -0.17 0.41 3.20 -0.73 -1.09 116.97 119.39 4r1r h TYR 197 Ca 0.12 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.04 4r1r h TYR 197 Cb 0.42 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 4r1r h TYR 197 CO 0.03 0.14 -0.03 -0.44 -1.64 0.00 0.00 178.16 176.21 4r1r h ASP 198 N 0.29 -0.14 -0.50 -2.11 3.32 -0.92 0.22 116.42 116.59 4r1r h ASP 198 Ca 0.12 0.05 0.10 0.00 0.02 0.00 0.00 57.03 57.32 4r1r h ASP 198 Cb 0.05 0.10 -0.10 0.00 0.22 0.00 0.00 39.33 39.59 4r1r h ASP 198 CO -0.09 -0.05 -0.27 0.00 -1.72 0.00 0.00 179.24 177.11 4r1r h ALA 199 N 1.16 0.03 0.03 3.45 0.00 -0.53 -0.29 119.26 123.12 4r1r h ALA 199 Ca 0.08 0.16 -0.24 0.00 0.00 0.00 0.00 54.91 54.91 4r1r h ALA 199 Cb 0.12 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 4r1r h ALA 199 CO -0.17 -0.62 -1.19 -0.39 0.00 0.00 0.00 179.25 176.88 4r1r h VAL 200 N -0.16 1.50 0.00 0.00 -1.51 -1.07 0.28 116.25 115.29 4r1r h VAL 200 Ca 0.22 -3.21 -0.06 0.00 -1.23 0.00 0.00 66.70 62.42 4r1r h VAL 200 Cb 0.51 2.79 -0.01 0.00 -2.13 0.00 0.00 31.29 32.45 4r1r h VAL 200 CO -0.59 0.88 -0.28 0.77 -1.23 0.00 0.00 177.57 177.12 4r1r h SER 201 N 0.02 0.00 -0.64 4.19 4.64 -0.09 -2.80 113.55 118.88 4r1r h SER 201 Ca -0.09 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.88 4r1r h SER 201 Cb 1.86 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.75 4r1r h SER 201 CO 0.14 0.28 0.21 0.35 -0.87 0.00 0.00 176.83 176.93 4r1r n THR 202 N -3.35 2.86 -2.18 2.95 -2.24 -0.16 -4.96 114.28 107.20 4r1r n THR 202 Ca 0.01 -2.53 -0.11 0.00 -2.27 0.00 0.00 64.05 59.15 4r1r n THR 202 Cb 0.50 -0.45 -0.02 0.00 -2.10 0.00 0.00 70.33 68.27 4r1r n THR 202 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 4r1r n PHE 203 N -1.11 -1.22 0.10 4.78 3.72 -1.06 -4.86 117.46 117.80 4r1r n PHE 203 Ca 0.45 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.70 4r1r n PHE 203 Cb 1.25 -2.55 -0.14 0.00 -0.94 0.00 0.00 39.48 37.11 4r1r n PHE 203 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 4r1r h LYS 204 N 0.00 0.25 -5.39 -1.08 1.57 -0.69 -3.40 116.57 107.82 4r1r h LYS 204 Ca -0.26 -0.42 -0.68 0.00 -1.87 0.00 0.00 60.65 57.42 4r1r h LYS 204 Cb 1.09 0.16 -0.33 0.00 0.08 0.00 0.00 32.23 33.23 4r1r h LYS 204 CO 0.32 1.20 -0.87 0.42 -0.57 0.00 0.00 179.45 179.94 4r1r s ILE 205 N -2.66 2.12 -0.15 1.86 1.01 -1.10 -0.89 121.20 121.39 4r1r s ILE 205 Ca -0.04 -1.00 -0.06 0.00 0.00 0.00 0.00 60.65 59.55 4r1r s ILE 205 Cb 0.07 -1.81 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 4r1r s ILE 205 CO 0.88 0.56 0.05 -0.44 0.00 0.00 0.00 174.94 175.99 4r1r s SER 206 N 0.30 5.58 0.06 3.58 0.01 0.32 -4.47 113.70 119.09 4r1r s SER 206 Ca -0.17 0.13 0.05 0.00 1.31 0.00 0.00 55.95 57.27 4r1r s SER 206 Cb -0.18 -1.86 -0.04 0.00 0.21 0.00 0.00 66.02 64.16 4r1r s SER 206 CO 0.08 0.25 -0.09 -0.76 0.41 0.00 0.00 173.24 173.13 4r1r s LEU 207 N -0.07 3.05 0.79 2.44 1.43 -1.26 -0.31 118.68 124.74 4r1r s LEU 207 Ca 0.06 -0.29 -0.14 0.00 -1.03 0.00 0.00 54.13 52.73 4r1r s LEU 207 Cb -0.12 -1.80 0.03 0.00 0.03 0.00 0.00 46.19 44.33 4r1r s LEU 207 CO 0.01 0.23 0.92 -0.81 0.23 0.00 0.00 176.35 176.93 4r1r n PRO 208 N 1.14 0.24 -0.13 1.29 -0.04 -1.26 -4.77 135.00 131.48 4r1r n PRO 208 Ca -0.14 0.14 -0.04 0.00 -0.04 0.00 0.00 63.50 63.41 4r1r n PRO 208 Cb 0.52 -2.20 0.04 0.00 -0.04 0.00 0.00 33.50 31.82 4r1r n PRO 208 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 4r1r h THR 209 N -0.71 0.79 -0.50 0.52 2.02 -1.98 -2.15 112.91 110.89 4r1r h THR 209 Ca -0.46 -0.07 0.05 0.00 0.77 0.00 0.00 66.41 66.70 4r1r h THR 209 Cb 1.32 0.55 -0.05 0.00 -1.74 0.00 0.00 68.15 68.23 4r1r h THR 209 CO 0.44 0.04 0.22 -0.65 0.37 0.00 0.00 175.52 175.94 4r1r h PRO 210 N 0.22 0.42 -0.14 6.66 0.10 -1.92 -2.20 132.00 135.14 4r1r h PRO 210 Ca 0.20 -0.03 -0.01 0.00 0.10 0.00 0.00 66.00 66.26 4r1r h PRO 210 Cb 0.24 -0.10 -0.01 0.00 0.10 0.00 0.00 31.00 31.24 4r1r h PRO 210 CO -0.26 0.28 0.04 0.82 0.10 0.00 0.00 178.00 178.98 4r1r h ILE 211 N 0.43 1.18 -0.15 4.15 2.04 -1.82 -1.10 117.51 122.24 4r1r h ILE 211 Ca 0.23 -0.56 0.04 0.00 1.00 0.00 0.00 64.86 65.57 4r1r h ILE 211 Cb 0.19 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 4r1r h ILE 211 CO -0.19 0.17 0.11 0.24 0.00 0.00 0.00 178.15 178.48 4r1r h MET 212 N 0.05 0.00 0.00 2.37 2.86 -1.04 -2.05 114.93 117.11 4r1r h MET 212 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 4r1r h MET 212 Cb 0.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.89 4r1r h MET 212 CO -0.00 0.00 -1.95 -1.13 1.06 0.00 0.00 176.91 174.89 4r1r n SER 213 N -4.49 0.14 -0.11 1.22 3.41 -0.86 -4.81 113.62 108.13 4r1r n SER 213 Ca 0.01 -0.02 -0.22 0.00 -0.26 0.00 0.00 58.87 58.37 4r1r n SER 213 Cb 0.24 1.95 -0.07 0.00 -0.26 0.00 0.00 64.21 66.07 4r1r n SER 213 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 4r1r n GLY 214 N 1.30 -0.35 3.58 5.00 0.00 -0.42 -4.84 105.19 109.45 4r1r n GLY 214 Ca -0.04 -0.12 -0.51 0.00 0.00 0.00 0.00 46.02 45.35 4r1r n GLY 214 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 4r1r n VAL 215 N -3.98 0.33 0.00 1.61 0.31 -0.82 0.09 118.33 115.87 4r1r n VAL 215 Ca -0.41 -0.18 0.00 0.00 -0.01 0.00 0.00 64.34 63.74 4r1r n VAL 215 Cb 0.78 -1.66 0.00 0.00 -0.91 0.00 0.00 33.84 32.05 4r1r n VAL 215 CO 0.00 0.00 0.00 -2.11 -1.32 0.00 0.00 176.83 173.40 4r1r n ARG 216 N 7.21 0.00 -2.81 5.55 1.85 -1.26 -4.48 116.66 122.71 4r1r n ARG 216 Ca 0.32 0.00 -0.21 0.00 -1.00 0.00 0.00 57.85 56.97 4r1r n ARG 216 Cb 0.24 0.00 0.03 0.00 -1.05 0.00 0.00 32.46 31.67 4r1r n ARG 216 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 4r1r s THR 217 N -1.73 3.07 0.64 8.89 -4.23 0.11 0.10 115.64 122.50 4r1r s THR 217 Ca 0.00 -0.70 0.39 0.00 -1.18 0.00 0.00 61.69 60.21 4r1r s THR 217 Cb 0.00 -3.12 0.41 0.00 1.34 0.00 0.00 72.50 71.13 4r1r s THR 217 CO 0.00 -0.08 2.33 -0.65 -0.54 0.00 0.00 174.62 175.68 4r1r h PRO 218 N 0.27 0.00 -7.27 3.99 0.11 -1.81 -3.37 132.00 123.91 4r1r h PRO 218 Ca -0.43 0.00 -0.44 0.00 0.11 0.00 0.00 66.00 65.24 4r1r h PRO 218 Cb 1.28 0.00 0.18 0.00 0.11 0.00 0.00 31.00 32.57 4r1r h PRO 218 CO 0.52 0.00 0.11 -0.08 -0.21 0.00 0.00 178.00 178.34 4r1r s THR 219 N -4.32 2.00 0.00 -1.15 -1.32 -1.26 -4.97 115.64 104.61 4r1r s THR 219 Ca -0.05 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.43 4r1r s THR 219 Cb 0.14 -2.32 0.00 0.00 -1.51 0.00 0.00 72.50 68.81 4r1r s THR 219 CO 0.46 0.00 0.66 0.54 -2.21 0.00 0.00 174.62 174.06 4r1r n ARG 220 N -4.52 0.00 -3.20 7.08 5.12 -1.26 -4.92 116.66 114.96 4r1r n ARG 220 Ca 0.04 -0.60 -0.45 0.00 -1.93 0.00 0.00 57.85 54.91 4r1r n ARG 220 Cb 0.56 -0.39 -0.04 0.00 -1.16 0.00 0.00 32.46 31.43 4r1r n ARG 220 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 4r1r s GLN 221 N 0.00 3.10 0.00 5.56 -0.21 -1.26 -1.05 119.66 125.80 4r1r s GLN 221 Ca 0.00 -1.60 0.00 0.00 0.02 0.00 0.00 55.36 53.78 4r1r s GLN 221 Cb 0.00 -4.32 0.00 0.00 1.00 0.00 0.00 33.01 29.69 4r1r s GLN 221 CO 0.00 -1.45 0.73 1.19 -2.12 0.00 0.00 175.29 173.64 4r1r n PHE 222 N 5.70 0.00 -2.62 0.91 3.72 -1.26 -4.97 117.46 118.95 4r1r n PHE 222 Ca -0.08 -0.25 -0.42 0.00 -0.05 0.00 0.00 57.45 56.65 4r1r n PHE 222 Cb 0.42 -0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 38.91 4r1r n PHE 222 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 4r1r s SER 223 N -0.50 7.26 -0.01 4.37 0.01 -1.26 -4.78 113.70 118.78 4r1r s SER 223 Ca 0.00 1.75 0.04 0.00 1.31 0.00 0.00 55.95 59.05 4r1r s SER 223 Cb 0.00 -2.57 -0.07 0.00 0.21 0.00 0.00 66.02 63.59 4r1r s SER 223 CO 0.00 -0.36 0.09 -1.20 0.41 0.00 0.00 173.24 172.18 4r1r n SER 224 N 4.14 3.96 -4.03 2.44 7.64 -1.26 -4.13 113.62 122.38 4r1r n SER 224 Ca 0.07 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.71 4r1r n SER 224 Cb 0.49 1.16 -0.17 0.00 -1.01 0.00 0.00 64.21 64.68 4r1r n SER 224 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 4r1r s VAL 226 N 0.62 -0.09 -0.23 0.00 0.11 -0.48 -2.85 120.40 117.49 4r1r s VAL 226 Ca -0.14 0.25 -0.06 0.00 -2.93 0.00 0.00 61.98 59.11 4r1r s VAL 226 Cb -0.15 -0.17 -0.02 0.00 -1.53 0.00 0.00 36.38 34.51 4r1r s VAL 226 CO 0.04 0.10 0.01 -0.76 -3.33 0.00 0.00 175.10 171.16 4r1r s LEU 227 N 1.40 3.16 -0.11 2.54 1.02 0.14 0.03 118.68 126.87 4r1r s LEU 227 Ca -0.06 -0.30 0.02 0.00 0.02 0.00 0.00 54.13 53.81 4r1r s LEU 227 Cb -0.12 -1.83 -0.01 0.00 0.02 0.00 0.00 46.19 44.25 4r1r s LEU 227 CO -0.04 -0.03 -0.19 -0.63 0.02 0.00 0.00 176.35 175.48 4r1r s ILE 228 N 1.54 2.55 -0.14 -0.59 1.01 0.26 -1.58 121.20 124.26 4r1r s ILE 228 Ca 0.06 -0.85 -0.04 0.00 0.00 0.00 0.00 60.65 59.82 4r1r s ILE 228 Cb -0.15 -2.02 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 4r1r s ILE 228 CO 0.00 0.55 -0.01 -0.70 0.00 0.00 0.00 174.94 174.77 4r1r s GLU 229 N 0.27 3.52 -0.16 2.79 2.12 -1.26 0.14 118.70 126.13 4r1r s GLU 229 Ca -0.13 -0.46 -0.03 0.00 0.36 0.00 0.00 54.97 54.70 4r1r s GLU 229 Cb -0.17 -2.92 -0.03 0.00 0.26 0.00 0.00 34.13 31.28 4r1r s GLU 229 CO 0.07 0.38 -0.04 0.00 -0.54 0.00 0.00 175.26 175.12 4r1r s GLY 231 N 0.46 1.74 -1.27 0.00 0.00 -1.26 -4.41 107.32 102.57 4r1r s GLY 231 Ca -0.04 -1.13 -0.06 0.00 0.00 0.00 0.00 44.72 43.49 4r1r s GLY 231 CO 0.03 -0.44 2.10 1.34 0.00 0.00 0.00 173.10 176.14 4r1r n ASP 232 N -3.59 6.86 -3.62 1.64 2.03 -1.26 -4.48 116.55 114.14 4r1r n ASP 232 Ca 0.14 -3.19 -0.15 0.00 0.52 0.00 0.00 54.79 52.11 4r1r n ASP 232 Cb 0.60 -1.38 -0.07 0.00 -0.72 0.00 0.00 41.12 39.55 4r1r n ASP 232 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 4r1r s SER 233 N 0.25 -0.72 0.28 1.67 1.04 -1.26 -4.93 113.70 110.04 4r1r s SER 233 Ca 0.46 1.28 0.02 0.00 0.48 0.00 0.00 55.95 58.20 4r1r s SER 233 Cb 0.14 1.27 0.63 0.00 0.10 0.00 0.00 66.02 68.17 4r1r s SER 233 CO -0.05 -0.31 1.77 -0.07 0.98 0.00 0.00 173.24 175.56 4r1r h LEU 234 N 4.66 0.65 -0.57 2.42 3.38 -1.98 0.71 115.31 124.58 4r1r h LEU 234 Ca -0.29 0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.78 4r1r h LEU 234 Cb 1.16 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.86 4r1r h LEU 234 CO 0.12 0.25 0.36 0.44 0.09 0.00 0.00 178.44 179.70 4r1r h ASP 235 N 0.70 0.68 -0.39 -0.43 3.32 -1.95 0.31 116.42 118.65 4r1r h ASP 235 Ca 0.52 -0.04 -0.15 0.00 0.02 0.00 0.00 57.03 57.37 4r1r h ASP 235 Cb 0.77 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 4r1r h ASP 235 CO -0.37 0.52 -0.36 -1.28 -1.72 0.00 0.00 179.24 176.03 4r1r h SER 236 N 0.78 1.00 -0.92 6.45 0.87 -1.01 -0.41 113.55 120.29 4r1r h SER 236 Ca 0.21 -0.46 0.03 0.00 -1.23 0.00 0.00 61.79 60.34 4r1r h SER 236 Cb -0.04 -0.28 -0.05 0.00 -0.44 0.00 0.00 62.40 61.58 4r1r h SER 236 CO -0.04 1.25 0.61 0.40 -0.53 0.00 0.00 176.83 178.52 4r1r h ILE 237 N 0.76 1.19 -0.39 2.23 2.04 0.56 0.19 117.51 124.09 4r1r h ILE 237 Ca 0.07 -0.41 -0.15 0.00 1.00 0.00 0.00 64.86 65.36 4r1r h ILE 237 Cb 0.95 -0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 4r1r h ILE 237 CO 0.09 0.22 -0.36 0.78 0.00 0.00 0.00 178.15 178.88 4r1r h ASN 238 N 1.19 0.99 0.13 1.72 2.35 -0.67 -2.20 115.58 119.10 4r1r h ASN 238 Ca 0.36 -0.46 -0.01 0.00 -0.55 0.00 0.00 56.30 55.64 4r1r h ASN 238 Cb -0.04 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.05 4r1r h ASN 238 CO -0.10 1.24 -0.06 0.00 -1.65 0.00 0.00 177.43 176.86 4r1r h ALA 239 N 0.78 -0.18 0.09 -0.83 0.00 -0.09 0.79 119.26 119.83 4r1r h ALA 239 Ca 0.07 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.93 4r1r h ALA 239 Cb 0.95 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 4r1r h ALA 239 CO 0.09 -0.57 -0.48 1.15 0.00 0.00 0.00 179.25 179.44 4r1r h THR 240 N -0.23 0.08 -0.73 0.00 2.02 -0.70 0.37 112.91 113.72 4r1r h THR 240 Ca -0.02 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.29 4r1r h THR 240 Cb 0.18 0.08 -0.09 0.00 -1.74 0.00 0.00 68.15 66.58 4r1r h THR 240 CO 0.03 0.00 0.29 -1.28 0.37 0.00 0.00 175.52 174.93 4r1r h SER 241 N -0.69 0.27 -0.80 4.18 0.87 -1.24 -0.40 113.55 115.74 4r1r h SER 241 Ca 0.01 0.10 -0.04 0.00 -1.23 0.00 0.00 61.79 60.64 4r1r h SER 241 Cb 0.72 0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 62.72 4r1r h SER 241 CO -0.28 0.12 0.34 0.28 -0.53 0.00 0.00 176.83 176.75 4r1r h SER 242 N 0.44 1.08 -0.42 6.23 0.02 -0.14 -2.36 113.55 118.41 4r1r h SER 242 Ca 0.39 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 4r1r h SER 242 Cb 0.57 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 4r1r h SER 242 CO -0.38 0.94 0.22 0.00 -1.14 0.00 0.00 176.83 176.47 4r1r h ALA 243 N 1.18 0.54 -0.68 3.77 0.00 0.33 -2.38 119.26 122.02 4r1r h ALA 243 Ca 0.27 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.09 4r1r h ALA 243 Cb 0.18 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 4r1r h ALA 243 CO -0.03 0.08 0.45 0.82 0.00 0.00 0.00 179.25 180.57 4r1r h ILE 244 N 0.54 1.17 -0.77 0.00 2.04 -0.90 -1.77 117.51 117.82 4r1r h ILE 244 Ca 0.15 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 4r1r h ILE 244 Cb 0.08 0.17 -0.04 0.00 -0.74 0.00 0.00 36.82 36.29 4r1r h ILE 244 CO -0.02 0.17 0.44 0.58 0.00 0.00 0.00 178.15 179.32 4r1r h VAL 245 N 0.92 1.23 -0.04 1.67 2.07 -1.17 0.17 116.25 121.11 4r1r h VAL 245 Ca 0.25 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 4r1r h VAL 245 Cb -0.10 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 29.84 4r1r h VAL 245 CO -0.06 0.24 0.02 0.11 0.02 0.00 0.00 177.57 177.90 4r1r h LYS 246 N 1.06 0.05 -0.47 1.57 1.79 -1.09 -2.96 116.57 116.51 4r1r h LYS 246 Ca 0.27 -0.01 -0.13 0.00 -2.18 0.00 0.00 60.65 58.60 4r1r h LYS 246 Cb 0.00 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.63 4r1r h LYS 246 CO -0.05 0.17 -0.22 1.88 -1.08 0.00 0.00 179.45 180.15 4r1r h TYR 247 N -0.08 1.14 0.00 -1.35 0.05 -1.01 -3.05 116.97 112.66 4r1r h TYR 247 Ca 0.01 -0.28 0.00 0.00 0.05 0.00 0.00 58.73 58.51 4r1r h TYR 247 Cb 0.14 -0.26 0.00 0.00 1.01 0.00 0.00 36.73 37.62 4r1r h TYR 247 CO -0.03 1.11 0.00 -0.39 -1.05 0.00 0.00 178.16 177.80 4r1r h VAL 248 N 0.84 0.00 0.00 -2.88 -1.51 -0.70 -1.20 116.25 110.80 4r1r h VAL 248 Ca 0.11 -0.40 0.00 0.00 -1.23 0.00 0.00 66.70 65.17 4r1r h VAL 248 Cb 0.81 1.28 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 4r1r h VAL 248 CO 0.07 0.00 0.00 0.77 -1.23 0.00 0.00 177.57 177.18 4r1r h SER 249 N 0.00 0.00 -0.34 4.19 4.64 -1.40 -3.08 113.55 117.56 4r1r h SER 249 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 4r1r h SER 249 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 4r1r h SER 249 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 4r1r n GLN 250 N -2.91 2.27 -1.70 4.77 6.02 -0.46 -5.01 117.38 120.36 4r1r n GLN 250 Ca 0.02 -2.02 0.00 0.00 -0.01 0.00 0.00 57.00 54.99 4r1r n GLN 250 Cb 0.34 -1.37 0.00 0.00 1.02 0.00 0.00 30.24 30.24 4r1r n GLN 250 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 4r1r n ARG 251 N 0.96 0.00 -3.61 -1.09 1.74 -1.15 -4.91 116.66 108.60 4r1r n ARG 251 Ca 0.14 0.04 -0.37 0.00 -0.77 0.00 0.00 57.85 56.89 4r1r n ARG 251 Cb 0.47 -3.18 -0.06 0.00 -1.02 0.00 0.00 32.46 28.67 4r1r n ARG 251 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 4r1r s ALA 252 N -2.00 3.73 0.32 7.54 0.00 -1.20 -4.72 121.76 125.44 4r1r s ALA 252 Ca 0.00 -0.37 -0.27 0.00 0.00 0.00 0.00 51.96 51.32 4r1r s ALA 252 Cb 0.00 -2.27 -0.09 0.00 0.00 0.00 0.00 23.12 20.75 4r1r s ALA 252 CO 0.00 0.46 1.07 0.20 0.00 0.00 0.00 175.76 177.48 4r1r s GLY 253 N -0.81 2.94 -0.04 0.00 0.00 0.80 -4.57 107.32 105.63 4r1r s GLY 253 Ca 0.20 0.80 0.06 0.00 0.00 0.00 0.00 44.72 45.78 4r1r s GLY 253 CO 0.09 1.33 -0.23 -0.42 0.00 0.00 0.00 173.10 173.87 4r1r s ILE 254 N -1.36 2.30 -0.18 0.90 -1.09 -0.67 -1.38 121.20 119.72 4r1r s ILE 254 Ca 0.49 -1.00 0.01 0.00 -2.23 0.00 0.00 60.65 57.93 4r1r s ILE 254 Cb -0.27 -1.84 0.02 0.00 -1.58 0.00 0.00 42.46 38.78 4r1r s ILE 254 CO 0.35 0.58 -0.20 -0.83 -1.23 0.00 0.00 174.94 173.61 4r1r s GLY 255 N -0.42 1.39 -0.15 6.18 0.00 0.11 -1.68 107.32 112.75 4r1r s GLY 255 Ca 0.04 -1.20 -0.00 0.00 0.00 0.00 0.00 44.72 43.56 4r1r s GLY 255 CO 0.01 0.25 -0.13 -0.42 0.00 0.00 0.00 173.10 172.81 4r1r s ILE 256 N 1.24 2.90 -0.41 0.90 1.01 0.36 0.92 121.20 128.12 4r1r s ILE 256 Ca 0.04 -0.70 -0.15 0.00 0.00 0.00 0.00 60.65 59.84 4r1r s ILE 256 Cb -0.13 -2.23 0.02 0.00 0.01 0.00 0.00 42.46 40.13 4r1r s ILE 256 CO -0.11 0.51 0.29 0.21 0.00 0.00 0.00 174.94 175.84 4r1r s ASN 257 N 0.66 6.08 -0.21 3.58 2.47 0.12 -0.48 114.94 127.16 4r1r s ASN 257 Ca -0.07 -0.90 0.12 0.00 0.42 0.00 0.00 52.86 52.43 4r1r s ASN 257 Cb -0.15 -2.15 0.42 0.00 -1.45 0.00 0.00 41.25 37.91 4r1r s ASN 257 CO 0.02 -0.44 1.26 0.00 -3.72 0.00 0.00 177.10 174.22 4r1r n ALA 258 N 5.14 3.51 0.22 1.71 0.00 -1.08 -0.17 120.51 129.84 4r1r n ALA 258 Ca -0.11 -3.12 0.08 0.00 0.00 0.00 0.00 53.44 50.29 4r1r n ALA 258 Cb 0.47 -0.44 0.46 0.00 0.00 0.00 0.00 19.45 19.95 4r1r n ALA 258 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 4r1r h GLY 259 N 0.85 0.00 2.00 0.00 0.00 -1.83 -3.15 103.07 100.95 4r1r h GLY 259 Ca 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.29 4r1r h GLY 259 CO 0.08 0.00 -0.40 3.21 0.00 0.00 0.00 176.54 179.43 4r1r h ARG 260 N 0.00 0.00 -6.25 4.80 3.08 -1.87 -3.45 114.38 110.68 4r1r h ARG 260 Ca -0.00 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.37 4r1r h ARG 260 Cb 0.70 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.78 4r1r h ARG 260 CO 0.04 0.40 0.82 -0.89 -1.07 0.00 0.00 179.97 179.27 4r1r n ILE 261 N -3.34 0.25 -1.41 2.04 5.41 -1.19 -4.56 119.36 116.56 4r1r n ILE 261 Ca 0.01 -0.05 -0.34 0.00 1.00 0.00 0.00 62.75 63.38 4r1r n ILE 261 Cb 0.61 -1.32 0.09 0.00 -0.71 0.00 0.00 39.64 38.31 4r1r n ILE 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 4r1r s ARG 262 N 2.56 2.14 0.77 0.38 1.70 -1.26 -4.83 118.95 120.41 4r1r s ARG 262 Ca 0.91 1.66 -0.11 0.00 -0.47 0.00 0.00 55.73 57.72 4r1r s ARG 262 Cb -0.90 -1.84 0.05 0.00 -0.57 0.00 0.00 34.95 31.68 4r1r s ARG 262 CO 0.54 -1.81 1.08 0.00 -1.08 0.00 0.00 175.30 174.03 4r1r s ALA 263 N -2.14 2.34 0.28 7.88 0.00 -1.26 -4.45 121.76 124.42 4r1r s ALA 263 Ca 0.72 -0.04 -0.30 0.00 0.00 0.00 0.00 51.96 52.34 4r1r s ALA 263 Cb -0.27 -3.16 -0.12 0.00 0.00 0.00 0.00 23.12 19.58 4r1r s ALA 263 CO 0.46 -1.61 1.60 -0.11 0.00 0.00 0.00 175.76 176.10 4r1r n LEU 264 N -3.38 4.29 0.00 0.00 7.94 -1.26 -2.30 117.00 122.29 4r1r n LEU 264 Ca 0.07 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.11 4r1r n LEU 264 Cb 0.55 -1.59 0.00 0.00 0.53 0.00 0.00 43.42 42.91 4r1r n LEU 264 CO 0.56 0.13 0.00 0.61 -1.11 0.00 0.00 177.39 177.58 4r1r n GLY 265 N 2.32 3.10 3.52 -3.96 0.00 -1.07 -4.95 105.19 104.14 4r1r n GLY 265 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 4r1r n GLY 265 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 4r1r n SER 266 N 0.11 -0.44 -4.77 1.61 7.64 -0.97 -4.43 113.62 112.37 4r1r n SER 266 