#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d0h n ALA 2 N 0.00 -0.89 -2.95 0.00 0.00 -1.11 -4.55 120.51 111.01 2d0h n ALA 2 Ca 0.00 -0.34 -0.44 0.00 0.00 0.00 0.00 53.44 52.66 2d0h n ALA 2 Cb 0.00 0.19 -0.02 0.00 0.00 0.00 0.00 19.45 19.61 2d0h n ALA 2 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2d0h s ASN 3 N -1.81 6.71 -0.26 0.00 0.02 -1.23 -4.42 114.94 113.96 2d0h s ASN 3 Ca 0.08 -2.23 0.18 0.00 -1.02 0.00 0.00 52.86 49.87 2d0h s ASN 3 Cb -0.01 -2.39 0.49 0.00 0.02 0.00 0.00 41.25 39.36 2d0h s ASN 3 CO 0.02 -0.99 1.14 -0.90 0.02 0.00 0.00 177.10 176.39 2d0h n ASP 4 N 6.28 2.51 -4.08 -1.22 3.85 -1.26 -4.98 116.55 117.64 2d0h n ASP 4 Ca 0.25 -2.54 -0.32 0.00 -0.71 0.00 0.00 54.79 51.47 2d0h n ASP 4 Cb 0.48 -0.43 -0.01 0.00 -1.35 0.00 0.00 41.12 39.81 2d0h n ASP 4 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 2d0h n ASN 5 N -0.60 -3.24 -3.65 -1.12 3.02 -1.25 -4.95 115.26 103.48 2d0h n ASN 5 Ca 0.18 -0.94 -0.06 0.00 -0.03 0.00 0.00 54.58 53.73 2d0h n ASN 5 Cb 0.86 -3.17 -0.07 0.00 -0.61 0.00 0.00 39.78 36.79 2d0h n ASN 5 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2d0h s ASN 6 N -3.49 -0.90 -0.24 6.41 3.04 -1.23 -4.33 114.94 114.20 2d0h s ASN 6 Ca 0.59 1.41 -0.13 0.00 0.04 0.00 0.00 52.86 54.77 2d0h s ASN 6 Cb -0.31 1.63 -0.04 0.00 -1.54 0.00 0.00 41.25 40.98 2d0h s ASN 6 CO 0.89 -0.23 0.28 -0.69 -3.04 0.00 0.00 177.10 174.31 2d0h s VAL 7 N 2.14 5.27 -0.61 -5.21 1.01 -1.26 -4.88 120.40 116.86 2d0h s VAL 7 Ca -0.08 0.42 -0.22 0.00 0.00 0.00 0.00 61.98 62.10 2d0h s VAL 7 Cb -0.08 -3.61 0.07 0.00 0.00 0.00 0.00 36.38 32.75 2d0h s VAL 7 CO -0.18 0.27 0.87 -1.61 0.00 0.00 0.00 175.10 174.45 2d0h s GLU 8 N 1.44 3.13 0.30 2.72 2.02 -1.26 -4.94 118.70 122.11 2d0h s GLU 8 Ca 0.12 -0.85 0.07 0.00 0.02 0.00 0.00 54.97 54.33 2d0h s GLU 8 Cb -0.15 -4.19 0.81 0.00 0.10 0.00 0.00 34.13 30.70 2d0h s GLU 8 CO 0.07 -1.64 1.70 -1.49 0.02 0.00 0.00 175.26 173.92 2d0h h TRP 9 N 9.39 0.79 -0.06 1.61 4.06 -1.97 -1.86 115.95 127.91 2d0h h TRP 9 Ca -0.28 0.04 0.02 0.00 2.06 0.00 0.00 58.89 60.72 2d0h h TRP 9 Cb 1.08 -0.20 -0.00 0.00 -1.00 0.00 0.00 29.16 29.03 2d0h h TRP 9 CO 0.91 -0.03 0.14 -0.91 -3.56 0.00 0.00 178.44 174.99 2d0h h ASN 10 N 0.45 0.00 0.08 -3.49 -0.26 -2.02 -1.40 115.58 108.94 2d0h h ASN 10 Ca 0.60 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.34 2d0h h ASN 10 Cb 1.17 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.43 2d0h h ASN 10 CO -0.52 0.00 -0.61 0.61 -1.06 0.00 0.00 177.43 175.85 2d0h n GLY 11 N -1.25 -0.51 3.80 2.83 0.00 -0.70 -4.96 105.19 104.41 2d0h n GLY 11 Ca -0.01 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 2d0h n GLY 11 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d0h s LEU 12 N -2.69 4.13 -0.28 0.99 1.43 -0.53 -2.99 118.68 118.75 2d0h s LEU 12 Ca 0.15 1.72 -0.26 0.00 -1.03 0.00 0.00 54.13 54.71 2d0h s LEU 12 Cb 0.18 -4.25 0.16 0.00 0.03 0.00 0.00 46.19 42.31 2d0h s LEU 12 CO 0.67 -0.21 1.25 0.12 0.23 0.00 0.00 176.35 178.41 2d0h s PHE 13 N -1.90 -0.22 -0.28 0.29 5.36 -0.73 -4.95 117.98 115.55 2d0h s PHE 13 Ca 0.56 0.51 -0.24 0.00 -0.96 0.00 0.00 56.93 56.80 2d0h s PHE 13 Cb -0.13 0.44 0.12 0.00 -0.34 0.00 0.00 43.02 43.11 2d0h s PHE 13 CO 0.18 -0.13 1.00 -1.58 -1.46 0.00 0.00 175.22 173.23 2d0h s HIS 14 N -0.16 -0.52 0.39 10.12 5.65 -1.26 -1.72 115.29 127.78 2d0h s HIS 14 Ca 0.05 1.23 -0.13 0.00 0.25 0.00 0.00 55.06 56.46 2d0h s HIS 14 Cb -0.04 0.36 0.05 0.00 -1.18 0.00 0.00 32.58 31.78 2d0h s HIS 14 CO -0.10 -0.25 0.75 -0.40 -0.65 0.00 0.00 174.74 174.09 2d0h n ASP 15 N 2.46 -2.19 -2.01 9.88 5.75 -1.26 -4.97 116.55 124.21 2d0h n ASP 15 Ca -0.13 -2.59 -0.15 0.00 -0.01 0.00 0.00 54.79 51.90 2d0h n ASP 15 Cb 0.56 3.67 0.20 0.00 -1.03 0.00 0.00 41.12 44.52 2d0h n ASP 15 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2d0h n GLN 16 N -0.53 2.63 -1.59 0.11 6.02 -1.26 -4.47 117.38 118.29 2d0h n GLN 16 Ca -0.08 -2.68 -0.30 0.00 -0.01 0.00 0.00 57.00 53.93 2d0h n GLN 16 Cb 0.58 -2.07 0.10 0.00 1.02 0.00 0.00 30.24 29.87 2d0h n GLN 16 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2d0h s GLY 17 N -0.95 1.61 0.36 1.08 0.00 -1.26 -4.59 107.32 103.57 2d0h s GLY 17 Ca 0.50 -0.34 0.19 0.00 0.00 0.00 0.00 44.72 45.07 2d0h s GLY 17 CO 0.11 0.13 1.59 -2.55 0.00 0.00 0.00 173.10 172.38 2d0h h PRO 18 N -1.18 0.05 0.00 2.90 0.11 -1.78 -0.42 132.00 131.68 2d0h h PRO 18 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2d0h h PRO 18 Cb 1.29 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2d0h h PRO 18 CO 0.61 0.03 0.00 -0.07 -0.21 0.00 0.00 178.00 178.36 2d0h h LEU 19 N 0.05 0.00 -0.78 2.35 -0.00 -1.92 -3.34 115.31 111.67 2d0h h LEU 19 Ca 0.82 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.70 2d0h h LEU 19 Cb 2.12 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.78 2d0h h LEU 19 CO -0.75 0.00 0.00 0.49 -0.00 0.00 0.00 178.44 178.18 2d0h n PHE 20 N -2.67 0.00 -3.41 1.13 3.72 -0.22 -4.78 117.46 111.24 2d0h n PHE 20 Ca 0.03 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.38 2d0h n PHE 20 Cb 0.36 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.83 2d0h n PHE 20 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2d0h s ASP 21 N -0.10 -0.37 0.00 4.37 3.68 -0.87 -1.89 116.67 121.49 2d0h s ASP 21 Ca 0.00 0.69 0.30 0.00 2.13 0.00 0.00 52.55 55.67 2d0h s ASP 21 Cb 0.00 1.52 1.68 0.00 -1.45 0.00 0.00 42.92 44.67 2d0h s ASP 21 CO 0.00 -0.27 2.09 -0.46 0.13 0.00 0.00 175.17 176.67 2d0h n ASN 22 N 5.39 0.27 -2.96 -0.34 6.94 -1.12 -4.26 115.26 119.18 2d0h n ASN 22 Ca -0.05 -1.13 -0.15 0.00 -0.02 0.00 0.00 54.58 53.23 2d0h n ASN 22 Cb 0.50 -0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.92 2d0h n ASN 22 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2d0h n ALA 23 N -0.77 0.52 0.29 -2.53 0.00 -1.26 -4.97 120.51 111.79 2d0h n ALA 23 Ca 0.22 -2.40 0.15 0.00 0.00 0.00 0.00 53.44 51.42 2d0h n ALA 23 Cb 0.15 -1.07 0.88 0.00 0.00 0.00 0.00 19.45 19.42 2d0h n ALA 23 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2d0h h PRO 24 N 3.65 0.00 -2.11 0.00 0.13 -1.85 -3.14 132.00 128.68 2d0h h PRO 24 Ca -0.03 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.52 2d0h h PRO 24 Cb 0.98 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.71 2d0h h PRO 24 CO 0.37 0.04 -0.80 0.39 -0.23 0.00 0.00 178.00 177.76 2d0h n GLU 25 N -3.66 1.81 -1.89 0.86 1.02 -1.26 -4.63 120.64 112.88 2d0h n GLU 25 Ca -0.02 -4.09 -0.40 0.00 -0.02 0.00 0.00 57.16 52.63 2d0h n GLU 25 Cb 0.14 -1.84 0.00 0.00 -0.02 0.00 0.00 31.44 29.73 2d0h n GLU 25 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2d0h s PRO 26 N -1.99 3.93 0.84 3.49 0.04 -1.19 -4.85 135.00 135.27 2d0h s PRO 26 Ca 0.38 2.38 -0.11 0.00 0.04 0.00 0.00 61.00 63.69 2d0h s PRO 26 Cb 0.16 -2.80 0.13 0.00 0.04 0.00 0.00 34.50 32.03 2d0h s PRO 26 CO -0.05 -0.61 1.18 0.95 0.04 0.00 0.00 177.00 178.51 2d0h s THR 27 N -1.19 2.07 0.13 1.26 -4.23 -1.26 0.26 115.64 112.68 2d0h s THR 27 Ca 0.57 -0.12 0.28 0.00 -1.18 0.00 0.00 61.69 61.24 2d0h s THR 27 Cb -0.43 -2.95 0.28 0.00 1.34 0.00 0.00 72.50 70.75 2d0h s THR 27 CO 0.56 0.00 1.85 0.77 -0.54 0.00 0.00 174.62 177.26 2d0h h SER 28 N -1.15 0.00 0.00 3.99 4.64 -1.90 -2.32 113.55 116.81 2d0h h SER 28 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2d0h h SER 28 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2d0h h SER 28 CO 0.50 0.00 -0.09 0.35 -0.87 0.00 0.00 176.83 176.72 2d0h n THR 29 N -2.52 0.96 -3.00 2.95 -2.24 -1.26 -2.04 114.28 107.14 2d0h n THR 29 Ca -0.02 -1.09 -0.40 0.00 -2.27 0.00 0.00 64.05 60.27 2d0h n THR 29 Cb 0.09 0.32 -0.05 0.00 -2.10 0.00 0.00 70.33 68.59 2d0h n THR 29 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2d0h s GLN 30 N -1.31 4.49 0.37 -0.78 0.74 -0.87 -4.76 119.66 117.54 2d0h s GLN 30 Ca 0.11 1.05 -0.22 0.00 0.05 0.00 0.00 55.36 56.35 2d0h s GLN 30 Cb 0.10 -3.36 -0.10 0.00 1.10 0.00 0.00 33.01 30.75 2d0h s GLN 30 CO 0.01 0.30 0.91 -1.54 -0.55 0.00 0.00 175.29 174.42 2d0h s SER 31 N -0.11 7.05 -0.27 6.67 1.04 -1.26 -4.52 113.70 122.29 2d0h s SER 31 Ca 0.38 1.67 0.02 0.00 0.48 0.00 0.00 55.95 58.50 2d0h s SER 31 Cb -0.20 -2.53 0.06 0.00 0.10 0.00 0.00 66.02 63.45 2d0h s SER 31 CO 0.23 -0.23 -0.09 -0.69 0.98 0.00 0.00 173.24 173.44 2d0h s VAL 32 N -1.95 2.32 -0.24 5.02 1.01 -1.16 -4.81 120.40 120.59 2d0h s VAL 32 Ca 0.56 -1.61 -0.14 0.00 0.00 0.00 0.00 61.98 60.79 2d0h s VAL 32 Cb -0.12 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 2d0h s VAL 32 CO 0.17 -0.06 0.34 -0.89 0.00 0.00 0.00 175.10 174.66 2d0h s THR 33 N 1.12 5.22 0.16 3.92 2.01 -1.26 -1.17 115.64 125.65 2d0h s THR 33 Ca -0.08 0.54 0.09 0.00 0.31 0.00 0.00 61.69 62.54 2d0h s THR 33 Cb -0.20 -3.67 -0.04 0.00 0.01 0.00 0.00 72.50 68.60 2d0h s THR 33 CO -0.04 0.23 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.25 2d0h s LEU 34 N 1.56 2.92 -0.03 4.42 1.43 0.10 -2.79 118.68 126.29 2d0h s LEU 34 Ca 0.15 -0.57 0.05 0.00 -1.03 0.00 0.00 54.13 52.73 2d0h s LEU 34 Cb -0.15 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.42 2d0h s LEU 34 CO 0.08 0.12 -0.19 -0.54 0.23 0.00 0.00 176.35 176.05 2d0h s LYS 35 N -2.67 1.75 -0.12 1.70 1.02 -0.79 -0.85 119.74 119.78 2d0h s LYS 35 Ca 0.23 -0.68 0.01 0.00 0.02 0.00 0.00 55.97 55.55 2d0h s LYS 35 Cb -0.09 -1.59 -0.01 0.00 -0.52 0.00 0.00 37.83 35.61 2d0h s LYS 35 CO 0.14 0.34 -0.15 -1.17 -0.92 0.00 0.00 175.35 173.59 2d0h s LEU 36 N -0.22 2.59 -0.08 3.17 2.96 0.18 -4.79 118.68 122.48 2d0h s LEU 36 Ca 0.02 -0.37 -0.11 0.00 -0.22 0.00 0.00 54.13 53.44 2d0h s LEU 36 Cb -0.10 -1.57 -0.05 0.00 0.50 0.00 0.00 46.19 44.97 2d0h s LEU 36 CO 0.01 0.17 0.26 -0.60 -1.32 0.00 0.00 176.35 174.87 2d0h s ARG 37 N 0.34 3.76 0.16 1.98 3.52 -0.70 -0.80 118.95 127.21 2d0h s ARG 37 Ca -0.13 0.11 -0.07 0.00 -0.13 0.00 0.00 55.73 55.51 2d0h s ARG 37 Cb -0.16 -3.24 -0.01 0.00 -1.56 0.00 0.00 34.95 29.97 2d0h s ARG 37 CO 0.06 0.65 0.24 0.95 -0.81 0.00 0.00 175.30 176.39 2d0h s THR 38 N -0.78 0.07 0.56 4.11 -4.23 -0.96 -1.77 115.64 112.64 2d0h s THR 38 Ca 0.18 -1.49 -0.20 0.00 -1.18 0.00 0.00 61.69 59.00 2d0h s THR 38 Cb -0.14 -1.88 -0.04 0.00 1.34 0.00 0.00 72.50 71.78 2d0h s THR 38 CO 0.07 -0.33 1.27 -0.36 -0.54 0.00 0.00 174.62 174.73 2d0h s PHE 39 N -3.98 2.38 0.17 3.99 2.99 -1.24 -0.18 117.98 122.11 2d0h s PHE 39 Ca 0.18 1.46 -0.33 0.00 0.00 0.00 0.00 56.93 58.24 2d0h s PHE 39 Cb 0.04 -3.62 -0.14 0.00 0.00 0.00 0.00 43.02 39.31 2d0h s PHE 39 CO 0.00 -2.46 1.53 1.17 -0.00 0.00 0.00 175.22 175.46 2d0h n LYS 40 N -1.26 2.08 -1.72 0.44 4.81 -0.48 -2.13 118.16 119.90 2d0h n LYS 40 Ca 0.12 0.75 -0.19 0.00 -0.87 0.00 0.00 58.31 58.12 2d0h n LYS 40 Cb 0.47 -2.49 -0.07 0.00 0.02 0.00 0.00 35.03 32.97 2d0h n LYS 40 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2d0h n GLY 41 N 3.12 1.38 0.11 3.14 0.00 -1.26 -4.29 105.19 107.39 2d0h n GLY 41 Ca 0.16 -0.10 -0.00 0.00 0.00 0.00 0.00 46.02 46.07 2d0h n GLY 41 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2d0h h ASP 42 N 0.00 0.00 -1.95 1.61 3.58 -1.64 -2.94 116.42 115.08 2d0h h ASP 42 Ca -0.40 0.00 -0.60 0.00 0.42 0.00 0.00 57.03 56.45 2d0h h ASP 42 Cb 1.26 0.00 -0.13 0.00 1.72 0.00 0.00 39.33 42.17 2d0h h ASP 42 CO 0.56 0.64 -0.61 0.27 -2.88 0.00 0.00 179.24 177.22 2d0h s ILE 43 N -2.89 1.90 -0.04 2.25 -4.36 -1.26 -4.54 121.20 112.25 2d0h s ILE 43 Ca 0.02 -2.02 0.11 0.00 -0.26 0.00 0.00 60.65 58.50 2d0h s ILE 43 Cb 0.08 -2.92 -0.17 0.00 1.25 0.00 0.00 42.46 40.70 2d0h s ILE 43 CO 0.77 -0.03 0.20 0.35 0.24 0.00 0.00 174.94 176.48 2d0h n THR 44 N -0.90 0.21 -3.52 8.37 -2.24 0.53 -4.92 114.28 111.81 2d0h n THR 44 Ca -0.05 -0.33 -0.09 0.00 -2.27 0.00 0.00 64.05 61.31 2d0h n THR 44 Cb 0.67 -0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.83 2d0h n THR 44 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2d0h s SER 45 N -3.65 -0.38 -0.06 3.42 1.04 -0.87 -5.02 113.70 108.18 2d0h s SER 45 Ca -0.05 0.15 -0.10 0.00 0.48 0.00 0.00 55.95 56.43 2d0h s SER 45 Cb 0.06 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.58 2d0h s SER 45 CO 0.48 -0.55 0.26 0.00 0.98 0.00 0.00 173.24 174.42 2d0h s ALA 46 N -2.48 -0.65 0.05 5.32 0.00 -1.26 -0.66 121.76 122.08 2d0h s ALA 46 Ca 0.02 0.52 0.05 0.00 0.00 0.00 0.00 51.96 52.55 2d0h s ALA 46 Cb -0.01 -0.23 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 2d0h s ALA 46 CO -0.05 -0.17 -0.14 -0.80 0.00 0.00 0.00 175.76 174.60 2d0h s ASN 47 N -0.46 1.62 -0.29 0.00 0.01 -0.42 -0.51 114.94 114.89 2d0h s ASN 47 Ca -0.06 -0.49 -0.15 0.00 -0.71 0.00 0.00 52.86 51.46 2d0h s ASN 47 Cb -0.04 -0.09 -0.03 0.00 0.41 0.00 0.00 41.25 41.50 2d0h s ASN 47 CO 0.02 0.00 0.35 -0.63 -1.51 0.00 0.00 177.10 175.33 2d0h s ILE 48 N -0.94 5.18 -0.36 0.60 1.01 0.16 -1.77 121.20 125.08 2d0h s ILE 48 Ca 0.00 0.40 -0.08 0.00 0.00 0.00 0.00 60.65 60.97 2d0h s ILE 48 Cb -0.08 -3.72 0.04 0.00 0.01 0.00 0.00 42.46 38.71 2d0h s ILE 48 CO 0.01 0.10 0.15 -0.75 0.00 0.00 0.00 174.94 174.45 2d0h s LYS 49 N 2.03 2.67 0.05 2.79 2.20 -0.17 -0.36 119.74 128.97 2d0h s LYS 49 Ca 0.13 -1.17 0.08 0.00 -0.36 0.00 0.00 55.97 54.65 2d0h s LYS 49 Cb -0.16 -3.57 -0.03 0.00 -1.51 0.00 0.00 37.83 32.57 2d0h s LYS 49 CO 0.11 -0.70 -0.23 1.52 -0.36 0.00 0.00 175.35 175.69 2d0h s TYR 50 N 1.45 2.01 -0.07 4.03 -0.85 0.07 -1.72 117.35 122.27 2d0h s TYR 50 Ca -0.00 -0.39 -0.17 0.00 -0.52 0.00 0.00 57.07 55.99 2d0h s TYR 50 Cb -0.20 -1.19 -0.05 0.00 0.38 0.00 0.00 41.96 40.91 2d0h s TYR 50 CO 0.04 0.12 0.45 -0.46 -1.52 0.00 0.00 175.55 174.18 2d0h s TRP 51 N -0.84 3.59 -0.20 -3.49 -0.11 0.15 0.50 118.94 118.55 2d0h s TRP 51 Ca 0.09 0.92 -0.02 0.00 1.22 0.00 0.00 56.10 58.32 2d0h s TRP 51 Cb -0.09 -2.45 0.00 0.00 -1.50 0.00 0.00 33.47 29.42 2d0h s TRP 51 CO 0.02 0.34 -0.11 0.34 -4.62 0.00 0.00 176.95 172.93 2d0h s ASP 52 N -0.00 3.85 0.49 5.86 3.68 -0.68 -1.82 116.67 128.04 2d0h s ASP 52 Ca 0.25 -0.48 0.33 0.00 2.13 0.00 0.00 52.55 54.77 2d0h s ASP 52 Cb -0.16 -1.63 1.50 0.00 -1.45 0.00 0.00 42.92 41.18 2d0h s ASP 52 CO 0.11 0.00 1.98 0.71 0.13 0.00 0.00 175.17 178.10 2d0h h THR 53 N 5.77 0.00 -0.63 1.71 1.35 -1.76 -2.03 112.91 117.32 2d0h h THR 53 Ca -0.42 -0.27 -0.03 0.00 -0.55 0.00 0.00 66.41 65.14 2d0h h THR 53 Cb 1.16 1.16 -0.03 0.00 -1.73 0.00 0.00 68.15 68.70 2d0h h THR 53 CO 0.61 0.00 0.29 0.00 -0.25 0.00 0.00 175.52 176.17 2d0h h ALA 54 N 2.06 0.81 0.00 6.62 0.00 -1.93 -3.32 119.26 123.50 2d0h h ALA 54 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2d0h h ALA 54 Cb 0.31 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2d0h h ALA 54 CO 0.00 0.39 -0.13 -0.40 0.00 0.00 0.00 179.25 179.11 2d0h n ASP 55 N -4.48 1.64 -3.98 0.00 3.85 -1.11 -5.01 116.55 107.46 2d0h n ASP 55 Ca 0.04 -2.67 -0.31 0.00 -0.71 0.00 0.00 54.79 51.14 2d0h n ASP 55 Cb 0.14 -0.33 0.01 0.00 -1.35 0.00 0.00 41.12 39.59 2d0h n ASP 55 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 2d0h n ASN 56 N -0.96 -4.07 -3.73 -1.12 5.15 -0.78 -4.96 115.26 104.79 2d0h n ASN 56 Ca 0.10 -0.84 -0.10 0.00 -0.60 0.00 0.00 54.58 53.14 2d0h n ASN 56 Cb 0.63 -3.60 -0.06 0.00 -0.53 0.00 0.00 39.78 36.22 2d0h n ASN 56 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2d0h s ALA 57 N -3.35 -0.64 0.46 5.20 0.00 -1.20 -5.00 121.76 117.23 2d0h s ALA 57 Ca 0.62 -0.22 -0.18 0.00 0.00 0.00 0.00 51.96 52.18 2d0h s ALA 57 Cb -0.32 0.54 -0.09 0.00 0.00 0.00 0.00 23.12 23.25 2d0h s ALA 57 CO 0.85 -0.55 0.94 -0.06 0.00 0.00 0.00 175.76 176.95 2d0h s PHE 58 N -3.54 3.40 -0.03 0.00 0.40 -1.26 -1.68 117.98 115.27 2d0h s PHE 58 Ca 0.02 1.47 0.00 0.00 -0.60 0.00 0.00 56.93 57.82 2d0h s PHE 58 Cb 0.02 -2.77 0.03 0.00 0.51 0.00 0.00 43.02 40.81 2d0h s PHE 58 CO -0.10 -0.22 0.01 -1.01 0.70 0.00 0.00 175.22 174.60 2d0h s HIS 59 N -2.40 0.24 -0.17 0.36 3.76 0.18 -4.94 115.29 112.31 2d0h s HIS 59 Ca 0.59 0.04 -0.13 0.00 -0.15 0.00 0.00 55.06 55.41 2d0h s HIS 59 Cb -0.10 -0.37 -0.05 0.00 1.11 0.00 0.00 32.58 33.17 2d0h s HIS 59 CO 0.24 -0.13 0.28 -1.58 -0.85 0.00 0.00 174.74 172.70 2d0h s TRP 60 N 1.10 3.44 -0.22 1.40 0.51 -1.26 -0.75 118.94 123.16 2d0h s TRP 60 Ca -0.09 0.55 -0.01 0.00 -2.12 0.00 0.00 56.10 54.44 2d0h s TRP 60 Cb -0.13 -2.34 0.06 0.00 -0.81 0.00 0.00 33.47 30.25 2d0h s TRP 60 CO -0.02 0.21 -0.01 0.08 -0.51 0.00 0.00 176.95 176.70 2d0h s VAL 61 N 0.56 1.12 0.73 4.03 1.01 0.52 -4.95 120.40 123.42 2d0h s VAL 61 Ca 0.15 -0.99 -0.15 0.00 0.00 0.00 0.00 61.98 61.00 2d0h s VAL 61 Cb -0.13 -1.50 0.04 0.00 0.00 0.00 0.00 36.38 34.79 2d0h s VAL 61 CO 0.04 -0.17 1.22 -2.84 0.00 0.00 0.00 175.10 173.34 2d0h s PRO 62 N 1.58 2.12 0.23 2.72 0.02 -1.26 0.38 135.00 140.79 2d0h s PRO 62 Ca -0.03 1.79 0.09 0.00 0.02 0.00 0.00 61.00 62.87 2d0h s PRO 62 Cb -0.18 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.47 2d0h s PRO 62 CO -0.08 -1.86 0.02 -1.64 -0.33 0.00 0.00 177.00 173.11 2d0h s MET 63 N -3.88 2.39 0.07 5.54 -1.94 0.34 -4.67 119.30 117.15 2d0h s MET 63 Ca 0.75 -1.28 0.07 0.00 -1.71 0.00 0.00 55.69 53.52 2d0h s MET 63 Cb -0.30 -2.27 -0.03 0.00 2.01 0.00 0.00 34.83 34.24 2d0h s MET 63 CO 0.45 0.40 -0.18 0.14 -0.01 0.00 0.00 175.02 175.82 2d0h s VAL 64 N -2.10 1.43 0.24 -6.03 -7.23 -0.38 -4.63 120.40 101.70 2d0h s VAL 64 Ca 0.30 -1.31 -0.31 0.00 -1.81 0.00 0.00 61.98 58.85 2d0h s VAL 64 Cb -0.08 -1.30 -0.11 0.00 0.56 0.00 0.00 36.38 35.45 2d0h s VAL 64 CO 0.20 -0.04 1.62 0.86 -0.31 0.00 0.00 175.10 177.43 2d0h s TRP 65 N -1.06 2.87 -0.09 2.82 -0.00 -1.26 -0.76 118.94 121.45 2d0h s TRP 65 Ca 0.03 0.62 -0.02 0.00 -0.00 0.00 0.00 56.10 56.74 2d0h s TRP 65 Cb -0.09 -4.06 -0.05 0.00 -0.00 0.00 0.00 33.47 29.27 2d0h s TRP 65 CO 0.03 -3.75 -0.10 -3.47 -0.00 0.00 0.00 176.95 169.65 2d0h n ASP 66 N 3.07 1.95 -2.82 5.86 -0.08 0.17 -4.85 116.55 119.84 2d0h n ASP 66 Ca 0.12 0.04 0.01 0.00 -1.51 0.00 0.00 54.79 53.45 2d0h n ASP 66 Cb 0.37 -0.22 0.01 0.00 2.34 0.00 0.00 41.12 43.62 2d0h n ASP 66 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2d0h n SER 67 N -3.11 -0.84 -4.49 1.67 3.41 -1.01 -4.98 113.62 104.27 2d0h n SER 67 Ca -0.18 -1.22 -0.27 0.00 -0.26 0.00 0.00 58.87 56.94 2d0h n SER 67 Cb 0.65 1.31 -0.11 0.00 -0.26 0.00 0.00 64.21 65.80 2d0h n SER 67 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2d0h s ASN 68 N -2.84 3.83 0.83 4.04 0.02 -1.26 0.48 114.94 120.04 2d0h s ASN 68 Ca 0.19 -0.70 -0.12 0.00 -1.02 0.00 0.00 52.86 51.21 2d0h s ASN 68 Cb -0.01 -0.49 0.09 0.00 0.02 0.00 0.00 41.25 40.87 2d0h s ASN 68 CO 0.00 0.12 1.16 1.51 0.02 0.00 0.00 177.10 179.91 2d0h s ASP 69 N -2.64 4.31 0.51 -1.22 -4.77 -1.09 -4.90 116.67 106.87 2d0h s ASP 69 Ca 0.22 0.87 0.25 0.00 -3.30 0.00 0.00 52.55 50.59 2d0h s ASP 69 Cb -0.09 -1.42 1.36 0.00 -1.09 0.00 0.00 42.92 41.68 2d0h s ASP 69 CO 0.12 -2.04 1.96 -0.65 0.70 0.00 0.00 175.17 175.26 2d0h h PRO 70 N -1.15 0.07 -0.00 2.11 0.11 -1.94 -0.66 132.00 130.54 2d0h h PRO 70 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2d0h h PRO 70 Cb 1.32 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2d0h h PRO 70 CO 0.65 0.05 -0.11 0.25 -0.21 0.00 0.00 178.00 178.62 2d0h n THR 71 N -4.37 0.00 -1.38 -1.15 -2.24 -1.26 -4.92 114.28 98.96 2d0h n THR 71 Ca 0.13 -0.06 -0.13 0.00 -2.27 0.00 0.00 64.05 61.72 2d0h n THR 71 Cb 0.68 -0.10 -0.06 0.00 -2.10 0.00 0.00 70.33 68.76 2d0h n THR 71 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2d0h n GLY 72 N 1.29 1.38 0.08 3.38 0.00 -0.25 -4.88 105.19 106.19 2d0h n GLY 72 Ca 0.14 -0.32 -0.02 0.00 0.00 0.00 0.00 46.02 45.82 2d0h n GLY 72 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2d0h n THR 73 N -2.56 1.16 -4.44 2.61 -1.04 -1.26 -4.85 114.28 103.90 2d0h n THR 73 Ca -0.13 -0.72 -0.22 0.00 -2.04 0.00 0.00 64.05 60.94 2d0h n THR 73 Cb 0.46 -0.64 -0.10 0.00 -1.82 0.00 0.00 70.33 68.23 2d0h n THR 73 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2d0h s PHE 74 N -2.85 2.02 0.22 -1.42 0.40 -1.26 -1.39 117.98 113.70 2d0h s PHE 74 Ca -0.05 -0.63 0.08 0.00 -0.60 0.00 0.00 56.93 55.73 2d0h s PHE 74 Cb 0.09 -1.11 -0.04 0.00 0.51 0.00 0.00 43.02 42.47 2d0h s PHE 74 CO 0.83 0.37 0.05 -0.51 0.70 0.00 0.00 175.22 176.65 2d0h s ASP 75 N -3.46 4.90 -0.11 1.36 1.01 0.74 -2.67 116.67 118.45 2d0h s ASP 75 Ca 0.29 -0.43 0.00 0.00 0.71 0.00 0.00 52.55 53.12 2d0h s ASP 75 Cb 0.02 -1.07 0.02 0.00 1.01 0.00 0.00 42.92 42.91 2d0h s ASP 75 CO 0.12 0.03 -0.09 -0.31 0.21 0.00 0.00 175.17 175.14 2d0h s TYR 76 N -2.01 1.52 -0.01 4.23 4.12 0.18 -2.28 117.35 123.10 2d0h s TYR 76 Ca 0.30 -0.73 0.02 0.00 0.02 0.00 0.00 57.07 56.68 2d0h s TYR 76 Cb -0.08 -1.22 -0.03 0.00 -1.52 0.00 0.00 41.96 39.10 2d0h s TYR 76 CO 0.21 -0.47 -0.03 -1.58 0.02 0.00 0.00 175.55 173.69 2d0h s TRP 77 N 1.47 3.01 0.05 2.71 0.52 0.02 0.43 118.94 127.15 2d0h s TRP 77 Ca 0.01 0.05 0.05 0.00 0.02 0.00 0.00 56.10 56.22 2d0h s TRP 77 Cb -0.13 -1.66 -0.02 0.00 -1.15 0.00 0.00 33.47 30.50 2d0h s TRP 77 CO -0.06 0.42 -0.14 -1.59 0.02 0.00 0.00 176.95 175.61 2d0h s LYS 78 N -1.37 0.84 0.03 4.98 -2.85 0.06 0.49 119.74 121.93 2d0h s LYS 78 Ca 0.17 -0.83 -0.11 0.00 -1.00 0.00 0.00 55.97 54.20 2d0h s LYS 78 Cb -0.11 -0.84 0.01 0.00 -2.06 0.00 0.00 37.83 34.83 2d0h s LYS 78 CO 0.08 0.20 0.22 0.20 0.10 0.00 0.00 175.35 176.14 2d0h s GLY 79 N -1.41 -0.02 -0.10 0.59 0.00 -0.03 -1.25 107.32 105.09 2d0h s GLY 79 Ca -0.01 -0.14 0.03 0.00 0.00 0.00 0.00 44.72 44.60 2d0h s GLY 79 CO 0.02 -0.33 -0.21 -1.59 0.00 0.00 0.00 173.10 170.99 2d0h s THR 80 N -2.30 1.86 -0.15 0.90 2.01 -1.26 0.01 115.64 116.71 2d0h s THR 80 Ca -0.07 -0.89 -0.20 0.00 0.31 0.00 0.00 61.69 60.84 2d0h s THR 80 Cb -0.02 -1.64 -0.03 0.00 0.01 0.00 0.00 72.50 70.82 2d0h s THR 80 CO -0.02 0.52 0.55 -0.63 -0.69 0.00 0.00 174.62 174.35 2d0h s ILE 81 N 0.56 5.11 0.44 1.82 1.01 -0.32 -4.95 121.20 124.86 2d0h s ILE 81 Ca -0.15 1.07 -0.24 0.00 0.00 0.00 0.00 60.65 61.34 2d0h s ILE 81 Cb -0.17 -3.88 -0.10 0.00 0.01 0.00 0.00 42.46 38.32 2d0h s ILE 81 CO 0.05 0.22 1.05 -2.65 0.00 0.00 0.00 174.94 173.61 2d0h n PRO 82 N 4.34 1.41 -2.84 2.79 -0.02 -1.26 -3.00 135.00 136.42 2d0h n PRO 82 Ca -0.04 0.51 -0.32 0.00 -2.02 0.00 0.00 63.50 61.63 2d0h n PRO 82 Cb 0.51 -2.11 -0.04 0.00 -0.02 0.00 0.00 33.50 31.83 2d0h n PRO 82 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2d0h s ALA 83 N -1.28 3.25 0.00 3.55 0.00 -1.26 -4.87 121.76 121.15 2d0h s ALA 83 Ca 0.64 0.00 0.00 0.00 0.00 0.00 0.00 51.96 52.60 2d0h s ALA 83 Cb -0.54 -2.85 0.00 0.00 0.00 0.00 0.00 23.12 19.73 2d0h s ALA 83 CO 0.56 0.06 0.00 -1.13 0.00 0.00 0.00 175.76 175.25 2d0h n SER 84 N -1.02 0.00 0.14 0.00 3.41 -1.25 -5.00 113.62 109.89 2d0h n SER 84 Ca 0.04 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.76 2d0h n SER 84 Cb 0.54 0.00 0.51 0.00 -0.26 0.00 0.00 64.21 65.00 2d0h n SER 84 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2d0h n PRO 85 N -0.29 0.17 -2.15 4.33 -0.02 -0.86 -4.70 135.00 131.48 2d0h n PRO 85 Ca 0.00 0.48 -0.38 0.00 -2.02 0.00 0.00 63.50 61.58 2d0h n PRO 85 Cb 0.00 -1.88 -0.00 0.00 -0.02 0.00 0.00 33.50 31.59 2d0h n PRO 85 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2d0h s SER 86 N -4.14 6.12 0.30 2.55 1.04 -1.26 -4.47 113.70 113.84 2d0h s SER 86 Ca 0.02 2.45 -0.29 0.00 0.48 0.00 0.00 55.95 58.62 2d0h s SER 86 Cb 0.08 -2.62 -0.09 0.00 0.10 0.00 0.00 66.02 63.49 2d0h s SER 86 CO 0.33 -0.97 1.11 -0.63 0.98 0.00 0.00 173.24 174.06 2d0h s ILE 87 N -1.43 3.45 0.05 -1.02 1.01 -1.26 -4.58 121.20 117.42 2d0h s ILE 87 Ca 0.62 1.40 0.02 0.00 0.00 0.00 0.00 60.65 62.69 2d0h s ILE 87 Cb -0.33 -3.87 -0.03 0.00 0.01 0.00 0.00 42.46 38.25 2d0h s ILE 87 CO 0.40 0.29 -0.07 -0.54 0.00 0.00 0.00 174.94 175.03 2d0h s LYS 88 N -1.64 0.59 -0.01 2.79 1.02 -0.52 -2.17 119.74 119.80 2d0h s LYS 88 Ca 0.47 -0.91 0.05 0.00 0.02 0.00 0.00 55.97 55.60 2d0h s LYS 88 Cb -0.31 -0.20 -0.01 0.00 -0.52 0.00 0.00 37.83 36.78 2d0h s LYS 88 CO 0.40 0.01 -0.17 0.71 -0.92 0.00 0.00 175.35 175.38 2d0h s TYR 89 N -2.09 1.52 0.05 3.18 1.51 -0.76 -1.54 117.35 119.22 2d0h s TYR 89 Ca -0.04 -0.29 -0.01 0.00 -1.01 0.00 0.00 57.07 55.71 2d0h s TYR 89 Cb -0.05 -0.97 -0.04 0.00 -0.11 0.00 0.00 41.96 40.79 2d0h s TYR 89 CO -0.02 -0.02 -0.02 1.52 -1.11 0.00 0.00 175.55 175.90 2d0h s TYR 90 N -0.44 0.47 0.26 2.71 -0.85 -0.65 0.35 117.35 119.21 2d0h s TYR 90 Ca 0.06 -0.99 -0.06 0.00 -0.52 0.00 0.00 57.07 55.57 2d0h s TYR 90 Cb -0.07 -0.35 -0.02 0.00 0.38 0.00 0.00 41.96 41.90 2d0h s TYR 90 CO -0.00 -0.36 0.36 -0.98 -1.52 0.00 0.00 175.55 173.04 2d0h s ARG 91 N -3.61 1.52 0.01 -3.49 1.70 -0.70 -0.83 118.95 113.56 2d0h s ARG 91 Ca 0.04 -1.52 0.08 0.00 -0.47 0.00 0.00 55.73 53.86 2d0h s ARG 91 Cb 0.06 0.39 -0.03 0.00 -0.57 0.00 0.00 34.95 34.80 2d0h s ARG 91 CO -0.09 -0.59 -0.24 -0.06 -1.08 0.00 0.00 175.30 173.24 2d0h s PHE 92 N -3.83 2.41 -0.29 5.89 0.40 0.26 -1.00 117.98 121.81 2d0h s PHE 92 Ca 0.30 -0.37 -0.05 0.00 -0.60 0.00 0.00 56.93 56.21 2d0h s PHE 92 Cb 0.02 -1.47 0.02 0.00 0.51 0.00 0.00 43.02 42.10 2d0h s PHE 92 CO 0.13 0.10 0.05 -1.14 0.70 0.00 0.00 175.22 175.06 2d0h s GLN 93 N -1.00 2.90 -0.21 0.44 0.74 -0.73 -1.65 119.66 120.15 2d0h s GLN 93 Ca 0.12 -0.97 -0.05 0.00 0.05 0.00 0.00 55.36 54.50 2d0h s GLN 93 Cb -0.10 -3.30 -0.02 0.00 1.10 0.00 0.00 33.01 30.69 2d0h s GLN 93 CO 0.01 -0.49 -0.00 0.42 -0.55 0.00 0.00 175.29 174.68 2d0h s ILE 94 N 1.43 3.85 0.03 -2.34 1.01 0.41 -1.31 121.20 124.28 2d0h s ILE 94 Ca 0.01 -0.34 0.09 0.00 0.00 0.00 0.00 60.65 60.40 2d0h s ILE 94 Cb -0.18 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.52 2d0h s ILE 94 CO 0.01 0.41 -0.25 0.20 0.00 0.00 0.00 174.94 175.31 2d0h s ASN 95 N 1.21 2.99 -0.28 3.58 0.01 0.16 -0.85 114.94 121.76 2d0h s ASN 95 Ca 0.03 -0.55 -0.03 0.00 -0.71 0.00 0.00 52.86 51.59 2d0h s ASN 95 Cb -0.15 -0.28 0.10 0.00 0.41 0.00 0.00 41.25 41.34 2d0h s ASN 95 CO 0.01 0.25 0.15 -0.62 -1.51 0.00 0.00 177.10 175.38 2d0h s ASP 96 N -1.11 3.18 1.78 -1.22 2.15 -0.38 -0.35 116.67 120.72 2d0h s ASP 96 Ca 0.11 -1.17 0.00 0.00 0.43 0.00 0.00 52.55 51.92 2d0h s ASP 96 Cb -0.10 -0.21 0.00 0.00 -0.30 0.00 0.00 42.92 42.32 2d0h s ASP 96 CO 0.01 -0.43 0.00 0.61 -0.17 0.00 0.00 175.17 175.20 2d0h n GLY 97 N 5.26 3.22 0.22 2.66 0.00 -1.26 -1.36 105.19 113.93 2d0h n GLY 97 Ca -0.05 -0.15 0.14 0.00 0.00 0.00 0.00 46.02 45.95 2d0h n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2d0h n THR 98 N 0.00 0.00 -3.31 2.61 -2.24 -1.26 -4.86 114.28 105.22 2d0h n THR 98 Ca 0.00 -0.12 -0.38 0.00 -2.27 0.00 0.00 64.05 61.28 2d0h n THR 98 Cb 0.00 0.15 -0.06 0.00 -2.10 0.00 0.00 70.33 68.32 2d0h n THR 98 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2d0h s SER 99 N -2.35 6.97 -0.01 3.42 0.15 -0.46 -5.07 113.70 116.35 2d0h s SER 99 Ca 0.31 1.16 0.01 0.00 0.70 0.00 0.00 55.95 58.12 2d0h s SER 99 Cb 0.20 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 62.18 2d0h s SER 99 CO 0.45 0.24 -0.02 -0.89 1.20 0.00 0.00 173.24 174.22 2d0h s THR 100 N -0.83 0.17 0.09 6.45 2.01 -1.26 -1.24 115.64 121.03 2d0h s THR 100 Ca 0.28 -0.06 0.04 0.00 0.31 0.00 0.00 61.69 62.27 2d0h s THR 100 Cb -0.18 -0.18 -0.03 0.00 0.01 0.00 0.00 72.50 72.12 2d0h s THR 100 CO 0.17 0.07 -0.12 0.00 -0.69 0.00 0.00 174.62 174.05 2d0h s ALA 101 N 0.17 1.18 0.20 7.40 0.00 -0.03 -4.91 121.76 125.77 2d0h s ALA 101 Ca -0.01 -1.12 0.10 0.00 0.00 0.00 0.00 51.96 50.92 2d0h s ALA 101 Cb -0.04 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 2d0h s ALA 101 CO -0.00 0.05 -0.14 -1.58 0.00 0.00 0.00 175.76 174.09 2d0h s TRP 102 N -1.95 2.51 -0.12 0.00 0.52 -0.23 -0.45 118.94 119.22 2d0h s TRP 102 Ca 0.03 -0.27 -0.06 0.00 0.02 0.00 0.00 56.10 55.82 2d0h s TRP 102 Cb -0.06 -1.21 0.05 0.00 -1.15 0.00 0.00 33.47 31.11 2d0h s TRP 102 CO 0.01 0.54 0.28 -0.47 0.02 0.00 0.00 176.95 177.33 2d0h s TYR 103 N -1.83 -0.41 0.00 -1.98 6.14 -0.66 -0.71 117.35 117.90 2d0h s TYR 103 Ca 0.25 0.93 0.00 0.00 0.64 0.00 0.00 57.07 58.89 2d0h s TYR 103 Cb -0.08 0.07 0.00 0.00 0.42 0.00 0.00 41.96 42.37 2d0h s TYR 103 CO 0.14 -0.29 0.00 0.27 0.64 0.00 0.00 175.55 176.31 2d0h n ASN 104 N 4.54 0.00 0.29 4.32 2.04 -0.69 -0.58 115.26 125.18 2d0h n ASN 104 Ca -0.20 -0.21 0.14 0.00 -0.44 0.00 0.00 54.58 53.88 2d0h n ASN 104 Cb 0.52 0.00 0.70 0.00 -2.53 0.00 0.00 39.78 38.47 2d0h n ASN 104 CO 0.00 0.00 0.00 1.23 -0.44 0.00 0.00 177.26 178.05 2d0h h GLY 105 N 0.00 0.00 -2.04 4.83 0.00 -0.42 0.20 103.07 105.64 2d0h h GLY 105 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2d0h h GLY 105 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.24 2d0h n ASN 106 N -2.96 3.98 0.00 0.19 3.02 -1.26 -4.79 115.26 113.45 2d0h n ASN 106 Ca 0.00 -2.56 0.00 0.00 -0.03 0.00 0.00 54.58 51.99 2d0h n ASN 106 Cb 0.52 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 2d0h n ASN 106 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2d0h n GLY 107 N 0.31 -1.52 3.81 7.41 0.00 0.71 -4.98 105.19 110.92 2d0h n GLY 107 Ca 0.20 -1.75 -0.34 0.00 0.00 0.00 0.00 46.02 44.13 2d0h n GLY 107 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d0h s PRO 108 N 0.00 4.00 -0.03 1.61 0.04 -1.26 -1.70 135.00 137.66 2d0h s PRO 108 Ca 0.00 1.27 -0.18 0.00 0.04 0.00 0.00 61.00 62.13 2d0h s PRO 108 Cb 0.00 -2.16 0.03 0.00 0.04 0.00 0.00 34.50 32.41 2d0h s PRO 108 CO 0.00 -0.24 0.40 0.45 0.04 0.00 0.00 177.00 177.64 2d0h s SER 109 N -2.04 -0.31 0.29 6.66 0.15 0.12 -4.97 113.70 113.61 2d0h s SER 109 Ca 0.64 0.28 0.18 0.00 0.70 0.00 0.00 55.95 57.76 2d0h s SER 109 Cb -0.14 0.40 0.11 0.00 -1.71 0.00 0.00 66.02 64.69 2d0h s SER 109 CO 0.17 -0.46 1.37 0.77 1.20 0.00 0.00 173.24 176.30 2d0h h SER 110 N 3.81 0.00 -3.77 5.45 4.64 -1.91 -0.60 113.55 121.18 2d0h h SER 110 Ca -0.29 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.35 2d0h h SER 110 Cb 1.17 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.07 2d0h h SER 110 CO 0.39 0.31 -0.80 0.42 -0.87 0.00 0.00 176.83 176.27 2d0h s THR 111 N -3.08 2.84 -0.20 2.95 -4.23 -1.26 -4.80 115.64 107.86 2d0h s THR 111 Ca 0.04 -1.45 -0.29 0.00 -1.18 0.00 0.00 61.69 58.81 2d0h s THR 111 Cb 0.07 -2.28 -0.03 0.00 1.34 0.00 0.00 72.50 71.60 2d0h s THR 111 CO 0.74 0.14 1.66 -0.70 -0.54 0.00 0.00 174.62 175.91 2d0h s GLU 112 N -2.02 3.81 0.80 3.99 2.12 -1.26 -4.77 118.70 121.36 2d0h s GLU 112 Ca 0.17 1.75 -0.12 0.00 0.36 0.00 0.00 54.97 57.13 2d0h s GLU 112 Cb -0.11 -4.05 0.08 0.00 0.26 0.00 0.00 34.13 30.32 2d0h s GLU 112 CO 0.09 -1.28 1.16 -2.14 -0.54 0.00 0.00 175.26 172.55 2d0h s PRO 113 N 4.69 1.74 0.00 4.30 0.02 -1.26 -4.96 135.00 139.53 2d0h s PRO 113 Ca 0.73 1.59 0.05 0.00 0.02 0.00 0.00 61.00 63.39 2d0h s PRO 113 Cb -0.26 -1.80 0.10 0.00 0.02 0.00 0.00 34.50 32.55 2d0h s PRO 113 CO 0.30 -2.10 0.94 0.27 -0.33 0.00 0.00 177.00 176.08 2d0h n ASN 114 N -3.41 2.04 -2.96 2.53 0.23 -1.26 -5.04 115.26 107.39 2d0h n ASN 114 Ca 0.12 -1.68 -0.11 0.00 -0.53 0.00 0.00 54.58 52.38 2d0h n ASN 114 Cb 0.51 -0.07 0.01 0.00 -2.08 0.00 0.00 39.78 38.15 2d0h n ASN 114 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2d0h s ALA 115 N -0.77 -0.21 -1.54 -2.53 0.00 -1.26 -4.96 121.76 110.49 2d0h s ALA 115 Ca 0.09 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 51.02 2d0h s ALA 115 Cb 0.05 0.82 0.00 0.00 0.00 0.00 0.00 23.12 23.99 2d0h s ALA 115 CO 0.07 -0.92 0.00 -0.25 0.00 0.00 0.00 175.76 174.66 2d0h n ASP 116 N -1.49 -4.78 -4.74 0.00 10.43 -1.26 -4.84 116.55 109.86 2d0h n ASP 116 Ca -0.06 0.27 -0.31 0.00 2.57 0.00 0.00 54.79 57.27 2d0h n ASP 116 Cb 0.60 -3.71 0.11 0.00 1.84 0.00 0.00 41.12 39.96 2d0h n ASP 116 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 2d0h s ASP 117 N -2.69 4.06 0.67 -2.24 -0.00 -1.26 0.29 116.67 115.49 2d0h s ASP 117 Ca 0.00 1.84 -0.11 0.00 -0.00 0.00 0.00 52.55 54.27 2d0h s ASP 117 Cb 0.00 -2.48 -0.01 0.00 -0.00 0.00 0.00 42.92 40.43 2d0h s ASP 117 CO 0.00 -2.32 1.06 -0.36 -0.00 0.00 0.00 175.17 173.55 2d0h s PHE 118 N -2.86 3.42 0.07 4.23 0.40 -0.01 -4.62 117.98 118.61 2d0h s PHE 118 Ca 0.62 1.21 0.05 0.00 -0.60 0.00 0.00 56.93 58.21 2d0h s PHE 118 Cb -0.18 -2.88 -0.04 0.00 0.51 0.00 0.00 43.02 40.43 2d0h s PHE 118 CO 0.57 -0.98 -0.02 0.71 0.70 0.00 0.00 175.22 176.19 2d0h s TYR 119 N -3.22 2.95 -0.26 0.36 2.02 -1.26 -1.63 117.35 116.30 2d0h s TYR 119 Ca 0.57 -0.04 -0.04 0.00 -0.37 0.00 0.00 57.07 57.19 2d0h s TYR 119 Cb -0.12 -1.54 0.09 0.00 -0.40 0.00 0.00 41.96 39.99 2d0h s TYR 119 CO 0.53 0.46 0.11 0.42 -1.57 0.00 0.00 175.55 175.50 2d0h s ILE 120 N -1.23 0.05 -0.40 2.71 1.01 -0.59 -4.87 121.20 117.88 2d0h s ILE 120 Ca 0.23 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.25 2d0h s ILE 120 Cb -0.11 -0.95 0.11 0.00 0.01 0.00 0.00 42.46 41.51 2d0h s ILE 120 CO 0.15 -0.58 0.13 -0.63 0.00 0.00 0.00 174.94 174.01 2d0h s ILE 121 N 2.05 2.50 0.34 2.92 1.01 -1.26 -1.43 121.20 127.33 2d0h s ILE 121 Ca 0.07 -2.58 -0.29 0.00 0.00 0.00 0.00 60.65 57.85 2d0h s ILE 121 Cb -0.16 -2.80 -0.11 0.00 0.01 0.00 0.00 42.46 39.40 2d0h s ILE 121 CO -0.27 -0.67 1.53 -2.84 0.00 0.00 0.00 174.94 172.69 2d0h s PRO 122 N 0.60 4.12 -1.28 2.79 0.02 -1.26 -3.37 135.00 136.61 2d0h s PRO 122 Ca 0.12 2.57 -0.07 0.00 0.02 0.00 0.00 61.00 63.65 2d0h s PRO 122 Cb -0.21 -2.99 0.01 0.00 0.02 0.00 0.00 34.50 31.33 2d0h s PRO 122 CO -0.06 -0.57 0.93 0.09 -0.33 0.00 0.00 177.00 177.06 2d0h n ASN 123 N 1.19 -5.91 -3.93 2.53 5.03 0.14 -4.65 115.26 109.67 2d0h n ASN 123 Ca 0.04 -0.42 -0.30 0.00 0.87 0.00 0.00 54.58 54.77 2d0h n ASN 123 Cb 0.38 -4.59 -0.16 0.00 -1.02 0.00 0.00 39.78 34.40 2d0h n ASN 123 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2d0h s PHE 124 N -3.24 2.37 -0.04 3.10 5.99 -1.22 -4.95 117.98 119.98 2d0h s PHE 124 Ca 0.46 -1.77 0.03 0.00 0.00 0.00 0.00 56.93 55.65 2d0h s