Ca 0.00 0.75 -0.39 0.00 1.01 0.00 0.00 58.87 60.25 4r1r n SER 266 Cb 0.00 -1.25 -0.04 0.00 -1.01 0.00 0.00 64.21 61.92 4r1r n SER 266 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 4r1r s PRO 267 N -2.34 4.34 -0.13 1.43 0.04 -1.26 0.11 135.00 137.19 4r1r s PRO 267 Ca 0.71 1.73 0.01 0.00 0.04 0.00 0.00 61.00 63.49 4r1r s PRO 267 Cb -0.43 -2.85 0.02 0.00 0.04 0.00 0.00 34.50 31.28 4r1r s PRO 267 CO 0.52 -0.04 -0.14 0.42 0.04 0.00 0.00 177.00 177.80 4r1r s ILE 268 N -1.38 1.48 0.00 0.56 1.01 0.23 -4.69 121.20 118.41 4r1r s ILE 268 Ca 0.52 -0.60 0.00 0.00 0.00 0.00 0.00 60.65 60.57 4r1r s ILE 268 Cb -0.29 -1.38 0.00 0.00 0.01 0.00 0.00 42.46 40.80 4r1r s ILE 268 CO 0.36 0.44 0.00 -1.14 0.00 0.00 0.00 174.94 174.60 4r1r n ARG 269 N 4.53 0.00 0.00 2.79 0.63 -1.26 -1.89 116.66 121.46 4r1r n ARG 269 Ca -0.17 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.76 4r1r n ARG 269 Cb 0.51 -2.33 0.00 0.00 0.45 0.00 0.00 32.46 31.09 4r1r n ARG 269 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 4r1r n GLY 270 N -2.00 0.92 0.41 5.14 0.00 -1.26 -4.75 105.19 103.65 4r1r n GLY 270 Ca 0.00 -0.38 0.03 0.00 0.00 0.00 0.00 46.02 45.67 4r1r n GLY 270 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4r1r n GLY 271 N 0.00 1.85 0.03 -0.02 0.00 -1.26 -4.73 105.19 101.06 4r1r n GLY 271 Ca 0.00 -0.38 0.12 0.00 0.00 0.00 0.00 46.02 45.76 4r1r n GLY 271 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 4r1r n GLU 272 N -0.41 0.19 -3.71 1.61 -0.58 -1.24 -4.92 120.64 111.58 4r1r n GLU 272 Ca 0.05 0.03 -0.12 0.00 -0.42 0.00 0.00 57.16 56.70 4r1r n GLU 272 Cb 0.70 -1.59 -0.07 0.00 -0.57 0.00 0.00 31.44 29.91 4r1r n GLU 272 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 4r1r s ALA 273 N -3.11 -0.85 -0.24 0.62 0.00 -0.79 -5.00 121.76 112.38 4r1r s ALA 273 Ca 0.07 0.16 -0.02 0.00 0.00 0.00 0.00 51.96 52.16 4r1r s ALA 273 Cb 0.15 0.34 0.08 0.00 0.00 0.00 0.00 23.12 23.68 4r1r s ALA 273 CO 0.74 -0.44 0.07 -0.06 0.00 0.00 0.00 175.76 176.07 4r1r s PHE 274 N -2.52 1.08 0.12 0.00 0.40 -1.26 0.75 117.98 116.55 4r1r s PHE 274 Ca -0.05 -1.09 -0.05 0.00 -0.60 0.00 0.00 56.93 55.13 4r1r s PHE 274 Cb -0.01 -1.19 -0.04 0.00 0.51 0.00 0.00 43.02 42.29 4r1r s PHE 274 CO -0.03 -0.72 0.00 1.58 0.70 0.00 0.00 175.22 176.75 4r1r n HIS 275 N 5.03 -0.66 0.77 0.36 -0.00 0.31 -4.64 115.22 116.39 4r1r n HIS 275 Ca -0.06 0.15 0.11 0.00 0.46 0.00 0.00 57.72 58.38 4r1r n HIS 275 Cb 0.45 -0.48 0.03 0.00 -0.12 0.00 0.00 29.99 29.88 4r1r n HIS 275 CO 0.00 0.00 0.00 2.41 0.46 0.00 0.00 176.34 179.21 4r1r n THR 276 N -0.33 0.08 0.00 3.57 -1.04 -1.26 -2.61 114.28 112.68 4r1r n THR 276 Ca 0.03 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 61.91 4r1r n THR 276 Cb 0.12 0.42 0.00 0.00 -1.82 0.00 0.00 70.33 69.05 4r1r n THR 276 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 4r1r n GLY 277 N 1.43 -1.92 0.09 3.41 0.00 -1.26 -4.77 105.19 102.17 4r1r n GLY 277 Ca 0.03 -2.21 -0.10 0.00 0.00 0.00 0.00 46.02 43.74 4r1r n GLY 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4r1r h ILE 279 N 0.00 0.07 -0.67 0.00 1.08 -1.97 0.77 117.51 116.80 4r1r h ILE 279 Ca -0.37 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.24 4r1r h ILE 279 Cb 2.08 0.07 -0.12 0.00 -3.07 0.00 0.00 36.82 35.78 4r1r h ILE 279 CO 0.06 0.00 -0.08 -0.65 -0.69 0.00 0.00 178.15 176.79 4r1r h PRO 280 N -0.28 0.05 -0.38 2.37 0.11 -1.86 0.20 132.00 132.21 4r1r h PRO 280 Ca 0.15 -0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.16 4r1r h PRO 280 Cb 0.57 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 4r1r h PRO 280 CO -0.65 0.03 -0.13 0.74 -0.21 0.00 0.00 178.00 177.78 4r1r h PHE 281 N 0.05 0.87 -0.61 0.65 0.04 -1.00 -2.29 116.94 114.65 4r1r h PHE 281 Ca 0.34 -0.20 0.11 0.00 2.80 0.00 0.00 57.97 61.02 4r1r h PHE 281 Cb 0.55 -0.21 -0.08 0.00 2.20 0.00 0.00 35.95 38.42 4r1r h PHE 281 CO -0.46 0.92 0.17 1.88 -0.60 0.00 0.00 178.31 180.23 4r1r h TYR 282 N 0.56 0.29 -0.13 -0.55 -1.99 0.31 0.68 116.97 116.15 4r1r h TYR 282 Ca 0.09 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.85 4r1r h TYR 282 Cb 0.67 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 39.35 4r1r h TYR 282 CO 0.05 0.02 0.05 0.87 -0.00 0.00 0.00 178.16 179.15 4r1r h LYS 283 N 0.32 0.17 -0.24 4.88 1.57 -0.50 -0.31 116.57 122.45 4r1r h LYS 283 Ca 0.32 -0.01 -0.16 0.00 -1.87 0.00 0.00 60.65 58.92 4r1r h LYS 283 Cb 0.45 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 4r1r h LYS 283 CO -0.37 0.14 -0.50 1.25 -0.57 0.00 0.00 179.45 179.41 4r1r h HIS 284 N 0.17 0.81 -0.49 -1.35 2.76 0.83 -2.49 115.15 115.40 4r1r h HIS 284 Ca 0.04 -0.27 -0.07 0.00 -2.20 0.00 0.00 60.37 57.88 4r1r h HIS 284 Cb 0.04 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 28.82 4r1r h HIS 284 CO 0.00 1.02 0.05 0.74 -1.30 0.00 0.00 177.93 178.44 4r1r h PHE 285 N 0.52 0.90 -0.74 5.26 0.04 0.69 -1.96 116.94 121.65 4r1r h PHE 285 Ca 0.02 -0.14 0.07 0.00 2.80 0.00 0.00 57.97 60.72 4r1r h PHE 285 Cb 1.05 -0.24 -0.06 0.00 2.20 0.00 0.00 35.95 38.90 4r1r h PHE 285 CO 0.05 0.84 0.43 0.37 -0.60 0.00 0.00 178.31 179.40 4r1r h GLN 286 N 0.70 0.75 -0.04 1.51 4.15 -1.05 0.16 115.11 121.29 4r1r h GLN 286 Ca 0.14 -0.05 -0.12 0.00 0.77 0.00 0.00 58.65 59.40 4r1r h GLN 286 Cb 0.45 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 4r1r h GLN 286 CO 0.02 0.50 -0.53 1.79 -1.93 0.00 0.00 178.83 178.67 4r1r h THR 287 N 0.77 1.37 -0.25 2.39 1.35 -1.27 -1.06 112.91 116.22 4r1r h THR 287 Ca 0.34 -1.82 -0.02 0.00 -0.55 0.00 0.00 66.41 64.36 4r1r h THR 287 Cb 0.22 1.93 -0.01 0.00 -1.73 0.00 0.00 68.15 68.56 4r1r h THR 287 CO -0.19 0.53 0.09 0.00 -0.25 0.00 0.00 175.52 175.69 4r1r h ALA 288 N 1.36 0.32 -0.85 6.62 0.00 -0.27 -0.17 119.26 126.27 4r1r h ALA 288 Ca -0.00 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.81 4r1r h ALA 288 Cb 0.97 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 4r1r h ALA 288 CO 0.08 -0.07 0.55 0.28 0.00 0.00 0.00 179.25 180.09 4r1r h VAL 289 N 0.24 1.14 -0.41 0.00 2.07 -0.41 -2.23 116.25 116.64 4r1r h VAL 289 Ca 0.08 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.23 4r1r h VAL 289 Cb 0.21 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 29.96 4r1r h VAL 289 CO -0.00 0.20 0.00 0.29 0.02 0.00 0.00 177.57 178.07 4r1r n LYS 290 N -4.55 2.03 0.17 1.57 4.01 -0.43 -4.45 118.16 116.51 4r1r n LYS 290 Ca 0.10 -1.59 0.13 0.00 -0.51 0.00 0.00 58.31 56.45 4r1r n LYS 290 Cb 0.08 -1.36 0.69 0.00 -0.51 0.00 0.00 35.03 33.92 4r1r n LYS 290 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 4r1r h SER 291 N 2.68 0.00 -2.22 4.39 4.64 -0.37 -2.90 113.55 119.77 4r1r h SER 291 Ca 0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.72 4r1r h SER 291 Cb 0.61 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.29 4r1r h SER 291 CO 0.00 0.00 -0.55 0.00 -0.87 0.00 0.00 176.83 175.41 4r1r n ALA 292 N -2.55 4.81 -2.62 5.18 0.00 -1.26 -5.03 120.51 119.03 4r1r n ALA 292 Ca 0.02 -4.67 -0.22 0.00 0.00 0.00 0.00 53.44 48.57 4r1r n ALA 292 Cb 0.28 -0.80 -0.15 0.00 0.00 0.00 0.00 19.45 18.78 4r1r n ALA 292 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 4r1r s SER 293 N -3.36 1.54 -0.49 0.00 0.01 -1.09 -4.88 113.70 105.42 4r1r s SER 293 Ca 0.48 -0.24 -0.27 0.00 1.31 0.00 0.00 55.95 57.24 4r1r s SER 293 Cb 0.29 -0.19 -0.05 0.00 0.21 0.00 0.00 66.02 66.28 4r1r s SER 293 CO -0.15 0.16 2.18 -1.10 0.41 0.00 0.00 173.24 174.74 4r1r s GLN 294 N -0.27 2.44 0.00 12.44 -1.52 -1.25 -2.91 119.66 128.59 4r1r s GLN 294 Ca 0.04 1.23 0.00 0.00 -1.95 0.00 0.00 55.36 54.68 4r1r s GLN 294 Cb -0.05 -4.48 0.00 0.00 -0.22 0.00 0.00 33.01 28.26 4r1r s GLN 294 CO -0.00 -2.90 0.00 0.41 -0.25 0.00 0.00 175.29 172.54 4r1r n GLY 295 N 5.85 2.72 0.00 3.09 0.00 -1.26 -4.25 105.19 111.34 4r1r n GLY 295 Ca 0.30 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.67 4r1r n GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4r1r n GLY 296 N 0.00 0.51 0.47 -0.02 0.00 -1.15 -5.04 105.19 99.96 4r1r n GLY 296 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 4r1r n GLY 296 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 4r1r n VAL 297 N 0.00 0.00 -2.41 1.61 0.31 -1.26 -4.96 118.33 111.61 4r1r n VAL 297 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.90 4r1r n VAL 297 Cb 0.00 -0.16 -0.02 0.00 -0.91 0.00 0.00 33.84 32.75 4r1r n VAL 297 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 4r1r s ARG 298 N -1.29 4.21 0.13 5.55 1.81 -1.26 -4.89 118.95 123.21 4r1r s ARG 298 Ca 0.00 1.64 0.00 0.00 -1.72 0.00 0.00 55.73 55.65 4r1r s ARG 298 Cb 0.00 -3.78 0.00 0.00 -0.45 0.00 0.00 34.95 30.72 4r1r s ARG 298 CO 0.00 -0.74 0.00 0.41 -0.68 0.00 0.00 175.30 174.29 4r1r n GLY 299 N 3.68 -2.01 2.26 -3.53 0.00 -1.26 -3.96 105.19 100.36 4r1r n GLY 299 Ca 0.14 -1.40 -0.03 0.00 0.00 0.00 0.00 46.02 44.74 4r1r n GLY 299 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4r1r n GLY 300 N -2.81 -4.29 3.44 -0.02 0.00 -1.26 -4.80 105.19 95.46 4r1r n GLY 300 Ca -0.01 0.79 -0.24 0.00 0.00 0.00 0.00 46.02 46.56 4r1r n GLY 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4r1r s ALA 301 N -0.68 2.61 -0.02 4.61 0.00 -1.26 -4.61 121.76 122.41 4r1r s ALA 301 Ca -0.13 -1.78 -0.25 0.00 0.00 0.00 0.00 51.96 49.81 4r1r s ALA 301 Cb 0.01 -0.27 0.05 0.00 0.00 0.00 0.00 23.12 22.91 4r1r s ALA 301 CO 0.53 0.31 0.54 0.00 0.00 0.00 0.00 175.76 177.14 4r1r s ALA 302 N -2.25 -1.39 -0.10 0.00 0.00 -1.26 -1.68 121.76 115.08 4r1r s ALA 302 Ca 0.26 0.89 0.02 0.00 0.00 0.00 0.00 51.96 53.13 4r1r s ALA 302 Cb -0.06 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.16 4r1r s ALA 302 CO 0.13 -0.36 -0.16 0.99 0.00 0.00 0.00 175.76 176.36 4r1r s THR 303 N -1.42 1.50 -0.19 0.00 2.01 -0.68 -2.48 115.64 114.38 4r1r s THR 303 Ca -0.11 -0.65 -0.06 0.00 0.31 0.00 0.00 61.69 61.17 4r1r s THR 303 Cb -0.02 -1.36 -0.03 0.00 0.01 0.00 0.00 72.50 71.10 4r1r s THR 303 CO 0.06 0.44 0.03 -0.22 -0.69 0.00 0.00 174.62 174.25 4r1r s LEU 304 N 0.89 3.51 0.07 4.42 0.20 -0.93 -0.49 118.68 126.35 4r1r s LEU 304 Ca -0.09 -0.08 0.01 0.00 0.69 0.00 0.00 54.13 54.67 4r1r s LEU 304 Cb -0.15 -1.89 -0.04 0.00 -0.43 0.00 0.00 46.19 43.68 4r1r s LEU 304 CO -0.00 0.11 0.19 -0.36 -0.29 0.00 0.00 176.35 176.00 4r1r s PHE 305 N 0.74 3.46 -0.04 5.38 0.40 0.37 -1.05 117.98 127.24 4r1r s PHE 305 Ca 0.02 0.21 -0.29 0.00 -0.60 0.00 0.00 56.93 56.26 4r1r s PHE 305 Cb -0.14 -1.73 0.07 0.00 0.51 0.00 0.00 43.02 41.73 4r1r s PHE 305 CO 0.02 0.57 0.65 1.52 0.70 0.00 0.00 175.22 178.68 4r1r s TYR 306 N -1.51 -0.62 0.69 0.36 -0.85 -1.05 -2.63 117.35 111.74 4r1r s TYR 306 Ca 0.34 1.04 -0.16 0.00 -0.52 0.00 0.00 57.07 57.77 4r1r s TYR 306 Cb -0.13 0.39 0.02 0.00 0.38 0.00 0.00 41.96 42.62 4r1r s TYR 306 CO 0.27 -0.60 1.18 -1.25 -1.52 0.00 0.00 175.55 173.64 4r1r s PRO 307 N -1.25 2.44 0.47 -3.49 0.04 -1.26 -1.25 135.00 130.70 4r1r s PRO 307 Ca -0.11 1.68 0.27 0.00 0.04 0.00 0.00 61.00 62.88 4r1r s PRO 307 Cb -0.00 -1.88 0.77 0.00 0.04 0.00 0.00 34.50 33.42 4r1r s PRO 307 CO 0.09 -1.58 1.76 1.98 0.04 0.00 0.00 177.00 179.29 4r1r h MET 308 N -0.01 0.00 -0.08 4.56 4.05 -1.78 -3.14 114.93 118.53 4r1r h MET 308 Ca -0.48 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.94 4r1r h MET 308 Cb 1.28 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.08 4r1r h MET 308 CO 0.52 0.06 0.00 -2.67 0.23 0.00 0.00 176.91 175.05 4r1r n TRP 309 N -3.14 0.08 -1.56 1.39 4.27 -1.26 -4.84 117.44 112.39 4r1r n TRP 309 Ca 0.02 -0.04 -0.40 0.00 -3.89 0.00 0.00 57.50 53.19 4r1r n TRP 309 Cb 0.45 0.00 0.03 0.00 -1.36 0.00 0.00 31.31 30.43 4r1r n TRP 309 CO 0.00 0.00 0.00 1.58 -2.29 0.00 0.00 177.69 176.98 4r1r n HIS 310 N 0.55 0.42 0.24 -2.67 -0.00 -1.19 -0.33 115.22 112.24 4r1r n HIS 310 Ca 0.17 0.51 0.09 0.00 0.46 0.00 0.00 57.72 58.95 4r1r n HIS 310 Cb 0.42 -2.11 0.62 0.00 -0.12 0.00 0.00 29.99 28.80 4r1r n HIS 310 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 4r1r h LEU 311 N 0.88 0.00 -3.49 0.27 5.85 -1.68 -2.23 115.31 114.91 4r1r h LEU 311 Ca -0.45 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 4r1r h LEU 311 Cb 1.37 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.39 4r1r h LEU 311 CO 0.52 0.15 0.01 -0.62 -0.34 0.00 0.00 178.44 178.16 4r1r n GLU 312 N -3.97 4.78 -0.31 1.25 1.02 -1.26 -4.68 120.64 117.48 4r1r n GLU 312 Ca -0.02 -3.06 0.06 0.00 -0.02 0.00 0.00 57.16 54.12 4r1r n GLU 312 Cb 0.24 -2.25 0.27 0.00 -0.02 0.00 0.00 31.44 29.68 4r1r n GLU 312 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 4r1r h VAL 313 N 3.85 0.99 0.00 2.62 3.04 -1.72 -0.53 116.25 124.50 4r1r h VAL 313 Ca 0.01 -0.33 -0.05 0.00 -1.01 0.00 0.00 66.70 65.31 4r1r h VAL 313 Cb 1.95 -0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 31.18 4r1r h VAL 313 CO 0.49 0.17 -0.26 -0.33 -1.01 0.00 0.00 177.57 176.63 4r1r h GLU 314 N 0.95 0.00 0.00 4.17 5.08 -1.85 0.80 114.58 123.73 4r1r h GLU 314 Ca 0.42 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.54 4r1r h GLU 314 Cb 0.36 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 4r1r h GLU 314 CO -0.18 0.26 -1.29 0.77 -1.00 0.00 0.00 179.01 177.57 4r1r h SER 315 N 0.00 0.00 -0.20 1.42 0.02 -1.72 -3.33 113.55 109.74 4r1r h SER 315 Ca -0.00 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.81 4r1r h SER 315 Cb 0.47 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.01 4r1r h SER 315 CO 0.03 0.98 -0.40 -0.07 -1.14 0.00 0.00 176.83 176.24 4r1r h LEU 316 N 0.00 0.70 -2.06 5.07 3.38 -0.65 -3.27 115.31 118.49 4r1r h LEU 316 Ca -0.13 -0.55 0.09 0.00 0.09 0.00 0.00 57.88 57.38 4r1r h LEU 316 Cb 1.86 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 42.39 4r1r h LEU 316 CO 0.11 1.12 0.24 -0.07 0.09 0.00 0.00 178.44 179.92 4r1r h LEU 317 N 0.31 0.00 -3.43 1.67 4.07 -0.96 -2.05 115.31 114.93 4r1r h LEU 317 Ca 0.01 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.90 4r1r h LEU 317 Cb 1.00 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.69 4r1r h LEU 317 CO 0.09 0.00 0.05 1.33 -1.08 0.00 0.00 178.44 178.83 4r1r n VAL 318 N -4.26 2.55 0.22 1.22 0.24 -1.23 -4.65 118.33 112.41 4r1r n VAL 318 Ca 0.04 -1.86 0.05 0.00 -2.04 0.00 0.00 64.34 60.54 4r1r n VAL 318 Cb 0.40 -0.29 0.49 0.00 -1.47 0.00 0.00 33.84 32.97 4r1r n VAL 318 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 4r1r h LEU 319 N 2.27 0.00 -1.82 1.34 3.38 -1.44 -2.17 115.31 116.87 4r1r h LEU 319 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 4r1r h LEU 319 Cb 1.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.51 4r1r h LEU 319 CO 0.40 0.20 0.00 2.29 0.09 0.00 0.00 178.44 181.42 4r1r n LYS 320 N -4.31 2.23 -1.63 1.13 2.85 -1.26 -2.55 118.16 114.63 4r1r n LYS 320 Ca -0.02 -1.81 -0.50 0.00 -1.05 0.00 0.00 58.31 54.93 4r1r n LYS 320 Cb 0.26 -1.47 -0.05 0.00 -0.65 0.00 0.00 35.03 33.11 4r1r n LYS 320 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 4r1r n ASN 321 N 1.13 2.27 -0.40 -5.58 2.85 -0.82 -4.82 115.26 109.89 4r1r n ASN 321 Ca 0.16 1.10 0.01 0.00 -0.11 0.00 0.00 54.58 55.74 4r1r n ASN 321 Cb 0.54 -1.28 0.04 0.00 1.24 0.00 0.00 39.78 40.32 4r1r n ASN 321 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 4r1r n ASN 322 N 3.09 0.98 -3.76 1.20 6.94 -1.26 -4.60 115.26 117.85 4r1r n ASN 322 Ca 0.18 -2.05 -0.30 0.00 -0.02 0.00 0.00 54.58 52.39 4r1r n ASN 322 Cb 0.23 -0.28 -0.15 0.00 -2.36 0.00 0.00 39.78 37.22 4r1r n ASN 322 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 4r1r s ARG 323 N -1.56 0.79 0.00 -3.83 3.52 -1.26 -5.12 118.95 111.49 4r1r s ARG 323 Ca 0.06 -1.07 0.00 0.00 -0.13 0.00 0.00 55.73 54.59 4r1r s ARG 323 Cb 0.04 -2.09 0.00 0.00 -1.56 0.00 0.00 34.95 31.33 4r1r s ARG 323 CO 0.03 -0.94 0.00 0.41 -0.81 0.00 0.00 175.30 173.98 4r1r n GLY 324 N 4.82 1.01 3.75 8.12 0.00 -1.26 -5.14 105.19 116.49 4r1r n GLY 324 Ca -0.03 -0.95 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 4r1r n GLY 324 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4r1r s VAL 325 N -2.00 2.89 0.41 1.61 0.11 -1.26 -4.92 120.40 117.24 4r1r s VAL 325 Ca 0.00 0.80 0.16 0.00 -2.93 0.00 0.00 61.98 60.01 4r1r s VAL 325 Cb 0.00 -3.51 0.36 0.00 -1.53 0.00 0.00 36.38 31.70 4r1r s VAL 325 CO 0.00 0.15 1.88 -0.08 -3.33 0.00 0.00 175.10 173.72 4r1r h GLU 326 N 4.44 0.44 0.00 1.54 4.57 -2.01 -1.61 114.58 121.96 4r1r h GLU 326 Ca -0.47 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 4r1r h GLU 326 Cb 1.22 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.71 4r1r h GLU 326 CO 0.72 0.29 0.00 0.41 -1.18 0.00 0.00 179.01 179.25 4r1r n GLY 327 N -1.50 -0.80 0.28 1.92 0.00 -1.26 -2.70 105.19 101.12 4r1r n GLY 327 Ca 0.18 -0.09 0.07 0.00 0.00 0.00 0.00 46.02 46.17 4r1r n GLY 327 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 4r1r n ASN 328 N -1.20 1.62 -3.90 1.61 5.03 -0.61 -4.95 115.26 112.85 4r1r n ASN 328 Ca 0.10 -2.83 -0.22 0.00 0.87 0.00 0.00 54.58 52.50 4r1r n ASN 328 Cb 0.12 -0.37 -0.17 0.00 -1.02 0.00 0.00 39.78 38.34 4r1r n ASN 328 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 4r1r s ARG 329 N -2.03 1.07 -0.67 3.52 1.81 -1.10 -4.79 118.95 116.76 4r1r s ARG 329 Ca 0.24 -0.16 0.05 0.00 -1.72 0.00 0.00 55.73 54.15 4r1r s ARG 329 Cb 0.22 -1.07 0.21 0.00 -0.45 0.00 0.00 34.95 33.85 4r1r s ARG 329 CO 0.01 -0.12 0.62 0.28 -0.68 0.00 0.00 175.30 175.41 4r1r n VAL 330 N 4.28 1.95 0.19 3.52 0.31 -1.05 -4.96 118.33 122.56 4r1r n VAL 330 Ca -0.20 -5.02 0.04 0.00 -0.01 0.00 0.00 64.34 59.15 4r1r n VAL 330 Cb 0.51 -2.14 0.37 0.00 -0.91 0.00 0.00 33.84 31.67 4r1r n VAL 330 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 4r1r h ARG 331 N 4.80 0.00 -1.25 5.55 3.08 -1.89 -3.37 114.38 121.30 4r1r h ARG 331 Ca 0.17 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.61 4r1r h ARG 331 Cb 0.71 0.00 -0.25 0.00 0.08 0.00 0.00 29.97 30.51 4r1r h ARG 331 CO 0.77 0.37 0.79 0.72 -1.07 0.00 0.00 179.97 181.55 4r1r n HIS 332 N -3.80 2.81 -3.76 3.04 8.25 -1.26 -4.82 115.22 115.67 4r1r n HIS 332 Ca -0.01 -2.71 -0.13 0.00 -0.26 0.00 0.00 57.72 54.61 4r1r n HIS 332 Cb 0.45 -1.33 -0.11 0.00 1.12 0.00 0.00 29.99 30.12 4r1r n HIS 332 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 4r1r s MET 333 N -3.37 0.40 0.43 -0.41 -1.94 -1.26 -4.87 119.30 108.28 4r1r s MET 333 Ca 0.57 0.40 -0.03 0.00 -1.71 0.00 0.00 55.69 54.92 4r1r s MET 333 Cb 0.44 0.19 -0.03 0.00 2.01 0.00 0.00 34.83 37.44 4r1r s MET 333 CO -0.06 -0.05 0.69 -0.51 -0.01 0.00 0.00 175.02 175.08 4r1r s ASP 334 N 0.06 6.25 0.12 3.03 1.01 -1.03 -4.87 116.67 121.24 4r1r s ASP 334 Ca -0.01 0.72 0.08 0.00 0.71 0.00 0.00 52.55 54.05 4r1r s ASP 334 Cb -0.02 -2.13 -0.04 0.00 1.01 0.00 0.00 42.92 41.73 4r1r s ASP 334 CO 0.01 -0.48 -0.19 -0.31 0.21 0.00 0.00 175.17 174.40 4r1r s TYR 335 N -2.58 1.74 -0.21 4.23 2.02 -1.19 -2.20 117.35 119.17 4r1r s TYR 335 Ca 0.45 -0.45 0.01 0.00 -0.37 0.00 0.00 57.07 56.71 4r1r s TYR 335 Cb -0.10 -0.92 0.05 0.00 -0.40 0.00 0.00 41.96 40.59 4r1r s TYR 335 CO 0.41 0.23 -0.08 0.20 -1.57 0.00 0.00 175.55 174.75 4r1r s GLY 336 N -2.18 1.23 0.07 0.71 0.00 -0.21 -0.19 107.32 106.75 4r1r s GLY 336 Ca 0.09 -1.21 -0.27 0.00 0.00 0.00 0.00 44.72 43.33 4r1r s GLY 336 CO 0.05 0.82 0.86 0.14 0.00 0.00 0.00 173.10 174.97 4r1r s VAL 337 N 1.43 4.63 -0.31 1.40 1.01 0.35 -2.52 120.40 126.39 4r1r s VAL 337 Ca -0.03 1.84 -0.11 0.00 0.00 0.00 0.00 61.98 63.69 4r1r s VAL 337 Cb -0.17 -4.21 -0.02 0.00 0.00 0.00 0.00 36.38 31.97 4r1r s VAL 337 CO -0.07 0.34 0.18 -1.10 0.00 0.00 0.00 175.10 174.44 4r1r s GLN 338 N 0.00 3.57 0.25 2.72 -0.21 -0.38 0.51 119.66 126.12 4r1r s GLN 338 Ca 0.43 -0.57 0.12 0.00 0.02 0.00 0.00 55.36 55.35 4r1r s GLN 338 Cb -0.22 -3.64 -0.05 0.00 1.00 0.00 0.00 33.01 30.11 4r1r s GLN 338 CO 0.26 -0.34 -0.21 0.42 -2.12 0.00 0.00 175.29 173.30 4r1r s ILE 339 N 1.68 2.47 0.27 1.08 1.01 0.12 -2.00 121.20 125.85 4r1r s ILE 339 Ca 0.06 -2.25 0.03 0.00 0.00 0.00 0.00 60.65 58.49 4r1r s ILE 339 Cb -0.17 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 4r1r s ILE 339 CO 0.08 -0.29 0.18 0.54 0.00 0.00 0.00 174.94 175.45 4r1r s ASN 340 N -3.20 1.08 0.23 3.58 4.22 -1.26 -0.08 114.94 119.50 4r1r s ASN 340 Ca 0.27 -1.55 -0.07 0.00 -2.14 0.00 0.00 52.86 49.37 4r1r s ASN 340 Cb -0.06 0.43 0.40 0.00 1.28 0.00 0.00 41.25 43.29 4r1r s ASN 340 CO 0.13 -0.92 1.70 0.50 -2.04 0.00 0.00 177.10 176.48 4r1r h LYS 341 N 2.34 0.30 -0.47 3.55 3.64 -1.99 -1.98 116.57 121.96 4r1r h LYS 341 Ca -0.32 -0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.13 4r1r h LYS 341 Cb 1.24 -0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 32.92 4r1r h LYS 341 CO 0.48 0.20 0.04 1.25 -2.27 0.00 0.00 179.45 179.15 4r1r h LEU 342 N 0.31 -0.11 -0.35 5.20 5.85 -1.97 -0.04 115.31 124.20 4r1r h LEU 342 Ca 0.38 0.10 0.04 0.00 0.84 0.00 0.00 57.88 59.24 4r1r h LEU 342 Cb 0.60 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.75 4r1r h LEU 342 CO -0.44 -0.02 0.11 0.24 -0.34 0.00 0.00 178.44 177.98 4r1r h MET 343 N 0.16 0.25 -0.68 1.25 2.86 -1.78 -1.55 114.93 115.44 4r1r h MET 343 Ca 0.24 -0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.88 4r1r h MET 343 Cb 0.34 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.91 4r1r h MET 343 CO -0.36 0.16 0.44 1.88 1.06 0.00 0.00 176.91 180.10 4r1r h TYR 344 N 0.25 0.84 -0.87 -0.22 0.05 -1.17 -2.47 116.97 113.38 4r1r h TYR 344 Ca 0.16 0.02 0.02 0.00 0.05 0.00 0.00 58.73 58.98 4r1r h TYR 344 Cb 0.14 -0.28 -0.05 0.00 1.01 0.00 0.00 36.73 37.55 4r1r h TYR 344 CO -0.15 0.51 0.57 1.15 -1.05 0.00 0.00 178.16 179.20 4r1r h THR 345 N 0.89 1.20 -0.88 -2.88 2.02 -0.30 -1.03 112.91 111.94 4r1r h THR 345 Ca 0.26 -0.39 0.02 0.00 0.77 0.00 0.00 66.41 67.06 4r1r h THR 345 Cb -0.07 -0.05 -0.05 0.00 -1.74 0.00 0.00 68.15 66.24 4r1r h THR 345 CO -0.07 0.21 0.58 0.03 0.37 0.00 0.00 175.52 176.64 4r1r h ARG 346 N 1.15 1.13 0.25 6.66 2.47 -0.85 -1.01 114.38 124.17 4r1r h ARG 346 Ca 0.33 -0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 58.97 4r1r h ARG 346 Cb -0.09 -0.25 0.00 0.00 -1.65 0.00 0.00 29.97 27.98 4r1r h ARG 346 CO -0.08 0.74 -0.13 1.25 0.56 0.00 0.00 179.97 182.32 4r1r h LEU 347 N 1.16 -0.31 -0.88 3.04 5.85 -0.95 -0.67 115.31 122.55 4r1r h LEU 347 Ca 0.34 0.01 0.03 0.00 0.84 0.00 0.00 57.88 59.10 4r1r h LEU 347 Cb -0.07 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 40.99 4r1r h LEU 347 CO -0.09 -0.21 0.57 -0.07 -0.34 0.00 0.00 178.44 178.29 4r1r h LEU 348 N -0.35 0.95 -0.01 2.25 3.38 -0.90 -1.42 115.31 119.22 4r1r h LEU 348 Ca -0.03 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.93 4r1r h LEU 348 Cb 0.27 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.81 4r1r h LEU 348 CO 0.05 0.66 -0.02 0.29 0.09 0.00 0.00 178.44 179.50 4r1r n LYS 349 N -4.53 0.16 -2.40 1.13 5.02 -0.42 -4.92 118.16 112.20 4r1r n LYS 349 Ca 0.11 -0.01 -0.09 0.00 -2.02 0.00 0.00 58.31 56.30 4r1r n LYS 349 Cb 0.08 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.60 4r1r n LYS 349 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 4r1r n GLY 350 N 1.42 0.09 0.87 0.72 0.00 -0.42 -5.04 105.19 102.84 4r1r n GLY 350 Ca 0.09 -0.44 -0.05 0.00 0.00 0.00 0.00 46.02 45.63 4r1r n GLY 350 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 4r1r n GLU 351 N -2.03 0.69 -3.45 1.61 1.02 -0.39 -4.91 120.64 113.18 4r1r n GLU 351 Ca -0.07 -0.65 -0.20 0.00 -0.02 0.00 0.00 57.16 56.21 4r1r n GLU 351 Cb 0.57 -0.10 -0.00 0.00 -0.02 0.00 0.00 31.44 31.88 4r1r n GLU 351 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 4r1r s ASP 352 N -1.86 5.99 -0.09 1.62 1.11 -1.26 -2.08 116.67 120.11 4r1r s ASP 352 Ca 0.14 -0.08 0.04 0.00 0.18 0.00 0.00 52.55 52.83 4r1r s ASP 352 Cb -0.01 -1.36 -0.01 0.00 1.07 0.00 0.00 42.92 42.61 4r1r s ASP 352 CO 0.09 -0.43 -0.22 -0.63 1.18 0.00 0.00 175.17 175.16 4r1r s ILE 353 N -2.21 2.31 -0.14 0.77 1.01 0.15 -4.75 121.20 118.33 4r1r s ILE 353 Ca 0.44 -0.95 -0.14 0.00 0.00 0.00 0.00 60.65 60.00 4r1r s ILE 353 Cb -0.10 -1.89 -0.05 0.00 0.01 0.00 0.00 42.46 40.44 4r1r s ILE 353 CO 0.32 0.56 0.33 -0.89 0.00 0.00 0.00 174.94 175.25 4r1r s THR 354 N 0.08 5.28 -0.20 2.92 2.01 -1.26 -1.44 115.64 123.03 4r1r s THR 354 Ca -0.10 0.62 -0.11 0.00 0.31 0.00 0.00 61.69 62.42 4r1r s THR 354 Cb -0.16 -3.66 -0.05 0.00 0.01 0.00 0.00 72.50 68.64 4r1r s THR 354 CO 0.06 0.39 0.16 -0.76 -0.69 0.00 0.00 174.62 173.78 4r1r s LEU 355 N 0.37 4.21 0.14 4.42 1.43 0.22 -4.82 118.68 124.65 4r1r s LEU 355 Ca 0.18 0.27 0.06 0.00 -1.03 0.00 0.00 54.13 53.61 4r1r s LEU 355 Cb -0.13 -2.13 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 4r1r s LEU 355 CO 0.05 0.16 -0.14 -0.36 0.23 0.00 0.00 176.35 176.29 4r1r s PHE 356 N 0.42 1.48 -0.04 0.29 0.08 0.55 -2.03 117.98 118.72 4r1r s PHE 356 Ca 0.09 -0.56 -0.20 0.00 0.12 0.00 0.00 56.93 56.38 4r1r s PHE 356 Cb -0.11 -0.76 -0.05 0.00 -0.57 0.00 0.00 43.02 41.53 4r1r s PHE 356 CO -0.01 0.19 0.57 0.45 -0.10 0.00 0.00 175.22 176.32 4r1r s SER 357 N -2.60 6.90 0.35 1.36 0.15 -1.26 -1.97 113.70 116.63 4r1r s SER 357 Ca 0.12 1.07 0.12 0.00 0.70 0.00 0.00 55.95 57.96 4r1r s SER 357 Cb -0.04 -2.35 0.94 0.00 -1.71 0.00 0.00 66.02 62.86 4r1r s SER 357 CO 0.04 0.05 1.77 -0.65 1.20 0.00 0.00 173.24 175.65 4r1r h PRO 358 N 6.06 0.53 0.00 5.44 0.11 -1.87 -0.52 132.00 141.75 4r1r h PRO 358 Ca -0.44 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.61 4r1r h PRO 358 Cb 1.20 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 4r1r h PRO 358 CO 0.72 0.35 -0.12 0.66 -0.21 0.00 0.00 178.00 179.40 4r1r h SER 359 N 0.55 0.00 -0.02 -2.05 4.64 -1.93 -3.02 113.55 111.72 4r1r h SER 359 Ca 0.59 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.91 4r1r h SER 359 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 4r1r h SER 359 CO -0.36 0.12 -0.00 0.47 -0.87 0.00 0.00 176.83 176.19 4r1r n ASP 360 N -3.73 2.11 -3.68 4.97 8.00 -0.20 -4.72 116.55 119.29 4r1r n ASP 360 Ca -0.02 -1.70 -0.29 0.00 0.71 0.00 0.00 54.79 53.49 4r1r n ASP 360 Cb 0.23 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.21 4r1r n ASP 360 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 4r1r s VAL 361 N -2.01 1.38 0.10 2.53 -7.23 -1.14 -4.92 120.40 109.11 4r1r s VAL 361 Ca 0.34 -2.73 -0.35 0.00 -1.81 0.00 0.00 61.98 57.42 4r1r s VAL 361 Cb 0.21 -1.96 -0.15 0.00 0.56 0.00 0.00 36.38 35.04 4r1r s VAL 361 CO 0.32 -0.96 1.49 -2.65 -0.31 0.00 0.00 175.10 173.00 4r1r n PRO 362 N 3.29 1.69 0.00 4.82 -0.02 -1.26 -2.32 135.00 141.19 4r1r n PRO 362 Ca 0.13 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 4r1r n PRO 362 Cb 0.36 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 4r1r n PRO 362 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 4r1r n GLY 363 N 3.09 2.90 0.39 -1.23 0.00 -1.26 -4.89 105.19 104.20 4r1r n GLY 363 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 4r1r n GLY 363 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 4r1r h LEU 364 N 0.00 -0.99 -0.14 0.99 6.46 -1.84 -2.33 115.31 117.47 4r1r h LEU 364 Ca 0.00 0.08 0.05 0.00 -0.12 0.00 0.00 57.88 57.89 4r1r h LEU 364 Cb 0.00 0.33 -0.07 0.00 -0.73 0.00 0.00 40.66 40.19 4r1r h LEU 364 CO 0.00 -0.52 -0.38 0.22 -0.62 0.00 0.00 178.44 177.14 4r1r h TYR 365 N -0.79 -1.07 -0.29 1.25 3.20 -1.90 -1.14 116.97 116.24 4r1r h TYR 365 Ca -0.03 0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.93 4r1r h TYR 365 Cb 0.69 0.49 -0.04 0.00 1.54 0.00 0.00 36.73 39.41 4r1r h TYR 365 CO -0.19 -0.45 0.02 -0.44 -1.64 0.00 0.00 178.16 175.47 4r1r h ASP 366 N -0.45 -0.07 -0.99 -2.11 5.19 -1.95 -2.04 116.42 114.01 4r1r h ASP 366 Ca 0.09 0.06 0.16 0.00 -0.62 0.00 0.00 57.03 56.71 4r1r h ASP 366 Cb 0.60 0.09 -0.10 0.00 0.18 0.00 0.00 39.33 40.10 4r1r h ASP 366 CO -0.38 0.00 0.60 0.00 -3.12 0.00 0.00 179.24 176.34 4r1r h ALA 367 N 1.23 1.56 -0.98 3.45 0.00 -0.82 -1.29 119.26 122.41 4r1r h ALA 367 Ca 0.14 0.06 0.26 0.00 0.00 0.00 0.00 54.91 55.36 4r1r h ALA 367 Cb 0.17 -0.13 -0.13 0.00 0.00 0.00 0.00 17.79 17.70 4r1r h ALA 367 CO -0.21 0.05 0.53 0.35 0.00 0.00 0.00 179.25 179.98 4r1r h PHE 368 N 0.84 0.89 0.07 0.00 3.57 -0.46 -0.16 116.94 121.69 4r1r h PHE 368 Ca 0.53 0.04 -0.34 0.00 3.53 0.00 0.00 57.97 61.74 4r1r h PHE 368 Cb 0.71 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 39.18 4r1r h PHE 368 CO -0.01 -0.04 -1.88 1.19 -2.23 0.00 0.00 178.31 175.34 4r1r n PHE 369 N -4.98 0.96 0.69 0.41 3.72 -0.56 -4.51 117.46 113.19 4r1r n PHE 369 Ca 0.27 0.27 0.11 0.00 -0.05 0.00 0.00 57.45 58.04 4r1r n PHE 369 Cb 0.79 -1.12 -0.09 0.00 -0.94 0.00 0.00 39.48 38.13 4r1r n PHE 369 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 4r1r n ALA 370 N -3.25 4.02 -3.23 4.37 0.00 -0.77 -4.63 120.51 117.02 4r1r n ALA 370 Ca -0.35 -0.53 -0.02 0.00 0.00 0.00 0.00 53.44 52.53 4r1r n ALA 370 Cb 0.92 -0.82 -0.03 0.00 0.00 0.00 0.00 19.45 19.52 4r1r n ALA 370 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 4r1r s ASP 371 N -3.51 -0.61 0.33 0.00 -1.08 -0.09 -4.70 116.67 107.01 4r1r s ASP 371 Ca 0.04 0.07 0.11 0.00 -0.52 0.00 0.00 52.55 52.24 4r1r s ASP 371 Cb 0.15 1.59 0.56 0.00 -1.46 0.00 0.00 42.92 43.76 4r1r s ASP 371 CO 0.86 -0.32 1.74 1.56 0.52 0.00 0.00 175.17 179.53 4r1r h GLN 372 N 8.08 0.05 0.25 4.34 1.08 -1.89 -0.08 115.11 126.94 4r1r h GLN 372 Ca -0.09 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.07 4r1r h GLN 372 Cb 1.15 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.59 4r1r h GLN 372 CO 0.22 0.50 -0.12 0.93 -0.95 0.00 0.00 178.83 179.41 4r1r h GLU 373 N 0.04 -0.32 -0.94 1.46 4.39 -1.95 -1.33 114.58 115.94 4r1r h GLU 373 Ca -0.00 0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.73 4r1r h GLU 373 Cb 0.82 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.50 4r1r h GLU 373 CO 0.06 -0.09 0.62 1.49 -1.16 0.00 0.00 179.01 179.92 4r1r h GLU 374 N -0.50 1.24 -0.19 2.33 4.57 -1.86 -0.98 114.58 119.18 4r1r h GLU 374 Ca -0.03 -0.08 0.02 0.00 -1.18 0.00 0.00 59.36 58.08 4r1r h GLU 374 Cb 0.37 -0.28 -0.02 0.00 -0.16 0.00 0.00 28.75 28.67 4r1r h GLU 374 CO 0.06 0.82 0.08 0.35 -1.18 0.00 0.00 179.01 179.14 4r1r h PHE 375 N 1.27 0.14 -0.61 0.92 3.57 -0.81 -0.21 116.94 121.21 4r1r h PHE 375 Ca 0.34 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.85 4r1r h PHE 375 Cb -0.14 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 4r1r h PHE 375 CO 0.00 0.08 0.39 1.49 -2.23 0.00 0.00 178.31 178.04 4r1r h GLU 376 N 0.18 0.81 0.38 1.11 4.81 -0.43 0.21 114.58 121.65 4r1r h GLU 376 Ca 0.08 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 4r1r h GLU 376 Cb 0.04 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 4r1r h GLU 376 CO -0.07 0.55 -0.42 -0.09 -0.73 0.00 0.00 179.01 178.24 4r1r h ARG 377 N 0.82 -0.78 -0.26 1.92 2.43 -0.79 -1.26 114.38 116.46 4r1r h ARG 377 Ca 0.22 0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.48 4r1r h ARG 377 Cb -0.07 0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 29.62 4r1r h ARG 377 CO -0.05 -0.52 0.04 -0.07 -1.51 0.00 0.00 179.97 177.87 4r1r h LEU 378 N -0.81 -0.00 -0.43 3.80 3.38 -0.96 -1.62 115.31 118.66 4r1r h LEU 378 Ca -0.05 0.04 0.07 0.00 0.09 0.00 0.00 57.88 58.04 4r1r h LEU 378 Cb 0.72 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.46 4r1r h LEU 378 CO -0.08 0.03 0.04 0.22 0.09 0.00 0.00 178.44 178.74 4r1r h TYR 379 N 0.14 0.05 -0.39 1.13 3.20 -0.44 0.25 116.97 120.90 4r1r h TYR 379 Ca 0.12 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.89 4r1r h TYR 379 Cb 0.13 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 4r1r h TYR 379 CO -0.17 -0.05 -0.26 1.79 -1.64 0.00 0.00 178.16 177.83 4r1r h THR 380 N 0.15 1.28 0.02 1.81 1.35 -1.04 -2.15 112.91 114.33 4r1r h THR 380 Ca 0.21 -1.42 0.01 0.00 -0.55 0.00 0.00 66.41 64.66 4r1r h THR 380 Cb 0.29 1.33 -0.03 0.00 -1.73 0.00 0.00 68.15 68.00 4r1r h THR 380 CO -0.32 0.48 -0.31 0.50 -0.25 0.00 0.00 175.52 175.62 4r1r h LYS 381 N 0.69 -0.39 -0.11 4.72 3.64 -0.55 -2.16 116.57 122.41 4r1r h LYS 381 Ca 0.08 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.52 4r1r h LYS 381 Cb 0.84 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.74 4r1r h LYS 381 CO 0.07 -0.26 0.14 1.88 -2.27 0.00 0.00 179.45 179.02 4r1r h TYR 382 N -0.40 0.00 -0.67 1.91 0.05 -0.97 -1.04 116.97 115.84 4r1r h TYR 382 Ca 0.00 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.74 4r1r h TYR 382 Cb 0.42 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.13 4r1r h TYR 382 CO -0.44 0.00 0.25 0.93 -1.05 0.00 0.00 178.16 177.86 4r1r h GLU 383 N 0.00 1.02 0.00 4.88 5.08 -0.72 -3.11 114.58 121.73 4r1r h GLU 383 Ca 0.05 -0.19 -0.17 0.00 -1.00 0.00 0.00 59.36 58.05 4r1r h GLU 383 Cb 0.34 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 4r1r h GLU 383 CO -0.00 0.86 -0.90 0.87 -1.00 0.00 0.00 179.01 178.83 4r1r h LYS 384 N 0.96 0.00 -6.11 2.33 6.56 -1.05 -3.44 116.57 115.82 4r1r h LYS 384 Ca 0.22 0.00 -0.57 0.00 -1.06 0.00 0.00 60.65 59.24 4r1r h LYS 384 Cb 0.23 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.90 4r1r h LYS 384 CO -0.02 0.69 1.41 0.34 -2.06 0.00 0.00 179.45 179.81 4r1r s ASP 385 N -6.47 5.76 0.33 0.86 -1.08 -0.75 -4.86 116.67 110.47 4r1r s ASP 385 Ca 0.01 2.10 0.26 0.00 -0.52 0.00 0.00 52.55 54.40 4r1r s ASP 385 Cb 0.09 -2.52 0.93 0.00 -1.46 0.00 0.00 42.92 39.96 4r1r s ASP 385 CO 0.79 -1.69 1.77 0.44 0.52 0.00 0.00 175.17 177.01 4r1r h ASP 386 N 13.67 0.00 1.62 -0.34 3.32 -1.86 -3.16 116.42 129.66 4r1r h ASP 386 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 4r1r h ASP 386 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 4r1r h ASP 386 CO 0.96 0.00 0.00 0.77 -1.72 0.00 0.00 179.24 179.25 4r1r h SER 387 N 0.00 0.00 -3.40 6.45 4.64 -1.95 -3.45 113.55 115.85 4r1r h SER 387 Ca 0.00 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.77 4r1r h SER 387 Cb 0.58 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.63 4r1r h SER 387 CO 0.00 0.00 0.16 -0.63 -0.87 0.00 0.00 176.83 175.49 4r1r s ILE 388 N -3.34 4.89 0.02 0.95 -1.09 -1.20 -5.03 121.20 116.40 4r1r s ILE 388 Ca 0.05 1.62 -0.30 0.00 -2.23 0.00 0.00 60.65 59.79 4r1r s ILE 388 Cb 0.07 -4.11 -0.06 0.00 -1.58 0.00 0.00 42.46 36.78 4r1r s ILE 388 CO 0.62 0.29 1.41 -0.60 -1.23 0.00 0.00 174.94 175.43 4r1r s ARG 389 N 0.47 4.28 0.33 2.79 3.52 -1.26 -4.99 118.95 124.09 4r1r s ARG 389 Ca 0.40 2.00 -0.02 0.00 -0.13 0.00 0.00 55.73 57.98 4r1r s ARG 389 Cb -0.19 -3.54 -0.00 0.00 -1.56 0.00 0.00 34.95 29.65 4r1r s ARG 389 CO 0.22 -0.57 0.44 -1.59 -0.81 0.00 0.00 175.30 172.99 4r1r s LYS 390 N 2.27 1.84 -0.13 5.12 -2.85 -1.26 -4.52 119.74 120.20 4r1r s LYS 390 Ca 0.65 -1.74 -0.12 0.00 -1.00 0.00 0.00 55.97 53.76 4r1r s LYS 390 Cb -0.32 0.43 0.03 0.00 -2.06 0.00 0.00 37.83 35.91 4r1r s LYS 390 CO 0.27 -0.75 0.34 -1.14 0.10 0.00 0.00 175.35 174.18 4r1r s GLN 391 N -3.21 0.40 -0.11 1.78 0.74 -0.86 -4.97 119.66 113.44 4r1r s GLN 391 Ca 0.31 0.48 -0.02 0.00 0.05 0.00 0.00 55.36 56.18 4r1r s GLN 391 Cb 0.00 0.19 -0.03 0.00 1.10 0.00 0.00 33.01 34.27 4r1r s GLN 391 CO 0.20 -0.05 -0.02 1.03 -0.55 0.00 0.00 175.29 175.90 4r1r s ARG 392 N 0.21 3.20 0.05 1.67 0.52 -1.26 0.69 118.95 124.02 4r1r s ARG 392 Ca -0.00 -0.46 0.02 0.00 -0.52 0.00 0.00 55.73 54.77 4r1r s ARG 392 Cb -0.03 -2.81 -0.02 0.00 0.52 0.00 0.00 34.95 32.61 4r1r s ARG 392 CO 0.00 0.53 -0.08 0.14 0.02 0.00 0.00 175.30 175.91 4r1r s VAL 393 N -0.43 0.59 -0.08 3.52 -7.23 -0.52 -4.97 120.40 111.29 4r1r s VAL 393 Ca 0.07 -1.12 -0.30 0.00 -1.81 0.00 0.00 61.98 58.82 4r1r s VAL 393 Cb -0.12 -0.68 -0.04 0.00 0.56 0.00 0.00 36.38 36.10 4r1r s VAL 393 CO 0.02 -0.38 1.47 -0.75 -0.31 0.00 0.00 175.10 175.15 4r1r s LYS 394 N -1.66 4.22 0.31 4.82 2.47 -1.26 0.29 119.74 128.94 4r1r s LYS 394 Ca -0.09 1.96 0.08 0.00 -1.56 0.00 0.00 55.97 56.37 4r1r s LYS 394 Cb -0.10 -3.83 0.84 0.00 -1.46 0.00 0.00 37.83 33.29 4r1r s LYS 394 CO 0.00 -0.75 1.73 0.00 0.16 0.00 0.00 175.35 176.50 4r1r h ALA 395 N 8.74 1.73 -0.88 3.13 0.00 -1.71 0.24 119.26 130.50 4r1r h ALA 395 Ca -0.34 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.69 4r1r h ALA 395 Cb 1.15 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 4r1r h ALA 395 CO 0.95 -0.23 0.56 0.28 0.00 0.00 0.00 179.25 180.81 4r1r h VAL 396 N 0.60 1.24 0.04 0.00 2.07 -1.88 -0.35 116.25 117.97 4r1r h VAL 396 Ca 0.62 -0.48 -0.00 0.00 0.82 0.00 0.00 66.70 67.67 4r1r h VAL 396 Cb 1.14 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 4r1r h VAL 396 CO -0.46 0.24 -0.02 -0.33 0.02 0.00 0.00 177.57 177.02 4r1r h GLU 397 N 1.21 -0.05 -0.33 1.57 5.08 -0.95 -0.70 114.58 120.41 4r1r h GLU 397 Ca 0.32 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.68 4r1r h GLU 397 Cb -0.09 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 4r1r h GLU 397 CO -0.06 0.16 0.18 1.25 -1.00 0.00 0.00 179.01 179.54 4r1r h LEU 398 N -0.26 0.41 -0.68 1.33 5.85 -1.19 0.37 115.31 121.15 4r1r h LEU 398 Ca -0.01 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 4r1r h LEU 398 Cb 0.24 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 4r1r h LEU 398 CO 0.01 0.38 0.35 -0.26 -0.34 0.00 0.00 178.44 178.57 4r1r h PHE 399 N 0.42 0.96 -0.30 1.25 0.04 -1.05 -0.24 116.94 118.01 4r1r h PHE 399 Ca 0.12 -0.04 -0.17 0.00 2.80 0.00 0.00 57.97 60.68 4r1r h PHE 399 Cb 0.05 -0.30 -0.00 0.00 2.20 0.00 0.00 35.95 37.90 4r1r h PHE 399 CO -0.03 0.70 -0.50 0.77 -0.60 0.00 0.00 178.31 178.65 4r1r h SER 400 N 0.94 0.93 -0.21 2.17 0.02 -0.77 0.34 113.55 116.98 4r1r h SER 400 Ca 0.24 -0.48 0.03 0.00 -0.84 0.00 0.00 61.79 60.74 4r1r h SER 400 Cb 0.09 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 4r1r h SER 400 CO -0.03 1.26 0.02 0.25 -1.14 0.00 0.00 176.83 