PHE 124 Cb -0.20 -1.61 0.01 0.00 0.00 0.00 0.00 43.02 41.21 2d0h s PHE 124 CO 0.57 -0.78 -0.11 0.21 -0.00 0.00 0.00 175.22 175.11 2d0h s LYS 125 N 1.40 1.30 0.17 10.12 2.47 -1.26 -4.70 119.74 129.24 2d0h s LYS 125 Ca -0.04 -0.37 0.05 0.00 -1.56 0.00 0.00 55.97 54.05 2d0h s LYS 125 Cb -0.19 -1.15 -0.04 0.00 -1.46 0.00 0.00 37.83 35.00 2d0h s LYS 125 CO -0.07 0.09 0.15 0.95 0.16 0.00 0.00 175.35 176.63 2d0h s THR 126 N 0.37 4.51 0.15 3.43 -4.23 -1.26 -5.03 115.64 113.57 2d0h s THR 126 Ca -0.07 -1.10 -0.32 0.00 -1.18 0.00 0.00 61.69 59.01 2d0h s THR 126 Cb -0.12 -3.32 -0.12 0.00 1.34 0.00 0.00 72.50 70.29 2d0h s THR 126 CO 0.02 -0.13 1.73 -2.65 -0.54 0.00 0.00 174.62 173.05 2d0h n PRO 127 N -0.43 2.57 0.25 3.99 -0.02 -1.26 -4.90 135.00 135.20 2d0h n PRO 127 Ca -0.08 0.93 0.13 0.00 -2.02 0.00 0.00 63.50 62.45 2d0h n PRO 127 Cb 0.55 -2.77 0.62 0.00 -0.02 0.00 0.00 33.50 31.87 2d0h n PRO 127 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2d0h h ASP 128 N 7.31 0.00 0.57 2.55 3.32 -1.97 -2.12 116.42 126.08 2d0h h ASP 128 Ca -0.45 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.53 2d0h h ASP 128 Cb 1.23 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.77 2d0h h ASP 128 CO 0.93 0.15 -0.34 4.11 -1.72 0.00 0.00 179.24 182.38 2d0h h TRP 129 N 0.00 0.00 -0.15 4.55 5.08 -1.95 -2.24 115.95 121.24 2d0h h TRP 129 Ca -0.00 0.00 -0.23 0.00 1.08 0.00 0.00 58.89 59.74 2d0h h TRP 129 Cb 0.54 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 26.71 2d0h h TRP 129 CO 0.00 0.34 -0.79 1.25 -1.28 0.00 0.00 178.44 177.96 2d0h h LEU 130 N 0.00 0.95 -1.04 0.11 5.85 -1.77 -1.32 115.31 118.10 2d0h h LEU 130 Ca -0.00 -0.63 -0.06 0.00 0.84 0.00 0.00 57.88 58.03 2d0h h LEU 130 Cb 0.71 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 2d0h h LEU 130 CO 0.04 1.43 0.08 0.11 -0.34 0.00 0.00 178.44 179.76 2d0h h LYS 131 N 0.54 0.76 -0.02 1.25 1.57 -1.34 -3.23 116.57 116.12 2d0h h LYS 131 Ca -0.06 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 2d0h h LYS 131 Cb 1.42 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.62 2d0h h LYS 131 CO 0.16 0.72 -0.32 0.09 -0.57 0.00 0.00 179.45 179.53 2d0h n ASN 132 N -4.26 1.96 -5.03 0.86 3.02 -0.87 -4.74 115.26 106.20 2d0h n ASN 132 Ca 0.03 -1.47 -0.20 0.00 -0.03 0.00 0.00 54.58 52.91 2d0h n ASN 132 Cb 0.25 0.30 0.07 0.00 -0.61 0.00 0.00 39.78 39.78 2d0h n ASN 132 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2d0h s GLY 133 N -2.37 1.71 -0.13 7.41 0.00 -0.50 -4.88 107.32 108.56 2d0h s GLY 133 Ca 0.22 -2.19 0.02 0.00 0.00 0.00 0.00 44.72 42.78 2d0h s GLY 133 CO 0.50 -1.70 -0.18 0.14 0.00 0.00 0.00 173.10 171.86 2d0h s VAL 134 N -2.71 1.76 0.19 1.40 1.01 -1.26 -4.15 120.40 116.64 2d0h s VAL 134 Ca 0.63 -0.80 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 2d0h s VAL 134 Cb -0.05 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.70 2d0h s VAL 134 CO 0.40 0.49 0.38 -0.32 0.00 0.00 0.00 175.10 176.05 2d0h s MET 135 N 0.95 3.53 -0.20 2.72 1.75 0.99 -1.73 119.30 127.32 2d0h s MET 135 Ca -0.06 -0.30 -0.04 0.00 -1.25 0.00 0.00 55.69 54.05 2d0h s MET 135 Cb -0.15 -2.85 0.07 0.00 2.84 0.00 0.00 34.83 34.74 2d0h s MET 135 CO -0.03 0.42 0.07 -0.47 -0.65 0.00 0.00 175.02 174.36 2d0h s TYR 136 N -1.82 0.64 -0.09 4.11 5.04 0.63 -0.59 117.35 125.28 2d0h s TYR 136 Ca 0.39 -0.68 -0.21 0.00 -2.44 0.00 0.00 57.07 54.12 2d0h s TYR 136 Cb -0.11 -0.91 -0.04 0.00 0.35 0.00 0.00 41.96 41.25 2d0h s TYR 136 CO 0.28 -0.61 0.62 -1.14 -1.34 0.00 0.00 175.55 173.36 2d0h s GLN 137 N 1.99 4.39 -0.08 4.97 0.74 0.73 -1.94 119.66 130.46 2d0h s GLN 137 Ca 0.02 0.71 0.05 0.00 0.05 0.00 0.00 55.36 56.19 2d0h s GLN 137 Cb -0.17 -3.45 -0.00 0.00 1.10 0.00 0.00 33.01 30.49 2d0h s GLN 137 CO -0.12 0.09 -0.24 0.42 -0.55 0.00 0.00 175.29 174.88 2d0h s ILE 138 N 0.78 2.03 -0.69 -2.34 1.01 0.21 -0.63 121.20 121.56 2d0h s ILE 138 Ca 0.33 -1.02 -0.16 0.00 0.00 0.00 0.00 60.65 59.80 2d0h s ILE 138 Cb -0.17 -1.74 0.17 0.00 0.01 0.00 0.00 42.46 40.73 2d0h s ILE 138 CO 0.15 0.56 0.68 0.12 0.00 0.00 0.00 174.94 176.44 2d0h s PHE 139 N 0.15 3.44 0.10 3.97 2.19 -1.26 -1.86 117.98 124.71 2d0h s PHE 139 Ca -0.13 -1.57 -0.08 0.00 0.33 0.00 0.00 56.93 55.49 2d0h s PHE 139 Cb -0.16 -3.86 0.11 0.00 -1.31 0.00 0.00 43.02 37.80 2d0h s PHE 139 CO 0.07 -1.07 0.69 -2.30 1.83 0.00 0.00 175.22 174.45 2d0h n PRO 140 N 4.89 -0.10 0.21 10.12 -0.02 -1.26 -0.97 135.00 147.87 2d0h n PRO 140 Ca 0.01 0.69 0.15 0.00 -2.02 0.00 0.00 63.50 62.33 2d0h n PRO 140 Cb 0.44 -1.02 0.69 0.00 -0.02 0.00 0.00 33.50 33.58 2d0h n PRO 140 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2d0h h ASP 141 N 0.00 0.00 -0.20 2.55 1.82 -1.85 -3.14 116.42 115.60 2d0h h ASP 141 Ca 0.16 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.80 2d0h h ASP 141 Cb 0.27 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.28 2d0h h ASP 141 CO -0.44 0.00 0.00 0.54 -1.61 0.00 0.00 179.24 177.73 2d0h n ARG 142 N -2.59 1.81 -0.04 0.28 5.12 -0.14 -1.26 116.66 119.84 2d0h n ARG 142 Ca -0.00 -1.68 -0.02 0.00 -1.93 0.00 0.00 57.85 54.22 2d0h n ARG 142 Cb 0.17 -1.26 -0.01 0.00 -1.16 0.00 0.00 32.46 30.20 2d0h n ARG 142 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 2d0h h PHE 143 N 2.28 0.00 -1.99 -1.55 -0.00 -1.57 -1.04 116.94 113.07 2d0h h PHE 143 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.97 58.00 2d0h h PHE 143 Cb 0.63 0.00 -0.21 0.00 -0.00 0.00 0.00 35.95 36.37 2d0h h PHE 143 CO 0.13 0.00 0.02 -0.47 -0.00 0.00 0.00 178.31 177.99 2d0h s TYR 144 N -1.67 -1.07 -0.85 0.41 6.14 -1.26 -4.52 117.35 114.51 2d0h s TYR 144 Ca -0.08 2.13 -0.22 0.00 0.64 0.00 0.00 57.07 59.53 2d0h s TYR 144 Cb 0.01 0.64 0.07 0.00 0.42 0.00 0.00 41.96 43.11 2d0h s TYR 144 CO 0.12 -0.53 1.20 1.21 0.64 0.00 0.00 175.55 178.19 2d0h s ASN 145 N 1.70 6.39 0.27 4.32 3.84 -1.26 -2.11 114.94 128.10 2d0h s ASN 145 Ca -0.10 -1.33 0.19 0.00 0.21 0.00 0.00 52.86 51.84 2d0h s ASN 145 Cb -0.05 -2.48 0.10 0.00 -0.55 0.00 0.00 41.25 38.27 2d0h s ASN 145 CO -0.20 -1.42 1.30 1.23 -2.79 0.00 0.00 177.10 175.22 2d0h h GLY 146 N 11.79 0.00 -7.15 1.21 0.00 -1.84 -3.43 103.07 103.64 2d0h h GLY 146 Ca -0.02 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.80 2d0h h GLY 146 CO 1.25 0.00 -0.76 -0.35 0.00 0.00 0.00 176.54 176.68 2d0h s ASP 147 N -6.03 2.91 0.49 0.19 -1.08 -1.26 -4.75 116.67 107.14 2d0h s ASP 147 Ca 0.03 -0.88 0.28 0.00 -0.52 0.00 0.00 52.55 51.46 2d0h s ASP 147 Cb 0.07 -0.49 0.86 0.00 -1.46 0.00 0.00 42.92 41.90 2d0h s ASP 147 CO 0.74 -0.34 1.80 0.77 0.52 0.00 0.00 175.17 178.66 2d0h h SER 148 N 8.30 0.00 0.78 -0.34 4.64 -1.92 -3.25 113.55 121.76 2d0h h SER 148 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2d0h h SER 148 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2d0h h SER 148 CO 0.35 0.03 0.00 0.77 -0.87 0.00 0.00 176.83 177.10 2d0h h SER 149 N 0.00 0.00 -0.02 4.97 4.64 -1.99 -2.79 113.55 118.35 2d0h h SER 149 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2d0h h SER 149 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 2d0h h SER 149 CO 0.00 0.00 -0.06 -0.46 -0.87 0.00 0.00 176.83 175.44 2d0h n ASN 150 N -2.86 2.58 -4.66 4.97 0.23 -1.22 -4.99 115.26 109.30 2d0h n ASN 150 Ca 0.00 -1.83 -0.45 0.00 -0.53 0.00 0.00 54.58 51.78 2d0h n ASN 150 Cb 0.25 0.06 -0.03 0.00 -2.08 0.00 0.00 39.78 37.98 2d0h n ASN 150 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2d0h n ASP 151 N 0.94 2.64 -4.69 0.53 10.43 -1.06 -4.28 116.55 121.06 2d0h n ASP 151 Ca 0.14 1.15 -0.42 0.00 2.57 0.00 0.00 54.79 58.23 2d0h n ASP 151 Cb 0.54 -1.41 -0.03 0.00 1.84 0.00 0.00 41.12 42.05 2d0h n ASP 151 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2d0h s VAL 152 N -0.13 3.85 0.25 2.53 1.01 -1.26 -5.00 120.40 121.64 2d0h s VAL 152 Ca 0.68 1.23 -0.05 0.00 0.00 0.00 0.00 61.98 63.84 2d0h s VAL 152 Cb -0.66 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 31.87 2d0h s VAL 152 CO 0.51 0.01 0.51 -1.10 0.00 0.00 0.00 175.10 175.02 2d0h s GLN 153 N 2.22 3.65 0.22 2.72 -1.52 -1.26 -4.44 119.66 121.25 2d0h s GLN 153 Ca 0.61 -0.00 -0.32 0.00 -1.95 0.00 0.00 55.36 53.70 2d0h s GLN 153 Cb -0.30 -2.70 -0.13 0.00 -0.22 0.00 0.00 33.01 29.66 2d0h s GLN 153 CO 0.26 0.29 1.54 2.41 -0.25 0.00 0.00 175.29 179.54 2d0h n THR 154 N -0.61 0.56 -0.90 -0.19 -1.04 -1.26 -1.33 114.28 109.52 2d0h n THR 154 Ca -0.02 -0.14 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 2d0h n THR 154 Cb 0.53 -1.67 0.00 0.00 -1.82 0.00 0.00 70.33 67.37 2d0h n THR 154 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2d0h n GLY 155 N 2.77 0.62 0.21 3.41 0.00 0.20 -4.89 105.19 107.51 2d0h n GLY 155 Ca 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.13 2d0h n GLY 155 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2d0h h SER 156 N 0.00 -0.40 -5.16 1.61 0.87 -1.44 -3.44 113.55 105.60 2d0h h SER 156 Ca 0.00 0.15 -0.08 0.00 -1.23 0.00 0.00 61.79 60.63 2d0h h SER 156 Cb 0.08 0.29 -0.14 0.00 -0.44 0.00 0.00 62.40 62.19 2d0h h SER 156 CO 0.00 -0.14 -0.34 -0.72 -0.53 0.00 0.00 176.83 175.10 2d0h s TYR 157 N -6.20 0.13 -0.01 2.24 -0.85 -1.26 -5.03 117.35 106.37 2d0h s TYR 157 Ca -0.14 -0.55 0.07 0.00 -0.52 0.00 0.00 57.07 55.93 2d0h s TYR 157 Cb 0.17 -0.03 -0.02 0.00 0.38 0.00 0.00 41.96 42.46 2d0h s TYR 157 CO 0.72 -0.57 -0.23 0.95 -1.52 0.00 0.00 175.55 174.91 2d0h s THR 158 N -3.86 2.36 -0.07 -3.49 -4.23 -1.26 -1.63 115.64 103.46 2d0h s THR 158 Ca 0.06 -1.06 -0.04 0.00 -1.18 0.00 0.00 61.69 59.47 2d0h s THR 158 Cb 0.04 -1.87 0.04 0.00 1.34 0.00 0.00 72.50 72.05 2d0h s THR 158 CO -0.10 0.54 0.16 -0.47 -0.54 0.00 0.00 174.62 174.21 2d0h s TYR 159 N -0.69 -0.19 -1.05 3.99 6.14 0.89 -4.80 117.35 121.64 2d0h s TYR 159 Ca 0.11 0.52 0.00 0.00 0.64 0.00 0.00 57.07 58.34 2d0h s TYR 159 Cb -0.10 -0.04 0.00 0.00 0.42 0.00 0.00 41.96 42.24 2d0h s TYR 159 CO 0.00 -0.16 0.00 -1.71 0.64 0.00 0.00 175.55 174.32 2d0h n ASN 160 N 4.02 -3.92 -0.02 4.32 2.85 -1.26 -2.26 115.26 118.99 2d0h n ASN 160 Ca -0.24 0.10 -0.00 0.00 -0.11 0.00 0.00 54.58 54.33 2d0h n ASN 160 Cb 0.53 -2.86 -0.00 0.00 1.24 0.00 0.00 39.78 38.69 2d0h n ASN 160 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2d0h n GLY 161 N -1.25 0.47 3.05 8.20 0.00 -1.26 -5.04 105.19 109.35 2d0h n GLY 161 Ca -0.12 -0.37 -0.19 0.00 0.00 0.00 0.00 46.02 45.33 2d0h n GLY 161 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d0h s THR 162 N -1.99 0.81 0.58 2.61 2.01 -0.96 -5.11 115.64 113.60 2d0h s THR 162 Ca 0.00 -0.47 -0.09 0.00 0.31 0.00 0.00 61.69 61.44 2d0h s THR 162 Cb 0.00 -0.69 -0.03 0.00 0.01 0.00 0.00 72.50 71.79 2d0h s THR 162 CO 0.00 0.21 0.95 -2.16 -0.69 0.00 0.00 174.62 172.93 2d0h s PRO 163 N -0.30 3.46 0.57 4.92 0.04 -1.26 -0.08 135.00 142.34 2d0h s PRO 163 Ca 0.04 0.49 -0.12 0.00 0.04 0.00 0.00 61.00 61.44 2d0h s PRO 163 Cb -0.04 -2.18 -0.05 0.00 0.04 0.00 0.00 34.50 32.26 2d0h s PRO 163 CO -0.00 -0.51 0.99 0.95 0.04 0.00 0.00 177.00 178.46 2d0h s THR 164 N -3.05 4.67 -0.01 1.26 -4.23 -0.64 -4.35 115.64 109.29 2d0h s THR 164 Ca 0.53 0.93 0.02 0.00 -1.18 0.00 0.00 61.69 61.99 2d0h s THR 164 Cb -0.11 -3.82 -0.00 0.00 1.34 0.00 0.00 72.50 69.91 2d0h s THR 164 CO 0.50 -0.96 -0.06 -0.70 -0.54 0.00 0.00 174.62 172.86 2d0h s GLU 165 N -4.74 0.54 -0.15 3.99 2.12 -0.50 0.60 118.70 120.56 2d0h s GLU 165 Ca 0.56 -0.22 -0.12 0.00 0.36 0.00 0.00 54.97 55.54 2d0h s GLU 165 Cb -0.11 -0.52 -0.05 0.00 0.26 0.00 0.00 34.13 33.72 2d0h s GLU 165 CO 0.45 0.13 0.25 0.21 -0.54 0.00 0.00 175.26 175.75 2d0h s LYS 166 N -0.09 4.09 -0.01 4.30 2.20 -1.26 -0.97 119.74 128.01 2d0h s LYS 166 Ca 0.02 0.03 0.02 0.00 -0.36 0.00 0.00 55.97 55.67 2d0h s LYS 166 Cb -0.03 -3.37 -0.03 0.00 -1.51 0.00 0.00 37.83 32.88 2d0h s LYS 166 CO -0.00 0.37 -0.04 0.15 -0.36 0.00 0.00 175.35 175.47 2d0h s LYS 167 N 0.08 2.65 0.41 4.03 -0.14 -0.37 -4.88 119.74 121.52 2d0h s LYS 167 Ca 0.15 -0.66 -0.25 0.00 -1.36 0.00 0.00 55.97 53.85 2d0h s LYS 167 Cb -0.13 -2.57 -0.08 0.00 -1.68 0.00 0.00 37.83 33.37 2d0h s LYS 167 CO 0.03 0.62 1.16 0.00 -0.76 0.00 0.00 175.35 176.40 2d0h s ALA 168 N -1.00 3.13 0.27 5.17 0.00 -1.26 -4.50 121.76 123.56 2d0h s ALA 168 Ca 0.17 0.94 -0.30 0.00 0.00 0.00 0.00 51.96 52.77 2d0h s ALA 168 Cb -0.11 -3.37 -0.11 0.00 0.00 0.00 0.00 23.12 19.53 2d0h s ALA 168 CO 0.08 -0.52 1.56 -0.46 0.00 0.00 0.00 175.76 176.41 2d0h s TRP 169 N -1.45 2.86 0.00 0.00 -0.11 -1.26 -2.06 118.94 116.92 2d0h s TRP 169 Ca 0.58 0.80 0.00 0.00 1.22 0.00 0.00 56.10 58.70 2d0h s TRP 169 Cb -0.30 -4.00 0.00 0.00 -1.50 0.00 0.00 33.47 27.67 2d0h s TRP 169 CO 0.37 -3.39 0.00 0.41 -4.62 0.00 0.00 176.95 169.72 2d0h n GLY 170 N 2.42 0.68 3.99 5.86 0.00 -1.26 -5.04 105.19 111.84 2d0h n GLY 170 Ca 0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.92 2d0h n GLY 170 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d0h s SER 171 N -2.28 5.76 0.40 1.61 1.04 -0.87 -5.05 113.70 114.31 2d0h s SER 171 Ca 0.00 -0.23 -0.25 0.00 0.48 0.00 0.00 55.95 55.95 2d0h s SER 171 Cb 0.00 -0.99 -0.11 0.00 0.10 0.00 0.00 66.02 65.02 2d0h s SER 171 CO 0.00 -0.66 1.13 -0.24 0.98 0.00 0.00 173.24 174.45 2d0h n SER 172 N -1.83 1.89 0.25 7.02 2.88 -1.26 -4.80 113.62 117.76 2d0h n SER 172 Ca 0.04 1.09 0.14 0.00 -1.33 0.00 0.00 58.87 58.82 2d0h n SER 172 Cb 0.59 -1.41 0.41 0.00 -0.75 0.00 0.00 64.21 63.04 2d0h n SER 172 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 2d0h h VAL 173 N 1.88 0.03 -3.27 2.46 -1.51 -1.94 -3.45 116.25 110.45 2d0h h VAL 173 Ca -0.45 -0.80 -0.53 0.00 -1.23 0.00 0.00 66.70 63.69 2d0h h VAL 173 Cb 1.32 1.78 0.05 0.00 -2.13 0.00 0.00 31.29 32.31 2d0h h VAL 173 CO 0.59 0.01 0.77 -0.31 -1.23 0.00 0.00 177.57 177.40 2d0h s TYR 174 N -3.42 3.06 0.47 5.19 1.51 -1.26 -4.95 117.35 117.95 2d0h s TYR 174 Ca 0.04 0.97 -0.24 0.00 -1.01 0.00 0.00 57.07 56.83 2d0h s TYR 174 Cb 0.07 -3.81 -0.07 0.00 -0.11 0.00 0.00 41.96 38.03 2d0h s TYR 174 CO 0.61 -2.71 1.39 0.00 -1.11 0.00 0.00 175.55 173.74 2d0h s ALA 175 N 0.25 3.13 0.78 3.71 0.00 -1.26 -4.99 121.76 123.37 2d0h s ALA 175 Ca 0.61 1.40 -0.11 0.00 0.00 0.00 0.00 51.96 53.86 2d0h s ALA 175 Cb -0.41 -3.57 0.06 0.00 0.00 0.00 0.00 23.12 19.19 2d0h s ALA 175 CO 0.40 -1.19 1.08 -0.51 0.00 0.00 0.00 175.76 175.54 2d0h s ASP 176 N -0.66 4.63 -0.09 0.00 1.11 -1.26 -4.85 116.67 115.55 2d0h s ASP 176 Ca 0.63 1.47 -0.37 0.00 0.18 0.00 0.00 52.55 54.47 2d0h s ASP 176 Cb -0.42 -2.24 -0.14 0.00 1.07 0.00 0.00 42.92 41.19 2d0h s ASP 176 CO 0.53 -1.90 1.69 -2.65 1.18 0.00 0.00 175.17 174.02 2d0h n PRO 177 N -3.41 1.62 0.00 8.23 -0.02 -1.26 -1.69 135.00 138.47 2d0h n PRO 177 Ca 0.07 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 2d0h n PRO 177 Cb 0.55 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 2d0h n PRO 177 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2d0h n GLY 178 N 3.85 1.19 3.62 -1.23 0.00 -1.26 -5.09 105.19 106.27 2d0h n GLY 178 Ca 0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.97 2d0h n GLY 178 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2d0h s TYR 179 N -2.09 2.52 -0.05 1.61 1.51 -0.68 -4.49 117.35 115.67 2d0h s TYR 179 Ca 0.00 -0.65 0.00 0.00 -1.01 0.00 0.00 57.07 55.42 2d0h s TYR 179 Cb 0.00 -1.76 -0.03 0.00 -0.11 0.00 0.00 41.96 40.06 2d0h s TYR 179 CO 0.00 0.44 -0.03 0.34 -1.11 0.00 0.00 175.55 175.19 2d0h s ASP 180 N -3.72 4.95 0.55 2.29 -1.08 -1.26 -4.75 116.67 113.65 2d0h s ASP 180 Ca 0.35 0.03 0.27 0.00 -0.52 0.00 0.00 52.55 52.68 2d0h s ASP 180 Cb 0.09 -1.30 1.45 0.00 -1.46 0.00 0.00 42.92 41.70 2d0h s ASP 180 CO 0.18 0.35 1.99 0.78 0.52 0.00 0.00 175.17 178.98 2d0h h ASN 181 N 4.97 0.00 0.17 -0.34 2.35 -1.93 0.42 115.58 121.22 2d0h h ASN 181 Ca -0.49 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.26 2d0h h ASN 181 Cb 1.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.55 2d0h h ASN 181 CO 0.54 0.00 -0.05 -1.20 -1.65 0.00 0.00 177.43 175.07 2d0h n SER 182 N -4.18 0.60 -0.72 5.81 7.64 -1.26 -3.74 113.62 117.77 2d0h n SER 182 Ca 0.09 -0.92 0.06 0.00 1.01 0.00 0.00 58.87 59.10 2d0h n SER 182 Cb 0.60 -0.03 0.18 0.00 -1.01 0.00 0.00 64.21 63.95 2d0h n SER 182 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2d0h n LEU 183 N -0.68 2.45 -4.67 -3.43 4.77 0.14 -1.34 117.00 114.23 2d0h n LEU 183 Ca 0.18 -3.61 -0.37 0.00 -0.03 0.00 0.00 56.01 52.19 2d0h n LEU 183 Cb 0.25 -0.45 -0.09 0.00 -2.33 0.00 0.00 43.42 40.80 2d0h n LEU 183 CO 0.20 1.26 -0.14 -0.69 -1.33 0.00 0.00 177.39 176.70 2d0h s VAL 184 N -2.75 5.34 -0.11 4.08 1.01 -1.22 -1.41 120.40 125.35 2d0h s VAL 184 Ca 0.37 0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.62 2d0h s VAL 184 Cb 0.37 -3.53 0.02 0.00 0.00 0.00 0.00 36.38 33.24 2d0h s VAL 184 CO -0.08 0.34 -0.12 -0.36 0.00 0.00 0.00 175.10 174.88 2d0h s PHE 185 N 1.02 1.73 -0.30 5.22 0.40 -0.14 -4.71 117.98 121.20 2d0h s PHE 185 Ca 0.09 -0.83 0.23 0.00 -0.60 0.00 0.00 56.93 55.81 2d0h s PHE 185 Cb -0.13 -1.31 0.02 0.00 0.51 0.00 0.00 43.02 42.11 2d0h s PHE 185 CO 0.04 -0.49 1.04 1.19 0.70 0.00 0.00 175.22 177.71 2d0h n PHE 186 N 4.51 0.82 0.00 0.36 3.01 -1.26 -1.24 117.46 123.66 2d0h n PHE 186 Ca -0.17 0.24 0.00 0.00 1.01 0.00 0.00 57.45 58.53 2d0h n PHE 186 Cb 0.51 -0.86 0.00 0.00 -0.01 0.00 0.00 39.48 39.11 2d0h n PHE 186 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2d0h n GLY 187 N 1.22 0.71 3.78 1.37 0.00 -1.25 -4.82 105.19 106.20 2d0h n GLY 187 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2d0h n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d0h n GLY 188 N -1.12 1.23 2.48 -0.02 0.00 -0.39 -4.26 105.19 103.12 2d0h n GLY 188 Ca 0.00 0.32 -0.12 0.00 0.00 0.00 0.00 46.02 46.21 2d0h n GLY 188 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2d0h n ASP 189 N 0.49 -0.83 0.10 1.61 5.68 -0.89 -3.94 116.55 118.77 2d0h n ASP 189 Ca 0.01 -2.52 -0.03 0.00 -0.50 0.00 0.00 54.79 51.76 2d0h n ASP 189 Cb 0.39 1.65 0.19 0.00 -1.14 0.00 0.00 41.12 42.21 2d0h n ASP 189 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 2d0h h LEU 190 N 0.00 0.22 -0.81 -2.12 3.38 -1.58 -2.64 115.31 111.76 2d0h h LEU 190 Ca -0.19 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.60 2d0h h LEU 190 Cb 0.90 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 2d0h h LEU 190 CO 0.27 0.69 0.06 0.00 0.09 0.00 0.00 178.44 179.55 2d0h h ALA 191 N 1.32 1.01 -0.38 1.53 0.00 -1.90 -1.60 119.26 119.25 2d0h h ALA 191 Ca 0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2d0h h ALA 191 Cb 0.94 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2d0h h ALA 191 CO 0.08 0.62 0.19 0.78 0.00 0.00 0.00 179.25 180.91 2d0h h GLY 192 N 1.01 0.58 0.96 0.00 0.00 -1.60 -0.85 103.07 103.18 2d0h h GLY 192 Ca 0.18 -0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.24 2d0h h GLY 192 CO 0.02 0.27 0.51 -2.22 0.00 0.00 0.00 176.54 175.11 2d0h h ILE 193 N 0.47 1.17 -0.41 2.60 2.04 -1.19 -1.62 117.51 120.58 2d0h h ILE 193 Ca 0.13 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 2d0h h ILE 193 Cb 0.11 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.22 2d0h h ILE 193 CO -0.02 0.19 0.19 -0.78 0.00 0.00 0.00 178.15 177.73 2d0h h ASP 194 N 1.03 0.54 0.17 1.72 3.58 -0.98 -2.47 116.42 120.01 2d0h h ASP 194 Ca 0.29 -0.13 -0.02 0.00 0.42 0.00 0.00 57.03 57.59 2d0h h ASP 194 Cb -0.08 -0.14 -0.00 0.00 1.72 0.00 0.00 39.33 40.83 2d0h h ASP 194 CO -0.08 0.52 -0.11 1.56 -2.88 0.00 0.00 179.24 178.26 2d0h h GLN 195 N 0.52 0.00 -0.57 0.28 4.20 -0.69 -2.47 115.11 116.39 2d0h h GLN 195 Ca 0.14 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.79 2d0h h GLN 195 Cb 0.13 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.87 2d0h h GLN 195 CO -0.02 0.11 0.07 1.63 -0.67 0.00 0.00 178.83 179.95 2d0h n LYS 196 N -4.09 4.21 0.21 1.46 4.76 -0.65 -4.43 118.16 119.63 2d0h n LYS 196 Ca -0.02 -3.10 0.07 0.00 -2.87 0.00 0.00 58.31 52.39 2d0h n LYS 196 Cb 0.19 -2.18 0.47 0.00 -1.84 0.00 0.00 35.03 31.67 2d0h n LYS 196 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2d0h h LEU 197 N 3.22 0.00 -0.67 -0.35 3.38 -1.09 -2.28 115.31 117.53 2d0h h LEU 197 Ca 0.08 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.92 2d0h h LEU 197 Cb 2.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.73 2d0h h LEU 197 CO 0.52 0.28 -0.35 1.23 0.09 0.00 0.00 178.44 180.22 2d0h h GLY 198 N 1.49 0.71 0.82 0.83 0.00 -1.77 0.13 103.07 105.27 2d0h h GLY 198 Ca -0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.61 2d0h h GLY 198 CO 0.04 0.61 -0.06 -1.82 0.00 0.00 0.00 176.54 175.30 2d0h h TYR 199 N 0.55 0.48 0.31 5.60 3.20 -1.75 0.19 116.97 125.54 2d0h h TYR 199 Ca 0.06 -0.11 -0.01 0.00 3.14 0.00 0.00 58.73 61.81 2d0h h TYR 199 Cb 0.85 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 39.01 2d0h h TYR 199 CO 0.04 0.67 -0.15 0.82 -1.64 0.00 0.00 178.16 177.90 2d0h h ILE 200 N 0.15 0.68 0.00 1.81 2.04 -1.30 -0.04 117.51 120.84 2d0h h ILE 200 Ca 0.05 -0.64 -0.18 0.00 1.00 0.00 0.00 64.86 65.10 2d0h h ILE 200 Cb 0.52 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 2d0h h ILE 200 CO 0.02 0.12 -0.89 0.11 0.00 0.00 0.00 178.15 177.51 2d0h h LYS 201 N -0.79 0.00 0.00 2.37 1.57 -0.84 -0.01 116.57 118.88 2d0h h LYS 201 Ca -0.04 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2d0h h LYS 201 Cb 0.51 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 2d0h h LYS 201 CO 0.07 0.77 -0.83 1.63 -0.57 0.00 0.00 179.45 180.52 2d0h n LYS 202 N -3.27 0.43 -0.10 3.15 4.76 -0.06 -3.42 118.16 119.65 2d0h n LYS 202 Ca -0.01 0.17 -0.08 0.00 -2.87 0.00 0.00 58.31 55.53 2d0h n LYS 202 Cb 0.87 -1.26 0.00 0.00 -1.84 0.00 0.00 35.03 32.80 2d0h n LYS 202 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 2d0h h THR 203 N -0.82 1.02 0.00 -0.18 2.02 -1.00 -3.34 112.91 110.62 2d0h h THR 203 Ca -0.00 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 2d0h h THR 203 Cb 0.83 0.59 -0.00 0.00 -1.74 0.00 0.00 68.15 67.82 2d0h h THR 203 CO -0.00 0.07 -0.55 -0.07 0.37 0.00 0.00 175.52 175.34 2d0h h LEU 204 N 0.39 0.00 0.00 2.58 3.38 -1.07 -3.43 115.31 117.16 2d0h h LEU 204 Ca 0.14 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2d0h h LEU 204 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2d0h h LEU 204 CO -0.07 0.81 0.00 0.61 0.09 0.00 0.00 178.44 179.88 2d0h n GLY 205 N 1.61 0.96 3.77 0.83 0.00 -0.08 -4.42 105.19 107.85 2d0h n GLY 205 Ca -0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 2d0h n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d0h s ALA 206 N -2.00 3.15 0.00 4.61 0.00 -0.80 -4.89 121.76 121.83 2d0h s ALA 206 Ca 0.00 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.05 2d0h s ALA 206 Cb 0.00 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.69 2d0h s ALA 206 CO 0.00 -0.72 0.77 0.27 0.00 0.00 0.00 175.76 176.08 2d0h n ASN 207 N -0.04 1.50 -4.03 0.00 2.04 -0.70 -3.86 115.26 110.16 2d0h n ASN 207 Ca 0.05 -1.56 -0.27 0.00 -0.44 0.00 0.00 54.58 52.37 2d0h n ASN 207 Cb 0.45 0.00 -0.17 0.00 -2.53 0.00 0.00 39.78 37.54 2d0h n ASN 207 CO 0.00 0.00 0.00 -0.63 -0.44 0.00 0.00 177.26 176.19 2d0h s ILE 208 N -0.56 1.29 -0.11 1.53 1.01 -0.70 -0.14 121.20 123.51 2d0h s ILE 208 Ca 0.00 -0.54 -0.02 0.00 0.00 0.00 0.00 60.65 60.10 2d0h s ILE 208 Cb 0.00 -1.19 -0.03 0.00 0.01 0.00 0.00 42.46 41.25 2d0h s ILE 208 CO 0.00 0.40 -0.05 -0.76 0.00 0.00 0.00 174.94 174.53 2d0h s LEU 209 N 0.90 3.24 -0.18 2.97 1.02 0.05 -0.27 118.68 126.42 2d0h s LEU 209 Ca -0.09 -0.06 0.01 0.00 0.02 0.00 0.00 54.13 54.00 2d0h s LEU 209 Cb -0.15 -1.75 0.03 0.00 0.02 0.00 0.00 46.19 44.34 2d0h s LEU 209 CO 0.00 0.27 -0.14 -0.47 0.02 0.00 0.00 176.35 176.03 2d0h s TYR 210 N -0.22 2.44 -0.07 0.29 5.04 -0.82 -0.59 117.35 123.42 2d0h s TYR 210 Ca 0.04 -1.50 -0.02 0.00 -2.44 0.00 0.00 57.07 53.14 2d0h s TYR 210 Cb -0.13 -1.69 -0.03 0.00 0.35 0.00 0.00 41.96 40.46 2d0h s TYR 210 CO 0.02 -0.74 0.02 -0.51 -1.34 0.00 0.00 175.55 173.01 2d0h s LEU 211 N 1.39 3.67 1.08 6.97 1.43 -0.90 -0.62 118.68 131.71 2d0h s LEU 211 Ca 0.02 0.15 -0.15 0.00 -1.03 0.00 0.00 54.13 53.12 2d0h s LEU 211 Cb -0.15 -1.90 0.23 0.00 0.03 0.00 0.00 46.19 44.40 2d0h s LEU 211 CO -0.10 0.36 1.10 0.20 0.23 0.00 0.00 176.35 178.14 2d0h s ASN 212 N -1.05 1.92 0.14 2.29 -0.87 -0.78 -2.91 114.94 113.67 2d0h s ASN 212 Ca 0.15 0.99 -0.33 0.00 -1.57 0.00 0.00 52.86 52.10 2d0h s ASN 212 Cb -0.11 -1.52 -0.17 0.00 -0.02 0.00 0.00 41.25 39.42 2d0h s ASN 212 CO 0.04 -3.55 0.87 -2.65 -2.57 0.00 0.00 177.10 169.25 2d0h n PRO 213 N -4.43 0.38 0.00 -0.60 -0.02 -1.26 -4.61 135.00 124.46 2d0h n PRO 213 Ca 0.08 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2d0h n PRO 213 Cb 0.58 -1.43 0.00 0.00 -0.02 0.00 0.00 33.50 32.63 2d0h n PRO 213 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 2d0h n ILE 214 N 0.82 0.23 -2.78 4.25 -5.35 -1.26 -4.76 119.36 110.51 2d0h n ILE 214 Ca 0.17 -0.41 -0.29 0.00 -0.27 0.00 0.00 62.75 61.95 2d0h n ILE 214 Cb 0.20 1.13 -0.02 0.00 -1.74 0.00 0.00 39.64 39.22 2d0h n ILE 214 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 2d0h s PHE 215 N -0.23 3.50 -0.21 4.28 0.08 -1.26 -0.99 117.98 123.15 2d0h s PHE 215 Ca 0.00 0.97 -0.42 0.00 0.12 0.00 0.00 56.93 57.60 2d0h s PHE 215 Cb 0.00 -2.40 -0.19 0.00 -0.57 0.00 0.00 43.02 39.86 2d0h s PHE 215 CO 0.00 -0.16 1.35 1.17 -0.10 0.00 0.00 175.22 177.48 2d0h n LYS 216 N -1.60 0.19 -3.57 0.44 3.00 -0.32 -4.31 118.16 111.99 2d0h n LYS 216 Ca 0.02 0.07 -0.11 0.00 -0.00 0.00 0.00 58.31 58.29 2d0h n LYS 216 Cb 0.54 -1.59 -0.05 0.00 0.00 0.00 0.00 35.03 33.93 2d0h n LYS 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2d0h s ALA 217 N 1.47 -1.92 0.13 3.14 0.00 -1.26 -0.70 121.76 122.61 2d0h s ALA 217 Ca 0.96 1.56 0.12 0.00 0.00 0.00 0.00 51.96 54.61 2d0h s ALA 217 Cb -1.32 -0.65 0.19 0.00 0.00 0.00 0.00 23.12 21.34 2d0h s ALA 217 CO 0.66 -0.32 1.50 -1.00 0.00 0.00 0.00 175.76 176.61 2d0h h PRO 218 N 2.58 0.00 -7.60 0.00 0.13 -1.93 -3.47 132.00 121.72 2d0h h PRO 218 Ca -0.19 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.48 2d0h h PRO 218 Cb 1.16 0.00 0.12 0.00 0.13 0.00 0.00 31.00 32.41 2d0h h PRO 218 CO 0.32 0.67 0.38 0.95 -0.23 0.00 0.00 178.00 180.08 2d0h s THR 219 N -3.20 1.99 -0.65 1.56 -4.23 -1.26 -4.92 115.64 104.93 2d0h s THR 219 Ca 0.01 0.00 0.25 0.00 -1.18 0.00 0.00 61.69 60.77 2d0h s THR 219 Cb 0.11 -2.92 0.18 0.00 1.34 0.00 0.00 72.50 71.20 2d0h s THR 219 CO 0.76 0.00 1.54 -0.55 -0.54 0.00 0.00 174.62 175.83 2d0h h ASN 220 N -1.27 0.00 0.29 3.99 -0.00 -1.49 -3.26 115.58 113.84 2d0h h ASN 220 Ca -0.47 -0.09 -0.28 0.00 -0.00 0.00 0.00 56.30 55.46 2d0h h ASN 220 Cb 1.32 0.00 -0.05 0.00 -0.00 0.00 0.00 38.32 39.59 2d0h h ASN 220 CO 0.62 0.04 -1.96 0.00 -0.00 0.00 0.00 177.43 176.13 2d0h n HIS 221 N -2.28 0.50 -2.66 4.14 1.44 -1.26 -4.73 115.22 110.37 2d0h n HIS 221 Ca 0.04 0.18 -0.18 0.00 -2.01 0.00 0.00 57.72 55.75 2d0h n HIS 221 Cb 0.45 -1.04 0.01 0.00 0.12 0.00 0.00 29.99 29.53 2d0h n HIS 221 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2d0h n LYS 222 N -2.83 -2.97 -0.06 -1.40 5.02 -1.23 -4.20 118.16 110.49 2d0h n LYS 222 Ca -0.21 0.79 0.11 0.00 -2.02 0.00 0.00 58.31 56.98 2d0h n LYS 222 Cb 1.02 -5.29 0.42 0.00 -0.02 0.00 0.00 35.03 31.15 2d0h n LYS 222 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2d0h n TYR 223 N -4.19 0.16 -3.07 2.13 4.02 -1.26 -4.18 117.16 110.78 2d0h n TYR 223 Ca -0.14 -0.08 -0.34 0.00 -0.01 0.00 0.00 57.90 57.32 2d0h n TYR 223 Cb 0.62 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.92 2d0h n TYR 223 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 2d0h n ASP 224 N 0.21 5.36 -4.60 7.72 5.75 -1.26 -4.74 116.55 124.99 2d0h n ASP 224 Ca 0.17 -3.53 -0.49 0.00 -0.01 0.00 0.00 54.79 50.93 2d0h n ASP 224 Cb 0.31 -0.92 -0.04 0.00 -1.03 0.00 0.00 41.12 39.44 2d0h n ASP 224 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 2d0h n THR 225 N 0.62 0.71 -0.03 2.12 -1.04 -1.26 -3.68 114.28 111.73 2d0h n THR 225 Ca 0.32 -0.18 -0.02 0.00 -2.04 0.00 0.00 64.05 62.13 2d0h n THR 225 Cb 0.36 -0.95 -0.05 0.00 -1.82 0.00 0.00 70.33 67.86 2d0h n THR 225 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 2d0h n GLN 226 N 1.99 2.47 -3.20 -2.82 7.27 0.12 0.27 117.38 123.48 2d0h n GLN 226 Ca 0.15 -0.01 0.00 0.00 0.07 0.00 0.00 57.00 57.21 2d0h n GLN 226 Cb 0.25 -1.18 -0.03 0.00 2.41 0.00 0.00 30.24 31.69 2d0h n GLN 226 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2d0h s ASP 227 N -3.69 -0.95 0.30 1.69 3.68 -1.09 -4.10 116.67 112.51 2d0h s ASP 227 Ca -0.03 0.62 0.26 0.00 2.13 0.00 0.00 52.55 55.53 2d0h s ASP 227 Cb 0.02 1.86 0.88 0.00 -1.45 0.00 0.00 42.92 44.23 2d0h s ASP 227 CO 0.28 -0.28 1.76 1.88 0.13 0.00 0.00 175.17 178.95 2d0h h TYR 228 N 8.05 0.00 -0.25 -5.34 -1.99 -1.93 -3.14 116.97 112.36 2d0h h TYR 228 Ca -0.20 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.53 2d0h h TYR 228 Cb 1.16 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.89 2d0h h TYR 228 CO 0.12 0.00 0.00 -1.33 -0.00 0.00 0.00 178.16 176.95 2d0h n MET 229 N -2.47 1.69 -3.69 4.88 2.81 -1.26 -4.90 117.12 114.19 2d0h n MET 229 Ca 0.04 -1.06 -0.14 0.00 -1.81 0.00 0.00 57.70 54.73 2d0h n MET 229 Cb 0.36 -1.29 -0.08 0.00 -0.71 0.00 0.00 33.22 31.49 2d0h n MET 229 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2d0h s ALA 230 N -1.67 -1.19 0.42 3.04 0.00 -1.23 -5.02 121.76 116.11 2d0h s ALA 230 Ca 0.25 1.02 -0.25 0.00 0.00 0.00 0.00 51.96 52.99 2d0h s ALA 230 Cb 0.13 -0.35 -0.08 0.00 0.00 0.00 0.00 23.12 22.82 2d0h s ALA 230 CO 0.18 -0.27 1.19 0.08 0.00 0.00 0.00 175.76 176.94 2d0h s VAL 231 N -0.56 3.05 0.23 0.00 1.01 -1.26 -1.17 120.40 121.70 2d0h s VAL 231 Ca -0.07 0.86 -0.30 0.00 0.00 0.00 0.00 61.98 62.47 2d0h s VAL 231 Cb -0.03 -3.47 -0.10 0.00 0.00 0.00 0.00 36.38 32.77 2d0h s VAL 231 CO 0.04 0.06 1.50 -0.62 0.00 0.00 0.00 175.10 176.08 2d0h s ASP 232 N -1.14 6.59 0.53 3.32 -1.08 -0.17 -4.34 116.67 120.38 2d0h s ASP 232 Ca 0.59 2.69 0.32 0.00 -0.52 0.00 0.00 52.55 55.64 2d0h s ASP 232 Cb -0.31 -2.62 1.47 0.00 -1.46 0.00 0.00 42.92 40.01 2d0h s ASP 232 CO 0.39 -0.77 1.84 -0.65 0.52 0.00 0.00 175.17 176.50 2d0h h PRO 233 N 5.54 0.04 0.00 4.34 0.11 -1.93 0.34 132.00 140.44 2d0h h PRO 233 Ca -0.45 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.61 2d0h h PRO 233 Cb 1.21 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2d0h h PRO 233 CO 0.82 0.03 -0.23 0.00 -0.21 0.00 0.00 178.00 178.41 2d0h h ALA 234 N 1.50 1.10 0.00 -0.75 0.00 -1.89 -2.71 119.26 116.50 2d0h h ALA 234 Ca 0.50 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2d0h h ALA 234 Cb 1.92 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.67 2d0h h ALA 234 CO -0.03 0.29 -0.99 1.19 0.00 0.00 0.00 179.25 179.70 2d0h n PHE 235 N -3.51 0.27 0.00 0.00 0.99 0.11 -4.65 117.46 110.68 2d0h n PHE 235 Ca -0.01 0.08 0.00 0.00 -0.00 0.00 0.00 57.45 57.52 2d0h n PHE 235 Cb 0.39 -0.44 0.00 0.00 -1.00 0.00 0.00 39.48 38.43 2d0h n PHE 235 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2d0h n GLY 236 N 1.37 0.38 3.40 1.37 0.00 -0.84 -1.49 105.19 109.38 2d0h n GLY 236 Ca 0.02 -1.50 -0.13 0.00 0.00 0.00 0.00 46.02 44.41 2d0h n GLY 236 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2d0h s ASP 237 N -4.00 0.53 0.51 1.61 3.84 -1.26 -3.80 116.67 114.10 2d0h s ASP 237 Ca 0.00 -1.35 0.18 0.00 -0.00 0.00 0.00 52.55 51.38 2d0h s ASP 237 Cb 0.00 0.54 1.27 0.00 -1.38 0.00 0.00 42.92 43.36 2d0h s ASP 237 CO 0.00 -1.09 2.09 0.78 -0.00 0.00 0.00 175.17 176.95 2d0h h ASN 238 N 2.30 0.05 -0.30 2.11 4.21 -1.95 -0.98 115.58 121.02 2d0h h ASN 238 Ca -0.30 -0.00 -0.17 0.00 1.21 0.00 0.00 56.30 57.04 2d0h h ASN 238 Cb 1.24 -0.01 -0.00 0.00 -1.12 0.00 0.00 38.32 38.43 2d0h h ASN 238 CO 0.42 0.03 -0.47 0.28 -1.29 0.00 0.00 177.43 176.40 2d0h h SER 239 N 0.05 0.95 -0.68 5.81 0.02 -1.99 -0.92 113.55 116.80 2d0h h SER 239 Ca 0.10 -0.47 -0.02 0.00 -0.84 0.00 0.00 61.79 60.56 2d0h h SER 239 Cb 0.34 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.58 2d0h h SER 239 CO -0.01 1.26 0.35 0.74 -1.14 0.00 0.00 176.83 178.04 2d0h h THR 240 N 0.69 1.22 -0.51 -2.27 2.02 -1.62 -1.19 112.91 111.25 2d0h h THR 240 Ca 0.04 -0.60 -0.07 0.00 0.77 0.00 0.00 66.41 66.55 2d0h h THR 240 Cb 1.06 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 2d0h h THR 240 CO 0.11 0.26 0.03 0.25 0.37 0.00 0.00 175.52 176.54 2d0h h LEU 241 N 0.99 0.85 -1.01 2.58 5.85 -0.97 -0.69 115.31 122.91 2d0h h LEU 241 Ca 0.24 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 2d0h h LEU 241 Cb 0.08 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 2d0h h LEU 241 CO -0.03 0.93 0.43 1.56 -0.34 0.00 0.00 178.44 180.98 2d0h h GLN 242 N 0.74 1.12 -0.25 1.25 4.20 -0.59 -0.50 115.11 121.09 2d0h h GLN 242 Ca 0.15 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 2d0h h GLN 242 Cb 0.47 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2d0h h GLN 242 CO 0.02 0.83 -0.14 1.15 -0.67 0.00 0.00 178.83 180.02 2d0h h THR 243 N 1.12 1.30 -0.45 -0.54 2.02 -0.95 -1.80 112.91 113.62 2d0h h THR 243 Ca 0.28 -1.24 0.01 0.00 0.77 0.00 0.00 66.41 66.23 2d0h h THR 243 Cb 0.05 1.58 -0.02 0.00 -1.74 0.00 0.00 68.15 68.01 2d0h h THR 243 CO -0.04 0.39 0.29 0.25 0.37 0.00 0.00 175.52 176.77 2d0h h LEU 244 N 0.26 0.49 -0.42 2.58 5.85 -0.77 0.18 115.31 123.48 2d0h h LEU 244 Ca 0.05 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 2d0h h LEU 244 Cb 0.66 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 2d0h h LEU 244 CO 0.04 0.35 0.25 0.40 -0.34 0.00 0.00 178.44 179.14 2d0h h ILE 245 N 0.59 1.14 -0.66 4.05 2.04 -1.08 0.23 117.51 123.82 2d0h h ILE 245 Ca 0.17 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.71 2d0h h ILE 245 Cb -0.04 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.60 