177.19 4r1r h LEU 401 N 0.67 -0.05 -0.00 5.07 5.85 -0.00 0.80 115.31 127.65 4r1r h LEU 401 Ca 0.03 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.79 4r1r h LEU 401 Cb 1.09 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 4r1r h LEU 401 CO 0.11 0.01 0.00 -0.03 -0.34 0.00 0.00 178.44 178.19 4r1r h MET 402 N 0.09 0.00 -0.37 1.25 4.05 -0.88 -1.90 114.93 117.17 4r1r h MET 402 Ca 0.10 -0.00 -0.09 0.00 -0.28 0.00 0.00 59.70 59.43 4r1r h MET 402 Cb 0.11 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.89 4r1r h MET 402 CO -0.15 0.00 -0.14 0.52 0.23 0.00 0.00 176.91 177.38 4r1r h MET 403 N 0.00 0.67 -0.19 0.39 2.86 0.31 -0.23 114.93 118.74 4r1r h MET 403 Ca 0.00 -0.22 0.03 0.00 -2.06 0.00 0.00 59.70 57.45 4r1r h MET 403 Cb 0.00 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.58 4r1r h MET 403 CO -0.00 0.78 0.02 0.37 1.06 0.00 0.00 176.91 179.14 4r1r h GLN 404 N 0.60 0.09 -0.45 1.72 4.15 0.78 0.47 115.11 122.48 4r1r h GLN 404 Ca 0.10 -0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.47 4r1r h GLN 404 Cb 0.58 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.23 4r1r h GLN 404 CO 0.04 0.06 0.09 0.93 -1.93 0.00 0.00 178.83 178.02 4r1r h GLU 405 N 0.09 0.68 -0.33 1.69 4.39 -1.05 0.53 114.58 120.59 4r1r h GLU 405 Ca 0.09 -0.13 -0.18 0.00 0.34 0.00 0.00 59.36 59.48 4r1r h GLU 405 Cb 0.09 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.64 4r1r h GLU 405 CO -0.13 0.63 -0.48 -0.09 -1.16 0.00 0.00 179.01 177.78 4r1r h ARG 406 N 0.66 0.91 0.12 2.33 2.43 -0.34 -2.04 114.38 118.45 4r1r h ARG 406 Ca 0.15 -0.54 -0.01 0.00 -0.81 0.00 0.00 59.98 58.77 4r1r h ARG 406 Cb 0.27 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 4r1r h ARG 406 CO -0.00 1.18 -0.06 0.00 -1.51 0.00 0.00 179.97 179.58 4r1r h ALA 407 N 0.72 -0.17 -0.18 2.80 0.00 0.55 0.22 119.26 123.19 4r1r h ALA 407 Ca 0.03 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 4r1r h ALA 407 Cb 1.09 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 4r1r h ALA 407 CO 0.11 -0.50 -0.35 0.66 0.00 0.00 0.00 179.25 179.18 4r1r h SER 408 N -0.36 0.40 0.06 0.00 4.64 -0.95 -3.32 113.55 114.02 4r1r h SER 408 Ca -0.02 -0.15 -0.37 0.00 -0.47 0.00 0.00 61.79 60.78 4r1r h SER 408 Cb 0.29 -0.11 -0.06 0.00 -0.31 0.00 0.00 62.40 62.21 4r1r h SER 408 CO 0.03 0.72 -2.31 0.35 -0.87 0.00 0.00 176.83 174.74 4r1r n THR 409 N -4.07 1.49 0.00 2.95 -2.24 -0.77 -4.99 114.28 106.66 4r1r n THR 409 Ca -0.01 -0.73 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 4r1r n THR 409 Cb 0.45 -1.00 0.00 0.00 -2.10 0.00 0.00 70.33 67.68 4r1r n THR 409 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4r1r n GLY 410 N 1.94 1.46 0.72 3.38 0.00 0.76 -4.90 105.19 108.55 4r1r n GLY 410 Ca -0.36 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.70 4r1r n GLY 410 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4r1r n ARG 411 N -2.00 1.64 -3.64 1.61 5.12 -1.26 -2.45 116.66 115.68 4r1r n ARG 411 Ca 0.00 -3.26 -0.39 0.00 -1.93 0.00 0.00 57.85 52.27 4r1r n ARG 411 Cb 0.00 -1.66 -0.10 0.00 -1.16 0.00 0.00 32.46 29.54 4r1r n ARG 411 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 4r1r s ILE 412 N -3.23 3.88 0.47 0.55 -1.09 -1.26 -3.16 121.20 117.36 4r1r s ILE 412 Ca 0.39 -1.81 -0.03 0.00 -2.23 0.00 0.00 60.65 56.97 4r1r s ILE 412 Cb 0.38 -3.55 -0.02 0.00 -1.58 0.00 0.00 42.46 37.68 4r1r s ILE 412 CO -0.05 -0.69 0.75 -0.31 -1.23 0.00 0.00 174.94 173.40 4r1r s TYR 413 N 1.30 3.43 0.07 3.97 2.02 0.73 -4.71 117.35 124.15 4r1r s TYR 413 Ca 0.06 0.60 0.08 0.00 -0.37 0.00 0.00 57.07 57.44 4r1r s TYR 413 Cb -0.24 -2.32 -0.03 0.00 -0.40 0.00 0.00 41.96 38.96 4r1r s TYR 413 CO -0.01 -0.33 -0.18 0.42 -1.57 0.00 0.00 175.55 173.87 4r1r s ILE 414 N -2.68 2.78 -0.10 2.71 1.09 -1.15 0.13 121.20 123.98 4r1r s ILE 414 Ca 0.47 -1.30 -0.03 0.00 -1.10 0.00 0.00 60.65 58.70 4r1r s ILE 414 Cb -0.10 -2.20 0.04 0.00 -1.06 0.00 0.00 42.46 39.14 4r1r s ILE 414 CO 0.42 0.26 0.05 -1.58 -0.10 0.00 0.00 174.94 173.99 4r1r s GLN 415 N -1.67 0.24 -0.70 2.79 0.74 0.18 -1.45 119.66 119.80 4r1r s GLN 415 Ca 0.16 0.08 -0.24 0.00 0.05 0.00 0.00 55.36 55.40 4r1r s GLN 415 Cb -0.10 -1.19 0.06 0.00 1.10 0.00 0.00 33.01 32.87 4r1r s GLN 415 CO 0.07 -0.45 1.10 -0.80 -0.55 0.00 0.00 175.29 174.65 4r1r s ASN 416 N 2.06 6.18 0.19 6.67 0.01 0.14 0.16 114.94 130.35 4r1r s ASN 416 Ca 0.03 -0.80 -0.06 0.00 -0.71 0.00 0.00 52.86 51.32 4r1r s ASN 416 Cb -0.14 -2.48 0.11 0.00 0.41 0.00 0.00 41.25 39.16 4r1r s ASN 416 CO -0.06 -1.59 1.58 -0.37 -1.51 0.00 0.00 177.10 175.14 4r1r h VAL 417 N 6.00 1.28 0.22 1.60 -1.51 -0.78 -2.17 116.25 120.89 4r1r h VAL 417 Ca -0.27 -1.43 -0.00 0.00 -1.23 0.00 0.00 66.70 63.76 4r1r h VAL 417 Cb 1.06 1.29 -0.01 0.00 -2.13 0.00 0.00 31.29 31.50 4r1r h VAL 417 CO 1.22 0.48 -0.15 -2.24 -1.23 0.00 0.00 177.57 175.65 4r1r h ASP 418 N 0.69 -0.38 -1.00 4.19 3.04 -1.79 -1.92 116.42 119.25 4r1r h ASP 418 Ca 0.08 0.03 0.12 0.00 -3.24 0.00 0.00 57.03 54.02 4r1r h ASP 418 Cb 0.83 0.12 -0.08 0.00 -1.04 0.00 0.00 39.33 39.15 4r1r h ASP 418 CO 0.07 -0.24 0.63 0.45 -2.04 0.00 0.00 179.24 178.11 4r1r h HIS 419 N -0.37 1.13 0.00 4.15 3.86 -1.89 0.27 115.15 122.30 4r1r h HIS 419 Ca -0.02 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 4r1r h HIS 419 Cb 0.32 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 28.43 4r1r h HIS 419 CO -0.10 0.44 0.00 0.00 0.86 0.00 0.00 177.93 179.13 4r1r n ASN 421 N -2.78 3.59 0.15 0.00 3.02 0.71 -4.52 115.26 115.43 4r1r n ASN 421 Ca -0.01 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.62 4r1r n ASN 421 Cb 0.17 1.18 0.06 0.00 -0.61 0.00 0.00 39.78 40.58 4r1r n ASN 421 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 4r1r h THR 422 N 0.00 0.28 -2.72 3.41 1.35 -0.85 -3.38 112.91 111.00 4r1r h THR 422 Ca -0.02 -1.44 -0.61 0.00 -0.55 0.00 0.00 66.41 63.79 4r1r h THR 422 Cb 0.45 1.99 -0.41 0.00 -1.73 0.00 0.00 68.15 68.45 4r1r h THR 422 CO 0.00 0.16 -0.73 1.57 -0.25 0.00 0.00 175.52 176.27 4r1r n HIS 423 N -3.00 1.73 -3.95 4.73 -0.00 -1.02 -4.84 115.22 108.86 4r1r n HIS 423 Ca 0.01 -3.93 -0.09 0.00 -0.00 0.00 0.00 57.72 53.71 4r1r n HIS 423 Cb 0.63 -0.31 -0.05 0.00 -0.00 0.00 0.00 29.99 30.26 4r1r n HIS 423 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 4r1r s SER 424 N -1.03 -0.13 0.00 0.26 1.04 -1.26 -4.76 113.70 107.81 4r1r s SER 424 Ca 0.29 -0.84 0.27 0.00 0.48 0.00 0.00 55.95 56.16 4r1r s SER 424 Cb 0.01 0.61 1.40 0.00 0.10 0.00 0.00 66.02 68.14 4r1r s SER 424 CO -0.17 -1.17 1.94 -0.81 0.98 0.00 0.00 173.24 174.01 4r1r n PRO 425 N -0.39 0.43 -4.26 4.02 -0.04 -1.26 -4.64 135.00 128.85 4r1r n PRO 425 Ca -0.03 0.03 -0.29 0.00 -0.04 0.00 0.00 63.50 63.17 4r1r n PRO 425 Cb 0.61 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.47 4r1r n PRO 425 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 4r1r s PHE 426 N -2.53 2.63 -0.38 0.54 0.08 -1.26 -0.13 117.98 116.94 4r1r s PHE 426 Ca 0.27 -0.21 -0.25 0.00 0.12 0.00 0.00 56.93 56.86 4r1r s PHE 426 Cb 0.18 -1.38 0.01 0.00 -0.57 0.00 0.00 43.02 41.26 4r1r s PHE 426 CO 0.41 0.41 0.89 0.34 -0.10 0.00 0.00 175.22 177.17 4r1r s ASP 427 N -2.20 6.63 0.55 1.36 2.15 -0.65 -4.48 116.67 120.02 4r1r s ASP 427 Ca 0.20 0.48 0.24 0.00 0.43 0.00 0.00 52.55 53.90 4r1r s ASP 427 Cb -0.11 -2.45 1.44 0.00 -0.30 0.00 0.00 42.92 41.51 4r1r s ASP 427 CO 0.12 -0.85 2.05 -0.65 -0.17 0.00 0.00 175.17 175.67 4r1r h PRO 428 N 8.54 0.00 -0.54 4.34 0.11 -1.84 0.22 132.00 142.83 4r1r h PRO 428 Ca -0.24 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.79 4r1r h PRO 428 Cb 1.08 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 4r1r h PRO 428 CO 0.97 0.00 0.01 0.00 -0.21 0.00 0.00 178.00 178.77 4r1r h ALA 429 N 1.79 1.00 0.02 -0.75 0.00 -1.92 -3.25 119.26 116.15 4r1r h ALA 429 Ca 0.16 -0.28 -0.39 0.00 0.00 0.00 0.00 54.91 54.39 4r1r h ALA 429 Cb 0.67 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 4r1r h ALA 429 CO -0.00 0.61 -2.37 -0.89 0.00 0.00 0.00 179.25 176.61 4r1r n ILE 430 N -4.20 1.55 -3.15 0.00 5.41 -0.60 -4.86 119.36 113.50 4r1r n ILE 430 Ca 0.03 -0.53 -0.20 0.00 1.00 0.00 0.00 62.75 63.05 4r1r n ILE 430 Cb 0.31 -1.58 -0.05 0.00 -0.71 0.00 0.00 39.64 37.61 4r1r n ILE 430 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 4r1r n ALA 431 N -3.40 1.33 -1.09 -1.39 0.00 0.69 -5.06 120.51 111.59 4r1r n ALA 431 Ca -0.45 -2.56 -0.31 0.00 0.00 0.00 0.00 53.44 50.11 4r1r n ALA 431 Cb 0.97 -0.98 0.11 0.00 0.00 0.00 0.00 19.45 19.55 4r1r n ALA 431 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 4r1r s PRO 432 N 0.01 1.86 -0.30 0.00 0.04 -1.23 -4.39 135.00 130.99 4r1r s PRO 432 Ca 0.33 1.37 -0.09 0.00 0.04 0.00 0.00 61.00 62.65 4r1r s PRO 432 Cb 0.08 -1.84 -0.01 0.00 0.04 0.00 0.00 34.50 32.78 4r1r s PRO 432 CO -0.15 -1.97 0.12 0.08 0.04 0.00 0.00 177.00 175.11 4r1r s VAL 433 N -2.69 4.41 -0.48 -0.36 1.01 -1.26 -4.25 120.40 116.77 4r1r s VAL 433 Ca 0.65 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 62.24 4r1r s VAL 433 Cb -0.20 -3.22 0.12 0.00 0.00 0.00 0.00 36.38 33.08 4r1r s VAL 433 CO 0.55 0.12 1.03 0.54 0.00 0.00 0.00 175.10 177.33 4r1r n ARG 434 N 4.95 2.28 -3.92 2.72 1.74 -1.26 -4.81 116.66 118.36 4r1r n ARG 434 Ca -0.14 -1.56 -0.01 0.00 -0.77 0.00 0.00 57.85 55.36 4r1r n ARG 434 Cb 0.49 -1.12 0.02 0.00 -1.02 0.00 0.00 32.46 30.83 4r1r n ARG 434 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 4r1r s GLN 435 N -0.88 0.97 0.00 5.56 -2.07 -1.26 -4.97 119.66 117.01 4r1r s GLN 435 Ca 0.10 -0.63 0.00 0.00 -1.82 0.00 0.00 55.36 53.01 4r1r s GLN 435 Cb 0.05 0.27 0.00 0.00 -1.09 0.00 0.00 33.01 32.25 4r1r s GLN 435 CO 0.07 -0.46 0.00 0.45 -1.32 0.00 0.00 175.29 174.04 4r1r n SER 436 N -1.16 1.06 -0.54 12.60 2.88 -1.26 -4.46 113.62 122.74 4r1r n SER 436 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 4r1r n SER 436 Cb 0.59 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 4r1r n SER 436 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 4r1r n ASN 437 N 0.00 1.04 0.01 -3.46 6.94 -1.23 -4.53 115.26 114.03 4r1r n ASN 437 Ca 0.00 -0.27 -0.10 0.00 -0.02 0.00 0.00 54.58 54.19 4r1r n ASN 437 Cb 0.00 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.38 4r1r n ASN 437 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 4r1r h LEU 438 N 0.00 -0.22 -2.93 -4.53 5.85 -1.87 -3.05 115.31 108.56 4r1r h LEU 438 Ca 0.00 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.77 4r1r h LEU 438 Cb 0.00 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.14 4r1r h LEU 438 CO 0.00 -0.10 0.00 0.00 -0.34 0.00 0.00 178.44 178.00 4r1r n LEU 440 N 1.18 -2.19 -0.00 0.00 7.99 -1.15 -4.56 117.00 118.26 4r1r n LEU 440 Ca 0.25 -0.10 0.01 0.00 -0.01 0.00 0.00 56.01 56.15 4r1r n LEU 440 Cb 0.82 -2.97 -0.02 0.00 -0.11 0.00 0.00 43.42 41.15 4r1r n LEU 440 CO 0.22 -0.08 -0.45 -1.84 -1.51 0.00 0.00 177.39 173.73 4r1r n GLU 441 N -3.34 0.97 -3.34 3.23 0.00 -1.26 -4.38 120.64 112.51 4r1r n GLU 441 Ca -0.21 -0.02 -0.36 0.00 0.00 0.00 0.00 57.16 56.58 4r1r n GLU 441 Cb 0.67 -0.99 -0.06 0.00 0.00 0.00 0.00 31.44 31.06 4r1r n GLU 441 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 4r1r s ILE 442 N -2.02 4.84 -0.33 3.84 -1.09 -1.26 -1.01 121.20 124.17 4r1r s ILE 442 Ca -0.01 0.89 0.03 0.00 -2.23 0.00 0.00 60.65 59.33 4r1r s ILE 442 Cb 0.01 -3.76 0.16 0.00 -1.58 0.00 0.00 42.46 37.29 4r1r s ILE 442 CO 0.09 0.29 0.40 0.00 -1.23 0.00 0.00 174.94 174.49 4r1r s ALA 443 N -1.41 -0.87 0.13 9.38 0.00 -1.26 -3.58 121.76 124.14 4r1r s ALA 443 Ca 0.36 -0.36 0.06 0.00 0.00 0.00 0.00 51.96 52.03 4r1r s ALA 443 Cb -0.16 -2.08 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 4r1r s ALA 443 CO 0.19 -1.94 -0.15 -0.51 0.00 0.00 0.00 175.76 173.35 4r1r s LEU 444 N 2.01 2.41 0.49 0.00 1.43 -1.26 -4.83 118.68 118.92 4r1r s LEU 444 Ca 0.13 -0.82 -0.21 0.00 -1.03 0.00 0.00 54.13 52.20 4r1r s LEU 444 Cb -0.13 -0.59 -0.08 0.00 0.03 0.00 0.00 46.19 45.43 4r1r s LEU 444 CO -0.18 -0.13 1.08 -2.16 0.23 0.00 0.00 176.35 175.18 4r1r s PRO 445 N -2.71 3.73 0.03 1.29 0.04 -1.26 -4.46 135.00 131.67 4r1r s PRO 445 Ca 0.10 1.49 -0.08 0.00 0.04 0.00 0.00 61.00 62.55 4r1r s PRO 445 Cb -0.05 -2.17 -0.00 0.00 0.04 0.00 0.00 34.50 32.33 4r1r s PRO 445 CO 0.03 -0.51 0.16 0.95 0.04 0.00 0.00 177.00 177.68 4r1r s THR 446 N -1.84 0.11 -0.03 1.26 -4.23 -1.26 -4.41 115.64 105.25 4r1r s THR 446 Ca 0.67 -0.91 0.02 0.00 -1.18 0.00 0.00 61.69 60.28 4r1r s THR 446 Cb -0.20 -0.84 0.01 0.00 1.34 0.00 0.00 72.50 72.81 4r1r s THR 446 CO 0.24 -0.50 -0.05 -0.54 -0.54 0.00 0.00 174.62 173.22 4r1r s LYS 447 N -2.40 0.70 0.57 3.99 1.02 -0.54 -4.92 119.74 118.16 4r1r s LYS 447 Ca -0.06 -0.16 -0.20 0.00 0.02 0.00 0.00 55.97 55.57 4r1r s LYS 447 Cb -0.02 -0.70 -0.04 0.00 -0.52 0.00 0.00 37.83 36.55 4r1r s LYS 447 CO -0.03 0.02 1.27 -2.14 -0.92 0.00 0.00 175.35 173.54 4r1r s PRO 448 N 0.46 3.04 0.25 -1.68 0.02 -1.25 -1.24 135.00 134.59 4r1r s PRO 448 Ca -0.06 1.99 0.04 0.00 0.02 0.00 0.00 61.00 62.99 4r1r s PRO 448 Cb -0.10 -2.07 -0.03 0.00 0.02 0.00 0.00 34.50 32.32 4r1r s PRO 448 CO 0.00 -1.20 0.39 -0.51 -0.33 0.00 0.00 177.00 175.35 4r1r s LEU 449 N -3.83 4.27 0.00 -5.54 1.02 -1.26 -4.44 118.68 108.90 4r1r s LEU 449 Ca 0.75 0.15 0.09 0.00 0.02 0.00 0.00 54.13 55.14 4r1r s LEU 449 Cb -0.35 -2.95 -0.03 0.00 0.02 0.00 0.00 46.19 42.88 4r1r s LEU 449 CO 0.39 -0.10 0.53 0.59 0.02 0.00 0.00 176.35 177.78 4r1r n ASN 450 N -1.41 0.92 -3.51 2.29 3.02 -1.26 -4.13 115.26 111.17 4r1r n ASN 450 Ca -0.08 -0.96 -0.13 0.00 -0.03 0.00 0.00 54.58 53.39 4r1r n ASN 450 Cb 0.57 0.64 -0.04 0.00 -0.61 0.00 0.00 39.78 40.34 4r1r n ASN 450 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 4r1r s ASP 451 N -1.45 -0.50 0.20 6.41 -1.08 -1.26 -4.44 116.67 114.54 4r1r s ASP 451 Ca 0.06 0.31 -0.12 0.00 -0.52 0.00 0.00 52.55 52.29 4r1r s ASP 451 Cb 0.07 0.46 0.25 0.00 -1.46 0.00 0.00 42.92 42.23 4r1r s ASP 451 CO 0.27 -0.62 1.69 0.58 0.52 0.00 0.00 175.17 177.61 4r1r h VAL 452 N 2.44 0.62 -0.40 1.11 2.07 -1.91 -1.61 116.25 118.57 4r1r h VAL 452 Ca -0.25 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.21 4r1r h VAL 452 Cb 1.21 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 4r1r h VAL 452 CO 0.35 0.03 0.00 0.59 0.02 0.00 0.00 177.57 178.56 4r1r n ASN 453 N -5.18 2.73 -4.67 0.57 3.02 -1.26 -4.60 115.26 105.86 4r1r n ASN 453 Ca 0.07 -2.16 -0.50 0.00 -0.03 0.00 0.00 54.58 51.96 4r1r n ASN 453 Cb 0.30 -0.38 -0.05 0.00 -0.61 0.00 0.00 39.78 39.03 4r1r n ASN 453 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 4r1r n ASP 454 N 0.63 2.97 -0.25 6.41 2.03 -0.61 -4.83 116.55 122.91 4r1r n ASP 454 Ca 0.15 1.04 0.13 0.00 0.52 0.00 0.00 54.79 56.63 4r1r n ASP 454 Cb 0.49 -1.32 0.43 0.00 -0.72 0.00 0.00 41.12 40.00 4r1r n ASP 454 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 4r1r n GLU 455 N 5.12 0.89 -0.04 -0.67 1.02 -1.26 -3.74 120.64 121.96 4r1r n GLU 455 Ca 0.21 -0.49 0.12 0.00 -0.02 0.00 0.00 57.16 56.98 4r1r n GLU 455 Cb 0.25 -1.49 0.21 0.00 -0.02 0.00 0.00 31.44 30.40 4r1r n GLU 455 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 4r1r n ASN 456 N -0.62 2.75 -4.84 1.62 4.13 -1.26 -4.86 115.26 112.17 4r1r n ASN 456 Ca 0.13 -1.89 -0.23 0.00 1.68 0.00 0.00 54.58 54.27 4r1r n ASN 456 Cb 0.34 -0.06 0.07 0.00 -1.54 0.00 0.00 39.78 38.59 4r1r n ASN 456 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 4r1r s GLY 457 N -1.87 1.78 -0.11 7.41 0.00 -1.25 -4.93 107.32 108.36 4r1r s GLY 457 Ca 0.32 -1.42 -0.04 0.00 0.00 0.00 0.00 44.72 43.58 4r1r s GLY 457 CO 0.31 -1.00 0.21 1.85 0.00 0.00 0.00 173.10 174.47 4r1r s GLU 458 N -5.00 0.10 -0.22 2.90 2.12 -0.37 -4.60 118.70 113.62 4r1r s GLU 458 Ca 0.61 0.64 -0.04 0.00 0.36 0.00 0.00 54.97 56.55 4r1r s GLU 458 Cb -0.08 -0.14 -0.01 0.00 0.26 0.00 0.00 34.13 34.16 4r1r s GLU 458 CO 0.42 -0.28 -0.04 0.42 -0.54 0.00 0.00 175.26 175.24 4r1r s ILE 459 N 2.23 3.35 0.28 -3.70 1.01 -0.95 -1.47 121.20 121.95 4r1r s ILE 459 Ca 0.01 -0.52 -0.29 0.00 0.00 0.00 0.00 60.65 59.84 4r1r s ILE 459 Cb -0.12 -2.53 -0.10 0.00 0.01 0.00 0.00 42.46 39.72 4r1r s ILE 459 CO -0.07 0.41 1.09 0.00 0.00 0.00 0.00 174.94 176.37 4r1r s ALA 460 N 1.47 3.41 0.10 9.38 0.00 -0.61 -4.30 121.76 131.20 4r1r s ALA 460 Ca 0.06 0.89 0.05 0.00 0.00 0.00 0.00 51.96 52.95 4r1r s ALA 460 Cb -0.14 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 4r1r s ALA 460 CO -0.03 -0.15 -0.13 -0.51 0.00 0.00 0.00 175.76 174.94 4r1r s LEU 461 N -1.41 2.36 -0.06 0.00 1.43 -1.26 0.28 118.68 120.01 4r1r s LEU 461 Ca 0.44 -0.74 -0.03 0.00 -1.03 0.00 0.00 54.13 52.78 4r1r s LEU 461 Cb -0.32 -0.49 0.04 0.00 0.03 0.00 0.00 46.19 45.45 4r1r s LEU 461 CO 0.41 -0.14 0.14 0.00 0.23 0.00 0.00 176.35 176.98 4r1r s THR 463 N 1.19 5.26 0.40 0.00 2.01 -1.24 -4.33 115.64 118.92 4r1r s THR 463 Ca -0.09 0.68 0.07 0.00 0.31 0.00 0.00 61.69 62.67 4r1r s THR 463 Cb -0.12 -3.70 -0.06 0.00 0.01 0.00 0.00 72.50 68.64 4r1r s THR 463 CO -0.06 0.35 0.13 -0.76 -0.69 0.00 0.00 174.62 173.59 4r1r s LEU 464 N 0.61 3.06 0.00 4.42 1.43 -1.26 -0.11 118.68 126.83 4r1r s LEU 464 Ca 0.19 -1.13 0.00 0.00 -1.03 0.00 0.00 54.13 52.17 4r1r s LEU 464 Cb -0.14 -1.32 0.00 0.00 0.03 0.00 0.00 46.19 44.76 4r1r s LEU 464 CO 0.06 -0.49 0.00 -1.20 0.23 0.00 0.00 176.35 174.95 4r1r n SER 465 N -1.15 0.00 -3.47 2.29 7.64 -1.09 -4.27 113.62 113.57 4r1r n SER 465 Ca -0.02 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.72 4r1r n SER 465 Cb 0.65 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.81 4r1r n SER 465 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 4r1r s ALA 466 N -2.00 -1.61 -0.11 -0.43 0.00 0.57 -0.62 121.76 117.57 4r1r s ALA 466 Ca 0.00 0.75 -0.15 0.00 0.00 0.00 0.00 51.96 52.56 4r1r s ALA 466 Cb 0.00 0.55 -0.05 0.00 0.00 0.00 0.00 23.12 23.62 4r1r s ALA 466 CO 0.00 -0.61 0.37 -0.06 0.00 0.00 0.00 175.76 175.45 4r1r s PHE 467 N -2.81 3.55 -0.65 0.00 0.08 0.70 0.12 117.98 118.97 4r1r s PHE 467 Ca -0.03 0.77 -0.25 0.00 0.12 0.00 0.00 56.93 57.54 4r1r s PHE 467 Cb -0.01 -2.37 0.05 0.00 -0.57 0.00 0.00 43.02 40.12 4r1r s PHE 467 CO -0.05 0.34 1.06 1.21 -0.10 0.00 0.00 175.22 177.69 4r1r s ASN 468 N 0.07 6.23 0.24 1.36 3.84 -0.07 -1.80 114.94 124.82 4r1r s ASN 468 Ca 0.21 -0.60 0.20 0.00 0.21 0.00 0.00 52.86 52.88 4r1r s ASN 468 Cb -0.14 -2.47 0.95 0.00 -0.55 0.00 0.00 41.25 39.04 4r1r s ASN 468 CO 0.08 -1.50 1.61 0.18 -2.79 0.00 0.00 177.10 174.67 4r1r n LEU 469 N 8.17 0.52 -0.36 3.21 4.77 -1.00 -1.60 117.00 130.71 4r1r n LEU 469 Ca 0.00 0.68 0.14 0.00 -0.03 0.00 0.00 56.01 56.80 4r1r n LEU 469 Cb 0.47 -0.68 0.51 0.00 -2.33 0.00 0.00 43.42 41.40 4r1r n LEU 469 CO 0.66 -0.71 0.82 0.61 -1.33 0.00 0.00 177.39 177.45 4r1r n GLY 470 N -0.70 -0.30 0.53 -0.72 0.00 -1.26 -3.95 105.19 98.79 4r1r n GLY 470 Ca 0.00 -0.41 0.05 0.00 0.00 0.00 0.00 46.02 45.67 4r1r n GLY 470 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4r1r n ALA 471 N -0.21 2.29 -2.56 4.61 0.00 -0.63 -4.98 120.51 119.02 4r1r n ALA 471 Ca 0.17 -0.93 -0.32 0.00 0.00 0.00 0.00 53.44 52.36 4r1r n ALA 471 Cb 0.33 -0.39 -0.11 0.00 0.00 0.00 0.00 19.45 19.28 4r1r n ALA 471 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 4r1r s ILE 472 N -0.95 3.51 -0.15 0.00 -4.36 -1.25 -4.86 121.20 113.13 4r1r s ILE 472 Ca 0.18 -0.75 -0.27 0.00 -0.26 0.00 0.00 60.65 59.56 4r1r s ILE 472 Cb 0.10 -2.48 -0.24 0.00 1.25 0.00 0.00 42.46 41.09 4r1r s ILE 472 CO 0.14 0.45 0.64 0.78 0.24 0.00 0.00 174.94 177.19 4r1r h ASN 473 N 4.77 0.00 -3.80 4.36 2.35 -1.93 -3.48 115.58 117.86 4r1r h ASN 473 Ca -0.48 -0.87 -0.35 0.00 -0.55 0.00 0.00 56.30 54.05 4r1r h ASN 473 Cb 1.17 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 39.39 4r1r h ASN 473 CO 0.52 1.07 -0.72 0.54 -1.65 0.00 0.00 177.43 177.20 4r1r s ASN 474 N -6.31 1.97 0.51 5.81 2.20 -1.26 -5.05 114.94 112.80 4r1r s ASN 474 Ca -0.20 -1.01 0.34 0.00 -0.94 0.00 0.00 52.86 51.05 4r1r s ASN 474 Cb -0.01 -0.04 1.71 0.00 -2.00 0.00 0.00 41.25 40.91 4r1r s ASN 474 CO 0.65 -0.29 2.03 -0.07 -2.94 0.00 0.00 177.10 176.47 4r1r h LEU 475 N 2.74 0.00 0.00 3.54 3.38 -2.01 -2.48 115.31 120.47 4r1r h LEU 475 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 4r1r h LEU 475 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 4r1r h LEU 475 CO 0.63 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.63 4r1r n ASP 476 N -2.77 0.00 0.22 -0.43 8.00 -1.26 -2.18 116.55 118.13 4r1r n ASP 476 Ca -0.01 -0.69 0.10 0.00 0.71 0.00 0.00 54.79 54.90 4r1r n ASP 476 Cb 0.13 -0.07 0.37 0.00 -0.02 0.00 0.00 41.12 41.54 4r1r n ASP 476 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 4r1r h GLU 477 N 0.00 0.00 0.00 -1.24 5.08 -1.88 -3.12 114.58 113.42 4r1r h GLU 477 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 4r1r h GLU 477 Cb 0.