2d0h h ILE 245 CO -0.05 0.14 0.42 -1.13 0.00 0.00 0.00 178.15 177.54 2d0h h ASN 246 N 0.55 0.72 0.12 1.72 -1.24 -0.80 -0.01 115.58 116.64 2d0h h ASN 246 Ca 0.15 -0.01 -0.10 0.00 0.71 0.00 0.00 56.30 57.05 2d0h h ASN 246 Cb 0.02 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 38.89 2d0h h ASN 246 CO -0.03 0.51 -0.34 0.44 -1.29 0.00 0.00 177.43 176.72 2d0h h ASP 247 N 0.85 0.33 -0.34 1.15 3.45 -0.10 -0.68 116.42 121.07 2d0h h ASP 247 Ca 0.25 -0.12 -0.12 0.00 0.43 0.00 0.00 57.03 57.47 2d0h h ASP 247 Cb -0.04 -0.09 -0.01 0.00 -0.56 0.00 0.00 39.33 38.63 2d0h h ASP 247 CO -0.08 0.65 -0.25 0.40 -1.57 0.00 0.00 179.24 178.40 2d0h h ILE 248 N 0.27 1.29 0.00 0.35 2.04 0.07 -2.88 117.51 118.66 2d0h h ILE 248 Ca 0.03 -1.40 0.00 0.00 1.00 0.00 0.00 64.86 64.50 2d0h h ILE 248 Cb 0.74 1.44 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 2d0h h ILE 248 CO 0.06 0.46 0.00 0.45 0.00 0.00 0.00 178.15 179.11 2d0h h HIS 249 N 0.55 0.00 -4.23 1.37 3.86 -0.78 0.48 115.15 116.40 2d0h h HIS 249 Ca 0.07 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.75 2d0h h HIS 249 Cb 0.81 0.00 0.16 0.00 1.06 0.00 0.00 27.41 29.44 2d0h h HIS 249 CO 0.06 0.00 0.33 0.45 0.86 0.00 0.00 177.93 179.63 2d0h s SER 250 N -5.59 3.92 0.00 2.45 0.15 -0.28 -4.25 113.70 110.10 2d0h s SER 250 Ca 0.03 2.20 0.08 0.00 0.70 0.00 0.00 55.95 58.95 2d0h s SER 250 Cb 0.08 -2.57 0.14 0.00 -1.71 0.00 0.00 66.02 61.96 2d0h s SER 250 CO 0.55 -2.44 0.96 0.35 1.20 0.00 0.00 173.24 173.86 2d0h n THR 251 N -3.28 0.48 0.31 6.45 -2.24 -1.26 -4.02 114.28 110.72 2d0h n THR 251 Ca 0.12 -0.74 0.12 0.00 -2.27 0.00 0.00 64.05 61.28 2d0h n THR 251 Cb 0.51 0.84 0.17 0.00 -2.10 0.00 0.00 70.33 69.76 2d0h n THR 251 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2d0h h ALA 252 N 1.49 0.83 -0.06 6.98 0.00 -1.92 -3.30 119.26 123.27 2d0h h ALA 252 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2d0h h ALA 252 Cb 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2d0h h ALA 252 CO 0.00 0.00 -0.11 0.27 0.00 0.00 0.00 179.25 179.41 2d0h n ASN 253 N -2.72 2.45 0.00 0.00 2.04 -1.26 -5.08 115.26 110.69 2d0h n ASN 253 Ca 0.03 -3.29 0.00 0.00 -0.44 0.00 0.00 54.58 50.88 2d0h n ASN 253 Cb 0.50 -0.48 0.00 0.00 -2.53 0.00 0.00 39.78 37.27 2d0h n ASN 253 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2d0h n GLY 254 N -1.22 0.82 3.68 4.83 0.00 -1.24 -4.35 105.19 107.71 2d0h n GLY 254 Ca 0.19 -2.02 -0.30 0.00 0.00 0.00 0.00 46.02 43.89 2d0h n GLY 254 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d0h s PRO 255 N -1.42 1.10 0.23 1.61 0.04 -1.26 -4.13 135.00 131.16 2d0h s PRO 255 Ca 0.00 1.15 -0.32 0.00 0.04 0.00 0.00 61.00 61.87 2d0h s PRO 255 Cb 0.00 -1.77 -0.12 0.00 0.04 0.00 0.00 34.50 32.65 2d0h s PRO 255 CO 0.00 -2.44 1.70 1.17 0.04 0.00 0.00 177.00 177.47 2d0h n LYS 256 N -4.06 2.78 -3.75 4.56 4.81 -1.26 -4.72 118.16 116.51 2d0h n LYS 256 Ca 0.08 1.00 -0.24 0.00 -0.87 0.00 0.00 58.31 58.29 2d0h n LYS 256 Cb 0.53 -2.84 -0.02 0.00 0.02 0.00 0.00 35.03 32.73 2d0h n LYS 256 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2d0h s GLY 257 N 1.04 2.25 0.02 3.14 0.00 0.16 -4.86 107.32 109.06 2d0h s GLY 257 Ca 0.73 -1.65 0.03 0.00 0.00 0.00 0.00 44.72 43.82 2d0h s GLY 257 CO 0.35 -1.83 -0.09 -0.19 0.00 0.00 0.00 173.10 171.34 2d0h s TYR 258 N -2.63 0.76 -0.14 1.90 2.02 0.80 -4.17 117.35 115.88 2d0h s TYR 258 Ca 0.42 -0.28 0.00 0.00 -0.37 0.00 0.00 57.07 56.84 2d0h s TYR 258 Cb -0.02 -0.46 -0.01 0.00 -0.40 0.00 0.00 41.96 41.07 2d0h s TYR 258 CO 0.25 -0.02 -0.15 -1.17 -1.57 0.00 0.00 175.55 172.89 2d0h s LEU 259 N -0.80 2.55 -0.17 -1.29 2.96 -1.26 -0.77 118.68 119.90 2d0h s LEU 259 Ca -0.01 -0.42 0.00 0.00 -0.22 0.00 0.00 54.13 53.48 2d0h s LEU 259 Cb -0.06 -1.57 0.00 0.00 0.50 0.00 0.00 46.19 45.06 2d0h s LEU 259 CO 0.00 0.12 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.37 2d0h s ILE 260 N 0.59 2.54 0.23 6.68 1.01 0.24 0.27 121.20 132.75 2d0h s ILE 260 Ca -0.09 -0.80 0.04 0.00 0.00 0.00 0.00 60.65 59.80 2d0h s ILE 260 Cb -0.16 -2.08 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 2d0h s ILE 260 CO 0.03 0.51 0.37 -0.76 0.00 0.00 0.00 174.94 175.09 2d0h s LEU 261 N 1.02 4.29 -0.26 2.97 1.43 -0.60 -2.11 118.68 125.43 2d0h s LEU 261 Ca -0.01 0.14 -0.22 0.00 -1.03 0.00 0.00 54.13 53.01 2d0h s LEU 261 Cb -0.15 -2.93 -0.01 0.00 0.03 0.00 0.00 46.19 43.13 2d0h s LEU 261 CO -0.04 -0.07 0.70 -0.62 0.23 0.00 0.00 176.35 176.55 2d0h s ASP 262 N -3.80 6.64 -0.45 2.29 3.68 -1.15 -0.87 116.67 123.03 2d0h s ASP 262 Ca 0.35 0.76 -0.15 0.00 2.13 0.00 0.00 52.55 55.64 2d0h s ASP 262 Cb -0.10 -2.37 0.05 0.00 -1.45 0.00 0.00 42.92 39.06 2d0h s ASP 262 CO 0.30 -0.44 0.35 -0.83 0.13 0.00 0.00 175.17 174.67 2d0h s GLY 263 N 1.47 2.03 -1.13 2.66 0.00 0.95 -4.69 107.32 108.61 2d0h s GLY 263 Ca 0.29 -1.96 -0.09 0.00 0.00 0.00 0.00 44.72 42.95 2d0h s GLY 263 CO 0.09 1.00 1.16 -0.62 0.00 0.00 0.00 173.10 174.72 2d0h n VAL 264 N 5.17 4.55 0.92 1.40 0.31 -1.26 -1.26 118.33 128.16 2d0h n VAL 264 Ca -0.12 -5.33 0.11 0.00 -0.01 0.00 0.00 64.34 59.00 2d0h n VAL 264 Cb 0.45 -2.57 0.08 0.00 -0.91 0.00 0.00 33.84 30.89 2d0h n VAL 264 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2d0h n PHE 265 N 2.97 0.00 0.11 3.52 3.72 -1.26 -4.35 117.46 122.17 2d0h n PHE 265 Ca 0.25 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.64 2d0h n PHE 265 Cb 0.39 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.94 2d0h n PHE 265 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 2d0h h ASN 266 N 4.11 0.00 -5.09 4.37 -0.73 -1.87 -3.45 115.58 112.92 2d0h h ASN 266 Ca 0.00 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.16 2d0h h ASN 266 Cb 0.90 0.00 -0.04 0.00 0.27 0.00 0.00 38.32 39.44 2d0h h ASN 266 CO 0.00 0.72 0.15 -1.38 -0.37 0.00 0.00 177.43 176.55 2d0h s HIS 267 N -2.98 0.11 0.41 0.67 -3.43 -1.26 -1.75 115.29 107.06 2d0h s HIS 267 Ca 0.02 -0.61 0.03 0.00 -0.80 0.00 0.00 55.06 53.70 2d0h s HIS 267 Cb 0.10 0.59 -0.03 0.00 -1.43 0.00 0.00 32.58 31.81 2d0h s HIS 267 CO 0.77 -1.29 0.10 0.95 -2.00 0.00 0.00 174.74 173.27 2d0h s THR 268 N -3.35 0.75 0.60 -5.38 -4.23 -0.65 -4.75 115.64 98.64 2d0h s THR 268 Ca 0.16 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.59 2d0h s THR 268 Cb -0.04 -2.38 -0.02 0.00 1.34 0.00 0.00 72.50 71.41 2d0h s THR 268 CO 0.10 0.00 0.96 -0.83 -0.54 0.00 0.00 174.62 174.31 2d0h s GLY 269 N -3.63 1.60 0.00 3.99 0.00 0.14 -2.77 107.32 106.65 2d0h s GLY 269 Ca 0.23 -0.39 0.24 0.00 0.00 0.00 0.00 44.72 44.80 2d0h s GLY 269 CO 0.13 -0.12 1.80 2.09 0.00 0.00 0.00 173.10 177.00 2d0h n ASP 270 N -2.66 0.00 -0.99 1.64 5.68 -0.42 -2.82 116.55 116.98 2d0h n ASP 270 Ca 0.05 0.23 0.11 0.00 -0.50 0.00 0.00 54.79 54.68 2d0h n ASP 270 Cb 0.56 -0.40 0.26 0.00 -1.14 0.00 0.00 41.12 40.40 2d0h n ASP 270 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2d0h n SER 271 N -1.40 2.95 -4.75 -1.12 3.41 -1.26 -1.54 113.62 109.92 2d0h n SER 271 Ca 0.09 -1.93 -0.41 0.00 -0.26 0.00 0.00 58.87 56.36 2d0h n SER 271 Cb 0.24 -0.24 -0.03 0.00 -0.26 0.00 0.00 64.21 63.93 2d0h n SER 271 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2d0h s HIS 272 N -1.53 3.22 0.45 7.33 2.46 -1.13 -4.60 115.29 121.50 2d0h s HIS 272 Ca 0.37 1.30 0.29 0.00 0.47 0.00 0.00 55.06 57.49 2d0h s HIS 272 Cb 0.21 -3.61 1.37 0.00 -0.13 0.00 0.00 32.58 30.42 2d0h s HIS 272 CO 0.29 -1.80 1.70 -1.35 -2.47 0.00 0.00 174.74 171.11 2d0h h PRO 273 N 4.71 0.16 -0.30 2.88 0.11 -1.93 0.85 132.00 138.48 2d0h h PRO 273 Ca -0.46 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.58 2d0h h PRO 273 Cb 1.22 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 2d0h h PRO 273 CO 0.73 0.11 -0.08 -1.49 -0.21 0.00 0.00 178.00 177.06 2d0h h TRP 274 N 0.17 0.52 0.00 0.65 6.55 -1.90 -3.35 115.95 118.58 2d0h h TRP 274 Ca 0.72 -0.07 -0.05 0.00 0.95 0.00 0.00 58.89 60.44 2d0h h TRP 274 Cb 2.27 -0.14 -0.01 0.00 -0.86 0.00 0.00 29.16 30.42 2d0h h TRP 274 CO -0.00 0.56 -1.05 0.34 -1.05 0.00 0.00 178.44 177.24 2d0h n PHE 275 N -4.24 0.19 -3.66 0.49 7.35 0.90 0.36 117.46 118.86 2d0h n PHE 275 Ca 0.01 0.08 -0.29 0.00 -0.76 0.00 0.00 57.45 56.49 2d0h n PHE 275 Cb 0.29 -0.61 0.04 0.00 0.35 0.00 0.00 39.48 39.55 2d0h n PHE 275 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 2d0h n ASP 276 N -4.47 -5.45 0.16 -2.13 2.03 0.26 -2.29 116.55 104.65 2d0h n ASP 276 Ca -0.17 -0.96 0.04 0.00 0.52 0.00 0.00 54.79 54.22 2d0h n ASP 276 Cb 0.51 -3.34 0.45 0.00 -0.72 0.00 0.00 41.12 38.01 2d0h n ASP 276 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 2d0h h LYS 277 N -1.64 0.16 -0.59 -0.67 3.64 -1.56 -2.87 116.57 113.03 2d0h h LYS 277 Ca -0.62 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.73 2d0h h LYS 277 Cb 1.34 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 2d0h h LYS 277 CO 0.46 0.29 0.00 0.66 -2.27 0.00 0.00 179.45 178.59 2d0h n TYR 278 N -4.32 1.98 -3.78 1.91 4.02 -1.26 -4.96 117.16 110.74 2d0h n TYR 278 Ca -0.01 -0.71 -0.34 0.00 -0.01 0.00 0.00 57.90 56.82 2d0h n TYR 278 Cb 0.24 -0.47 0.03 0.00 -0.02 0.00 0.00 39.34 39.13 2d0h n TYR 278 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2d0h n ASN 279 N 0.71 -4.72 -0.19 7.72 5.15 -1.08 -4.90 115.26 117.94 2d0h n ASN 279 Ca 0.28 -1.08 0.09 0.00 -0.60 0.00 0.00 54.58 53.26 2d0h n ASN 279 Cb 1.15 -2.99 -0.06 0.00 -0.53 0.00 0.00 39.78 37.35 2d0h n ASN 279 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2d0h n ASN 280 N -2.58 1.26 -4.15 1.20 3.02 -1.26 -5.00 115.26 107.73 2d0h n ASN 280 Ca -0.11 -1.13 -0.14 0.00 -0.03 0.00 0.00 54.58 53.17 2d0h n ASN 280 Cb 0.59 0.77 -0.11 0.00 -0.61 0.00 0.00 39.78 40.42 2d0h n ASN 280 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2d0h s PHE 281 N -2.43 0.97 0.00 3.10 0.40 -1.26 -5.09 117.98 113.67 2d0h s PHE 281 Ca 0.11 -0.66 0.00 0.00 -0.60 0.00 0.00 56.93 55.78 2d0h s PHE 281 Cb 0.14 -0.54 0.00 0.00 0.51 0.00 0.00 43.02 43.13 2d0h s PHE 281 CO 0.61 -0.04 0.57 0.45 0.70 0.00 0.00 175.22 177.52 2d0h n SER 282 N 0.67 0.00 -4.16 1.36 2.88 -1.26 -4.70 113.62 108.41 2d0h n SER 282 Ca -0.17 0.57 -0.38 0.00 -1.33 0.00 0.00 58.87 57.56 2d0h n SER 282 Cb 0.57 -0.07 0.01 0.00 -0.75 0.00 0.00 64.21 63.97 2d0h n SER 282 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2d0h n SER 283 N -1.22 -3.92 -4.46 -3.46 3.41 -1.26 -4.85 113.62 97.86 2d0h n SER 283 Ca 0.00 0.59 -0.43 0.00 -0.26 0.00 0.00 58.87 58.77 2d0h n SER 283 Cb 0.00 -0.83 -0.04 0.00 -0.26 0.00 0.00 64.21 63.08 2d0h n SER 283 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2d0h s GLN 284 N -1.12 3.16 0.98 4.33 -0.21 -1.26 -5.03 119.66 120.51 2d0h s GLN 284 Ca 0.54 -0.76 -0.12 0.00 0.02 0.00 0.00 55.36 55.04 2d0h s GLN 284 Cb -0.45 -4.17 0.18 0.00 1.00 0.00 0.00 33.01 29.56 2d0h s GLN 284 CO 0.67 -1.62 1.08 0.20 -2.12 0.00 0.00 175.29 173.51 2d0h s GLY 285 N 3.32 1.61 0.34 3.09 0.00 -1.26 -4.34 107.32 110.08 2d0h s GLY 285 Ca 0.22 0.01 0.08 0.00 0.00 0.00 0.00 44.72 45.03 2d0h s GLY 285 CO 0.12 0.56 1.83 0.00 0.00 0.00 0.00 173.10 175.61 2d0h h ALA 286 N -1.91 1.80 0.00 3.20 0.00 -0.08 0.41 119.26 122.68 2d0h h ALA 286 Ca -0.52 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.33 2d0h h ALA 286 Cb 1.30 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2d0h h ALA 286 CO 0.51 -0.08 -0.45 -0.92 0.00 0.00 0.00 179.25 178.31 2d0h h TYR 287 N 0.72 0.00 0.00 0.00 3.20 -1.69 -3.31 116.97 115.89 2d0h h TYR 287 Ca 0.50 0.00 -0.27 0.00 3.14 0.00 0.00 58.73 62.10 2d0h h TYR 287 Cb 0.81 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.03 2d0h h TYR 287 CO -0.00 0.45 -1.54 0.93 -1.64 0.00 0.00 178.16 176.35 2d0h h GLU 288 N 0.00 0.00 -2.90 1.82 5.08 -1.09 -3.44 114.58 114.05 2d0h h GLU 288 Ca -0.00 -0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 2d0h h GLU 288 Cb 0.80 0.00 -0.28 0.00 0.50 0.00 0.00 28.75 29.77 2d0h h GLU 288 CO 0.06 0.61 -0.41 0.45 -1.00 0.00 0.00 179.01 178.72 2d0h s SER 289 N -6.24 -0.35 0.30 1.42 0.15 -0.67 -4.95 113.70 103.36 2d0h s SER 289 Ca -0.03 0.65 0.23 0.00 0.70 0.00 0.00 55.95 57.50 2d0h s SER 289 Cb 0.08 0.54 1.10 0.00 -1.71 0.00 0.00 66.02 66.04 2d0h s SER 289 CO 0.82 -0.17 1.71 0.00 1.20 0.00 0.00 173.24 176.80 2d0h n GLN 290 N 4.14 0.18 -0.85 5.44 6.02 -1.26 -1.03 117.38 130.02 2d0h n GLN 290 Ca -0.24 0.53 -0.02 0.00 -0.01 0.00 0.00 57.00 57.27 2d0h n GLN 290 Cb 0.54 -1.93 0.29 0.00 1.02 0.00 0.00 30.24 30.16 2d0h n GLN 290 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2d0h n SER 291 N -2.29 4.65 -4.76 1.08 2.88 -1.26 -4.89 113.62 109.03 2d0h n SER 291 Ca 0.00 -2.96 -0.40 0.00 -1.33 0.00 0.00 58.87 54.19 2d0h n SER 291 Cb 0.14 -0.70 -0.03 0.00 -0.75 0.00 0.00 64.21 62.87 2d0h n SER 291 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2d0h s SER 292 N -0.74 7.06 0.60 -3.46 0.15 -0.20 -4.91 113.70 112.21 2d0h s SER 292 Ca 0.47 2.42 0.40 0.00 0.70 0.00 0.00 55.95 59.94 2d0h s SER 292 Cb 0.37 -2.63 2.09 0.00 -1.71 0.00 0.00 66.02 64.14 2d0h s SER 292 CO 0.12 -0.30 2.22 -0.65 1.20 0.00 0.00 173.24 175.83 2d0h h PRO 293 N 3.60 0.00 -0.26 5.44 0.11 -1.91 -2.19 132.00 136.79 2d0h h PRO 293 Ca -0.48 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.56 2d0h h PRO 293 Cb 1.22 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 2d0h h PRO 293 CO 0.66 0.00 -0.05 0.91 -0.21 0.00 0.00 178.00 179.32 2d0h n TRP 294 N -2.96 0.86 -0.35 0.65 8.01 -1.26 -4.73 117.44 117.65 2d0h n TRP 294 Ca -0.02 -1.22 -0.02 0.00 -1.31 0.00 0.00 57.50 54.93 2d0h n TRP 294 Cb 0.11 -0.37 0.10 0.00 -2.01 0.00 0.00 31.31 29.14 2d0h n TRP 294 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.69 175.76 2d0h h TYR 295 N 1.21 1.19 0.00 -5.99 3.20 -1.72 -2.16 116.97 112.70 2d0h h TYR 295 Ca 0.09 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.99 2d0h h TYR 295 Cb 1.47 -0.40 0.00 0.00 1.54 0.00 0.00 36.73 39.34 2d0h h TYR 295 CO 0.67 0.74 0.00 0.27 -1.64 0.00 0.00 178.16 178.20 2d0h n ASN 296 N -4.43 0.21 0.27 -2.11 6.94 -1.26 -2.97 115.26 111.90 2d0h n ASN 296 Ca 0.11 0.55 0.17 0.00 -0.02 0.00 0.00 54.58 55.40 2d0h n ASN 296 Cb 0.02 -0.60 0.71 0.00 -2.36 0.00 0.00 39.78 37.55 2d0h n ASN 296 CO 0.00 0.00 0.00 1.88 -1.03 0.00 0.00 177.26 178.11 2d0h h TYR 297 N 0.00 0.00 -1.22 -2.53 0.99 -1.68 -3.43 116.97 109.10 2d0h h TYR 297 Ca 0.00 0.00 -0.64 0.00 2.00 0.00 0.00 58.73 60.09 2d0h h TYR 297 Cb 0.27 0.00 -0.13 0.00 1.00 0.00 0.00 36.73 37.87 2d0h h TYR 297 CO 0.00 0.00 -0.51 0.71 -0.00 0.00 0.00 178.16 178.36 2d0h s TYR 298 N -3.67 1.81 -0.22 4.88 1.51 -1.16 -0.22 117.35 120.28 2d0h s TYR 298 Ca 0.01 -1.11 -0.00 0.00 -1.01 0.00 0.00 57.07 54.96 2d0h s TYR 298 Cb 0.09 -1.42 0.06 0.00 -0.11 0.00 0.00 41.96 40.58 2d0h s TYR 298 CO 0.51 -0.00 -0.04 0.99 -1.11 0.00 0.00 175.55 175.91 2d0h s THR 299 N -3.01 1.29 0.03 -0.71 2.01 -1.26 -4.70 115.64 109.30 2d0h s THR 299 Ca 0.11 -1.02 -0.01 0.00 0.31 0.00 0.00 61.69 61.08 2d0h s THR 299 Cb 0.01 -1.59 -0.04 0.00 0.01 0.00 0.00 72.50 70.89 2d0h s THR 299 CO 0.07 -0.09 0.17 -0.36 -0.69 0.00 0.00 174.62 173.71 2d0h s PHE 300 N 1.51 3.46 -0.14 4.92 0.40 -1.26 -0.52 117.98 126.36 2d0h s PHE 300 Ca -0.04 0.27 0.11 0.00 -0.60 0.00 0.00 56.93 56.67 2d0h s PHE 300 Cb -0.18 -1.77 -0.16 0.00 0.51 0.00 0.00 43.02 41.42 2d0h s PHE 300 CO -0.07 0.60 0.03 0.66 0.70 0.00 0.00 175.22 177.15 2d0h n TYR 301 N 0.68 0.00 -3.31 0.36 4.01 0.31 -4.82 117.16 114.39 2d0h n TYR 301 Ca -0.09 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.54 2d0h n TYR 301 Cb 0.52 -0.67 -0.06 0.00 -0.31 0.00 0.00 39.34 38.82 2d0h n TYR 301 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2d0h s THR 302 N -2.33 -0.56 0.33 -0.72 2.01 -0.97 -5.04 115.64 108.36 2d0h s THR 302 Ca -0.08 -0.62 -0.29 0.00 0.31 0.00 0.00 61.69 61.02 2d0h s THR 302 Cb 0.04 -0.55 -0.11 0.00 0.01 0.00 0.00 72.50 71.89 2d0h s THR 302 CO 0.55 -0.38 1.54 1.87 -0.69 0.00 0.00 174.62 177.51 2d0h n TRP 303 N 4.47 2.91 0.02 4.92 -0.00 -1.26 -1.87 117.44 126.64 2d0h n TRP 303 Ca 0.09 0.35 0.09 0.00 -0.00 0.00 0.00 57.50 58.03 2d0h n TRP 303 Cb 0.49 -2.56 -0.13 0.00 -0.00 0.00 0.00 31.31 29.10 2d0h n TRP 303 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2d0h n PRO 304 N 1.31 0.56 -0.02 5.87 -0.04 -1.26 -4.88 135.00 136.54 2d0h n PRO 304 Ca 0.05 -0.15 0.06 0.00 -0.04 0.00 0.00 63.50 63.42 2d0h n PRO 304 Cb 0.38 -1.41 0.33 0.00 -0.04 0.00 0.00 33.50 32.76 2d0h n PRO 304 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2d0h n ASP 305 N -2.08 0.34 -3.89 3.54 4.64 -1.20 -4.62 116.55 113.28 2d0h n ASP 305 Ca -0.03 -1.67 -0.29 0.00 -1.38 0.00 0.00 54.79 51.41 2d0h n ASP 305 Cb 0.45 -0.03 -0.16 0.00 -1.04 0.00 0.00 41.12 40.34 2d0h n ASP 305 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 2d0h s SER 306 N -1.36 3.54 0.11 1.67 0.15 -0.78 -5.03 113.70 111.99 2d0h