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 4r1r h GLU 477 CO 0.00 0.20 -0.08 -0.07 -1.00 0.00 0.00 179.01 178.06 4r1r h LEU 478 N 0.00 0.00 0.43 1.33 3.38 -1.66 -2.88 115.31 115.92 4r1r h LEU 478 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 4r1r h LEU 478 Cb 0.86 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 4r1r h LEU 478 CO 0.03 0.08 -0.28 -0.08 0.09 0.00 0.00 178.44 178.27 4r1r h GLU 479 N 0.00 -0.67 -0.31 1.13 4.81 -1.76 0.31 114.58 118.09 4r1r h GLU 479 Ca -0.00 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 4r1r h GLU 479 Cb 0.39 0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 4r1r h GLU 479 CO 0.01 -0.45 0.20 0.93 -0.73 0.00 0.00 179.01 178.97 4r1r h GLU 480 N -0.69 0.42 -0.78 1.92 3.07 -1.75 -2.35 114.58 114.41 4r1r h GLU 480 Ca -0.05 -0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 58.78 4r1r h GLU 480 Cb 0.58 -0.09 -0.04 0.00 -0.84 0.00 0.00 28.75 28.36 4r1r h GLU 480 CO 0.03 0.30 0.47 -0.07 -1.40 0.00 0.00 179.01 178.34 4r1r h LEU 481 N 0.41 0.94 -0.44 1.33 3.38 -1.40 -1.70 115.31 117.83 4r1r h LEU 481 Ca 0.11 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 4r1r h LEU 481 Cb -0.02 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 4r1r h LEU 481 CO -0.02 0.73 0.04 0.00 0.09 0.00 0.00 178.44 179.28 4r1r h ALA 482 N 1.25 0.59 0.02 1.53 0.00 -0.19 0.14 119.26 122.61 4r1r h ALA 482 Ca 0.28 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.98 4r1r h ALA 482 Cb -0.04 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.53 4r1r h ALA 482 CO -0.05 0.34 -0.45 0.82 0.00 0.00 0.00 179.25 179.91 4r1r h ILE 483 N 0.61 0.12 -0.40 0.00 2.04 -1.06 0.43 117.51 119.24 4r1r h ILE 483 Ca 0.13 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.03 4r1r h ILE 483 Cb 0.43 0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 36.58 4r1r h ILE 483 CO 0.01 0.00 0.17 -0.07 0.00 0.00 0.00 178.15 178.27 4r1r h LEU 484 N -0.61 0.22 0.14 1.44 4.07 -1.18 -0.35 115.31 119.04 4r1r h LEU 484 Ca 0.04 0.03 -0.01 0.00 0.08 0.00 0.00 57.88 58.02 4r1r h LEU 484 Cb 0.68 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.42 4r1r h LEU 484 CO -0.32 0.17 -0.07 0.00 -1.08 0.00 0.00 178.44 177.15 4r1r h ALA 485 N 1.24 -0.18 0.01 1.53 0.00 -0.55 -1.63 119.26 119.68 4r1r h ALA 485 Ca 0.18 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 4r1r h ALA 485 Cb 0.13 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.99 4r1r h ALA 485 CO -0.15 -0.58 -0.01 0.28 0.00 0.00 0.00 179.25 178.79 4r1r h VAL 486 N -0.24 1.11 -0.58 0.00 2.07 -0.81 -2.15 116.25 115.65 4r1r h VAL 486 Ca -0.02 -0.37 0.03 0.00 0.82 0.00 0.00 66.70 67.16 4r1r h VAL 486 Cb 0.19 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 4r1r h VAL 486 CO 0.03 0.09 0.35 0.03 0.02 0.00 0.00 177.57 178.10 4r1r h ARG 487 N -0.17 0.68 -0.45 1.57 3.08 -1.06 -0.27 114.38 117.75 4r1r h ARG 487 Ca -0.00 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 4r1r h ARG 487 Cb 0.17 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 4r1r h ARG 487 CO 0.00 0.45 0.15 0.00 -1.07 0.00 0.00 179.97 179.50 4r1r h ALA 488 N 1.26 0.59 -0.08 0.04 0.00 -1.26 -2.14 119.26 117.67 4r1r h ALA 488 Ca 0.24 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 4r1r h ALA 488 Cb 0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 4r1r h ALA 488 CO -0.10 0.24 -0.62 -0.07 0.00 0.00 0.00 179.25 178.69 4r1r h LEU 489 N 0.60 0.32 -0.96 0.00 3.38 -1.00 -2.36 115.31 115.28 4r1r h LEU 489 Ca 0.15 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 4r1r h LEU 489 Cb 0.26 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 4r1r h LEU 489 CO -0.01 0.86 0.01 -0.78 0.09 0.00 0.00 178.44 178.62 4r1r h ASP 490 N 0.20 0.73 -0.66 -0.43 3.58 -0.95 -1.95 116.42 116.95 4r1r h ASP 490 Ca -0.01 -0.17 -0.07 0.00 0.42 0.00 0.00 57.03 57.21 4r1r h ASP 490 Cb 1.14 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 41.97 4r1r h ASP 490 CO 0.10 0.79 0.15 0.00 -2.88 0.00 0.00 179.24 177.40 4r1r h ALA 491 N 1.29 0.87 -0.96 -0.78 0.00 -1.21 -2.58 119.26 115.90 4r1r h ALA 491 Ca 0.14 -0.24 0.09 0.00 0.00 0.00 0.00 54.91 54.90 4r1r h ALA 491 Cb 0.42 -0.25 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 4r1r h ALA 491 CO 0.02 0.59 0.62 1.25 0.00 0.00 0.00 179.25 181.73 4r1r h LEU 492 N 0.98 0.93 -1.77 0.00 5.85 -0.83 -1.24 115.31 119.24 4r1r h LEU 492 Ca 0.21 0.02 0.07 0.00 0.84 0.00 0.00 57.88 59.01 4r1r h LEU 492 Cb 0.38 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 4r1r h LEU 492 CO 0.00 0.56 0.28 -0.07 -0.34 0.00 0.00 178.44 178.88 4r1r h LEU 493 N 1.04 0.24 0.00 2.25 3.38 -1.03 0.06 115.31 121.26 4r1r h LEU 493 Ca 0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.41 4r1r h LEU 493 Cb 0.31 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.01 4r1r h LEU 493 CO -0.19 0.16 -0.57 0.44 0.09 0.00 0.00 178.44 178.37 4r1r h ASP 494 N 0.28 0.00 0.19 -0.43 3.32 -1.31 -3.38 116.42 115.09 4r1r h ASP 494 Ca 0.19 -0.17 -0.28 0.00 0.02 0.00 0.00 57.03 56.79 4r1r h ASP 494 Cb 0.39 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.96 4r1r h ASP 494 CO -0.04 0.09 -1.25 0.22 -1.72 0.00 0.00 179.24 176.54 4r1r h TYR 495 N 0.00 0.74 -4.40 4.55 3.20 -0.46 -3.48 116.97 117.12 4r1r h TYR 495 Ca 0.00 -0.54 -0.49 0.00 3.14 0.00 0.00 58.73 60.84 4r1r h TYR 495 Cb 0.77 -0.03 0.09 0.00 1.54 0.00 0.00 36.73 39.10 4r1r h TYR 495 CO 0.00 1.48 0.38 1.14 -1.64 0.00 0.00 178.16 179.52 4r1r s GLN 496 N -2.52 2.48 0.16 1.82 -2.07 -0.88 -4.96 119.66 113.69 4r1r s GLN 496 Ca -0.13 0.53 -0.03 0.00 -1.82 0.00 0.00 55.36 53.91 4r1r s GLN 496 Cb 0.03 -1.97 -0.05 0.00 -1.09 0.00 0.00 33.01 29.93 4r1r s GLN 496 CO 0.88 -1.32 0.37 -0.51 -1.32 0.00 0.00 175.29 173.39 4r1r s ASP 497 N -4.17 6.43 -0.28 12.60 1.01 -0.22 -5.02 116.67 127.03 4r1r s ASP 497 Ca 0.59 0.49 0.02 0.00 0.71 0.00 0.00 52.55 54.36 4r1r s ASP 497 Cb -0.12 -2.05 0.08 0.00 1.01 0.00 0.00 42.92 41.84 4r1r s ASP 497 CO 0.53 0.02 -0.01 -0.31 0.21 0.00 0.00 175.17 175.61 4r1r s TYR 498 N -1.74 2.82 0.23 4.23 2.02 -1.26 -4.87 117.35 118.79 4r1r s TYR 498 Ca 0.39 -2.21 0.27 0.00 -0.37 0.00 0.00 57.07 55.15 4r1r s TYR 498 Cb -0.12 -2.05 1.18 0.00 -0.40 0.00 0.00 41.96 40.57 4r1r s TYR 498 CO 0.27 -0.86 1.94 -1.00 -1.57 0.00 0.00 175.55 174.32 4r1r h PRO 499 N 7.85 0.00 -4.54 -1.71 0.13 -2.00 -3.42 132.00 128.31 4r1r h PRO 499 Ca -0.13 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.44 4r1r h PRO 499 Cb 1.04 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.82 4r1r h PRO 499 CO 0.46 0.16 -0.82 0.42 -0.23 0.00 0.00 178.00 177.99 4r1r s ILE 500 N -3.82 1.30 0.19 -3.56 1.01 -1.26 -5.05 121.20 110.01 4r1r s ILE 500 Ca -0.01 -0.50 -0.16 0.00 0.00 0.00 0.00 60.65 59.98 4r1r s ILE 500 Cb 0.11 -1.23 0.18 0.00 0.01 0.00 0.00 42.46 41.53 4r1r s ILE 500 CO 0.60 0.41 1.31 -2.65 0.00 0.00 0.00 174.94 174.61 4r1r n PRO 501 N 4.44 -0.22 -0.04 2.79 -0.02 -1.26 -0.41 135.00 140.28 4r1r n PRO 501 Ca -0.17 1.30 0.13 0.00 -2.02 0.00 0.00 63.50 62.74 4r1r n PRO 501 Cb 0.51 -1.93 0.55 0.00 -0.02 0.00 0.00 33.50 32.61 4r1r n PRO 501 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 4r1r h ALA 502 N 1.09 2.12 -0.07 3.55 0.00 -1.81 -1.21 119.26 122.92 4r1r h ALA 502 Ca 0.28 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 55.00 4r1r h ALA 502 Cb 0.49 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.24 4r1r h ALA 502 CO -0.84 -0.25 -0.63 0.00 0.00 0.00 0.00 179.25 177.54 4r1r h ALA 503 N 1.72 0.18 -0.58 0.00 0.00 -0.92 -2.48 119.26 117.17 4r1r h ALA 503 Ca 0.25 -0.56 0.07 0.00 0.00 0.00 0.00 54.91 54.68 4r1r h ALA 503 Cb 0.61 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 4r1r h ALA 503 CO -0.06 0.45 0.27 -0.22 0.00 0.00 0.00 179.25 179.69 4r1r h LYS 504 N 0.16 0.48 -0.53 0.00 3.64 -1.14 -1.91 116.57 117.27 4r1r h LYS 504 Ca -0.06 -0.03 0.11 0.00 -1.27 0.00 0.00 60.65 59.40 4r1r h LYS 504 Cb 1.29 -0.11 -0.10 0.00 -0.41 0.00 0.00 32.23 32.90 4r1r h LYS 504 CO 0.13 0.32 -0.13 0.00 -2.27 0.00 0.00 179.45 177.50 4r1r h ARG 505 N 0.49 0.01 -0.32 1.90 2.47 -1.18 0.49 114.38 118.24 4r1r h ARG 505 Ca 0.28 -0.00 -0.10 0.00 -1.26 0.00 0.00 59.98 58.90 4r1r h ARG 505 Cb 0.26 -0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.57 4r1r h ARG 505 CO -0.23 0.00 -0.18 0.78 0.56 0.00 0.00 179.97 180.90 4r1r h GLY 506 N 0.01 0.75 0.86 0.04 0.00 -1.30 -0.88 103.07 102.55 4r1r h GLY 506 Ca 0.26 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.86 4r1r h GLY 506 CO -0.55 0.63 0.03 0.00 0.00 0.00 0.00 176.54 176.65 4r1r h ALA 507 N 0.76 0.35 -0.01 3.60 0.00 -0.74 -1.38 119.26 121.84 4r1r h ALA 507 Ca 0.07 -0.20 -0.15 0.00 0.00 0.00 0.00 54.91 54.63 4r1r h ALA 507 Cb 0.72 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 4r1r h ALA 507 CO 0.05 0.05 -0.69 0.52 0.00 0.00 0.00 179.25 179.19 4r1r h MET 508 N 0.24 0.07 0.06 0.00 2.86 -0.99 -0.10 114.93 117.07 4r1r h MET 508 Ca 0.08 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 4r1r h MET 508 Cb 0.36 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.04 4r1r h MET 508 CO 0.01 0.73 -0.03 0.78 1.06 0.00 0.00 176.91 179.46 4r1r h GLY 509 N 1.89 -0.08 0.00 8.32 0.00 -1.05 -3.37 103.07 108.78 4r1r h GLY 509 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.35 4r1r h GLY 509 CO 0.10 -0.03 -0.64 0.54 0.00 0.00 0.00 176.54 176.51 4r1r n ARG 510 N -4.90 3.14 -4.24 4.80 1.74 -0.53 0.06 116.66 116.73 4r1r n ARG 510 Ca -0.08 -0.02 -0.35 0.00 -0.77 0.00 0.00 57.85 56.63 4r1r n ARG 510 Cb 0.25 -1.02 -0.06 0.00 -1.02 0.00 0.00 32.46 30.61 4r1r n ARG 510 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 4r1r n ARG 511 N -1.34 -0.82 -2.63 5.56 1.74 -0.05 -0.70 116.66 118.41 4r1r n ARG 511 Ca 0.01 0.09 -0.41 0.00 -0.77 0.00 0.00 57.85 56.78 4r1r n ARG 511 Cb 0.17 -3.31 -0.04 0.00 -1.02 0.00 0.00 32.46 28.25 4r1r n ARG 511 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 4r1r s THR 512 N -4.14 4.14 0.23 0.55 -4.23 -1.26 -4.01 115.64 106.92 4r1r s THR 512 Ca 0.14 1.86 0.09 0.00 -1.18 0.00 0.00 61.69 62.59 4r1r s THR 512 Cb -0.08 -4.19 -0.05 0.00 1.34 0.00 0.00 72.50 69.53 4r1r s THR 512 CO 0.99 0.32 -0.15 -0.76 -0.54 0.00 0.00 174.62 174.48 4r1r s LEU 513 N -0.34 2.56 -0.34 4.79 1.43 0.99 -3.73 118.68 124.04 4r1r s LEU 513 Ca 0.47 -1.04 -0.01 0.00 -1.03 0.00 0.00 54.13 52.53 4r1r s LEU 513 Cb -0.27 -0.79 0.13 0.00 0.03 0.00 0.00 46.19 45.29 4r1r s LEU 513 CO 0.33 -0.13 0.20 -0.83 0.23 0.00 0.00 176.35 176.14 4r1r s GLY 514 N -3.38 0.81 -0.13 -3.19 0.00 0.84 -3.49 107.32 98.78 4r1r s GLY 514 Ca 0.25 -1.74 -0.05 0.00 0.00 0.00 0.00 44.72 43.19 4r1r s GLY 514 CO 0.10 2.07 0.04 -0.42 0.00 0.00 0.00 173.10 174.88 4r1r s ILE 515 N 1.24 4.58 0.00 0.90 1.01 0.54 -2.69 121.20 126.78 4r1r s ILE 515 Ca 0.16 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.68 4r1r s ILE 515 Cb -0.22 -2.99 0.00 0.00 0.01 0.00 0.00 42.46 39.26 4r1r s ILE 515 CO -0.06 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.03 4r1r n GLY 516 N 2.76 5.56 3.31 6.18 0.00 0.21 -1.53 105.19 121.68 4r1r n GLY 516 Ca -0.18 -1.43 -0.18 0.00 0.00 0.00 0.00 46.02 44.23 4r1r n GLY 516 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 4r1r s VAL 517 N 0.10 1.61 0.15 1.61 -7.23 -1.26 -0.21 120.40 115.16 4r1r s VAL 517 Ca 0.00 -2.07 0.03 0.00 -1.81 0.00 0.00 61.98 58.13 4r1r s VAL 517 Cb 0.00 -1.90 -0.04 0.00 0.56 0.00 0.00 36.38 34.99 4r1r s VAL 517 CO 0.00 -0.54 -0.06 0.27 -0.31 0.00 0.00 175.10 174.46 4r1r s ILE 518 N -2.74 0.90 -0.72 -0.62 -4.36 -0.74 -4.20 121.20 108.72 4r1r s ILE 518 Ca 0.18 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.57 4r1r s ILE 518 Cb -0.02 -1.92 0.00 0.00 1.25 0.00 0.00 42.46 41.78 4r1r s ILE 518 CO 0.05 -0.68 0.00 -3.20 0.24 0.00 0.00 174.94 171.36 4r1r n ASN 519 N -0.19 -3.67 -0.03 4.36 2.85 0.20 -2.36 115.26 116.42 4r1r n ASN 519 Ca -0.09 0.15 -0.09 0.00 -0.11 0.00 0.00 54.58 54.43 4r1r n ASN 519 Cb 0.62 -1.96 -0.03 0.00 1.24 0.00 0.00 39.78 39.65 4r1r n ASN 519 CO 0.00 0.00 0.00 0.15 -2.11 0.00 0.00 177.26 175.30 4r1r h PHE 520 N 0.00 0.05 -0.24 1.20 3.57 -1.74 -1.98 116.94 117.80 4r1r h PHE 520 Ca -0.15 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.42 4r1r h PHE 520 Cb 0.55 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.23 4r1r h PHE 520 CO 0.19 0.01 -0.12 0.00 -2.23 0.00 0.00 178.31 176.17 4r1r h ALA 521 N 1.12 0.07 -0.32 2.41 0.00 -1.81 0.11 119.26 120.84 4r1r h ALA 521 Ca 0.07 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.13 4r1r h ALA 521 Cb 0.07 0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 4r1r h ALA 521 CO -0.10 -0.54 0.03 -0.92 0.00 0.00 0.00 179.25 177.72 4r1r h TYR 522 N -0.10 0.04 -0.33 0.00 3.20 -1.91 0.73 116.97 118.60 4r1r h TYR 522 Ca 0.13 0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.09 4r1r h TYR 522 Cb 0.29 0.03 -0.07 0.00 1.54 0.00 0.00 36.73 38.52 4r1r h TYR 522 CO -0.30 -0.02 -0.15 -0.92 -1.64 0.00 0.00 178.16 175.13 4r1r h TYR 523 N 0.13 -0.35 -0.80 -3.82 3.20 -0.41 0.26 116.97 115.18 4r1r h TYR 523 Ca 0.16 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 62.04 4r1r h TYR 523 Cb 0.19 0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.63 4r1r h TYR 523 CO -0.21 -0.22 0.43 -0.07 -1.64 0.00 0.00 178.16 176.45 4r1r h LEU 524 N -0.09 1.00 -0.04 2.82 3.38 -0.31 -2.67 115.31 119.41 4r1r h LEU 524 Ca 0.17 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.05 4r1r h LEU 524 Cb 0.35 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 4r1r h LEU 524 CO -0.39 0.81 0.01 0.00 0.09 0.00 0.00 178.44 178.96 4r1r h ALA 525 N 1.35 0.04 0.00 1.53 0.00 0.10 -0.40 119.26 121.88 4r1r h ALA 525 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 4r1r h ALA 525 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 4r1r h ALA 525 CO -0.04 -0.47 0.00 0.36 0.00 0.00 0.00 179.25 179.09 4r1r n LYS 526 N -5.08 0.12 -0.30 0.00 2.85 -0.14 -0.78 118.16 114.83 4r1r n LYS 526 Ca -0.06 0.16 0.08 0.00 -1.05 0.00 0.00 58.31 57.43 4r1r n LYS 526 Cb 0.04 -1.50 0.23 0.00 -0.65 0.00 0.00 35.03 33.14 4r1r n LYS 526 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 4r1r n HIS 527 N -1.40 0.74 -3.45 5.58 8.25 -0.89 -4.98 115.22 119.07 4r1r n HIS 527 Ca 0.06 -0.55 -0.24 0.00 -0.26 0.00 0.00 57.72 56.73 4r1r n HIS 527 Cb 0.18 -0.07 0.06 0.00 1.12 0.00 0.00 29.99 31.27 4r1r n HIS 527 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 4r1r n GLY 528 N 0.74 -0.53 3.49 -1.41 0.00 0.04 -5.01 105.19 102.51 4r1r n GLY 528 Ca 0.17 0.21 -0.24 0.00 0.00 0.00 0.00 46.02 46.16 4r1r n GLY 528 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4r1r s LYS 529 N -6.16 1.74 0.45 1.61 -0.14 -0.21 -5.04 119.74 112.00 4r1r s LYS 529 Ca 0.51 -1.74 0.03 0.00 -1.36 0.00 0.00 55.97 53.41 4r1r s LYS 529 Cb -0.23 -1.80 -0.04 0.00 -1.68 0.00 0.00 37.83 34.08 4r1r s LYS 529 CO 0.62 0.33 0.03 1.03 -0.76 0.00 0.00 175.35 176.60 4r1r s ARG 530 N -3.53 2.05 -0.14 1.68 0.52 -1.26 -4.18 118.95 114.10 4r1r s ARG 530 Ca 0.30 -2.25 -0.15 0.00 -0.52 0.00 0.00 55.73 53.11 4r1r s ARG 530 Cb -0.05 -1.38 -0.25 0.00 0.52 0.00 0.00 34.95 33.79 4r1r s ARG 530 CO 0.15 -0.28 0.42 1.88 0.02 0.00 0.00 175.30 177.50 4r1r h TYR 531 N 1.59 0.32 0.00 -0.53 -1.99 -1.96 -3.33 116.97 111.07 4r1r h TYR 531 Ca -0.43 -0.24 -0.03 0.00 2.00 0.00 0.00 58.73 60.04 4r1r h TYR 531 Cb 1.28 -0.01 -0.00 0.00 2.00 0.00 0.00 36.73 40.00 4r1r h TYR 531 CO 1.23 1.59 -0.15 0.66 -0.00 0.00 0.00 178.16 181.48 4r1r h SER 532 N -0.41 0.00 -0.03 3.88 4.64 -1.93 -3.24 113.55 116.46 4r1r h SER 532 Ca -0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 4r1r h SER 532 Cb 1.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.78 4r1r h SER 532 CO -0.01 0.15 -0.06 -0.90 -0.87 0.00 0.00 176.83 175.14 4r1r n ASP 533 N -3.16 2.83 0.00 4.97 5.68 -1.26 -3.95 116.55 121.65 4r1r n ASP 533 Ca 0.03 -1.92 0.00 0.00 -0.50 0.00 0.00 54.79 52.40 4r1r n ASP 533 Cb 0.54 0.06 0.00 0.00 -1.14 0.00 0.00 41.12 40.58 4r1r n ASP 533 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 4r1r n GLY 534 N 1.35 0.72 0.25 6.12 0.00 -1.26 -4.94 105.19 107.43 4r1r n GLY 534 Ca 0.14 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.32 4r1r n GLY 534 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 4r1r h SER 535 N 0.00 0.00 -0.02 1.61 4.64 -1.89 -2.65 113.55 115.24 4r1r h SER 535 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 4r1r h SER 535 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 4r1r h SER 535 CO 0.00 0.00 -0.05 0.00 -0.87 0.00 0.00 176.83 175.91 4r1r n ALA 536 N -1.97 2.58 -0.02 5.18 0.00 -1.25 -4.73 120.51 120.30 4r1r n ALA 536 Ca -0.01 -0.64 -0.14 0.00 0.00 0.00 0.00 53.44 52.65 4r1r n ALA 536 Cb 0.16 -0.65 -0.09 0.00 0.00 0.00 0.00 19.45 18.87 4r1r n ALA 536 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 4r1r h ASN 537 N 3.52 -1.65 -0.72 0.00 4.21 -1.81 0.19 115.58 119.32 4r1r h ASN 537 Ca 0.00 0.20 -0.04 0.00 1.21 0.00 0.00 56.30 57.67 4r1r h ASN 537 Cb 0.77 0.65 -0.03 0.00 -1.12 0.00 0.00 38.32 38.59 4r1r h ASN 537 CO 0.00 -0.45 0.29 0.78 -1.29 0.00 0.00 177.43 176.76 4r1r h ASN 538 N -0.53 1.01 -0.67 5.81 2.35 -1.85 0.05 115.58 121.76 4r1r h ASN 538 Ca 0.03 -0.15 -0.06 0.00 -0.55 0.00 0.00 56.30 55.58 4r1r h ASN 538 Cb 0.63 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.71 4r1r h ASN 538 CO -0.43 0.90 0.19 0.25 -1.65 0.00 0.00 177.43 176.69 4r1r h LEU 539 N 1.07 0.99 -0.59 1.61 5.85 -1.76 0.23 115.31 122.71 4r1r h LEU 539 Ca 0.25 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 4r1r h LEU 539 Cb 0.21 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 4r1r h LEU 539 CO -0.02 0.95 0.29 0.74 -0.34 0.00 0.00 178.44 180.06 4r1r h THR 540 N 0.99 1.21 -0.52 1.05 2.02 0.18 0.20 112.91 118.03 4r1r h THR 540 Ca 0.21 -0.59 0.01 0.00 0.77 0.00 0.00 66.41 66.81 4r1r h THR 540 Cb 0.32 0.50 -0.03 0.00 -1.74 0.00 0.00 68.15 67.21 4r1r h THR 540 CO -0.00 0.24 0.34 -0.74 0.37 0.00 0.00 175.52 175.73 4r1r h HIS 541 N 0.81 0.65 -0.14 3.16 -0.00 -0.56 0.66 115.15 119.72 4r1r h HIS 541 Ca 0.20 0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.59 4r1r h HIS 541 Cb 0.11 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 27.30 4r1r h HIS 541 CO -0.00 0.41 0.07 -0.22 -0.00 0.00 0.00 177.93 178.19 4r1r h LYS 542 N 0.70 0.21 -0.69 5.26 3.64 -0.52 -1.69 116.57 123.47 4r1r h LYS 542 Ca 0.19 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 4r1r h LYS 542 Cb -0.08 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.67 4r1r h LYS 542 CO -0.04 0.25 0.35 1.15 -2.27 0.00 0.00 179.45 178.88 4r1r h THR 543 N 0.11 1.23 0.00 1.00 2.02 -0.22 -2.38 112.91 114.67 4r1r h THR 543 Ca 0.05 -0.62 -0.05 0.00 0.77 0.00 0.00 66.41 66.56 4r1r h THR 543 Cb 0.11 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 4r1r h THR 543 CO -0.01 0.26 -0.22 -0.26 0.37 0.00 0.00 175.52 175.66 4r1r h PHE 544 N 0.96 0.00 -0.33 3.16 0.04 -0.82 -2.80 116.94 117.15 4r1r h PHE 544 Ca 0.24 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.96 4r1r h PHE 544 Cb 0.10 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.24 4r1r h PHE 544 CO 0.00 0.22 -0.00 1.49 -0.60 0.00 0.00 178.31 179.43 4r1r h GLU 545 N 0.00 0.59 0.01 1.51 4.81 -0.99 -1.59 114.58 118.92 4r1r h GLU 545 Ca -0.00 -0.19 0.02 0.00 -0.13 0.00 0.00 59.36 59.06 4r1r h GLU 545 Cb 1.15 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 4r1r h GLU 545 CO 0.03 0.72 -0.17 0.00 -0.73 0.00 0.00 179.01 178.86 4r1r h ALA 546 N 0.85 -0.21 -0.05 2.92 0.00 -1.34 0.11 119.26 121.54 4r1r h ALA 546 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.04 4r1r h ALA 546 Cb 0.45 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 4r1r h ALA 546 CO 0.02 -0.66 -0.18 0.82 0.00 0.00 0.00 179.25 179.25 4r1r h ILE 547 N -0.28 0.56 -0.61 0.00 2.04 -1.35 -0.03 117.51 117.85 4r1r h ILE 547 Ca 0.05 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.83 4r1r h ILE 547 Cb 0.35 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 4r1r h ILE 547 CO -0.16 0.00 0.06 -0.61 0.00 0.00 0.00 178.15 177.44 4r1r h GLN 548 N -0.26 1.04 0.51 2.37 5.75 -1.09 -2.13 115.11 121.30 4r1r h GLN 548 Ca 0.07 -0.30 -0.02 0.00 -0.15 0.00 0.00 58.65 58.25 4r1r h GLN 548 Cb 0.36 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.79 4r1r h GLN 548 CO -0.21 1.00 -0.37 -0.92 -2.65 0.00 0.00 178.83 175.68 4r1r h TYR 549 N 0.95 -0.99 0.00 3.99 3.20 -0.28 -1.76 116.97 122.08 4r1r h TYR 549 Ca 0.18 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.00 4r1r h TYR 549 Cb 0.49 0.37 -0.01 0.00 1.54 0.00 0.00 36.73 39.12 4r1r h TYR 549 CO 0.04 -0.54 -0.22 1.88 -1.64 0.00 0.00 178.16 177.67 4r1r h TYR 550 N -0.86 0.00 -0.26 -3.82 0.05 -1.04 -1.04 116.97 110.01 4r1r h TYR 550 Ca -0.05 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.66 4r1r h TYR 550 Cb 0.72 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.45 4r1r h TYR 550 CO -0.15 0.22 -0.08 -0.07 -1.05 0.00 0.00 178.16 177.04 4r1r h LEU 551 N 0.00 0.52 -0.58 3.88 3.38 -1.22 -0.26 115.31 121.03 4r1r h LEU 551 Ca -0.00 -0.38 -0.07 0.00 0.09 0.00 0.00 57.88 57.52 4r1r h LEU 551 Cb 0.41 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 4r1r h LEU 551 CO 0.03 0.78 0.09 -0.07 0.09 0.00 0.00 178.44 179.36 4r1r h LEU 552 N 0.25 0.92 -0.17 1.67 3.38 -1.00 -0.44 115.31 119.93 4r1r h LEU 552 Ca 0.06 -0.26 0.05 0.00 0.09 0.00 0.00 57.88 57.82 4r1r h LEU 552 Cb 0.57 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 4r1r h LEU 552 CO 0.03 0.95 -0.16 0.50 0.09 0.00 0.00 178.44 179.85 4r1r h LYS 553 N 0.86 -0.17 -0.12 1.13 3.64 -1.10 0.45 116.57 121.26 4r1r h LYS 553 Ca 0.18 0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.59 4r1r h LYS 553 Cb 0.42 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.26 4r1r h LYS 553 CO 0.01 -0.12 -0.04 0.00 -2.27 0.00 0.00 179.45 177.03 4r1r h ALA 554 N 0.91 0.06 -0.42 5.00 0.00 -0.62 0.28 119.26 124.47 4r1r h ALA 554 Ca 0.11 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 4r1r h ALA 554 Cb 0.34 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 4r1r h ALA 554 CO -0.28 -0.50 0.22 1.03 0.00 0.00 0.00 179.25 179.72 4r1r h SER 555 N -0.02 0.54 -0.50 0.00 0.87 -0.61 -0.53 113.55 113.30 4r1r h SER 555 Ca 0.06 -0.11 0.01 0.00 -1.23 0.00 0.00 61.79 60.53 4r1r h SER 555 Cb 0.12 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 61.91 4r1r h SER 555 CO -0.13 0.49 0.32 -1.13 -0.53 0.00 0.00 176.83 175.85 4r1r h ASN 556 N 0.55 0.53 -0.26 6.23 -0.73 0.28 -1.13 115.58 121.04 4r1r h ASN 556 Ca 0.15 -0.01 0.03 0.00 1.87 0.00 0.00 56.30 58.35 4r1r h ASN 556 Cb 0.09 -0.12 -0.03 0.00 0.27 0.00 0.00 38.32 38.52 4r1r h ASN 556 CO -0.02 0.38 0.06 -0.33 -0.37 0.00 0.00 177.43 177.15 4r1r h GLU 557 N 0.64 0.15 -0.79 6.67 4.39 0.02 -2.43 114.58 123.24 4r1r h GLU 557 Ca 0.19 -0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.96 4r1r h GLU 557 Cb -0.03 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.53 4r1r h GLU 557 CO -0.07 0.10 0.52 1.25 -1.16 0.00 0.00 179.01 179.65 4r1r h LEU 558 N 0.16 0.71 -0.72 1.33 5.85 -0.46 -0.90 115.31 121.27 4r1r h LEU 558 Ca 0.12 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 4r1r h LEU 558 Cb 0.12 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 4r1r h LEU 558 CO -0.15 0.44 0.04 0.00 -0.34 0.00 0.00 178.44 178.42 4r1r h ALA 559 N 1.59 0.93 -0.11 1.25 0.00 -0.77 0.22 119.26 122.36 4r1r h ALA 559 Ca 0.35 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 55.01 4r1r h ALA 559 Cb 0.34 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 4r1r h ALA 559 CO -0.13 0.65 -0.07 0.87 0.00 0.00 0.00 179.25 180.57 4r1r h LYS 560 N 0.94 -0.06 -0.22 0.00 1.57 -0.74 0.68 116.57 118.74 4r1r h LYS 560 Ca 0.18 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.93 4r1r h LYS 560 Cb 0.49 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 4r1r h LYS 560 CO 0.02 -0.04 0.00 1.49 -0.57 0.00 0.00 179.45 180.35 4r1r h GLU 561 N -0.07 0.39 0.00 3.15 4.81 -1.04 -3.39 114.58 118.43 4r1r h GLU 561 Ca 0.07 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 4r1r h GLU 561 Cb 0.17 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.51 4r1r h GLU 561 CO -0.16 0.57 0.00 1.04 -0.73 0.00 0.00 179.01 179.74 4r1r n GLN 562 N -4.67 0.41 0.00 1.92 6.02 0.75 -5.10 117.38 116.70 4r1r n GLN 562 Ca -0.04 -0.71 0.00 0.00 -0.01 0.00 0.00 57.00 56.24 4r1r n GLN 562 Cb 0.23 -0.88 0.00 0.00 1.02 0.00 0.00 30.24 30.61 4r1r n GLN 562 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 4r1r n GLY 563 N -0.14 0.36 3.66 1.08 0.00 0.24 -4.98 105.19 105.40 4r1r n GLY 563 Ca 0.00 -1.47 -0.29 0.00 0.00 0.00 0.00 46.02 44.27 4r1r n GLY 563 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4r1r s ALA 564 N -1.67 0.83 0.34 4.61 0.00 -1.25 -4.54 121.76 120.08 4r1r s ALA 564 Ca 0.00 -0.29 -0.28 0.00 0.00 0.00 0.00 51.96 51.39 4r1r s ALA 564 Cb 0.00 -3.14 -0.10 0.00 0.00 0.00 0.00 23.12 19.88 4r1r s ALA 564 CO 0.00 -2.92 1.23 0.00 0.00 0.00 0.00 175.76 174.07 4r1r n PRO 566 N 0.68 -0.31 -0.77 0.00 -0.02 -1.05 -0.76 135.00 132.76 4r1r n PRO 566 Ca 0.01 1.22 -0.15 0.00 -2.02 0.00 0.00 63.50 62.57 4r1r n PRO 566 Cb 0.44 -1.80 0.06 0.00 -0.02 0.00 0.00 33.50 32.17 4r1r n PRO 566 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 4r1r n TRP 567 N -5.05 1.54 0.20 6.00 8.01 0.11 -4.47 117.44 123.79 4r1r n TRP 567 Ca 0.03 -1.62 0.05 0.00 -1.31 0.00 0.00 57.50 54.65 4r1r n TRP 567 Cb 0.24 -0.80 0.50 0.00 -2.01 0.00 0.00 31.31 29.24 4r1r n TRP 567 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.69 177.03 4r1r h PHE 568 N 1.04 0.06 0.00 -5.99 3.57 -1.14 -2.07 116.94 112.40 4r1r h PHE 568 Ca 0.30 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.80 4r1r h PHE 568 Cb 1.36 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.08 4r1r h PHE 568 CO 0.80 0.19 0.00 0.27 -2.23 0.00 0.00 178.31 177.34 4r1r n ASN 569 N -4.36 0.37 -0.37 0.41 6.94 -1.26 -1.86 115.26 115.13 4r1r n ASN 569 Ca -0.02 0.65 0.14 0.00 -0.02 0.00 0.00 54.58 55.33 4r1r n ASN 569 Cb 0.22 -0.71 0.46 0.00 -2.36 0.00 0.00 39.78 37.39 4r1r n ASN 569 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 4r1r n GLU 570 N -1.97 1.28 -3.19 -3.83 1.02 -0.78 -4.93 120.64 108.25 4r1r n GLU 570 Ca -0.00 -0.75 -0.25 0.00 -0.02 0.00 0.00 57.16 56.14 4r1r n GLU 570 Cb 0.07 -1.48 -0.01 0.00 -0.02 0.00 0.00 31.44 29.99 4r1r n GLU 570 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 4r1r s THR 571 N -2.23 5.04 0.13 2.62 -4.23 -0.78 -1.64 115.64 114.55 4r1r s THR 571 Ca 0.32 -0.21 0.16 0.00 -1.18 0.00 0.00 61.69 60.77 4r1r s THR 571 Cb 0.20 -3.84 0.07 0.00 1.34 0.00 0.00 72.50 70.26 4r1r s THR 571 CO 0.42 -0.59 1.62 0.71 -0.54 0.00 0.00 174.62 176.24 4r1r h THR 572 N 0.72 1.04 -0.65 3.99 1.35 -0.76 -2.98 112.91 115.63 4r1r h THR 572 Ca -0.49 -1.90 0.06 0.00 -0.55 0.00 0.00 66.41 63.53 4r1r h THR 572 Cb 1.21 2.13 -0.06 0.00 -1.73 0.00 0.00 68.15 69.70 4r1r h THR 572 CO 0.62 0.48 0.35 1.88 -0.25 0.00 0.00 175.52 178.60 4r1r h TYR 573 N 0.00 0.64 -0.85 4.73 0.05 -1.69 -1.14 116.97 118.71 4r1r h TYR 573 Ca -0.00 0.02 0.21 0.00 0.05 0.00 0.00 58.73 59.01 4r1r h TYR 573 Cb 1.09 -0.19 -0.05 0.00 1.01 0.00 0.00 36.73 38.58 4r1r h TYR 573 CO 0.00 0.30 0.58 0.00 -1.05 0.00 0.00 178.16 177.98 4r1r h ALA 574 N 1.35 2.38 -0.37 3.88 0.00 -1.73 0.13 119.26 124.90 4r1r h ALA 574 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 4r1r h ALA 574 Cb 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 4r1r h ALA 574 CO -0.19 -0.64 0.00 1.63 0.00 0.00 0.00 179.25 180.05 4r1r n LYS 575 N -4.44 1.97 -1.00 0.00 5.02 -0.48 -4.79 118.16 114.44 4r1r n LYS 575 Ca 0.18 -1.36 -0.00 0.00 -2.02 0.00 0.00 58.31 55.10 4r1r n LYS 575 Cb 0.73 -1.35 -0.00 0.00 -0.02 0.00 0.00 35.03 34.40 4r1r n LYS 575 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 4r1r n GLY 576 N 1.02 0.49 3.78 0.72 0.00 0.44 -5.03 105.19 106.60 4r1r n GLY 576 Ca 0.13 -0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 4r1r n GLY 576 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4r1r s ILE 577 N -1.99 4.92 0.28 -0.61 1.01 -0.88 -5.01 121.20 118.92 4r1r s ILE 577 Ca 0.00 1.16 0.10 0.00 0.00 0.00 0.00 60.65 61.91 4r1r s ILE 577 Cb 0.00 -3.89 -0.05 0.00 0.01 0.00 0.00 42.46 38.53 4r1r s ILE 577 CO 0.00 0.45 -0.16 -0.76 0.00 0.00 0.00 174.94 174.47 4r1r s LEU 578 N -0.37 2.60 0.25 2.97 1.43 -1.26 -3.73 118.68 120.57 4r1r s LEU 578 Ca 0.29 -1.07 -0.03 0.00 -1.03 0.00 0.00 54.13 52.30 4r1r s LEU 578 Cb -0.18 -0.97 0.51 0.00 0.03 0.00 0.00 46.19 45.58 4r1r s LEU 578 CO 0.16 -0.07 1.73 -0.65 0.23 0.00 0.00 176.35 177.76 4r1r h PRO 579 N 2.28 0.45 0.00 1.29 0.10 -1.93 0.53 132.00 134.73 4r1r h PRO 579 Ca -0.40 -0.03 0.00 0.00 0.10 0.00 0.00 66.00 65.67 4r1r h PRO 579 Cb 1.25 -0.10 0.00 0.00 0.10 0.00 0.00 31.00 32.25 4r1r h PRO 579 CO 0.63 0.30 0.00 0.44 0.10 0.00 0.00 178.00 179.47 4r1r n ILE 580 N -4.99 0.99 -0.01 4.15 -5.35 -1.26 -2.12 119.36 110.77 4r1r n ILE 580 Ca 0.16 0.25 0.10 0.00 -0.27 0.00 0.00 62.75 62.99 4r1r n ILE 580 Cb 0.45 -1.13 -0.17 0.00 -1.74 0.00 0.00 39.64 37.05 4r1r n ILE 580 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 4r1r n ASP 581 N -1.32 0.08 -0.26 7.28 8.00 0.19 -4.63 116.55 125.89 4r1r n ASP 581 Ca 0.03 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.56 4r1r n ASP 581 Cb 0.06 1.94 0.05 0.00 -0.02 0.00 0.00 41.12 43.15 4r1r n ASP 581 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 4r1r n THR 582 N -2.27 0.57 -0.90 -3.53 -2.24 -0.90 -5.01 114.28 100.01 4r1r n THR 582 Ca -0.05 -0.79 -0.30 0.00 -2.27 0.00 0.00 64.05 60.64 4r1r n THR 582 Cb 0.58 0.76 0.17 0.00 -2.10 0.00 0.00 70.33 69.74 4r1r n THR 582 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 4r1r s TYR 583 N -0.76 1.91 -0.21 4.78 -0.85 -1.16 -4.34 117.35 116.72 4r1r s TYR 583 Ca 0.09 1.47 -0.29 0.00 -0.52 0.00 0.00 57.07 57.82 4r1r s TYR 583 Cb 0.05 -3.19 -0.02 0.00 0.38 0.00 0.00 41.96 39.17 4r1r s TYR 583 CO 0.07 -2.77 1.55 0.21 -1.52 0.00 0.00 175.55 173.09 4r1r s LYS 584 N -4.73 3.88 0.51 -3.49 2.47 -1.26 -4.91 119.74 112.21 4r1r s LYS 584 Ca 0.65 1.66 0.24 0.00 -1.56 0.00 0.00 55.97 56.97 4r1r s LYS 584 Cb -0.21 -3.99 1.33 0.00 -1.46 0.00 0.00 37.83 33.50 4r1r s LYS 584 CO 0.59 -1.18 1.95 0.87 0.16 0.00 0.00 175.35 177.73 4r1r h LYS 585 N 10.23 0.10 -1.13 4.03 1.57 -1.91 -2.09 116.57 127.38 4r1r h LYS 585 Ca -0.33 -0.01 0.32 0.00 -1.87 0.00 0.00 60.65 58.77 4r1r h LYS 585 Cb 1.14 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.37 4r1r h LYS 585 CO 1.00 0.07 0.79 -0.44 -0.57 0.00 0.00 179.45 180.30 4r1r h ASP 586 N 0.10 0.10 -1.00 0.86 5.19 -1.91 0.53 116.42 120.29 4r1r h ASP 586 Ca 0.33 0.02 0.26 0.00 -0.62 0.00 0.00 57.03 57.01 4r1r h ASP 586 Cb 1.15 0.00 -0.07 0.00 0.18 0.00 0.00 39.33 40.59 4r1r h ASP 586 CO -0.04 0.02 0.67 -0.07 -3.12 0.00 0.00 179.24 176.70 4r1r h LEU 587 N 0.09 0.33 -1.39 1.55 3.38 -1.67 -1.43 115.31 116.17 4r1r h LEU 587 Ca 0.56 0.05 0.16 0.00 0.09 0.00 0.00 57.88 58.75 4r1r h LEU 587 Cb 2.06 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 42.73 4r1r h LEU 587 CO -0.08 0.09 0.57 0.44 0.09 0.00 0.00 178.44 179.55 4r1r h ASP 588 N 0.31 0.54 0.87 -0.43 3.32 -1.12 -1.32 116.42 118.60 4r1r h ASP 588 Ca 0.53 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.62 4r1r h ASP 588 Cb 1.52 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 41.00 4r1r h ASP 588 CO -0.19 0.26 0.00 0.71 -1.72 0.00 0.00 179.24 178.30 4r1r h THR 589 N 0.57 0.00 -0.08 0.35 1.35 -1.47 -3.22 112.91 110.41 4r1r h THR 589 Ca 0.45 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.99 4r1r h THR 589 Cb 0.87 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 4r1r h THR 589 CO -0.19 0.00 0.00 2.30 -0.25 0.00 0.00 175.52 177.38 4r1r n ILE 590 N -2.42 0.44 -3.71 6.82 -5.35 -0.51 -5.00 119.36 109.64 4r1r n ILE 590 Ca 0.02 -0.72 -0.12 0.00 -0.27 0.00 0.00 62.75 61.66 4r1r n ILE 590 Cb 0.27 0.84 -0.10 0.00 -1.74 0.00 0.00 39.64 38.91 4r1r n ILE 590 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 4r1r s ALA 591 N -0.69 -1.11 -0.23 -1.28 0.00 -1.13 -4.83 121.76 112.50 4r1r s ALA 591 Ca 0.08 1.44 0.02 0.00 0.00 0.00 0.00 51.96 53.51 4r1r s ALA 591 Cb 0.05 -0.86 0.02 0.00 0.00 0.00 0.00 23.12 22.33 4r1r s ALA 591 CO 0.07 -0.24 0.66 0.27 0.00 0.00 0.00 175.76 176.51 4r1r n ASN 592 N 3.59 1.36 -4.72 0.00 6.94 -1.26 -4.66 115.26 116.50 4r1r n ASN 592 Ca -0.18 -1.26 -0.43 0.00 -0.02 0.00 0.00 54.58 52.69 4r1r n ASN 592 Cb 0.56 -0.01 -0.02 0.00 -2.36 0.00 0.00 39.78 37.96 4r1r n ASN 592 CO 0.00 0.00 0.00 1.21 -1.03 0.00 0.00 177.26 177.44 4r1r n GLU 593 N 0.03 2.49 -1.90 -3.83 4.07 -1.26 -4.99 120.64 115.25 4r1r n GLU 593 Ca 0.01 0.89 -0.30 0.00 -0.06 0.00 0.00 57.16 57.70 4r1r n GLU 593 Cb 0.09 -2.63 0.04 0.00 -0.06 0.00 0.00 31.44 28.88 4r1r n GLU 593 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 4r1r s PRO 594 N -0.47 3.04 0.14 5.31 0.04 -1.26 -4.96 135.00 136.83 4r1r s PRO 594 Ca 0.65 0.52 -0.30 0.00 0.04 0.00 0.00 61.00 61.91 4r1r s PRO 594 Cb -0.54 -2.04 -0.06 0.00 0.04 0.00 0.00 34.50 31.89 4r1r s PRO 594 CO 0.49 -0.91 0.98 -0.51 0.04 0.00 0.00 177.00 177.09 4r1r s LEU 595 N -5.30 4.52 0.00 -3.56 1.43 -1.26 -4.88 118.68 109.62 4r1r s LEU 595 Ca 0.57 1.86 0.15 0.00 -1.03 0.00 0.00 54.13 55.69 4r1r s LEU 595 Cb -0.11 -3.59 -0.13 0.00 0.03 0.00 0.00 46.19 42.39 4r1r s LEU 595 CO 0.52 -0.06 0.70 1.41 0.23 0.00 0.00 176.35 179.15 4r1r n HIS 596 N 2.57 0.00 -4.23 0.29 8.25 -1.26 -5.00 115.22 115.84 4r1r n HIS 596 Ca 0.02 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.23 4r1r n HIS 596 Cb 0.48 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.52 4r1r n HIS 596 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 4r1r s TYR 597 N -2.34 2.81 -1.00 4.41 2.02 -1.26 -5.05 117.35 116.95 4r1r s TYR 597 Ca 0.07 -0.17 -0.23 0.00 -0.37 0.00 0.00 57.07 56.38 4r1r s TYR 597 Cb 0.12 -1.32 0.04 0.00 -0.40 0.00 0.00 41.96 40.40 4r1r s TYR 597 CO 0.58 0.55 1.51 0.34 -1.57 0.00 0.00 175.55 176.96 4r1r s ASP 598 N -3.25 6.32 0.16 2.29 -1.08 -1.26 -4.79 116.67 115.06 4r1r s ASP 598 Ca 0.29 -1.33 0.02 0.00 -0.52 0.00 0.00 52.55 51.00 4r1r s ASP 598 Cb -0.08 -2.57 -0.01 0.00 -1.46 0.00 0.00 42.92 38.80 4r1r s ASP 598 CO 0.19 -1.67 1.37 -0.50 0.52 0.00 0.00 175.17 175.09 4r1r h TRP 599 N 10.00 0.34 -0.14 -5.34 4.06 -1.99 -3.18 115.95 119.69 4r1r h TRP 599 Ca 0.18 -0.18 -0.10 0.00 2.06 0.00 0.00 58.89 60.84 4r1r h TRP 599 Cb 1.01 -0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 29.12 4r1r h TRP 599 CO 1.27 0.99 -0.35 0.93 -3.56 0.00 0.00 178.44 177.72 4r1r h GLU 600 N 0.13 0.29 -0.19 0.49 4.39 -1.99 0.37 114.58 118.07 4r1r h GLU 600 Ca -0.05 -0.12 -0.02 0.00 0.34 0.00 0.00 59.36 59.51 4r1r h GLU 600 Cb 1.50 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 30.13 4r1r h GLU 600 CO 0.14 0.61 0.05 0.00 -1.16 0.00 0.00 179.01 178.65 4r1r h ALA 601 N 1.38 0.25 -0.75 3.43 0.00 -1.97 -2.91 119.26 118.69 4r1r h ALA 601 Ca 0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 4r1r h ALA 601 Cb 0.74 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 4r1r h ALA 601 CO 0.06 -0.12 0.44 1.25 0.00 0.00 0.00 179.25 180.88 4r1r h LEU 602 N 0.12 0.92 -0.27 0.00 5.85 -1.43 -2.15 115.31 118.35 4r1r h LEU 602 Ca 0.06 -0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.77 4r1r h LEU 602 Cb 0.25 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 40.97 4r1r h LEU 602 CO -0.00 0.73 -0.22 -0.09 -0.34 0.00 0.00 178.44 178.51 4r1r h ARG 603 N 1.03 -0.21 -0.40 1.25 2.43 -0.14 -0.32 114.38 118.03 4r1r h ARG 603 Ca 0.27 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.49 4r1r h ARG 603 Cb -0.01 0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.55 4r1r h ARG 603 CO -0.05 -0.14 0.17 0.93 -1.51 0.00 0.00 179.97 179.38 4r1r h GLU 604 N -0.21 0.35 -0.57 0.20 4.39 -1.27 -1.96 114.58 115.50 4r1r h GLU 604 Ca 0.15 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.79 4r1r h GLU 604 Cb 0.44 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 4r1r h GLU 604 CO -0.40 0.23 0.20 1.03 -1.16 0.00 0.00 179.01 178.91 4r1r h SER 605 N 0.36 0.78 0.24 1.42 0.87 -0.75 -1.30 113.55 115.17 4r1r h SER 605 Ca 0.18 -0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 4r1r h SER 605 Cb 0.12 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 4r1r h SER 605 CO -0.15 0.72 -0.12 0.40 -0.53 0.00 0.00 176.83 177.15 4r1r h ILE 606 N 0.83 0.81 -0.80 2.23 2.04 -0.78 -0.60 117.51 121.23 4r1r h ILE 606 Ca 0.19 -0.29 0.14 0.00 1.00 0.00 0.00 64.86 65.91 4r1r h ILE 606 Cb 0.21 0.98 -0.09 0.00 -0.74 0.00 0.00 36.82 37.17 4r1r h ILE 606 CO -0.01 0.06 0.38 0.11 0.00 0.00 0.00 178.15 178.69 4r1r h LYS 607 N -0.47 0.54 0.08 2.37 1.57 -1.02 1.12 116.57 120.76 4r1r h LYS 607 Ca -0.03 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 4r1r h LYS 607 Cb 0.35 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.54 4r1r h LYS 607 CO 0.05 0.36 -0.04 1.15 -0.57 0.00 0.00 179.45 180.40 4r1r h THR 608 N 0.55 0.81 -0.01 -0.16 2.02 -1.21 -3.39 112.91 111.53 4r1r h THR 608 Ca 0.44 -1.39 0.00 0.00 0.77 0.00 0.00 66.41 66.23 4r1r h THR 608 Cb 0.63 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 4r1r h THR 608 CO -0.37 0.25 -0.63 1.41 0.37 0.00 0.00 175.52 176.55 4r1r n HIS 609 N -4.81 0.00 -4.31 3.16 8.25 -0.24 -5.10 115.22 112.18 4r1r n HIS 609 Ca -0.06 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.41 4r1r n HIS 609 Cb 0.24 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.35 4r1r n HIS 609 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 4r1r n GLY 610 N 1.43 -1.42 3.37 -1.41 0.00 0.38 -4.48 105.19 103.07 4r1r n GLY 610 Ca 0.07 -1.16 -0.30 0.00 0.00 0.00 0.00 46.02 44.63 4r1r n GLY 610 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4r1r s LEU 611 N 0.00 2.28 0.19 0.99 1.43 -1.26 -4.54 118.68 117.77 4r1r s LEU 611 Ca 0.00 -0.57 -0.03 0.00 -1.03 0.00 0.00 54.13 52.50 4r1r s LEU 611 Cb 0.00 -1.33 0.12 0.00 0.03 0.00 0.00 46.19 45.01 4r1r s LEU 611 CO 0.00 0.25 1.52 -0.09 0.23 0.00 0.00 176.35 178.26 4r1r h ARG 612 N 4.67 0.59 -5.33 1.70 9.65 -1.81 -1.70 114.38 122.14 4r1r h ARG 612 Ca -0.47 -0.35 -0.67 0.00 -1.10 0.00 0.00 59.98 57.39 4r1r h ARG 612 Cb 1.15 0.03 -0.31 0.00 -1.39 0.00 0.00 29.97 29.45 4r1r h ARG 612 CO 0.44 0.96 -0.85 -0.80 2.80 0.00 0.00 179.97 182.52 4r1r s ASN 613 N -6.90 3.35 0.40 -3.80 -0.87 -1.26 -3.40 114.94 102.46 4r1r s ASN 613 Ca -0.08 -0.49 0.18 0.00 -1.57 0.00 0.00 52.86 50.90 4r1r s ASN 613 Cb 0.11 -1.47 0.86 0.00 -0.02 0.00 0.00 41.25 40.74 4r1r s ASN 613 CO 0.84 0.16 1.84 0.28 -2.57 0.00 0.00 177.10 177.66 4r1r h SER 614 N 6.71 0.00 -3.92 -1.22 0.02 -1.05 -3.43 113.55 110.66 4r1r h SER 614 Ca -0.21 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.50 4r1r h SER 614 Cb 1.23 0.00 -0.27 0.00 0.14 0.00 0.00 62.40 63.50 4r1r h SER 614 CO 0.50 0.32 -0.72 0.42 -1.14 0.00 0.00 176.83 176.20 4r1r s THR 615 N -3.98 0.08 -0.01 -2.27 -4.23 -1.26 -4.91 115.64 99.07 4r1r s THR 615 Ca -0.02 -0.16 0.00 0.00 -1.18 0.00 0.00 61.69 60.34 4r1r s THR 615 Cb 0.13 -0.10 -0.01 0.00 1.34 0.00 0.00 72.50 73.86 4r1r s THR 615 CO 0.68 -0.05 -0.00 0.18 -0.54 0.00 0.00 174.62 174.89 4r1r n LEU 616 N 2.86 1.61 -4.45 4.79 4.77 -1.23 -0.01 117.00 125.34 4r1r n LEU 616 Ca -0.14 -0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.55 4r1r n LEU 616 Cb 0.59 -0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.55 4r1r n LEU 616 CO 0.25 0.28 -0.51 -0.94 -1.33 0.00 0.00 177.39 175.14 4r1r s SER 617 N -3.61 3.71 -0.29 -1.43 1.04 -1.25 -0.34 113.70 111.52 4r1r s SER 617 Ca -0.01 -0.58 -0.15 0.00 0.48 0.00 0.00 55.95 55.69 4r1r s SER 617 Cb 0.00 -0.47 0.14 0.00 0.10 0.00 0.00 66.02 65.80 4r1r s SER 617 CO 0.02 0.19 0.90 0.00 0.98 0.00 0.00 173.24 175.34 4r1r s ALA 618 N -1.08 -2.36 -0.46 5.32 0.00 -0.58 -1.10 121.76 121.50 4r1r s ALA 618 Ca 0.16 2.19 -0.23 0.00 0.00 0.00 0.00 51.96 54.08 4r1r s ALA 618 Cb -0.10 -1.82 0.03 0.00 0.00 0.00 0.00 23.12 21.22 4r1r s ALA 618 CO 0.08 -0.67 0.79 -0.51 0.00 0.00 0.00 175.76 175.45 4r1r s LEU 619 N 2.02 4.26 0.18 0.00 1.43 -0.79 -3.22 118.68 122.57 4r1r s LEU 619 Ca -0.06 -0.13 0.10 0.00 -1.03 0.00 0.00 54.13 53.00 4r1r s LEU 619 Cb -0.06 -2.95 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 4r1r s LEU 619 CO -0.17 -0.93 -0.14 0.00 0.23 0.00 0.00 176.35 175.34 4r1r s MET 620 N 3.31 1.91 1.03 1.70 0.23 -1.26 -1.67 119.30 124.55 4r1r s MET 620 Ca 0.30 -1.34 -0.12 0.00 -1.03 0.00 0.00 55.69 53.50 4r1r s MET 620 Cb -0.12 -2.07 0.21 0.00 -1.53 0.00 0.00 34.83 31.31 4r1r s MET 620 CO 0.22 0.42 1.07 -1.25 -2.03 0.00 0.00 175.02 173.46 4r1r s PRO 621 N -2.78 0.14 -0.28 3.16 0.04 -1.26 -4.62 135.00 129.39 4r1r s PRO 621 Ca 0.24 0.89 -0.17 0.00 0.04 0.00 0.00 61.00 61.99 4r1r s PRO 621 Cb -0.09 -1.67 0.11 0.00 0.04 0.00 0.00 34.50 32.89 4r1r s PRO 621 CO 0.14 -3.02 0.82 -1.54 0.04 0.00 0.00 177.00 173.43 4r1r s SER 622 N -2.93 -0.74 -0.01 6.66 1.04 -1.26 -4.89 113.70 111.56 4r1r s SER 622 Ca 0.66 1.22 -0.00 0.00 0.48 0.00 0.00 55.95 58.31 4r1r s SER 622 Cb -0.22 1.29 -0.01 0.00 0.10 0.00 0.00 66.02 67.19 4r1r s SER 622 CO 0.60 -0.20 -0.01 1.21 0.98 0.00 0.00 173.24 175.83 4r1r n GLU 623 N 3.80 0.03 0.03 4.02 4.07 -1.26 -4.22 120.64 127.10 4r1r n GLU 623 Ca -0.18 0.01 -0.19 0.00 -0.06 0.00 0.00 57.16 56.74 4r1r n GLU 623 Cb 0.58 -0.64 -0.13 0.00 -0.06 0.00 0.00 31.44 31.19 4r1r n GLU 623 CO 0.00 0.00 0.00 1.15 -0.06 0.00 0.00 177.13 178.22 4r1r h THR 624 N -0.03 1.48 -0.42 6.31 2.02 -1.99 -2.65 112.91 117.63 4r1r h THR 624 Ca -0.03 -2.32 -0.04 0.00 0.77 0.00 0.00 66.41 64.79 4r1r h THR 624 Cb 1.03 2.93 -0.02 0.00 -1.74 0.00 0.00 68.15 70.35 4r1r h THR 624 CO -0.02 0.66 0.09 0.77 0.37 0.00 0.00 175.52 177.39 4r1r h SER 625 N -0.26 0.65 -0.88 4.18 4.64 -1.89 -2.84 113.55 117.14 4r1r h SER 625 Ca -0.11 -0.24 -0.01 0.00 -0.47 0.00 0.00 61.79 60.96 4r1r h SER 625 Cb 1.47 -0.17 -0.04 0.00 -0.31 0.00 0.00 62.40 63.35 4r1r h SER 625 CO 0.13 0.73 0.53 0.28 -0.87 0.00 0.00 176.83 177.63 4r1r h SER 626 N 0.54 1.07 -0.99 4.97 0.02 -1.83 -2.48 113.55 114.85 4r1r h SER 626 Ca 0.13 -0.07 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 4r1r h SER 626 Cb 0.34 -0.27 -0.06 0.00 0.14 0.00 0.00 62.40 62.55 4r1r h SER 626 CO 0.00 0.82 0.65 1.56 -1.14 0.00 0.00 176.83 178.72 4r1r h GLN 627 N 1.22 1.22 -0.31 3.45 4.20 -1.23 -0.78 115.11 122.88 4r1r h GLN 627 Ca 0.32 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.91 4r1r h GLN 627 Cb -0.04 -0.28 -0.02 0.00 0.30 0.00 0.00 27.48 27.44 4r1r h GLN 627 CO -0.06 0.81 -0.01 0.82 -0.67 0.00 0.00 178.83 179.72 4r1r h ILE 628 N 1.26 1.19 -0.48 2.54 1.08 -1.28 -2.73 117.51 119.08 4r1r h ILE 628 Ca 0.39 -0.75 0.00 0.00 -0.39 0.00 0.00 64.86 64.11 4r1r h ILE 628 Cb -0.01 0.97 0.00 0.00 -3.07 0.00 0.00 36.82 34.71 4r1r h ILE 628 CO -0.12 0.26 0.00 -1.54 -0.69 0.00 0.00 178.15 176.06 4r1r n SER 629 N -4.29 4.53 -3.86 1.72 3.41 -0.94 -4.70 113.62 109.48 4r1r n SER 629 Ca 0.01 -2.68 -0.34 0.00 -0.26 0.00 0.00 58.87 55.60 4r1r n SER 629 Cb 0.24 -0.55 0.02 0.00 -0.26 0.00 0.00 64.21 63.65 4r1r n SER 629 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 4r1r n ASN 630 N 0.44 -4.79 -4.22 4.04 4.05 -0.54 -4.96 115.26 109.28 4r1r n ASN 630 Ca 0.23 -1.07 -0.20 0.00 0.45 0.00 0.00 54.58 53.99 4r1r n ASN 630 Cb 0.91 -2.13 -0.12 0.00 1.23 0.00 0.00 39.78 39.68 4r1r n ASN 630 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 4r1r s ALA 631 N -3.29 1.43 0.50 5.20 0.00 -0.41 -4.53 121.76 120.66 4r1r s ALA 631 Ca 0.28 -1.11 -0.22 0.00 0.00 0.00 0.00 51.96 50.91 4r1r s ALA 631 Cb -0.14 -0.15 -0.06 0.00 0.00 0.00 0.00 23.12 22.76 4r1r s ALA 631 CO 0.92 0.24 1.22 0.95 0.00 0.00 0.00 175.76 179.09 4r1r s THR 632 N -1.28 2.76 0.14 0.00 -4.23 -1.26 -4.55 115.64 107.22 4r1r s THR 632 Ca 0.02 0.56 -0.30 0.00 -1.18 0.00 0.00 61.69 60.79 4r1r s THR 632 Cb -0.10 -3.28 -0.07 0.00 1.34 0.00 0.00 72.50 70.39 4r1r s THR 632 CO 0.03 -0.02 1.21 0.20 -0.54 0.00 0.00 174.62 175.50 4r1r s ASN 633 N -1.27 7.07 0.00 3.99 -0.87 -1.26 -0.63 114.94 121.97 4r1r s ASN 633 Ca 0.67 2.16 0.00 0.00 -1.57 0.00 0.00 52.86 54.13 4r1r s ASN 633 Cb -0.32 -2.60 0.00 0.00 -0.02 0.00 0.00 41.25 38.31 4r1r s ASN 633 CO 0.38 -0.42 0.00 0.61 -2.57 0.00 0.00 177.10 175.10 4r1r n GLY 634 N 2.64 1.82 0.82 0.66 0.00 -1.26 -1.16 105.19 108.71 4r1r n GLY 634 Ca 0.06 0.19 0.07 0.00 0.00 0.00 0.00 46.02 46.34 4r1r n GLY 634 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 4r1r n ILE 635 N 0.00 1.36 -3.33 -0.61 -5.35 -1.26 -2.67 119.36 107.49 4r1r n ILE 635 Ca 0.00 -1.21 -0.35 0.00 -0.27 0.00 0.00 62.75 60.92 4r1r n ILE 635 Cb 0.00 0.30 -0.06 0.00 -1.74 0.00 0.00 39.64 38.14 4r1r n ILE 635 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 4r1r s GLU 636 N -1.48 3.98 0.33 6.28 0.41 -0.31 -4.72 118.70 123.19 4r1r s GLU 636 Ca 0.31 0.50 -0.28 0.00 -0.41 0.00 0.00 54.97 55.09 4r1r s GLU 636 Cb 0.20 -2.85 -0.10 0.00 -1.78 0.00 0.00 34.13 29.59 4r1r s GLU 636 CO 0.16 0.43 1.24 -1.25 -0.49 0.00 0.00 175.26 175.34 4r1r s PRO 637 N -2.15 4.37 0.79 0.39 0.04 -1.26 -4.42 135.00 132.76 4r1r s PRO 637 Ca 0.41 2.06 -0.14 0.00 0.04 0.00 0.00 61.00 63.37 4r1r s PRO 637 Cb -0.14 -3.04 0.06 0.00 0.04 0.00 0.00 34.50 31.42 4r1r s PRO 637 CO 0.20 -0.11 1.15 -0.35 0.04 0.00 0.00 177.00 177.92 4r1r n PRO 638 N 0.78 0.29 0.11 0.56 -0.04 -1.26 -4.45 135.00 131.00 4r1r n PRO 638 Ca 0.00 0.17 0.07 0.00 -0.04 0.00 0.00 63.50 63.70 4r1r n PRO 638 Cb 0.43 -2.39 0.02 0.00 -0.04 0.00 0.00 33.50 31.51 4r1r n PRO 638 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 4r1r h ARG 639 N -0.71 0.00 -2.49 0.54 3.08 -1.95 0.17 114.38 113.01 4r1r h ARG 639 Ca -0.47 0.00 0.16 0.00 0.07 0.00 0.00 59.98 59.74 4r1r h ARG 639 Cb 1.31 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.31 4r1r h ARG 639 CO 0.46 0.18 0.56 0.20 -1.07 0.00 0.00 179.97 180.30 4r1r s GLY 640 N -4.47 0.05 0.18 0.04 0.00 -1.26 -4.56 107.32 97.30 4r1r s GLY 640 Ca 0.01 -0.25 -0.05 0.00 0.00 0.00 0.00 44.72 44.44 4r1r s GLY 640 CO 0.76 1.81 1.51 -0.97 0.00 0.00 0.00 173.10 176.22 4r1r h TYR 641 N 2.00 0.82 -3.48 1.90 0.05 -1.94 -3.44 116.97 112.89 4r1r h TYR 641 Ca -0.27 -0.27 -0.67 0.00 0.05 0.00 0.00 58.73 57.57 4r1r h TYR 641 Cb 1.22 -0.16 -0.30 0.00 1.01 0.00 0.00 36.73 38.49 4r1r h TYR 641 CO 1.15 1.02 -0.84 0.08 -1.05 0.00 0.00 178.16 178.52 4r1r s VAL 642 N -4.16 2.43 -0.12 -2.88 1.01 -1.26 -0.97 120.40 114.45 4r1r s VAL 642 Ca -0.08 -0.90 -0.16 0.00 0.00 0.00 0.00 61.98 60.84 4r1r s VAL 642 Cb 0.11 -1.96 -0.05 0.00 0.00 0.00 0.00 36.38 34.49 4r1r s VAL 642 CO 0.85 0.55 0.38 -0.55 0.00 0.00 0.00 175.10 176.33 4r1r s SER 643 N 0.20 6.58 -0.13 3.32 0.15 0.20 -4.90 113.70 119.13 4r1r s SER 643 Ca -0.12 0.69 -0.01 0.00 0.70 0.00 0.00 55.95 57.21 4r1r s SER 643 Cb -0.16 -2.23 -0.02 0.00 -1.71 0.00 0.00 66.02 61.90 4r1r s SER 643 CO 0.07 0.10 -0.11 -0.63 1.20 0.00 0.00 173.24 173.87 4r1r s ILE 644 N 0.29 3.26 0.04 6.45 1.09 -1.26 -1.55 121.20 129.52 4r1r s ILE 644 Ca 0.21 -0.59 0.03 0.00 -1.10 0.00 0.00 60.65 59.20 4r1r s ILE 644 Cb -0.14 -2.38 -0.02 0.00 -1.06 0.00 0.00 42.46 38.86 4r1r s ILE 644 CO 0.08 0.52 -0.10 -0.54 -0.10 0.00 0.00 174.94 174.80 4r1r s LYS 645 N 0.26 0.64 0.15 2.79 1.02 0.39 -4.98 119.74 120.02 4r1r s LYS 645 Ca -0.08 -0.69 -0.13 0.00 0.02 0.00 0.00 55.97 55.09 4r1r s LYS 645 Cb -0.15 -0.53 -0.07 0.00 -0.52 0.00 0.00 37.83 36.56 4r1r s LYS 645 CO 0.05 0.12 0.53 0.00 -0.92 0.00 0.00 175.35 175.13 4r1r s ALA 646 N -1.04 3.59 0.22 5.17 0.00 -1.26 0.14 121.76 128.59 4r1r s ALA 646 Ca -0.04 -0.18 -0.08 0.00 0.00 0.00 0.00 51.96 51.66 4r1r s ALA 646 Cb -0.08 -2.48 -0.02 0.00 0.00 0.00 0.00 23.12 20.54 4r1r s ALA 646 CO 0.01 0.47 0.33 0.45 0.00 0.00 0.00 175.76 177.02 4r1r s SER 647 N -1.80 0.01 0.19 0.00 0.15 -0.74 -4.87 113.70 106.64 4r1r s SER 647 Ca 0.38 -1.11 -0.03 0.00 0.70 0.00 0.00 55.95 55.89 4r1r s SER 647 Cb -0.14 0.49 0.12 0.00 -1.71 0.00 0.00 66.02 64.78 4r1r s SER 647 CO 0.19 -1.01 1.51 0.07 1.20 0.00 0.00 173.24 175.21 4r1r h LYS 648 N 2.42 0.56 0.00 5.44 2.10 -2.03 -3.14 116.57 121.92 4r1r h LYS 648 Ca -0.30 -0.34 -0.12 0.00 -2.00 0.00 0.00 60.65 57.88 4r1r h LYS 648 Cb 1.25 0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 32.60 4r1r h LYS 648 CO 0.43 0.95 -0.58 -0.44 -2.00 0.00 0.00 179.45 177.81 4r1r h ASP 649 N 0.43 0.00 -0.27 7.07 3.32 -2.02 -3.49 116.42 121.46 4r1r h ASP 649 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 4r1r h ASP 649 Cb 1.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.63 4r1r h ASP 649 CO 0.10 0.58 0.00 0.61 -1.72 0.00 0.00 179.24 178.81 4r1r n GLY 650 N 0.79 -0.57 3.68 2.75 0.00 -1.19 -5.05 105.19 105.60 4r1r n GLY 650 Ca 0.00 -1.28 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 4r1r n GLY 650 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4r1r s ILE 651 N -2.93 4.85 -0.25 -0.61 1.01 -1.26 -1.79 121.20 120.22 4r1r s ILE 651 Ca 0.00 1.76 -0.16 0.00 0.00 0.00 0.00 60.65 62.25 4r1r s ILE 651 Cb 0.00 -4.19 -0.03 0.00 0.01 0.00 0.00 42.46 38.25 4r1r s ILE 651 CO 0.00 0.02 0.43 -0.76 0.00 0.00 0.00 174.94 174.64 4r1r s LEU 652 N 2.07 4.07 -0.03 2.97 1.43 0.12 -4.85 118.68 124.47 4r1r s LEU 652 Ca 0.41 0.43 0.05 0.00 -1.03 0.00 0.00 54.13 53.99 4r1r s LEU 652 Cb -0.17 -2.54 -0.03 0.00 0.03 0.00 0.00 46.19 43.49 4r1r s LEU 652 CO 0.14 -0.20 -0.16 -0.13 0.23 0.00 0.00 176.35 176.23 4r1r s ARG 653 N 1.98 2.37 -0.04 1.70 0.52 -1.26 -0.46 118.95 123.76 4r1r s ARG 653 Ca 0.18 -0.78 -0.01 0.00 -0.52 0.00 0.00 55.73 54.60 4r1r s ARG 653 Cb -0.15 -2.30 0.03 0.00 0.52 0.00 0.00 34.95 33.05 4r1r s ARG 653 CO 0.09 0.60 0.03 -1.14 0.02 0.00 0.00 175.30 174.91 4r1r s GLN 654 N -0.86 0.07 -0.10 3.54 0.74 -0.60 -4.48 119.66 117.98 4r1r s GLN 654 Ca 0.12 0.24 -0.13 0.00 0.05 0.00 0.00 55.36 55.64 4r1r s GLN 654 Cb -0.10 -0.49 -0.05 0.00 1.10 0.00 0.00 33.01 33.47 4r1r s GLN 654 CO 0.01 -0.25 0.32 0.08 -0.55 0.00 0.00 175.29 174.90 4r1r s VAL 655 N 1.65 5.24 0.50 1.34 1.01 -1.26 -0.63 120.40 128.26 4r1r s VAL 655 Ca -0.01 0.61 -0.21 0.00 0.00 0.00 0.00 61.98 62.37 4r1r s VAL 655 Cb -0.13 -3.63 -0.09 0.00 0.00 0.00 0.00 36.38 32.54 4r1r s VAL 655 CO -0.03 0.49 0.88 1.33 0.00 0.00 0.00 175.10 177.77 4r1r n VAL 656 N 2.71 2.75 -1.64 2.92 0.24 -0.15 -4.83 118.33 120.34 4r1r n VAL 656 Ca -0.14 -0.50 -0.48 0.00 -2.04 0.00 0.00 64.34 61.19 4r1r n VAL 656 Cb 0.53 -1.03 -0.04 0.00 -1.47 0.00 0.00 33.84 31.83 4r1r n VAL 656 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 4r1r n PRO 657 N -0.21 1.73 -3.97 7.34 -0.04 -1.26 -2.77 135.00 135.82 4r1r n PRO 657 Ca 0.11 0.62 -0.27 0.00 -0.04 0.00 0.00 63.50 63.93 4r1r n PRO 657 Cb 0.43 -2.30 -0.02 0.00 -0.04 0.00 0.00 33.50 31.58 4r1r n PRO 657 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 4r1r n ASP 658 N 2.70 -0.96 -0.15 3.54 2.03 -1.26 -4.87 116.55 117.58 4r1r n ASP 658 Ca 0.16 -0.99 -0.08 0.00 0.52 0.00 0.00 54.79 54.40 4r1r n ASP 658 Cb 0.26 -3.11 0.01 0.00 -0.72 0.00 0.00 41.12 37.56 4r1r n ASP 658 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 4r1r h TYR 659 N -1.81 0.64 -0.88 -0.67 3.20 -1.87 -0.91 116.97 114.67 4r1r h TYR 659 Ca -0.62 -0.02 0.12 0.00 3.14 0.00 0.00 58.73 61.34 4r1r h TYR 659 Cb 1.38 -0.20 -0.13 0.00 1.54 0.00 0.00 36.73 39.32 4r1r h TYR 659 CO 0.51 0.50 -0.40 -1.91 -1.64 0.00 0.00 178.16 175.22 4r1r n GLU 660 N -4.67 -0.27 0.03 1.82 2.13 -1.26 -1.02 120.64 117.41 4r1r n GLU 660 Ca 0.01 1.34 0.11 0.00 0.66 0.00 0.00 57.16 59.28 4r1r n GLU 660 Cb 0.10 -1.98 -0.06 0.00 0.27 0.00 0.00 31.44 29.77 4r1r n GLU 660 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 4r1r n HIS 661 N -5.22 0.35 -0.04 4.31 8.25 -1.14 -4.53 115.22 117.20 4r1r n HIS 661 Ca 0.07 0.10 0.02 0.00 -0.26 0.00 0.00 57.72 57.65 4r1r n HIS 661 Cb 0.31 -0.58 0.06 0.00 1.12 0.00 0.00 29.99 30.89 4r1r n HIS 661 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 4r1r n LEU 662 N -2.24 2.24 -0.24 2.41 4.77 -0.36 -4.78 117.00 118.80 4r1r n LEU 662 Ca -0.01 -1.87 0.03 0.00 -0.03 0.00 0.00 56.01 54.13 4r1r n LEU 662 Cb 0.51 -0.08 0.12 0.00 -2.33 0.00 0.00 43.42 41.64 4r1r n LEU 662 CO 0.42 0.55 0.79 1.12 -1.33 0.00 0.00 177.39 178.95 4r1r h HIS 663 N 0.81 -0.15 0.00 -1.77 2.07 -1.27 0.53 115.15 115.36 4r1r h HIS 663 Ca 0.00 0.06 0.00 0.00 -2.85 0.00 0.00 60.37 57.58 4r1r h HIS 663 Cb 0.54 0.18 0.00 0.00 2.57 0.00 0.00 27.41 30.70 4r1r h HIS 663 CO 0.08 -0.25 0.00 -0.25 -3.07 0.00 0.00 177.93 174.44 4r1r n ASP 664 N -5.37 0.72 0.12 3.10 8.00 -1.26 -3.35 116.55 118.51 4r1r n ASP 664 Ca 0.11 0.63 -0.21 0.00 0.71 0.00 0.00 54.79 56.03 4r1r n ASP 664 Cb 0.42 -0.80 -0.15 0.00 -0.02 0.00 0.00 41.12 40.57 4r1r n ASP 664 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 4r1r h ALA 665 N 2.37 -0.04 -2.37 2.24 0.00 -0.29 -3.46 119.26 117.71 4r1r h ALA 665 Ca 0.00 -0.86 -0.53 0.00 0.00 0.00 0.00 54.91 53.52 4r1r h ALA 665 Cb 0.51 0.10 0.20 0.00 0.00 0.00 0.00 17.79 18.60 4r1r h ALA 665 CO 0.00 0.80 -0.06 0.66 0.00 0.00 0.00 179.25 180.65 4r1r n TYR 666 N -3.66 0.09 -3.78 0.00 4.01 -0.83 -4.74 117.16 108.24 4r1r n TYR 666 Ca -0.13 0.35 -0.30 0.00 -0.16 0.00 0.00 57.90 57.65 4r1r n TYR 666 Cb 1.06 -1.96 -0.15 0.00 -0.31 0.00 0.00 39.34 37.98 4r1r n TYR 666 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 4r1r s GLU 667 N -3.93 0.97 0.63 -0.72 2.12 -1.26 -5.06 118.70 111.44 4r1r s GLU 667 Ca 0.66 -1.40 -0.17 0.00 0.36 0.00 0.00 54.97 54.41 4r1r s GLU 667 Cb -0.26 -2.28 -0.02 0.00 0.26 0.00 0.00 34.13 31.83 4r1r s GLU 667 CO 0.59 -1.01 1.17 -0.51 -0.54 0.00 0.00 175.26 174.95 4r1r s LEU 668 N 1.24 3.54 0.21 2.70 1.43 -1.26 -4.62 118.68 121.92 4r1r s LEU 668 Ca 0.12 2.25 -0.20 0.00 -1.03 0.00 0.00 54.13 55.27 4r1r s LEU 668 Cb -0.19 -4.58 0.17 0.00 0.03 0.00 0.00 46.19 41.62 4r1r s LEU 668 CO -0.17 -1.67 1.57 0.25 0.23 0.00 0.00 176.35 176.55 4r1r h LEU 669 N 0.50 -1.36 0.00 1.79 5.85 -0.87 0.46 115.31 121.67 4r1r h LEU 669 Ca -0.49 0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.51 4r1r h LEU 669 Cb 1.28 0.69 0.00 0.00 0.37 0.00 0.00 40.66 43.00 4r1r h LEU 669 CO 0.54 -0.30 0.00 0.79 -0.34 0.00 0.00 178.44 179.13 4r1r n TRP 670 N -5.45 0.00 0.07 1.25 5.03 -1.26 -3.07 117.44 114.01 4r1r n TRP 670 Ca 0.07 0.00 0.01 0.00 3.03 0.00 0.00 57.50 60.60 4r1r n TRP 670 Cb 0.37 0.00 -0.05 0.00 -1.03 0.00 0.00 31.31 30.61 4r1r n TRP 670 CO 0.00 0.00 0.00 0.93 -0.03 0.00 0.00 177.69 178.59 4r1r h GLU 671 N 0.00 0.00 -6.88 -0.99 5.08 -1.25 -3.45 114.58 107.08 4r1r h GLU 671 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 4r1r h GLU 671 Cb 0.00 0.00 0.08 0.00 0.50 0.00 0.00 28.75 29.33 4r1r h GLU 671 CO 0.00 0.39 0.71 -1.64 -1.00 0.00 0.00 179.01 177.47 4r1r s MET 672 N -2.93 4.26 0.27 2.33 -1.94 -1.17 -4.88 119.30 115.23 4r1r s MET 672 Ca -0.00 2.36 0.26 0.00 -1.71 0.00 0.00 55.69 56.59 4r1r s MET 672 Cb 0.08 -3.04 0.83 0.00 2.01 0.00 0.00 34.83 34.71 4r1r s MET 672 CO 0.79 -0.35 1.75 -1.00 -0.01 0.00 0.00 175.02 176.21 4r1r h PRO 673 N 3.51 0.00 0.00 2.03 0.14 -1.91 -3.48 132.00 132.28 4r1r h PRO 673 Ca -0.49 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.65 4r1r h PRO 673 Cb 1.23 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.37 4r1r h PRO 673 CO 0.67 0.00 0.00 0.41 0.14 0.00 0.00 178.00 179.22 4r1r n GLY 674 N 0.87 1.33 0.00 1.56 0.00 -1.26 -5.04 105.19 102.65 4r1r n GLY 674 Ca 0.04 -0.77 0.09 0.00 0.00 0.00 0.00 46.02 45.38 4r1r n GLY 674 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 4r1r n ASN 675 N -0.20 0.86 0.05 1.61 3.02 -1.26 -4.69 115.26 114.65 4r1r n ASN 675 Ca 0.00 -0.87 -0.12 0.00 -0.03 0.00 0.00 54.58 53.56 4r1r n ASN 675 Cb 0.00 1.06 -0.05 0.00 -0.61 0.00 0.00 39.78 40.19 4r1r n ASN 675 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 4r1r h ASP 676 N 0.00 -0.92 -0.17 6.41 3.32 -1.96 0.25 116.42 123.35 4r1r h ASP 676 Ca 0.00 0.12 0.05 0.00 0.02 0.00 0.00 57.03 57.22 4r1r h ASP 676 Cb 0.47 0.37 -0.07 0.00 0.22 0.00 0.00 39.33 40.33 4r1r h ASP 676 CO 0.00 -0.37 -0.39 1.23 -1.72 0.00 0.00 179.24 177.99 4r1r h GLY 677 N -0.44 -0.60 0.99 2.75 0.00 -1.76 0.46 103.07 104.46 4r1r h GLY 677 Ca 0.07 0.49 -0.01 0.00 0.00 0.00 0.00 47.33 47.88 4r1r h GLY 677 CO -0.27 -0.22 0.31 -1.82 0.00 0.00 0.00 176.54 174.54 4r1r h TYR 678 N -0.44 0.72 -0.69 5.60 3.20 -1.50 -1.82 116.97 122.04 4r1r h TYR 678 Ca 0.09 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 4r1r h TYR 678 Cb 0.60 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 4r1r h TYR 678 CO -0.48 0.51 0.43 -0.07 -1.64 0.00 0.00 178.16 176.90 4r1r h LEU 679 N 0.72 0.81 -0.86 2.82 3.38 0.29 -1.06 115.31 121.40 4r1r h LEU 679 Ca 0.19 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 4r1r h LEU 679 Cb 0.01 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 4r1r h LEU 679 CO -0.03 0.61 0.33 1.56 0.09 0.00 0.00 178.44 181.00 4r1r h GLN 680 N 0.94 1.16 -0.24 1.13 4.20 -0.12 -1.45 115.11 120.72 4r1r h GLN 680 Ca 0.25 -0.20 -0.10 0.00 0.06 0.00 0.00 58.65 58.66 4r1r h GLN 680 Cb -0.06 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.51 4r1r h GLN 680 CO -0.05 0.93 -0.27 -0.07 -0.67 0.00 0.00 178.83 178.70 4r1r h LEU 681 N 1.14 0.48 -0.46 1.46 3.38 -0.66 -0.67 115.31 119.97 4r1r h LEU 681 Ca 0.27 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 4r1r h LEU 681 Cb 0.19 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 4r1r h LEU 681 CO -0.03 0.74 0.01 0.58 0.09 0.00 0.00 178.44 179.83 4r1r h VAL 682 N 0.42 1.26 -0.48 1.22 2.07 -0.81 -1.92 116.25 118.01 4r1r h VAL 682 Ca 0.06 -1.04 0.04 0.00 0.82 0.00 0.00 66.70 66.57 4r1r h VAL 682 Cb 0.69 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.44 4r1r h VAL 682 CO 0.05 0.36 0.26 1.23 0.02 0.00 0.00 177.57 179.49 4r1r h GLY 683 N 0.67 0.68 1.05 2.17 0.00 -0.71 0.76 103.07 107.69 4r1r h GLY 683 Ca 0.13 -0.18 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 4r1r h GLY 683 CO 0.02 0.13 0.38 -2.22 0.00 0.00 0.00 176.54 174.86 4r1r h ILE 684 N 0.51 1.26 -0.49 2.60 2.04 -1.09 -2.06 117.51 120.27 4r1r h ILE 684 Ca 0.21 -0.75 -0.09 0.00 1.00 0.00 0.00 64.86 65.22 4r1r h ILE 684 Cb 0.09 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 4r1r h ILE 684 CO -0.13 0.32 -0.05 0.24 0.00 0.00 0.00 178.15 178.53 4r1r h MET 685 N 1.20 0.86 0.00 2.37 2.86 -0.61 -2.69 114.93 118.92 4r1r h MET 685 Ca 0.28 -0.27 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 4r1r h MET 685 Cb 0.14 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.72 4r1r h MET 685 CO -0.03 0.89 0.00 0.94 1.06 0.00 0.00 176.91 179.77 4r1r n GLN 686 N -4.18 0.19 -0.12 1.72 -0.06 0.19 -2.20 117.38 112.93 4r1r n GLN 686 Ca 0.02 0.43 -0.06 0.00 -2.00 0.00 0.00 57.00 55.39 4r1r n GLN 686 Cb 0.34 -1.88 0.02 0.00 -4.06 0.00 0.00 30.24 24.67 4r1r n GLN 686 CO 0.00 0.00 0.00 -0.22 -0.20 0.00 0.00 177.06 176.64 4r1r h LYS 687 N 0.00 0.34 0.00 3.69 3.64 -1.19 -3.25 116.57 119.81 4r1r h LYS 687 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 4r1r h LYS 687 Cb 0.35 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 4r1r h LYS 687 CO 0.00 0.23 -1.25 1.19 -2.27 0.00 0.00 179.45 177.35 4r1r n PHE 688 N -4.96 0.02 -2.86 1.91 3.72 -0.94 -4.26 117.46 110.09 4r1r n PHE 688 Ca 0.02 0.01 -0.41 0.00 -0.05 0.00 0.00 57.45 57.01 4r1r n PHE 688 Cb 0.11 -0.17 -0.04 0.00 -0.94 0.00 0.00 39.48 38.44 4r1r n PHE 688 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 4r1r s ILE 689 N -3.15 4.83 0.12 4.37 -1.09 -1.01 -4.81 121.20 120.46 4r1r s ILE 689 Ca 0.04 1.80 -0.20 0.00 -2.23 0.00 0.00 60.65 60.05 4r1r s ILE 689 Cb 0.15 -4.20 -0.07 0.00 -1.58 0.00 0.00 42.46 36.77 4r1r s ILE 689 CO 0.87 0.26 1.73 0.44 -1.23 0.00 0.00 174.94 177.01 4r1r h ASP 690 N 6.33 -0.01 0.00 3.58 3.32 -1.90 -3.43 116.42 124.31 4r1r h ASP 690 Ca -0.42 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.66 4r1r h ASP 690 Cb 1.21 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.80 4r1r h ASP 690 CO 0.74 0.02 0.00 0.00 -1.72 0.00 0.00 179.24 178.27 4r1r n GLN 691 N -5.10 0.00 -3.61 3.56 6.02 -0.26 -4.38 117.38 113.61 4r1r n GLN 691 Ca -0.03 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.81 4r1r n GLN 691 Cb 0.08 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.29 4r1r n GLN 691 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 4r1r n SER 692 N 0.00 -0.28 -4.23 1.08 2.88 -0.18 -4.89 113.62 108.01 4r1r n SER 692 Ca 0.00 -2.57 -0.25 0.00 -1.33 0.00 0.00 58.87 54.73 4r1r n SER 692 Cb 0.00 1.13 -0.14 0.00 -0.75 0.00 0.00 64.21 64.45 4r1r n SER 692 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 4r1r s ILE 693 N -2.92 1.56 -1.44 2.46 1.01 -1.26 -1.88 121.20 118.72 4r1r s ILE 693 Ca 0.27 -1.13 -0.12 0.00 0.00 0.00 0.00 60.65 59.66 4r1r s ILE 693 Cb 0.01 -1.36 0.05 0.00 0.01 0.00 0.00 42.46 41.17 4r1r s ILE 693 CO 0.19 0.19 2.27 -1.20 0.00 0.00 0.00 174.94 176.39 4r1r n SER 694 N 1.92 4.92 -4.77 3.58 7.64 -0.67 -4.63 113.62 121.61 4r1r n SER 694 Ca -0.17 -2.87 -0.40 0.00 1.01 0.00 0.00 58.87 56.44 4r1r n SER 694 Cb 0.54 -1.60 -0.02 0.00 -1.01 0.00 0.00 64.21 62.11 4r1r n SER 694 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 4r1r s ALA 695 N 2.35 3.46 0.34 -0.43 0.00 -1.26 -4.74 121.76 121.47 4r1r s ALA 695 Ca 0.49 1.22 0.08 0.00 0.00 0.00 0.00 51.96 53.74 4r1r s ALA 695 Cb 0.14 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.76 4r1r s ALA 695 CO -0.07 -0.60 0.21 -0.80 0.00 0.00 0.00 175.76 174.50 4r1r s ASN 696 N -0.56 4.97 -0.03 0.00 0.02 -1.26 0.28 114.94 118.35 4r1r s ASN 696 Ca 0.49 -0.64 0.04 0.00 -1.02 0.00 0.00 52.86 51.73 4r1r s ASN 696 Cb -0.39 -0.84 -0.00 0.00 0.02 0.00 0.00 41.25 40.04 4r1r s ASN 696 CO 0.51 -0.32 -0.15 0.42 0.02 0.00 0.00 177.10 177.58 4r1r s THR 697 N -2.37 1.25 -0.05 1.60 -4.23 -0.88 -4.95 115.64 106.02 4r1r s THR 697 Ca 0.39 -0.63 0.04 0.00 -1.18 0.00 0.00 61.69 60.31 4r1r s THR 697 Cb -0.04 -1.07 -0.00 0.00 1.34 0.00 0.00 72.50 72.73 4r1r s THR 697 CO 0.24 0.36 -0.16 0.20 -0.54 0.00 0.00 174.62 174.73 4r1r s ASN 698 N -0.01 2.08 -0.02 3.99 0.01 -1.26 -0.56 114.94 119.16 4r1r s ASN 698 Ca -0.02 -0.34 0.03 0.00 -0.71 0.00 0.00 52.86 51.82 4r1r s ASN 698 Cb -0.10 -0.65 0.00 0.00 0.41 0.00 0.00 41.25 40.91 4r1r s ASN 698 CO 0.01 0.13 -0.09 -0.31 -1.51 0.00 0.00 177.10 175.33 4r1r s TYR 699 N 0.16 0.93 -0.21 2.20 2.02 -0.26 -4.74 117.35 117.45 4r1r s TYR 699 Ca -0.06 -0.22 0.01 0.00 -0.37 0.00 0.00 57.07 56.42 4r1r s TYR 699 Cb -0.12 -0.66 0.03 0.00 -0.40 0.00 0.00 41.96 40.81 4r1r s TYR 699 CO 0.03 -0.08 -0.15 0.34 -1.57 0.00 0.00 175.55 174.12 4r1r s ASP 700 N 0.12 3.69 0.25 2.29 -1.08 -1.26 -1.99 116.67 118.69 4r1r s ASP 700 Ca -0.02 -0.82 -0.03 0.00 -0.52 0.00 0.00 52.55 51.16 4r1r s ASP 700 Cb -0.08 -1.55 0.44 0.00 -1.46 0.00 0.00 42.92 40.28 4r1r s ASP 700 CO 0.00 -0.06 1.80 -0.65 0.52 0.00 0.00 175.17 176.79 4r1r h PRO 701 N 7.93 0.77 0.00 4.34 0.11 -1.86 -2.03 132.00 141.25 4r1r h PRO 701 Ca -0.38 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.68 4r1r h PRO 701 Cb 1.12 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.05 4r1r h PRO 701 CO 0.59 0.51 0.00 -1.13 -0.21 0.00 0.00 178.00 177.76 4r1r n SER 702 N -4.75 0.00 -0.83 -2.05 3.41 -1.26 -1.05 113.62 107.09 4r1r n SER 702 Ca 0.15 -0.17 0.12 0.00 -0.26 0.00 0.00 58.87 58.71 4r1r n SER 702 Cb 0.32 -0.13 0.24 0.00 -0.26 0.00 0.00 64.21 64.38 4r1r n SER 702 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 4r1r n ARG 703 N -1.13 2.14 -4.67 4.33 1.74 -0.76 -4.93 116.66 113.38 4r1r n ARG 703 Ca 0.08 -1.66 -0.26 0.00 -0.77 0.00 0.00 57.85 55.24 4r1r n ARG 703 Cb 0.07 -1.47 -0.14 0.00 -1.02 0.00 0.00 32.46 29.90 4r1r n ARG 703 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 4r1r s PHE 704 N -1.95 1.80 -0.06 -1.55 0.40 -0.22 -5.09 117.98 111.32 4r1r s PHE 704 Ca 0.32 -0.37 -0.36 0.00 -0.60 0.00 0.00 56.93 55.92 4r1r s PHE 704 Cb 0.20 -1.08 -0.14 0.00 0.51 0.00 0.00 43.02 42.52 4r1r s PHE 704 CO 0.31 0.08 1.73 -2.30 0.70 0.00 0.00 175.22 175.74 4r1r n PRO 705 N 1.93 1.85 -1.06 0.24 -0.02 -1.26 -0.91 135.00 135.78 4r1r n PRO 705 Ca -0.17 0.68 -0.02 0.00 -2.02 0.00 0.00 63.50 61.97 4r1r n PRO 705 Cb 0.53 -2.45 -0.01 0.00 -0.02 0.00 0.00 33.50 31.56 4r1r n PRO 705 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 4r1r n SER 706 N 5.24 -3.98 -2.29 2.55 7.64 -1.26 -3.55 113.62 117.97 4r1r n SER 706 Ca 0.22 0.05 -0.19 0.00 1.01 0.00 0.00 58.87 59.96 4r1r n SER 706 Cb 0.25 -1.65 0.01 0.00 -1.01 0.00 0.00 64.21 61.81 4r1r n SER 706 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 4r1r n GLY 707 N -1.76 -0.38 2.97 0.23 0.00 -0.09 -5.00 105.19 101.16 4r1r n GLY 707 Ca -0.02 -0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 4r1r n GLY 707 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4r1r s LYS 708 N -5.14 1.74 -0.15 1.61 -2.85 -1.23 -4.79 119.74 108.92 4r1r s LYS 708 Ca 0.10 -0.37 -0.29 0.00 -1.00 0.00 0.00 55.97 54.41 4r1r s LYS 708 Cb -0.04 -1.63 -0.03 0.00 -2.06 0.00 0.00 37.83 34.06 4r1r s LYS 708 CO 0.12 -0.16 1.56 0.08 0.10 0.00 0.00 175.35 177.05 4r1r s VAL 709 N 1.32 3.77 0.30 1.79 1.01 -1.26 -4.69 120.40 122.64 4r1r s VAL 709 Ca -0.02 0.90 -0.29 0.00 0.00 0.00 0.00 61.98 62.57 4r1r s VAL 709 Cb -0.14 -3.68 -0.10 0.00 0.00 0.00 0.00 36.38 32.46 4r1r s VAL 709 CO -0.05 -0.19 1.42 -2.16 0.00 0.00 0.00 175.10 174.13 4r1r s PRO 710 N 4.24 4.25 0.25 2.72 0.04 -1.26 -4.91 135.00 140.32 4r1r s PRO 710 Ca 0.69 2.35 -0.06 0.00 0.04 0.00 0.00 61.00 64.02 4r1r s PRO 710 Cb -0.27 -3.06 0.30 0.00 0.04 0.00 0.00 34.50 31.50 4r1r s PRO 710 CO 0.27 -0.39 1.90 1.98 0.04 0.00 0.00 177.00 180.80 4r1r h MET 711 N 4.12 1.17 -0.57 4.56 4.05 -2.00 -1.63 114.93 124.62 4r1r h MET 711 Ca -0.48 -0.07 0.09 0.00 -0.28 0.00 0.00 59.70 58.97 4r1r h MET 711 Cb 1.22 -0.26 -0.11 0.00 -0.80 0.00 0.00 31.60 31.65 4r1r h MET 711 CO 0.71 0.77 -0.39 0.37 0.23 0.00 0.00 176.91 178.61 4r1r h GLN 712 N 1.20 -0.20 -0.67 0.39 5.75 -1.99 0.42 115.11 120.01 4r1r h GLN 712 Ca 0.37 0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.92 4r1r h GLN 712 Cb -0.01 0.04 -0.04 0.00 1.07 0.00 0.00 27.48 28.54 4r1r h GLN 712 CO -0.12 -0.13 0.42 0.37 -2.65 0.00 0.00 178.83 176.72 4r1r h GLN 713 N -0.20 0.79 -0.76 1.69 5.75 -1.69 0.11 115.11 120.79 4r1r h GLN 713 Ca 0.20 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.66 4r1r h GLN 713 Cb 0.56 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 28.89 4r1r h GLN 713 CO -0.68 0.52 0.49 -0.07 -2.65 0.00 0.00 178.83 176.44 4r1r h LEU 714 N 0.82 0.89 -0.34 -2.39 3.38 -0.74 -1.51 115.31 115.42 4r1r h LEU 714 Ca 0.27 -0.04 -0.18 0.00 0.09 0.00 0.00 57.88 58.02 4r1r h LEU 714 Cb 0.02 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 4r1r h LEU 714 CO -0.11 0.67 -0.52 -0.07 0.09 0.00 0.00 178.44 178.50 4r1r h LEU 715 N 1.04 0.93 -0.25 1.67 3.38 -0.35 -2.59 115.31 119.15 4r1r h LEU 715 Ca 0.28 -0.49 0.04 0.00 0.09 0.00 0.00 57.88 57.80 4r1r h LEU 715 Cb -0.08 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.36 4r1r h LEU 715 CO -0.06 1.28 -0.01 0.50 0.09 0.00 0.00 178.44 180.25 4r1r h LYS 716 N 0.65 0.07 -0.30 1.13 1.63 -0.53 -0.90 116.57 118.33 4r1r h LYS 716 Ca 0.02 -0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.77 4r1r h LYS 716 Cb 1.12 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 32.72 4r1r h LYS 716 CO 0.12 0.04 -0.00 -0.44 -3.45 0.00 0.00 179.45 175.72 4r1r h ASP 717 N 0.07 0.42 0.11 4.20 3.32 -1.26 -0.78 116.42 122.50 4r1r h ASP 717 Ca 0.12 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 4r1r h ASP 717 Cb 0.15 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 4r1r h ASP 717 CO -0.20 0.49 -0.07 0.25 -1.72 0.00 0.00 179.24 177.99 4r1r h LEU 718 N 0.44 -0.16 -0.50 1.55 5.85 -0.85 -1.76 115.31 119.86 4r1r h LEU 718 Ca 0.10 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 4r1r h LEU 718 Cb 0.29 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 4r1r h LEU 718 CO 0.01 -0.11 0.31 -0.07 -0.34 0.00 0.00 178.44 178.24 4r1r h LEU 719 N -0.17 0.60 -0.12 2.25 3.38 -0.62 -1.89 115.31 118.74 4r1r h LEU 719 Ca -0.01 -0.05 0.05 0.00 0.09 0.00 0.00 57.88 57.96 4r1r h LEU 719 Cb 0.14 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 4r1r h LEU 719 CO 0.01 0.46 -0.25 0.74 0.09 0.00 0.00 178.44 179.50 4r1r h THR 720 N 0.68 0.41 -0.64 0.22 2.02 -1.03 0.22 112.91 114.79 4r1r h THR 720 Ca 0.18 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.49 4r1r h THR 720 Cb -0.03 0.41 -0.10 0.00 -1.74 0.00 0.00 68.15 66.70 4r1r h THR 720 CO -0.04 0.00 0.12 0.00 0.37 0.00 0.00 175.52 175.98 4r1r h ALA 721 N 0.61 0.76 -0.66 6.16 0.00 -0.94 -0.35 119.26 124.85 4r1r h ALA 721 Ca 0.10 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 4r1r h ALA 721 Cb 0.46 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 4r1r h ALA 721 CO -0.30 -0.33 0.32 -0.92 0.00 0.00 0.00 179.25 178.03 4r1r h TYR 722 N 0.24 0.94 -1.00 0.00 3.20 -0.24 -1.54 116.97 118.57 4r1r h TYR 722 Ca 0.35 -0.04 0.05 0.00 3.14 0.00 0.00 58.73 62.23 4r1r h TYR 722 Cb 0.55 -0.29 -0.06 0.00 1.54 0.00 0.00 36.73 38.46 4r1r h TYR 722 CO -0.27 0.70 0.65 -0.22 -1.64 0.00 0.00 178.16 177.38 4r1r h LYS 723 N 0.91 1.17 -0.80 1.82 3.64 0.11 -2.43 116.57 121.00 4r1r h LYS 723 Ca 0.23 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.47 4r1r h LYS 723 Cb 0.11 -0.26 -0.04 0.00 -0.41 0.00 0.00 32.23 31.62 4r1r h LYS 723 CO -0.03 0.77 0.09 1.19 -2.27 0.00 0.00 179.45 179.20 4r1r n PHE 724 N -4.48 1.44 -1.52 1.91 3.72 -0.87 -4.60 117.46 113.06 4r1r n PHE 724 Ca 0.15 -0.64 -0.07 0.00 -0.05 0.00 0.00 57.45 56.84 4r1r n PHE 724 Cb 0.15 -0.43 -0.02 0.00 -0.94 0.00 0.00 39.48 38.24 4r1r n PHE 724 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 4r1r n GLY 725 N 0.19 0.62 3.70 1.37 0.00 -0.91 -4.49 105.19 105.66 4r1r n GLY 725 Ca 0.22 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 4r1r n GLY 725 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4r1r s VAL 726 N -2.28 3.72 -0.08 1.61 1.01 -0.60 -4.93 120.40 118.86 4r1r s VAL 726 Ca 0.00 1.18 -0.25 0.00 0.00 0.00 0.00 61.98 62.90 4r1r s VAL 726 Cb 0.00 -3.76 -0.27 0.00 0.00 0.00 0.00 36.38 32.36 4r1r s VAL 726 CO 0.00 0.04 0.90 0.11 0.00 0.00 0.00 175.10 176.15 4r1r h LYS 727 N 7.29 0.16 -5.03 2.72 1.57 -1.89 -3.43 116.57 117.96 4r1r h LYS 727 Ca -0.40 -0.22 -0.40 0.00 -1.87 0.00 0.00 60.65 57.76 4r1r h LYS 727 Cb 1.19 0.08 -0.14 0.00 0.08 0.00 0.00 32.23 33.44 4r1r h LYS 727 CO 0.87 1.05 -0.61 0.95 -0.57 0.00 0.00 179.45 181.14 4r1r s THR 728 N -2.60 0.82 -0.04 -0.16 -4.23 -1.26 0.26 115.64 108.43 4r1r s THR 728 Ca -0.16 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.34 4r1r s THR 728 Cb -0.00 -2.70 0.03 0.00 1.34 0.00 0.00 72.50 71.16 4r1r s THR 728 CO 0.75 0.00 0.03 -0.76 -0.54 0.00 0.00 174.62 174.10 4r1r s LEU 729 N -3.39 0.74 0.00 4.79 1.43 -0.53 -4.52 118.68 117.20 4r1r s LEU 729 Ca 0.37 0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.49 4r1r s LEU 729 Cb 0.08 -0.19 0.00 0.00 0.03 0.00 0.00 46.19 46.12 4r1r s LEU 729 CO 0.14 -0.17 0.00 0.00 0.23 0.00 0.00 176.35 176.56 4r1r n TYR 730 N 4.66 0.00 -1.07 0.29 9.36 0.14 -2.93 117.16 127.61 4r1r n TYR 730 Ca -0.17 0.00 -0.36 0.00 3.32 0.00 0.00 57.90 60.69 4r1r n TYR 730 Cb 0.50 0.00 0.05 0.00 -0.63 0.00 0.00 39.34 39.26 4r1r n TYR 730 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 4r1r n TYR 731 N 0.00 -3.63 -4.05 2.98 4.01 -1.26 -4.72 117.16 110.49 4r1r n TYR 731 Ca 0.00 0.16 -0.31 0.00 -0.16 0.00 0.00 57.90 57.59 4r1r n TYR 731 Cb 0.00 -1.60 -0.16 0.00 -0.31 0.00 0.00 39.34 37.27 4r1r n TYR 731 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 4r1r s GLN 732 N -2.08 2.37 -0.17 -0.72 0.74 -1.03 -2.07 119.66 116.71 4r1r s GLN 732 Ca 0.49 -0.90 -0.15 0.00 0.05 0.00 0.00 55.36 54.85 4r1r s GLN 732 Cb -0.28 -2.51 -0.04 0.00 1.10 0.00 0.00 33.01 31.28 4r1r s GLN 732 CO 0.74 -0.37 0.37 -0.80 -0.55 0.00 0.00 175.29 174.68 4r1r s ASN 733 N 1.32 6.48 -0.05 6.67 0.01 0.28 -4.57 114.94 125.09 4r1r s ASN 733 Ca -0.00 0.57 0.03 0.00 -0.71 0.00 0.00 52.86 52.75 4r1r s ASN 733 Cb -0.16 -2.22 -0.03 0.00 0.41 0.00 0.00 41.25 39.26 4r1r s ASN 733 CO -0.09 0.02 -0.12 -0.89 -1.51 0.00 0.00 177.10 174.50 4r1r s THR 734 N 0.80 3.25 0.40 1.60 2.01 -1.26 -1.10 115.64 121.34 4r1r s THR 734 Ca 0.19 -0.66 -0.24 0.00 0.31 0.00 0.00 61.69 61.29 4r1r s THR 734 Cb -0.14 -2.29 -0.09 0.00 0.01 0.00 0.00 72.50 69.99 4r1r s THR 734 CO 0.07 0.58 1.06 -0.60 -0.69 0.00 0.00 174.62 175.04 4r1r s ARG 735 N -0.78 4.14 -1.04 4.92 3.52 -0.84 -4.97 118.95 123.90 4r1r s ARG 735 Ca 0.12 1.55 -0.03 0.00 -0.13 0.00 0.00 55.73 57.24 4r1r s ARG 735 Cb -0.11 -2.55 0.31 0.00 -1.56 0.00 0.00 34.95 31.04 4r1r s ARG 735 CO 0.01 -0.17 1.49 -3.47 -0.81 0.00 0.00 175.30 172.35 4r1r n ASP 736 N -0.06 6.40 0.00 -2.12 2.03 -1.26 -4.79 116.55 116.75 4r1r n ASP 736 Ca 0.05 -3.47 0.00 0.00 0.52 0.00 0.00 54.79 51.89 4r1r n ASP 736 Cb 0.49 -1.21 0.00 0.00 -0.72 0.00 0.00 41.12 39.68 4r1r n ASP 736 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89