s SER 306 Ca 0.20 -1.05 -0.07 0.00 0.70 0.00 0.00 55.95 55.73 2d0h s SER 306 Cb 0.09 -1.02 -0.01 0.00 -1.71 0.00 0.00 66.02 63.38 2d0h s SER 306 CO 0.15 -0.25 0.18 -0.72 1.20 0.00 0.00 173.24 173.80 2d0h s TYR 307 N 1.53 0.31 0.52 3.44 -0.85 -1.26 -0.53 117.35 120.51 2d0h s TYR 307 Ca -0.04 -0.73 -0.22 0.00 -0.52 0.00 0.00 57.07 55.56 2d0h s TYR 307 Cb -0.18 -0.12 -0.05 0.00 0.38 0.00 0.00 41.96 41.98 2d0h s TYR 307 CO -0.07 -0.57 1.28 0.00 -1.52 0.00 0.00 175.55 174.68 2d0h s ALA 308 N -3.91 2.84 0.38 9.51 0.00 0.33 -4.92 121.76 125.99 2d0h s ALA 308 Ca 0.10 1.18 -0.08 0.00 0.00 0.00 0.00 51.96 53.16 2d0h s ALA 308 Cb 0.05 -3.50 0.03 0.00 0.00 0.00 0.00 23.12 19.70 2d0h s ALA 308 CO -0.07 -1.13 0.64 -1.13 0.00 0.00 0.00 175.76 174.06 2d0h n SER 309 N -0.91 -1.82 -4.59 0.00 3.41 -1.26 -1.41 113.62 107.04 2d0h n SER 309 Ca 0.10 -2.79 -0.43 0.00 -0.26 0.00 0.00 58.87 55.49 2d0h n SER 309 Cb 0.46 3.19 -0.04 0.00 -0.26 0.00 0.00 64.21 67.57 2d0h n SER 309 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2d0h s PHE 310 N -2.53 3.00 -1.40 7.33 2.19 -0.82 -4.22 117.98 121.53 2d0h s PHE 310 Ca 0.23 0.65 -0.16 0.00 0.33 0.00 0.00 56.93 57.99 2d0h s PHE 310 Cb -0.03 -3.85 0.15 0.00 -1.31 0.00 0.00 43.02 37.97 2d0h s PHE 310 CO 0.17 -0.97 0.52 1.28 1.83 0.00 0.00 175.22 178.05 2d0h n LEU 311 N 7.04 -1.04 0.00 6.12 4.77 -1.26 -0.67 117.00 131.95 2d0h n LEU 311 Ca 0.08 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.34 2d0h n LEU 311 Cb 0.48 -1.72 0.00 0.00 -2.33 0.00 0.00 43.42 39.85 2d0h n LEU 311 CO 0.62 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.42 2d0h n GLY 312 N -1.06 0.90 3.60 -0.72 0.00 -1.26 -5.00 105.19 101.65 2d0h n GLY 312 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 2d0h n GLY 312 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2d0h s PHE 313 N -3.60 2.48 0.38 1.61 0.08 0.15 -4.90 117.98 114.18 2d0h s PHE 313 Ca 0.00 0.64 0.14 0.00 0.12 0.00 0.00 56.93 57.83 2d0h s PHE 313 Cb 0.00 -4.36 0.97 0.00 -0.57 0.00 0.00 43.02 39.06 2d0h s PHE 313 CO 0.00 -1.81 1.82 -0.91 -0.10 0.00 0.00 175.22 174.22 2d0h h ASN 314 N 10.42 0.54 0.09 1.36 -0.26 -1.94 0.03 115.58 125.81 2d0h h ASN 314 Ca -0.26 0.06 0.00 0.00 -0.56 0.00 0.00 56.30 55.54 2d0h h ASN 314 Cb 1.09 -0.03 0.00 0.00 -1.06 0.00 0.00 38.32 38.32 2d0h h ASN 314 CO 1.11 0.20 0.00 -1.54 -1.06 0.00 0.00 177.43 176.14 2d0h n SER 315 N -4.60 0.00 -3.17 5.81 3.41 -1.26 -4.20 113.62 109.61 2d0h n SER 315 Ca 0.21 -0.71 -0.27 0.00 -0.26 0.00 0.00 58.87 57.84 2d0h n SER 315 Cb 0.68 -0.05 -0.06 0.00 -0.26 0.00 0.00 64.21 64.52 2d0h n SER 315 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2d0h n LEU 316 N -1.05 4.23 -4.68 1.04 4.77 -0.00 -1.30 117.00 120.00 2d0h n LEU 316 Ca 0.19 -5.58 -0.44 0.00 -0.03 0.00 0.00 56.01 50.15 2d0h n LEU 316 Cb 0.11 -0.62 -0.03 0.00 -2.33 0.00 0.00 43.42 40.55 2d0h n LEU 316 CO 0.16 2.22 1.11 -0.81 -1.33 0.00 0.00 177.39 178.74 2d0h n PRO 317 N 0.24 2.20 -2.84 3.23 -0.04 -1.11 -1.95 135.00 134.74 2d0h n PRO 317 Ca 0.31 0.79 -0.41 0.00 -0.04 0.00 0.00 63.50 64.15 2d0h n PRO 317 Cb 0.40 -2.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.32 2d0h n PRO 317 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2d0h s LYS 318 N -0.03 4.56 0.10 0.54 2.20 -0.50 -1.64 119.74 124.97 2d0h s LYS 318 Ca 0.70 1.25 -0.30 0.00 -0.36 0.00 0.00 55.97 57.26 2d0h s LYS 318 Cb -0.63 -3.42 -0.06 0.00 -1.51 0.00 0.00 37.83 32.22 2d0h s LYS 318 CO 0.46 0.11 1.15 -0.51 -0.36 0.00 0.00 175.35 176.20 2d0h s LEU 319 N 0.50 4.41 -0.54 5.43 1.43 -0.72 -4.01 118.68 125.18 2d0h s LEU 319 Ca 0.45 2.03 -0.20 0.00 -1.03 0.00 0.00 54.13 55.38 2d0h s LEU 319 Cb -0.21 -3.59 0.07 0.00 0.03 0.00 0.00 46.19 42.49 2d0h s LEU 319 CO 0.26 -0.37 0.72 0.21 0.23 0.00 0.00 176.35 177.39 2d0h s ASN 320 N 0.63 6.23 0.00 2.29 2.47 0.69 -4.61 114.94 122.64 2d0h s ASN 320 Ca 0.55 -0.95 0.27 0.00 0.42 0.00 0.00 52.86 53.15 2d0h s ASN 320 Cb -0.29 -2.32 1.40 0.00 -1.45 0.00 0.00 41.25 38.59 2d0h s ASN 320 CO 0.31 -1.03 1.92 -1.22 -3.72 0.00 0.00 177.10 173.36 2d0h n TYR 321 N 6.52 0.00 -1.49 0.43 4.01 -0.85 -4.64 117.16 121.14 2d0h n TYR 321 Ca -0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 2d0h n TYR 321 Cb 0.45 -0.22 0.00 0.00 -0.31 0.00 0.00 39.34 39.26 2d0h n TYR 321 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2d0h n GLY 322 N 0.91 1.74 3.89 2.72 0.00 -1.26 -4.55 105.19 108.64 2d0h n GLY 322 Ca 0.14 -0.31 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 2d0h n GLY 322 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2d0h s ASN 323 N -4.00 4.76 0.32 1.61 -0.87 -1.26 -4.60 114.94 110.90 2d0h s ASN 323 Ca 0.00 -1.06 -0.27 0.00 -1.57 0.00 0.00 52.86 49.96 2d0h s ASN 323 Cb 0.00 0.03 -0.13 0.00 -0.02 0.00 0.00 41.25 41.13 2d0h s ASN 323 CO 0.00 -0.93 0.91 -1.20 -2.57 0.00 0.00 177.10 173.31 2d0h n SER 324 N -1.68 0.82 0.00 -1.22 7.64 -1.26 -1.58 113.62 116.34 2d0h n SER 324 Ca 0.01 1.12 0.00 0.00 1.01 0.00 0.00 58.87 61.01 2d0h n SER 324 Cb 0.63 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.58 2d0h n SER 324 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d0h n GLY 325 N 1.34 0.85 3.68 0.23 0.00 -1.26 -5.03 105.19 105.00 2d0h n GLY 325 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2d0h n GLY 325 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d0h s SER 326 N -2.70 3.05 0.29 1.61 1.04 -0.61 -4.86 113.70 111.52 2d0h s SER 326 Ca 0.00 1.67 0.01 0.00 0.48 0.00 0.00 55.95 58.11 2d0h s SER 326 Cb 0.00 -2.31 0.44 0.00 0.10 0.00 0.00 66.02 64.25 2d0h s SER 326 CO 0.00 -2.93 1.78 0.00 0.98 0.00 0.00 173.24 173.07 2d0h h ALA 327 N -1.75 1.18 -0.35 5.32 0.00 -1.90 -1.84 119.26 119.93 2d0h h ALA 327 Ca -0.50 -0.27 -0.17 0.00 0.00 0.00 0.00 54.91 53.98 2d0h h ALA 327 Cb 1.28 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 2d0h h ALA 327 CO 0.51 0.53 -0.44 0.28 0.00 0.00 0.00 179.25 180.13 2d0h h VAL 328 N 0.58 1.27 0.00 0.00 2.07 -1.88 -1.51 116.25 116.78 2d0h h VAL 328 Ca 0.11 -1.61 -0.05 0.00 0.82 0.00 0.00 66.70 65.97 2d0h h VAL 328 Cb 0.48 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 2d0h h VAL 328 CO 0.03 0.53 -0.24 0.03 0.02 0.00 0.00 177.57 177.94 2d0h h ARG 329 N 0.71 0.00 0.23 1.57 3.08 -1.75 -1.41 114.38 116.81 2d0h h ARG 329 Ca 0.04 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 2d0h h ARG 329 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.09 2d0h h ARG 329 CO 0.10 0.24 -0.11 0.78 -1.07 0.00 0.00 179.97 179.92 2d0h h GLY 330 N 1.02 -0.32 1.93 0.04 0.00 -0.93 0.25 103.07 105.06 2d0h h GLY 330 Ca -0.00 0.12 -0.04 0.00 0.00 0.00 0.00 47.33 47.41 2d0h h GLY 330 CO 0.03 -0.12 -0.16 -0.39 0.00 0.00 0.00 176.54 175.91 2d0h h VAL 331 N -0.80 1.14 0.05 4.60 -1.51 -1.14 -0.49 116.25 118.10 2d0h h VAL 331 Ca -0.03 -0.66 -0.17 0.00 -1.23 0.00 0.00 66.70 64.61 2d0h h VAL 331 Cb 0.51 1.28 -0.01 0.00 -2.13 0.00 0.00 31.29 30.94 2d0h h VAL 331 CO 0.05 0.20 -0.89 0.40 -1.23 0.00 0.00 177.57 176.10 2d0h h ILE 332 N 0.08 1.28 0.00 7.19 1.08 -1.29 -0.16 117.51 125.69 2d0h h ILE 332 Ca 0.02 -2.34 0.00 0.00 -0.39 0.00 0.00 64.86 62.15 2d0h h ILE 332 Cb 0.33 2.83 0.00 0.00 -3.07 0.00 0.00 36.82 36.91 2d0h h ILE 332 CO 0.02 0.57 0.00 0.00 -0.69 0.00 0.00 178.15 178.05 2d0h n TYR 333 N -4.29 0.00 -0.09 1.37 4.11 -0.27 -1.28 117.16 116.72 2d0h n TYR 333 Ca -0.21 0.00 -0.15 0.00 -0.00 0.00 0.00 57.90 57.53 2d0h n TYR 333 Cb 0.71 0.01 -0.14 0.00 -0.00 0.00 0.00 39.34 39.92 2d0h n TYR 333 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.86 176.95 2d0h n ASN 334 N 0.00 1.35 -4.76 9.48 3.02 0.71 -4.83 115.26 120.23 2d0h n ASN 334 Ca 0.00 0.02 -0.30 0.00 -0.03 0.00 0.00 54.58 54.27 2d0h n ASN 334 Cb 0.14 -0.07 0.11 0.00 -0.61 0.00 0.00 39.78 39.35 2d0h n ASN 334 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2d0h s ASN 335 N -6.29 3.99 0.34 6.41 0.01 -0.21 -4.92 114.94 114.27 2d0h s ASN 335 Ca -0.23 1.42 0.02 0.00 -0.71 0.00 0.00 52.86 53.36 2d0h s ASN 335 Cb 0.08 -2.12 0.61 0.00 0.41 0.00 0.00 41.25 40.22 2d0h s ASN 335 CO 0.72 -2.30 1.99 0.28 -1.51 0.00 0.00 177.10 176.27 2d0h h SER 336 N -1.32 0.77 -0.71 -1.22 0.02 -1.95 -2.37 113.55 106.77 2d0h h SER 336 Ca -0.48 -0.02 -0.44 0.00 -0.84 0.00 0.00 61.79 60.01 2d0h h SER 336 Cb 1.27 -0.19 -0.25 0.00 0.14 0.00 0.00 62.40 63.37 2d0h h SER 336 CO 0.57 0.54 0.14 -0.46 -1.14 0.00 0.00 176.83 176.48 2d0h n ASN 337 N -4.44 4.50 -4.72 3.07 6.94 -1.26 -4.72 115.26 114.63 2d0h n ASN 337 Ca 0.08 -3.76 -0.31 0.00 -0.02 0.00 0.00 54.58 50.57 2d0h n ASN 337 Cb 0.07 -0.70 0.13 0.00 -2.36 0.00 0.00 39.78 36.92 2d0h n ASN 337 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2d0h s SER 338 N -2.36 3.72 0.11 0.53 1.04 -0.89 -4.74 113.70 111.11 2d0h s SER 338 Ca 0.53 1.98 -0.21 0.00 0.48 0.00 0.00 55.95 58.74 2d0h s SER 338 Cb 0.45 -2.53 -0.08 0.00 0.10 0.00 0.00 66.02 63.95 2d0h s SER 338 CO 0.02 -2.56 1.75 0.58 0.98 0.00 0.00 173.24 174.01 2d0h h VAL 339 N -1.50 0.97 -0.80 5.02 2.07 -0.83 0.42 116.25 121.61 2d0h h VAL 339 Ca -0.44 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.06 2d0h h VAL 339 Cb 1.25 0.85 -0.04 0.00 -1.52 0.00 0.00 31.29 31.82 2d0h h VAL 339 CO 0.47 0.02 0.52 0.00 0.02 0.00 0.00 177.57 178.60 2d0h h ALA 340 N 1.08 1.02 -0.06 1.67 0.00 -1.46 -2.92 119.26 118.60 2d0h h ALA 340 Ca 0.06 -0.05 -0.23 0.00 0.00 0.00 0.00 54.91 54.70 2d0h h ALA 340 Cb 0.03 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.52 2d0h h ALA 340 CO -0.06 0.38 -0.88 -0.22 0.00 0.00 0.00 179.25 178.48 2d0h h LYS 341 N 1.04 0.57 -0.31 0.00 3.64 -1.76 -3.18 116.57 116.57 2d0h h LYS 341 Ca 0.30 -0.54 0.07 0.00 -1.27 0.00 0.00 60.65 59.21 2d0h h LYS 341 Cb -0.07 0.14 -0.08 0.00 -0.41 0.00 0.00 32.23 31.80 2d0h h LYS 341 CO -0.08 1.16 -0.31 1.15 -2.27 0.00 0.00 179.45 179.10 2d0h h THR 342 N 0.36 0.27 0.00 1.00 2.02 -0.71 -0.42 112.91 115.42 2d0h h THR 342 Ca -0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.11 2d0h h THR 342 Cb 1.50 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 2d0h h THR 342 CO 0.16 0.00 0.00 1.88 0.37 0.00 0.00 175.52 177.93 2d0h h TYR 343 N -0.28 0.00 0.00 3.16 -1.99 -1.67 -2.99 116.97 113.20 2d0h h TYR 343 Ca 0.15 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.88 2d0h h TYR 343 Cb 0.52 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.25 2d0h h TYR 343 CO -0.48 0.00 -0.21 1.28 -0.00 0.00 0.00 178.16 178.75 2d0h n LEU 344 N -3.01 0.73 -4.95 3.88 4.77 -0.80 -0.38 117.00 117.24 2d0h n LEU 344 Ca 0.03 0.45 -0.22 0.00 -0.03 0.00 0.00 56.01 56.24 2d0h n LEU 344 Cb 0.45 -0.28 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 2d0h n LEU 344 CO 0.32 -0.13 -0.06 0.20 -1.33 0.00 0.00 177.39 176.39 2d0h s ASN 345 N -4.32 6.25 0.83 -1.43 0.02 -0.23 -4.13 114.94 111.92 2d0h s ASN 345 Ca 0.09 0.07 -0.10 0.00 -1.02 0.00 0.00 52.86 51.90 2d0h s ASN 345 Cb 0.13 -1.83 0.09 0.00 0.02 0.00 0.00 41.25 39.66 2d0h s ASN 345 CO 0.63 -0.04 1.11 -2.84 0.02 0.00 0.00 177.10 175.99 2d0h s PRO 346 N -3.79 1.76 -0.04 -0.60 0.02 -1.26 -1.21 135.00 129.89 2d0h s PRO 346 Ca 0.34 1.30 0.01 0.00 0.02 0.00 0.00 61.00 62.67 2d0h s PRO 346 Cb -0.09 -1.83 0.10 0.00 0.02 0.00 0.00 34.50 32.69 2d0h s PRO 346 CO 0.28 -2.03 0.76 -0.35 -0.33 0.00 0.00 177.00 175.33 2d0h n PRO 347 N -3.80 1.41 -0.08 5.54 -0.04 -1.26 -4.81 135.00 131.96 2d0h n PRO 347 Ca 0.10 -0.38 -0.08 0.00 -0.04 0.00 0.00 63.50 63.10 2d0h n PRO 347 Cb 0.53 -1.49 -0.03 0.00 -0.04 0.00 0.00 33.50 32.47 2d0h n PRO 347 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2d0h n TYR 348 N 0.13 0.00 -3.76 0.54 4.02 -0.64 -4.80 117.16 112.66 2d0h n TYR 348 Ca 0.04 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.70 2d0h n TYR 348 Cb 0.43 -0.43 0.02 0.00 -0.02 0.00 0.00 39.34 39.34 2d0h n TYR 348 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2d0h n SER 349 N -4.23 -1.35 -4.66 7.72 7.64 -0.35 -4.89 113.62 113.51 2d0h n SER 349 Ca -0.12 -0.88 -0.28 0.00 1.01 0.00 0.00 58.87 58.59 2d0h n SER 349 Cb 0.45 -3.76 0.19 0.00 -1.01 0.00 0.00 64.21 60.08 2d0h n SER 349 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2d0h s VAL 350 N -3.73 2.01 -1.32 0.44 -7.23 0.49 -4.95 120.40 106.11 2d0h s VAL 350 Ca 0.05 0.00 0.14 0.00 -1.81 0.00 0.00 61.98 60.36 2d0h s VAL 350 Cb -0.01 -2.46 0.34 0.00 0.56 0.00 0.00 36.38 34.81 2d0h s VAL 350 CO 0.83 -0.01 1.26 0.47 -0.31 0.00 0.00 175.10 177.35 2d0h n ASP 351 N -4.28 3.01 0.00 4.85 9.92 0.14 -4.69 116.55 125.50 2d0h n ASP 351 Ca 0.05 -1.92 0.00 0.00 -0.53 0.00 0.00 54.79 52.38 2d0h n ASP 351 Cb 0.57 -0.24 0.00 0.00 -0.64 0.00 0.00 41.12 40.81 2d0h n ASP 351 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2d0h n GLY 352 N 0.82 1.21 3.07 0.44 0.00 -1.08 -1.19 105.19 108.47 2d0h n GLY 352 Ca 0.14 -1.04 -0.22 0.00 0.00 0.00 0.00 46.02 44.89 2d0h n GLY 352 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2d0h s TRP 353 N -2.00 1.19 -0.25 1.61 0.52 0.35 -1.56 118.94 118.81 2d0h s TRP 353 Ca 0.00 -0.26 -0.08 0.00 0.02 0.00 0.00 56.10 55.77 2d0h s TRP 353 Cb 0.00 -0.79 -0.04 0.00 -1.15 0.00 0.00 33.47 31.49 2d0h s TRP 353 CO 0.00 -0.06 0.10 0.50 0.02 0.00 0.00 176.95 177.51 2d0h s ARG 354 N -0.13 3.79 -0.54 4.98 3.00 -0.05 -1.58 118.95 128.42 2d0h s ARG 354 Ca 0.02 -0.41 -0.24 0.00 -1.00 0.00 0.00 55.73 54.09 2d0h s ARG 354 Cb -0.07 -3.40 0.04 0.00 0.00 0.00 0.00 34.95 31.52 2d0h s ARG 354 CO 0.00 -0.11 0.92 -0.51 0.00 0.00 0.00 175.30 175.60 2d0h s LEU 355 N 1.46 4.13 0.28 -0.88 1.43 0.20 -0.03 118.68 125.27 2d0h s LEU 355 Ca 0.06 -0.32 -0.29 0.00 -1.03 0.00 0.00 54.13 52.55 2d0h s LEU 355 Cb -0.15 -2.86 -0.10 0.00 0.03 0.00 0.00 46.19 43.12 2d0h s LEU 355 CO 0.05 -1.19 1.25 0.21 0.23 0.00 0.00 176.35 176.90 2d0h s ASN 356 N 2.75 6.94 -1.08 2.29 2.47 -0.39 -1.19 114.94 126.74 2d0h s ASN 356 Ca 0.30 2.50 -0.13 0.00 0.42 0.00 0.00 52.86 55.96 2d0h s ASN 356 Cb -0.13 -2.63 0.12 0.00 -1.45 0.00 0.00 41.25 37.16 2d0h s ASN 356 CO 0.20 -0.42 0.36 0.00 -3.72 0.00 0.00 177.10 173.51 2d0h n ALA 357 N 1.37 -1.11 -0.08 1.71 0.00 -1.26 -4.41 120.51 116.74 2d0h n ALA 357 Ca 0.01 -0.08 0.25 0.00 0.00 0.00 0.00 53.44 53.62 2d0h n ALA 357 Cb 0.43 -1.80 0.72 0.00 0.00 0.00 0.00 19.45 18.79 2d0h n ALA 357 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d0h h ALA 358 N 0.93 2.59 0.00 0.00 0.00 -1.71 -1.83 119.26 119.25 2d0h h ALA 358 Ca -0.35 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 2d0h h ALA 358 Cb 1.23 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2d0h h ALA 358 CO 0.50 -0.97 -0.06 -0.56 0.00 0.00 0.00 179.25 178.16 2d0h h GLN 359 N 0.00 0.00 0.00 0.00 3.07 -1.86 -3.24 115.11 113.08 2d0h h GLN 359 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.08 2d0h h GLN 359 Cb 1.53 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.09 2d0h h GLN 359 CO -0.00 0.06 -1.01 0.66 0.09 0.00 0.00 178.83 178.63 2d0h n TYR 360 N -3.17 0.63 -1.69 0.06 4.02 -0.69 -1.38 117.16 114.94 2d0h n TYR 360 Ca 0.01 0.18 -0.57 0.00 -0.01 0.00 0.00 57.90 57.51 2d0h n TYR 360 Cb 0.38 -0.73 -0.07 0.00 -0.02 0.00 0.00 39.34 38.89 2d0h n TYR 360 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 2d0h n VAL 361 N -2.35 0.25 -3.42 -0.72 0.31 -1.22 -3.42 118.33 107.76 2d0h n VAL 361 Ca 0.01 -0.05 -0.04 0.00 -0.01 0.00 0.00 64.34 64.25 2d0h n VAL 361 Cb 0.50 -1.13 0.01 0.00 -0.91 0.00 0.00 33.84 32.31 2d0h n VAL 361 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2d0h n ASP 362 N 4.89 -0.89 -4.61 4.52 -0.08 -1.26 -4.23 116.55 114.89 2d0h n ASP 362 Ca 0.25 -1.69 -0.26 0.00 -1.51 0.00 0.00 54.79 51.58 2d0h n ASP 362 Cb 0.13 1.50 -0.08 0.00 2.34 0.00 0.00 41.12 45.01 2d0h n ASP 362 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2d0h s ALA 363 N -1.57 3.06 -1.21 -1.67 0.00 -1.26 -2.01 121.76 117.09 2d0h s ALA 363 Ca 0.08 -1.46 0.00 0.00 0.00 0.00 0.00 51.96 50.58 2d0h s ALA 363 Cb -0.02 -0.82 0.00 0.00 0.00 0.00 0.00 23.12 22.28 2d0h s ALA 363 CO 0.06 0.45 0.00 0.09 0.00 0.00 0.00 175.76 176.35 2d0h n ASN 364 N -0.13 -4.23 0.00 0.00 5.03 -1.26 -1.79 115.26 112.88 2d0h n ASN 364 Ca -0.10 0.17 0.00 0.00 0.87 0.00 0.00 54.58 55.52 2d0h n ASN 364 Cb 0.56 -3.60 0.00 0.00 -1.02 0.00 0.00 39.78 35.72 2d0h n ASN 364 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2d0h n GLY 365 N -0.80 0.68 3.63 7.41 0.00 -1.26 -5.02 105.19 109.82 2d0h n GLY 365 Ca -0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 2d0h n GLY 365 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2d0h s ASN 366 N -2.45 2.43 0.00 1.61 -0.87 -0.74 -4.93 114.94 109.99 2d0h s ASN 366 Ca 0.00 2.04 0.25 0.00 -1.57 0.00 0.00 52.86 53.58 2d0h s ASN 366 Cb 0.00 -2.51 1.24 0.00 -0.02 0.00 0.00 41.25 39.95 2d0h s ASN 366 CO 0.00 -3.38 1.83 -3.20 -2.57 0.00 0.00 177.10 169.78 2d0h n ASN 367 N -4.41 0.77 0.00 -1.22 4.05 -1.26 -4.50 115.26 108.68 2d0h n ASN 367 Ca 0.10 -1.39 0.00 0.00 0.45 0.00 0.00 54.58 53.74 2d0h n ASN 367 Cb 0.53 -0.02 0.00 0.00 1.23 0.00 0.00 39.78 41.51 2d0h n ASN 367 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2d0h n GLY 368 N 1.03 -1.57 3.98 8.20 0.00 -1.22 -4.12 105.19 111.50 2d0h n GLY 368 Ca 0.19 -1.41 -0.31 0.00 0.00 0.00 0.00 46.02 44.48 2d0h n GLY 368 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2d0h n SER 369 N 0.01 -4.31 -3.22 1.61 7.64 -0.48 -4.94 113.62 109.93 2d0h n SER 369 Ca 0.00 -0.84 -0.18 0.00 1.01 0.00 0.00 58.87 58.86 2d0h n SER 369 Cb 0.00 -3.61 -0.07 0.00 -1.01 0.00 0.00 64.21 59.52 2d0h n SER 369 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2d0h n ASP 370 N -2.80 -0.94 -0.32 6.43 5.68 -1.26 -5.04 116.55 118.30 2d0h n ASP 370 Ca 0.04 -3.16 0.03 0.00 -0.50 0.00 0.00 54.79 51.20 2d0h n ASP 370 Cb 0.52 2.00 0.18 0.00 -1.14 0.00 0.00 41.12 42.68 2d0h n ASP 370 CO 0.00 0.00 0.00 -0.37 -1.33 0.00 0.00 177.20 175.50 2d0h h VAL 371 N 2.08 0.97 -0.11 2.12 -1.51 -1.99 -1.62 116.25 116.19 2d0h h VAL 371 Ca -0.25 -0.32 -0.01 0.00 -1.23 0.00 0.00 66.70 64.89 2d0h h VAL 371 Cb 1.23 -0.05 -0.00 0.00 -2.13 0.00 0.00 31.29 30.33 2d0h h VAL 371 CO 0.36 0.17 0.03 0.74 -1.23 0.00 0.00 177.57 177.64 2d0h h THR 372 N 0.94 1.18 -0.33 7.19 2.02 -1.97 0.08 112.91 122.01 2d0h h THR 372 Ca 0.42 -0.54 0.06 0.00 0.77 0.00 0.00 66.41 67.12 2d0h h THR 372 Cb 0.33 1.34 -0.06 0.00 -1.74 0.00 0.00 68.15 68.02 2d0h h THR 372 CO -0.23 0.16 -0.02 -1.13 0.37 0.00 0.00 175.52 174.67 2d0h h ASN 373 N -0.02 -0.18 0.07 4.18 -0.73 -1.63 0.92 115.58 118.20 2d0h h ASN 373 Ca 0.03 0.08 -0.07 0.00 1.87 0.00 0.00 56.30 58.22 2d0h h ASN 373 Cb 0.22 0.15 -0.01 0.00 0.27 0.00 0.00 38.32 38.95 2d0h h ASN 373 CO -0.00 -0.05 -0.20 0.45 -0.37 0.00 0.00 177.43 177.25 2d0h h HIS 374 N 0.07 0.27 -0.43 0.67 3.86 -1.17 -2.24 115.15 116.18 2d0h h HIS 374 Ca 0.16 -0.04 -0.07 0.00 -1.16 0.00 0.00 60.37 59.26 2d0h h HIS 374 Cb 0.23 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.61 2d0h h HIS 374 CO -0.26 0.45 -0.01 0.37 0.86 0.00 0.00 177.93 179.34 2d0h h GLN 375 N 0.23 0.77 -0.45 2.45 4.15 0.21 -1.81 115.11 120.65 2d0h h GLN 375 Ca 0.04 -0.25 -0.02 0.00 0.77 0.00 0.00 58.65 59.19 2d0h h GLN 375 Cb 0.50 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.10 2d0h h GLN 375 CO 0.03 0.84 0.21 0.82 -1.93 0.00 0.00 178.83 178.81 2d0h h ILE 376 N 0.61 1.18 0.00 2.39 2.04 -0.47 -1.95 117.51 121.31 2d0h h ILE 376 Ca 0.12 -0.53 -0.03 0.00 1.00 0.00 0.00 64.86 65.42 2d0h h ILE 376 Cb 0.50 0.70 -0.00 0.00 -0.74 0.00 0.00 36.82 37.28 2d0h h ILE 376 CO 0.02 0.20 -0.15 -0.50 0.00 0.00 0.00 178.15 177.72 2d0h h TRP 377 N 0.58 0.00 -0.28 1.37 -0.00 -1.34 -0.82 115.95 115.46 2d0h h TRP 377 Ca 0.15 0.00 -0.10 0.00 -0.00 0.00 0.00 58.89 58.95 2d0h h TRP 377 Cb 0.12 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.28 2d0h h TRP 377 CO -0.01 0.15 -0.21 0.77 -0.00 0.00 0.00 178.44 179.14 2d0h h SER 378 N 0.00 0.67 0.05 -3.49 0.02 -0.61 -1.22 113.55 108.97 2d0h h SER 378 Ca -0.00 -0.45 -0.13 0.00 -0.84 0.00 0.00 61.79 60.37 2d0h h SER 378 Cb 0.48 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 2d0h h SER 378 CO 0.02 0.98 -0.42 -0.33 -1.14 0.00 0.00 176.83 175.93 2d0h h GLU 379 N 0.38 0.46 -0.42 3.45 5.08 -0.94 -2.25 114.58 120.34 2d0h h GLU 379 Ca 0.05 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 2d0h h GLU 379 Cb 0.76 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 2d0h h GLU 379 CO 0.06 0.81 0.11 0.35 -1.00 0.00 0.00 179.01 179.34 2d0h h PHE 380 N 0.38 0.69 -0.45 4.33 3.57 -1.06 -1.46 116.94 122.95 2d0h h PHE 380 Ca 0.03 -0.08 -0.03 0.00 3.53 0.00 0.00 57.97 61.42 2d0h h PHE 380 Cb 0.90 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.43 2d0h h PHE 380 CO 0.03 0.64 0.15 -0.09 -2.23 0.00 0.00 178.31 176.82 2d0h h ARG 381 N 0.53 0.69 -1.00 1.11 2.43 -1.13 -0.30 114.38 116.71 2d0h h ARG 381 Ca 0.13 -0.14 0.04 0.00 -0.81 0.00 0.00 59.98 59.20 2d0h h ARG 381 Cb 0.29 -0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 29.68 2d0h h ARG 381 CO -0.00 0.66 0.66 -0.97 -1.51 0.00 0.00 179.97 178.80 2d0h h ASN 382 N 0.59 1.09 0.05 -3.80 -0.73 -1.21 0.12 115.58 111.70 2d0h h ASN 382 Ca 0.15 -0.01 -0.00 0.00 1.87 0.00 0.00 56.30 58.30 2d0h h ASN 382 Cb 0.24 -0.25 0.00 0.00 0.27 0.00 0.00 38.32 38.58 2d0h h ASN 382 CO -0.01 0.75 -0.03 0.00 -0.37 0.00 0.00 177.43 177.78 2d0h h ALA 383 N 1.42 -0.07 -0.19 1.57 0.00 -0.98 -1.93 119.26 119.07 2d0h h ALA 383 Ca 0.40 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2d0h h ALA 383 Cb 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2d0h h ALA 383 CO -0.12 -0.26 0.13 0.28 0.00 0.00 0.00 179.25 179.27 2d0h h VAL 384 N -0.62 1.05 0.00 0.00 2.07 -0.86 -1.92 116.25 115.97 2d0h h VAL 384 Ca -0.01 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 2d0h h VAL 384 Cb 0.54 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 2d0h h VAL 384 CO 0.01 0.05 -0.23 0.11 0.02 0.00 0.00 177.57 177.53 2d0h h LYS 385 N 0.26 0.00 -0.28 1.57 1.79 -0.85 -0.94 116.57 118.12 2d0h h LYS 385 Ca 0.07 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.51 2d0h h LYS 385 Cb -0.03 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.61 2d0h h LYS 385 CO -0.02 0.23 0.05 0.78 -1.08 0.00 0.00 179.45 179.41 2d0h h GLY 386 N 0.91 0.50 0.91 3.86 0.00 -0.63 -2.05 103.07 106.57 2d0h h GLY 386 Ca -0.00 -0.33 -0.08 0.00 0.00 0.00 0.00 47.33 46.92 2d0h h GLY 386 CO 0.03 0.30 -0.12 -2.08 0.00 0.00 0.00 176.54 174.67 2d0h h VAL 387 N 0.28 1.29 -1.80 4.60 2.07 -0.96 -3.42 116.25 118.31 2d0h h VAL 387 Ca 0.09 -1.21 -0.20 0.00 0.82 0.00 0.00 66.70 66.20 2d0h h VAL 387 Cb 0.33 1.44 -0.29 0.00 -1.52 0.00 0.00 31.29 31.25 2d0h h VAL 387 CO 0.00 0.39 -0.53 0.21 0.02 0.00 0.00 177.57 177.66 2d0h s ASN 388 N -6.28 0.51 0.15 0.57 3.84 -0.40 -5.01 114.94 108.32 2d0h s ASN 388 Ca -0.13 -0.28 0.10 0.00 0.21 0.00 0.00 52.86 52.76 2d0h s ASN 388 Cb 0.08 1.04 0.54 0.00 -0.55 0.00 0.00 41.25 42.36 2d0h s ASN 388 CO 0.79 -0.35 1.30 -1.54 -2.79 0.00 0.00 177.10 174.51 2d0h n SER 389 N 5.35 0.26 -1.08 -4.21 3.41 -0.77 -1.02 113.62 115.55 2d0h n SER 389 Ca -0.01 0.61 0.07 0.00 -0.26 0.00 0.00 58.87 59.29 2d0h n SER 389 Cb 0.49 -0.65 0.28 0.00 -0.26 0.00 0.00 64.21 64.07 2d0h n SER 389 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2d0h n ASN 390 N -1.84 4.08 -4.69 4.04 3.02 -1.26 -4.73 115.26 113.88 2d0h n ASN 390 Ca -0.01 -3.07 -0.39 0.00 -0.03 0.00 0.00 54.58 51.09 2d0h n ASN 390 Cb 0.03 -0.58 -0.06 0.00 -0.61 0.00 0.00 39.78 38.56 2d0h n ASN 390 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2d0h s ALA 391 N -2.86 3.50 0.41 5.41 0.00 -0.19 -4.81 121.76 123.22 2d0h s ALA 391 Ca 0.45 -0.25 -0.23 0.00 0.00 0.00 0.00 51.96 51.92 2d0h s ALA 391 Cb 0.36 -2.81 -0.10 0.00 0.00 0.00 0.00 23.12 20.58 2d0h s ALA 391 CO 0.09 -0.29 1.00 0.00 0.00 0.00 0.00 175.76 176.57 2d0h s ALA 392 N 1.28 3.06 -0.21 0.00 0.00 -0.33 -4.86 121.76 120.71 2d0h s ALA 392 Ca 0.27 0.58 -0.03 0.00 0.00 0.00 0.00 51.96 52.78 2d0h s ALA 392 Cb -0.16 -3.22 0.06 0.00 0.00 0.00 0.00 23.12 19.81 2d0h s ALA 392 CO 0.11 -0.07 0.04 0.42 0.00 0.00 0.00 175.76 176.26 2d0h s ILE 393 N -1.83 0.57 -0.18 0.00 1.01 -1.26 -0.49 121.20 119.01 2d0h s ILE 393 Ca 0.59 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.61 2d0h s ILE 393 Cb -0.17 -1.10 0.03 0.00 0.01 0.00 0.00 42.46 41.23 2d0h s ILE 393 CO 0.22 -0.25 -0.13 -0.63 0.00 0.00 0.00 174.94 174.15 2d0h s ILE 394 N 1.83 1.75 0.13 2.92 1.01 -0.62 -0.69 121.20 127.53 2d0h s ILE 394 Ca -0.00 -0.93 -0.10 0.00 0.00 0.00 0.00 60.65 59.61 2d0h s ILE 394 Cb -0.17 -1.72 -0.06 0.00 0.01 0.00 0.00 42.46 40.52 2d0h s ILE 394 CO -0.10 0.32 0.46 -0.83 0.00 0.00 0.00 174.94 174.79 2d0h s GLY 395 N 1.38 2.34 -0.06 6.18 0.00 -0.82 0.63 107.32 116.97 2d0h s GLY 395 Ca 0.01 -0.33 -0.28 0.00 0.00 0.00 0.00 44.72 44.12 2d0h s GLY 395 CO -0.10 -0.13 0.93 1.62 0.00 0.00 0.00 173.10 175.42 2d0h s GLN 396 N -2.17 4.47 -0.28 2.90 0.74 -0.33 -1.69 119.66 123.30 2d0h s GLN 396 Ca 0.38 1.28 -0.23 0.00 0.05 0.00 0.00 55.36 56.84 2d0h s GLN 396 Cb -0.13 -3.50 0.09 0.00 1.10 0.00 0.00 33.01 30.57 2d0h s GLN 396 CO 0.20 -0.14 0.84 -0.47 -0.55 0.00 0.00 175.29 175.16 2d0h s TYR 397 N 1.41 -0.71 -0.16 1.67 5.04 -1.26 -4.14 117.35 119.20 2d0h s TYR 397 Ca 0.47 1.64 0.21 0.00 -2.44 0.00 0.00 57.07 56.95 2d0h s TYR 397 Cb -0.19 0.36 -0.12 0.00 0.35 0.00 0.00 41.96 42.35 2d0h s TYR 397 CO 0.22 -0.34 0.82 0.91 -1.34 0.00 0.00 175.55 175.82 2d0h n TRP 398 N 2.83 0.69 -0.67 4.97 7.02 -1.26 -4.39 117.44 126.63 2d0h n TRP 398 Ca -0.15 0.21 0.00 0.00 -1.02 0.00 0.00 57.50 56.54 2d0h n TRP 398 Cb 0.56 -0.87 0.00 0.00 -2.42 0.00 0.00 31.31 28.58 2d0h n TRP 398 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2d0h n GLY 399 N 1.26 3.18 3.59 6.99 0.00 -1.26 -3.27 105.19 115.68 2d0h n GLY 399 Ca -0.04 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 2d0h n GLY 399 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2d0h s ASN 400 N -0.21 6.23 -0.02 1.61 2.47 -1.26 -4.56 114.94 119.21 2d0h s ASN 400 Ca 0.00 0.54 0.05 0.00 0.42 0.00 0.00 52.86 53.87 2d0h s ASN 400 Cb 0.00 -2.54 0.17 0.00 -1.45 0.00 0.00 41.25 37.43 2d0h s ASN 400 CO 0.00 -1.57 1.04 0.00 -3.72 0.00 0.00 177.10 172.85 2d0h n ALA 401 N 9.20 2.58 -0.30 1.71 0.00 -1.26 -4.47 120.51 127.97 2d0h n ALA 401 Ca 0.14 -0.37 0.13 0.00 0.00 0.00 0.00 53.44 53.35 2d0h n ALA 401 Cb 0.49 -1.00 0.28 0.00 0.00 0.00 0.00 19.45 19.22 2d0h n ALA 401 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2d0h h ASN 402 N 1.05 -0.10 -0.11 0.00 -0.73 -1.90 -0.95 115.58 112.85 2d0h h ASN 402 Ca 0.00 0.21 0.03 0.00 1.87 0.00 0.00 56.30 58.41 2d0h h ASN 402 Cb 0.42 0.31 -0.00 0.00 0.27 0.00 0.00 38.32 39.32 2d0h h ASN 402 CO 0.04 -0.20 0.11 -0.65 -0.37 0.00 0.00 177.43 176.35 2d0h h PRO 403 N 0.16 0.00 -0.33 6.67 0.11 -1.93 0.77 132.00 137.44 2d0h h PRO 403 Ca 0.55 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.66 2d0h h PRO 403 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2d0h h PRO 403 CO -0.70 0.00 0.00 0.91 -0.21 0.00 0.00 178.00 178.00 2d0h n TRP 404 N -3.99 0.43 0.00 0.65 8.01 -0.38 -4.65 117.44 117.51 2d0h n TRP 404 Ca -0.00 -0.25 0.00 0.00 -1.31 0.00 0.00 57.50 55.94 2d0h n TRP 404 Cb 0.22 -0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.51 2d0h n TRP 404 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.69 176.93 2d0h n THR 405 N 1.26 0.00 0.07 -0.99 -2.24 -0.79 -1.51 114.28 110.08 2d0h n THR 405 Ca 0.17 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.95 2d0h n THR 405 Cb 0.54 -0.90 0.04 0.00 -2.10 0.00 0.00 70.33 67.92 2d0h n THR 405 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2d0h n ALA 406 N -2.67 1.20 0.91 6.98 0.00 0.20 -1.20 120.51 125.92 2d0h n ALA 406 Ca 0.00 -0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.55 2d0h n ALA 406 Cb 0.22 -1.03 0.18 0.00 0.00 0.00 0.00 19.45 18.82 2d0h n ALA 406 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2d0h n GLN 407 N -1.37 0.06 -1.21 0.00 1.13 -1.26 -4.96 117.38 109.78 2d0h n GLN 407 Ca 0.01 0.01 -0.07 0.00 -1.94 0.00 0.00 57.00 55.00 2d0h n GLN 407 Cb 0.01 -1.53 -0.03 0.00 0.11 0.00 0.00 30.24 28.81 2d0h n GLN 407 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2d0h n GLY 408 N 1.47 0.79 0.02 1.08 0.00 -0.34 -4.84 105.19 103.37 2d0h n GLY 408 Ca 0.05 -0.13 0.01 0.00 0.00 0.00 0.00 46.02 45.94 2d0h n GLY 408 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2d0h n ASN 409 N -0.63 1.42 0.00 1.61 2.04 -1.26 -4.65 115.26 113.79 2d0h n ASN 409 Ca -0.07 -1.81 0.00 0.00 -0.44 0.00 0.00 54.58 52.26 2d0h n ASN 409 Cb 0.43 -0.04 0.00 0.00 -2.53 0.00 0.00 39.78 37.65 2d0h n ASN 409 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2d0h n GLN 410 N -0.42 0.00 -3.11 -3.83 6.02 -1.26 -4.05 117.38 110.73 2d0h n GLN 410 Ca 0.01 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.73 2d0h n GLN 410 Cb 0.36 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.60 2d0h n GLN 410 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2d0h s TRP 411 N 0.79 3.51 0.01 1.08 0.51 -0.57 -4.67 118.94 119.60 2d0h s TRP 411 Ca 0.00 0.64 0.11 0.00 -2.12 0.00 0.00 56.10 54.73 2d0h s TRP 411 Cb 0.00 -2.13 -0.14 0.00 -0.81 0.00 0.00 33.47 30.39 2d0h s TRP 411 CO 0.00 0.00 1.20 -0.44 -0.51 0.00 0.00 176.95 177.20 2d0h h ASP 412 N 0.96 0.00 -0.59 2.95 3.32 -1.21 -3.42 116.42 118.43 2d0h h ASP 412 Ca -0.48 0.00 0.03 0.00 0.02 0.00 0.00 57.03 56.60 2d0h h ASP 412 Cb 1.20 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 2d0h h ASP 412 CO 0.63 0.84 0.08 0.00 -1.72 0.00 0.00 179.24 179.07 2d0h n ALA 413 N -2.35 -0.32 -2.82 3.45 0.00 -1.13 -4.43 120.51 112.91 2d0h n ALA 413 Ca -0.03 -0.10 -0.11 0.00 0.00 0.00 0.00 53.44 53.21 2d0h n ALA 413 Cb 0.90 0.04 -0.07 0.00 0.00 0.00 0.00 19.45 20.32 2d0h n ALA 413 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d0h s ALA 414 N -1.11 0.37 -0.22 0.00 0.00 -1.26 -1.95 121.76 117.59 2d0h s ALA 414 Ca 0.03 -1.24 -0.29 0.00 0.00 0.00 0.00 51.96 50.46 2d0h s ALA 414 Cb -0.00 1.19 -0.04 0.00 0.00 0.00 0.00 23.12 24.27 2d0h s ALA 414 CO 0.00 -0.76 1.80 0.95 0.00 0.00 0.00 175.76 177.75 2d0h s THR 415 N -3.93 3.45 -0.54 0.00 -4.23 -0.68 -2.21 115.64 107.49 2d0h s THR 415 Ca 0.29 0.50 -0.07 0.00 -1.18 0.00 0.00 61.69 61.23 2d0h s THR 415 Cb 0.02 -3.50 -0.18 0.00 1.34 0.00 0.00 72.50 70.18 2d0h s THR 415 CO 0.12 -0.24 3.13 -3.20 -0.54 0.00 0.00 174.62 173.88 2d0h n ASN 416 N 9.32 5.92 0.07 3.99 2.85 -0.65 -4.46 115.26 132.31 2d0h n ASN 416 Ca 0.22 -2.43 -0.12 0.00 -0.11 0.00 0.00 54.58 52.13 2d0h n ASN 416 Cb 0.45 -1.35 -0.07 0.00 1.24 0.00 0.00 39.78 40.06 2d0h n ASN 416 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 2d0h h PHE 417 N 4.03 -0.15 -0.03 1.20 -1.00 -1.82 -1.07 116.94 118.09 2d0h h PHE 417 Ca 0.40 0.00 -0.14 0.00 2.81 0.00 0.00 57.97 61.05 2d0h h PHE 417 Cb 0.96 0.06 -0.02 0.00 3.61 0.00 0.00 35.95 40.56 2d0h h PHE 417 CO 1.78 -0.10 -0.61 0.22 -1.61 0.00 0.00 178.31 178.00 2d0h h ASP 418 N -0.14 0.14 -0.02 2.17 3.58 -1.79 -0.73 116.42 119.62 2d0h h ASP 418 Ca 0.00 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.38 2d0h h ASP 418 Cb 0.13 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.14 2d0h h ASP 418 CO -0.02 0.71 -0.20 0.61 -2.88 0.00 0.00 179.24 177.46 2d0h n GLY 419 N 0.24 0.46 2.02 -0.78 0.00 -1.21 -4.63 105.19 101.29 2d0h n GLY 419 Ca -0.02 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.38 2d0h n GLY 419 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2d0h n PHE 420 N 0.67 -1.39 -0.04 1.61 7.35 -0.45 -4.83 117.46 120.38 2d0h n PHE 420 Ca 0.11 0.25 -0.09 0.00 -0.76 0.00 0.00 57.45 56.97 2d0h n PHE 420 Cb 0.50 0.77 -0.02 0.00 0.35 0.00 0.00 39.48 41.08 2d0h n PHE 420 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 2d0h h THR 421 N 0.00 0.37 0.50 -2.13 2.02 -1.37 -1.30 112.91 111.00 2d0h h THR 421 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 2d0h h THR 421 Cb 0.00 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 66.79 2d0h h THR 421 CO 0.00 0.00 -0.24 -0.61 0.37 0.00 0.00 175.52 175.04 2d0h h GLN 422 N -0.27 -0.65 -0.72 6.66 5.75 -1.39 -1.56 115.11 122.93 2d0h h GLN 422 Ca 0.13 0.04 0.02 0.00 -0.15 0.00 0.00 58.65 58.70 2d0h h GLN 422 Cb 0.47 0.15 -0.04 0.00 1.07 0.00 0.00 27.48 29.13 2d0h h GLN 422 CO -0.38 -0.37 0.46 -1.00 -2.65 0.00 0.00 178.83 174.89 2d0h h PRO 423 N -0.83 0.89 -0.58 -2.39 0.13 -1.78 -0.33 132.00 127.12 2d0h h PRO 423 Ca -0.07 -0.05 0.02 0.00 -0.87 0.00 0.00 66.00 65.03 2d0h h PRO 423 Cb 0.58 -0.20 -0.04 0.00 0.13 0.00 0.00 31.00 31.47 2d0h h PRO 423 CO 0.11 0.59 0.36 0.28 -0.23 0.00 0.00 178.00 179.11 2d0h h VAL 424 N 0.92 1.08 -0.03 1.56 2.07 -1.25 -0.81 116.25 119.79 2d0h h VAL 424 Ca 0.28 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.55 2d0h h VAL 424 Cb -0.03 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.04 2d0h h VAL 424 CO -0.09 0.13 0.01 -1.28 0.02 0.00 0.00 177.57 176.36 2d0h h SER 425 N 0.71 0.03 0.37 0.57 0.87 -0.66 -1.66 113.55 113.78 2d0h h SER 425 Ca 0.23 -0.08 -0.07 0.00 -1.23 0.00 0.00 61.79 60.64 2d0h h SER 425 Cb 0.00 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 2d0h h SER 425 CO -0.09 0.11 -0.33 -0.33 -0.53 0.00 0.00 176.83 175.66 2d0h h GLU 426 N -0.04 0.00 0.00 2.24 5.08 -0.79 0.52 114.58 121.58 2d0h h GLU 426 Ca 0.01 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 2d0h h GLU 426 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2d0h h GLU 426 CO -0.00 0.33 -0.15 2.35 -1.00 0.00 0.00 179.01 180.54 2d0h h TRP 427 N 0.00 0.15 0.00 4.33 7.01 -1.00 -2.83 115.95 123.60 2d0h h TRP 427 Ca -0.00 -0.08 -0.08 0.00 2.11 0.00 0.00 58.89 60.84 2d0h h TRP 427 Cb 0.60 -0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.64 2d0h h TRP 427 CO 0.00 0.88 -0.51 0.82 -2.79 0.00 0.00 178.44 176.84 2d0h h ILE 428 N -0.63 0.97 0.00 2.65 2.04 -1.29 -3.40 117.51 117.85 2d0h h ILE 428 Ca -0.02 -1.90 -0.01 0.00 1.00 0.00 0.00 64.86 63.93 2d0h h ILE 428 Cb 0.92 2.00 -0.00 0.00 -0.74 0.00 0.00 36.82 39.01 2d0h h ILE 428 CO 0.03 0.33 -0.73 0.71 0.00 0.00 0.00 178.15 178.49 2d0h h THR 429 N -1.00 0.03 -0.15 -0.27 1.35 -1.12 -3.48 112.91 108.28 2d0h h THR 429 Ca -0.12 -1.06 -0.06 0.00 -0.55 0.00 0.00 66.41 64.61 2d0h h THR 429 Cb 0.89 1.67 -0.03 0.00 -1.73 0.00 0.00 68.15 68.95 2d0h h THR 429 CO -0.07 0.02 -0.06 0.61 -0.25 0.00 0.00 175.52 175.77 2d0h n GLY 430 N 1.17 0.63 3.30 5.82 0.00 -0.71 -4.84 105.19 110.56 2d0h n GLY 430 Ca 0.01 -0.67 -0.16 0.00 0.00 0.00 0.00 46.02 45.19 2d0h n GLY 430 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d0h s LYS 431 N -1.89 1.21 0.72 1.61 -0.14 -0.85 -0.35 119.74 120.06 2d0h s LYS 431 Ca 0.00 -1.53 -0.07 0.00 -1.36 0.00 0.00 55.97 53.01 2d0h s LYS 431 Cb 0.00 -0.86 0.07 0.00 -1.68 0.00 0.00 37.83 35.36 2d0h s LYS 431 CO 0.00 0.12 1.03 0.16 -0.76 0.00 0.00 175.35 175.90 2d0h s ASP 432 N -3.25 4.70 0.00 2.83 3.84 0.39 -2.55 116.67 122.63 2d0h s ASP 432 Ca 0.20 0.43 0.06 0.00 -0.00 0.00 0.00 52.55 53.24 2d0h s ASP 432 Cb 0.01 -1.03 0.33 0.00 -1.38 0.00 0.00 42.92 40.85 2d0h s ASP 432 CO 0.04 -1.67 1.03 0.00 -0.00 0.00 0.00 175.17 174.56 2d0h n TYR 433 N -2.97 0.00 0.46 2.11 0.18 -1.26 -0.78 117.16 114.89 2d0h n TYR 433 Ca 0.09 0.00 0.12 0.00 1.88 0.00 0.00 57.90 59.98 2d0h n TYR 433 Cb 0.60 -0.25 0.22 0.00 -0.38 0.00 0.00 39.34 39.54 2d0h n TYR 433 CO 0.00 0.00 0.00 1.04 -2.08 0.00 0.00 176.86 175.82 2d0h n GLN 434 N -1.25 2.44 -1.44 -3.48 1.13 -1.26 -2.46 117.38 111.06 2d0h n GLN 434 Ca 0.03 -2.17 -0.05 0.00 -1.94 0.00 0.00 57.00 52.88 2d0h n GLN 434 Cb 0.05 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 28.88 2d0h n GLN 434 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2d0h n ASN 435 N 1.40 -3.13 -4.85 1.08 4.05 0.04 -4.85 115.26 108.99 2d0h n ASN 435 Ca 0.19 0.08 -0.34 0.00 0.45 0.00 0.00 54.58 54.95 2d0h n ASN 435 Cb 0.59 -1.51 -0.06 0.00 1.23 0.00 0.00 39.78 40.03 2d0h n ASN 435 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 177.26 174.41 2d0h s ASN 436 N -2.90 6.78 0.18 1.20 0.01 -1.26 -4.83 114.94 114.12 2d0h s ASN 436 Ca 0.00 1.05 -0.31 0.00 -0.71 0.00 0.00 52.86 52.88 2d0h s ASN 436 Cb 0.00 -2.28 -0.10 0.00 0.41 0.00 0.00 41.25 39.28 2d0h s ASN 436 CO 0.00 0.05 1.57 -0.44 -1.51 0.00 0.00 177.10 176.78 2d0h s SER 437 N -1.88 6.56 -0.30 -1.22 0.01 -1.26 -0.46 113.70 115.15 2d0h s SER 437 Ca 0.40 2.66 -0.15 0.00 1.31 0.00 0.00 55.95 60.17 2d0h s SER 437 Cb -0.14 -2.60 0.18 0.00 0.21 0.00 0.00 66.02 63.67 2d0h s SER 437 CO 0.20 -0.83 1.07 0.00 0.41 0.00 0.00 173.24 174.08 2d0h s ALA 438 N 1.00 -3.07 0.17 1.44 0.00 0.53 -4.75 121.76 117.08 2d0h s ALA 438 Ca 0.69 1.79 0.08 0.00 0.00 0.00 0.00 51.96 54.53 2d0h s ALA 438 Cb -0.44 -2.25 -0.04 0.00 0.00 0.00 0.00 23.12 20.38 2d0h s ALA 438 CO 0.33 -1.12 -0.16 0.45 0.00 0.00 0.00 175.76 175.25 2d0h s SER 439 N 2.53 2.55 0.01 0.00 0.15 -1.25 -2.00 113.70 115.70 2d0h s SER 439 Ca -0.01 -0.91 -0.01 0.00 0.70 0.00 0.00 55.95 55.72 2d0h s SER 439 Cb -0.06 -0.14 -0.01 0.00 -1.71 0.00 0.00 66.02 64.10 2d0h s SER 439 CO -0.15 -0.10 0.01 0.27 1.20 0.00 0.00 173.24 174.47 2d0h s ILE 440 N -2.38 0.09 1.02 6.45 -4.36 -1.08 -4.98 121.20 115.96 2d0h s ILE 440 Ca 0.17 -0.73 -0.16 0.00 -0.26 0.00 0.00 60.65 59.68 2d0h s ILE 440 Cb -0.04 -0.25 0.21 0.00 1.25 0.00 0.00 42.46 43.62 2d0h s ILE 440 CO 0.06 -0.40 1.20 -0.94 0.24 0.00 0.00 174.94 175.11 2d0h s SER 441 N -1.21 2.60 0.18 4.36 1.04 -1.26 -4.45 113.70 114.97 2d0h s SER 441 Ca -0.13 0.59 -0.10 0.00 0.48 0.00 0.00 55.95 56.78 2d0h s SER 441 Cb -0.08 -0.85 0.07 0.00 0.10 0.00 0.00 66.02 65.26 2d0h s SER 441 CO -0.00 -3.08 1.66 0.74 0.98 0.00 0.00 173.24 173.54 2d0h h THR 442 N -1.87 1.26 -0.60 2.02 2.02 -1.93 -0.20 112.91 113.61 2d0h h THR 442 Ca -0.46 -1.04 -0.09 0.00 0.77 0.00 0.00 66.41 65.59 2d0h h THR 442 Cb 1.28 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 68.40 2d0h h THR 442 CO 0.44 0.38 0.02 0.71 0.37 0.00 0.00 175.52 177.45 2d0h h THR 443 N 0.95 1.26 -0.13 3.16 1.35 -1.93 -1.13 112.91 116.44 2d0h h THR 443 Ca 0.19 -1.11 -0.10 0.00 -0.55 0.00 0.00 66.41 64.84 2d0h h THR 443 Cb 0.46 0.77 -0.01 0.00 -1.73 0.00 0.00 68.15 67.64 2d0h h THR 443 CO 0.02 0.40 -0.35 -0.61 -0.25 0.00 0.00 175.52 174.73 2d0h h GLN 444 N 0.95 0.26 -0.01 4.72 5.75 -1.88 -0.91 115.11 124.00 2d0h h GLN 444 Ca 0.18 -0.11 -0.00 0.00 -0.15 0.00 0.00 58.65 58.56 2d0h h GLN 444 Cb 0.52 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.06 2d0h h GLN 444 CO 0.02 0.59 0.00 0.35 -2.65 0.00 0.00 178.83 177.14 2d0h h PHE 445 N 0.23 0.02 -0.86 3.99 -0.00 -0.56 0.25 116.94 120.01 2d0h h PHE 445 Ca 0.03 -0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 57.98 2d0h h PHE 445 Cb 0.74 -0.00 -0.04 0.00 -0.00 0.00 0.00 35.95 36.64 2d0h h PHE 445 CO 0.01 0.30 0.47 0.22 -0.00 0.00 0.00 178.31 179.32 2d0h h ASP 446 N -0.27 1.07 -0.23 0.41 1.82 -1.05 -0.91 116.42 117.26 2d0h h ASP 446 Ca 0.00 -0.09 -0.06 0.00 -0.39 0.00 0.00 57.03 56.50 2d0h h ASP 446 Cb 0.30 -0.27 -0.01 0.00 0.68 0.00 0.00 39.33 40.03 2d0h h ASP 446 CO 0.00 0.85 -0.08 -1.28 -1.61 0.00 0.00 179.24 177.12 2d0h h SER 447 N 1.20 0.47 0.10 2.28 0.87 -1.07 -1.63 113.55 115.76 2d0h h SER 447 Ca 0.30 -0.39 0.01 0.00 -1.23 0.00 0.00 61.79 60.48 2d0h h SER 447 Cb 0.02 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.84 2d0h h SER 447 CO -0.05 0.75 -0.13 -0.25 -0.53 0.00 0.00 176.83 176.63 2d0h h TRP 448 N 0.18 -0.33 -0.71 2.24 2.91 -0.71 0.62 115.95 120.14 2d0h h TRP 448 Ca 0.05 0.00 0.08 0.00 1.13 0.00 0.00 58.89 60.16 2d0h h TRP 448 Cb 0.56 0.13 -0.06 0.00 -0.51 0.00 0.00 29.16 29.28 2d0h h TRP 448 CO 0.06 -0.20 0.38 -0.07 -1.03 0.00 0.00 178.44 177.58 2d0h h LEU 449 N -0.27 0.54 -0.22 0.65 3.38 -1.14 -1.36 115.31 116.89 2d0h h LEU 449 Ca 0.01 0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2d0h h LEU 449 Cb 0.27 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 2d0h h LEU 449 CO -0.06 0.32 -0.35 -0.09 0.09 0.00 0.00 178.44 178.36 2d0h h ARG 450 N 0.67 0.63 -0.71 1.13 2.43 -0.95 -1.70 114.38 115.88 2d0h h ARG 450 Ca 0.34 -0.38 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2d0h h ARG 450 Cb 0.29 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 2d0h h ARG 450 CO -0.23 0.99 0.38 0.78 -1.51 0.00 0.00 179.97 180.39 2d0h h GLY 451 N 0.33 1.05 1.53 2.80 0.00 -0.59 -0.50 103.07 107.69 2d0h h GLY 451 Ca 0.02 -0.47 -0.24 0.00 0.00 0.00 0.00 47.33 46.64 2d0h h GLY 451 CO 0.08 0.45 -1.04 -0.91 0.00 0.00 0.00 176.54 175.12 2d0h h THR 452 N 0.99 1.41 -0.88 4.70 1.35 -1.26 -3.05 112.91 116.16 2d0h h THR 452 Ca 0.25 -2.58 0.01 0.00 -0.55 0.00 0.00 66.41 63.55 2d0h h THR 452 Cb 0.03 2.56 -0.05 0.00 -1.73 0.00 0.00 68.15 68.97 2d0h h THR 452 CO -0.04 0.77 0.58 0.03 -0.25 0.00 0.00 175.52 176.61 2d0h h ARG 453 N 0.20 1.14 0.00 4.72 3.08 -0.95 -0.60 114.38 121.97 2d0h h ARG 453 Ca -0.10 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.88 2d0h h ARG 453 Cb 1.70 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 31.49 2d0h h ARG 453 CO 0.18 0.75 0.00 0.00 -1.07 0.00 0.00 179.97 179.83 2d0h n ALA 454 N -2.34 1.12 0.73 0.04 0.00 -0.23 -0.65 120.51 119.18 2d0h n ALA 454 Ca 0.10 0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.76 2d0h n ALA 454 Cb 0.03 -1.19 0.48 0.00 0.00 0.00 0.00 19.45 18.77 2d0h n ALA 454 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2d0h n ASN 455 N -1.91 0.48 -4.29 0.00 3.02 -0.23 -4.80 115.26 107.52 2d0h n ASN 455 Ca -0.00 0.55 -0.16 0.00 -0.03 0.00 0.00 54.58 54.94 2d0h n ASN 455 Cb 0.05 -0.68 -0.10 0.00 -0.61 0.00 0.00 39.78 38.44 2d0h n ASN 455 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2d0h s TYR 456 N -3.08 1.49 0.78 3.10 1.51 0.17 -4.53 117.35 116.80 2d0h s TYR 456 Ca 0.11 -0.66 -0.11 0.00 -1.01 0.00 0.00 57.07 55.41 2d0h s TYR 456 Cb 0.14 -0.72 0.06 0.00 -0.11 0.00 0.00 41.96 41.33 2d0h s TYR 456 CO 0.54 0.22 1.09 -2.14 -1.11 0.00 0.00 175.55 174.15 2d0h s PRO 457 N -3.62 2.20 0.14 -1.71 0.02 -1.26 -4.81 135.00 125.96 2d0h s PRO 457 Ca 0.19 1.08 -0.18 0.00 0.02 0.00 0.00 61.00 62.11 2d0h s PRO 457 Cb 0.00 -1.90 0.01 0.00 0.02 0.00 0.00 34.50 32.64 2d0h s PRO 457 CO 0.04 -1.66 1.73 1.15 -0.33 0.00 0.00 177.00 177.93 2d0h h THR 458 N -1.14 0.86 -0.32 0.99 2.02 -1.89 -1.92 112.91 111.51 2d0h h THR 458 Ca -0.44 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 66.68 2d0h h THR 458 Cb 1.24 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 68.34 2d0h h THR 458 CO 0.53 0.03 0.18 -0.55 0.37 0.00 0.00 175.52 176.07 2d0h h ASN 459 N 0.14 0.38 -0.49 4.18 -0.00 -1.93 -1.23 115.58 116.63 2d0h h ASN 459 Ca 0.13 -0.02 -0.13 0.00 -0.00 0.00 0.00 56.30 56.28 2d0h h ASN 459 Cb 0.14 -0.09 -0.01 0.00 -0.00 0.00 0.00 38.32 38.35 2d0h h ASN 459 CO -0.18 0.30 -0.19 0.58 -0.00 0.00 0.00 177.43 177.94 2d0h h VAL 460 N 0.44 1.27 -0.33 6.14 2.07 -1.67 -2.25 116.25 121.91 2d0h h VAL 460 Ca 0.11 -1.35 0.01 0.00 0.82 0.00 0.00 66.70 66.29 2d0h h VAL 460 Cb 0.01 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 2d0h h VAL 460 CO -0.02 0.47 0.21 1.56 0.02 0.00 0.00 177.57 179.81 2d0h h GLN 461 N 0.85 0.42 0.00 1.57 4.20 -0.50 -1.57 115.11 120.08 2d0h h GLN 461 Ca 0.11 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.80 2d0h h GLN 461 Cb 0.77 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.46 2d0h h GLN 461 CO 0.06 0.28 0.00 1.04 -0.67 0.00 0.00 178.83 179.54 2d0h n GLN 462 N -4.87 0.05 0.00 1.46 6.02 -0.57 -2.85 117.38 116.61 2d0h n GLN 462 Ca -0.01 0.30 0.06 0.00 -0.01 0.00 0.00 57.00 57.34 2d0h n GLN 462 Cb 0.03 -1.59 0.03 0.00 1.02 0.00 0.00 30.24 29.73 2d0h n GLN 462 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2d0h n SER 463 N -1.68 1.74 -4.76 1.08 7.64 -0.67 -3.70 113.62 113.27 2d0h n SER 463 Ca 0.03 -1.37 -0.39 0.00 1.01 0.00 0.00 58.87 58.14 2d0h n SER 463 Cb 0.18 0.19 0.02 0.00 -1.01 0.00 0.00 64.21 63.59 2d0h n SER 463 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2d0h s MET 464 N -1.22 3.56 -0.59 1.43 -1.94 -0.74 -4.52 119.30 115.27 2d0h s MET 464 Ca 0.12 2.37 -0.25 0.00 -1.71 0.00 0.00 55.69 56.23 2d0h s MET 464 Cb 0.10 -2.56 0.04 0.00 2.01 0.00 0.00 34.83 34.42 2d0h s MET 464 CO 0.21 -0.90 1.01 1.41 -0.01 0.00 0.00 175.02 176.75 2d0h s MET 465 N -2.56 3.30 -0.55 2.03 1.75 -0.94 -0.11 119.30 122.22 2d0h s MET 465 Ca 0.63 -0.30 -0.15 0.00 -1.25 0.00 0.00 55.69 54.62 2d0h s MET 465 Cb -0.43 -4.09 0.14 0.00 2.84 0.00 0.00 34.83 33.28 2d0h s MET 465 CO 0.54 -1.64 0.51 -0.80 -0.65 0.00 0.00 175.02 172.97 2d0h s ASN 466 N 3.11 6.19 0.10 1.11 0.01 -0.35 -1.64 114.94 123.48 2d0h s ASN 466 Ca 0.31 -1.86 0.09 0.00 -0.71 0.00 0.00 52.86 50.69 2d0h s ASN 466 Cb -0.12 -2.20 -0.04 0.00 0.41 0.00 0.00 41.25 39.30 2d0h s ASN 466 CO 0.18 -0.83 -0.20 0.72 -1.51 0.00 0.00 177.10 175.46 2d0h s PHE 467 N 1.48 2.48 0.13 2.20 -0.71 -1.26 -0.61 117.98 121.70 2d0h s PHE 467 Ca 0.04 -0.29 0.10 0.00 -1.04 0.00 0.00 56.93 55.74 2d0h s PHE 467 Cb -0.28 -1.35 0.05 0.00 -1.21 0.00 0.00 43.02 40.23 2d0h s PHE 467 CO 0.02 0.34 1.43 -0.07 -1.34 0.00 0.00 175.22 175.60 2d0h h LEU 468 N 3.95 0.00 -7.72 -1.99 3.38 -1.96 -3.37 115.31 107.60 2d0h h LEU 468 Ca -0.50 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.46 2d0h h LEU 468 Cb 1.16 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.82 2d0h h LEU 468 CO 0.45 0.79 0.05 -0.44 0.09 0.00 0.00 178.44 179.37 2d0h s SER 469 N -6.69 -0.26 0.24 -0.43 0.01 -1.26 -4.59 113.70 100.72 2d0h s SER 469 Ca 0.01 -0.50 -0.06 0.00 1.31 0.00 0.00 55.95 56.70 2d0h s SER 469 Cb 0.10 0.59 0.02 0.00 0.21 0.00 0.00 66.02 66.95 2d0h s SER 469 CO 0.78 -1.08 0.43 -0.46 0.41 0.00 0.00 173.24 173.32 2d0h n ASN 470 N -0.36 -1.22 0.00 2.44 6.94 -1.26 -4.42 115.26 117.38 2d0h n ASN 470 Ca -0.09 -2.13 0.04 0.00 -0.02 0.00 0.00 54.58 52.38 2d0h n ASN 470 Cb 0.62 2.12 0.17 0.00 -2.36 0.00 0.00 39.78 40.33 2d0h n ASN 470 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2d0h n HIS 471 N -0.36 0.00 0.48 -2.53 1.44 -1.26 -2.92 115.22 110.07 2d0h n HIS 471 Ca -0.03 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.74 2d0h n HIS 471 Cb 0.39 -0.44 0.06 0.00 0.12 0.00 0.00 29.99 30.12 2d0h n HIS 471 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 2d0h n ASP 472 N -1.44 2.10 -4.31 4.39 8.00 -1.26 -4.75 116.55 119.28 2d0h n ASP 472 Ca 0.02 -1.55 -0.18 0.00 0.71 0.00 0.00 54.79 53.79 2d0h n ASP 472 Cb 0.08 -0.01 -0.10 0.00 -0.02 0.00 0.00 41.12 41.07 2d0h n ASP 472 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2d0h s ILE 473 N -1.04 0.69 0.68 0.53 -4.36 -1.15 -4.79 121.20 111.76 2d0h s ILE 473 Ca 0.15 -2.00 -0.14 0.00 -0.26 0.00 0.00 60.65 58.40 2d0h s ILE 473 Cb 0.11 -2.65 0.01 0.00 1.25 0.00 0.00 42.46 41.17 2d0h s ILE 473 CO 0.16 0.00 1.12 0.42 0.24 0.00 0.00 174.94 176.87 2d0h s THR 474 N -3.61 3.16 0.44 8.37 -4.23 -1.03 -4.58 115.64 114.16 2d0h s THR 474 Ca 0.37 0.52 -0.23 0.00 -1.18 0.00 0.00 61.69 61.17 2d0h s THR 474 Cb 0.08 -3.04 -0.08 0.00 1.34 0.00 0.00 72.50 70.80 2d0h s THR 474 CO 0.14 -0.35 1.13 -0.13 -0.54 0.00 0.00 174.62 174.88 2d0h s ARG 475 N -4.17 3.87 0.18 3.99 1.81 -0.27 -4.72 118.95 119.65 2d0h s ARG 475 Ca 0.67 1.70 -0.13 0.00 -1.72 0.00 0.00 55.73 56.25 2d0h s ARG 475 Cb -0.21 -2.44 0.09 0.00 -0.45 0.00 0.00 34.95 31.94 2d0h s ARG 475 CO 0.43 -0.44 1.85 0.35 -0.68 0.00 0.00 175.30 176.81 2d0h h PHE 476 N 2.16 0.74 0.00 -0.53 3.57 -1.84 -1.52 116.94 119.53 2d0h h PHE 476 Ca -0.49 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.01 2d0h h PHE 476 Cb 1.24 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 39.73 2d0h h PHE 476 CO 0.55 0.47 -0.09 0.00 -2.23 0.00 0.00 178.31 177.00 2d0h h ALA 477 N 1.21 1.33 0.19 2.41 0.00 -1.86 0.19 119.26 122.72 2d0h h ALA 477 Ca 0.22 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.80 2d0h h ALA 477 Cb -0.09 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 17.71 2d0h h ALA 477 CO -0.05 0.12 -1.06 1.15 0.00 0.00 0.00 179.25 179.40 2d0h h THR 478 N 0.00 1.43 0.00 0.00 2.02 -1.66 -0.79 112.91 113.91 2d0h h THR 478 Ca -0.00 -2.60 -0.03 0.00 0.77 0.00 0.00 66.41 64.55 2d0h h THR 478 Cb 0.26 3.15 -0.00 0.00 -1.74 0.00 0.00 68.15 69.82 2d0h h THR 478 CO 0.01 0.75 -0.13 0.03 0.37 0.00 0.00 175.52 176.56 2d0h h ARG 479 N -0.18 0.00 -0.00 6.66 3.08 -0.57 -1.08 114.38 122.30 2d0h h ARG 479 Ca -0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.86 2d0h h ARG 479 Cb 1.84 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.89 2d0h h ARG 479 CO 0.20 0.13 -0.06 0.43 -1.07 0.00 0.00 179.97 179.60 2d0h n SER 480 N -4.15 0.17 -1.10 7.04 7.64 0.59 -4.83 113.62 118.98 2d0h n SER 480 Ca -0.02 -0.22 -0.12 0.00 1.01 0.00 0.00 58.87 59.51 2d0h n SER 480 Cb 0.21 -0.21 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 2d0h n SER 480 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d0h n GLY 481 N 1.32 0.85 1.67 0.23 0.00 -0.41 -2.40 105.19 106.44 2d0h n GLY 481 Ca 0.13 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2d0h n GLY 481 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d0h n GLY 482 N -1.31 0.72 3.55 -0.02 0.00 -0.32 -4.98 105.19 102.83 2d0h n GLY 482 Ca -0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 2d0h n GLY 482 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2d0h s ASP 483 N -2.36 6.14 0.47 1.61 3.68 -1.01 -4.85 116.67 120.35 2d0h s ASP 483 Ca 0.00 -0.76 0.14 0.00 2.13 0.00 0.00 52.55 54.06 2d0h s ASP 483 Cb 0.00 -2.56 1.11 0.00 -1.45 0.00 0.00 42.92 40.02 2d0h s ASP 483 CO 0.00 -1.83 2.08 0.25 0.13 0.00 0.00 175.17 175.81 2d0h h LEU 484 N 13.57 0.21 -1.55 -1.34 6.46 -1.94 -1.52 115.31 129.20 2d0h h LEU 484 Ca -0.08 -0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.63 2d0h h LEU 484 Cb 1.04 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.92 2d0h h LEU 484 CO 1.32 0.14 -0.20 -0.50 -0.62 0.00 0.00 178.44 178.59 2d0h h TRP 485 N 0.24 0.03 -0.17 1.25 4.06 -1.90 0.42 115.95 119.88 2d0h h TRP 485 Ca 0.11 -0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.03 2d0h h TRP 485 Cb 0.14 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 28.28 2d0h h TRP 485 CO -0.00 0.23 -0.03 0.87 -3.56 0.00 0.00 178.44 175.95 2d0h h LYS 486 N 0.03 0.25 -0.15 0.49 1.57 -1.56 0.68 116.57 117.88 2d0h h LYS 486 Ca 0.00 -0.04 -0.17 0.00 -1.87 0.00 0.00 60.65 58.58 2d0h h LYS 486 Cb 0.37 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2d0h h LYS 486 CO 0.03 0.31 -0.60 1.15 -0.57 0.00 0.00 179.45 179.77 2d0h h THR 487 N 0.25 1.33 0.23 -0.16 2.02 -1.00 -1.91 112.91 113.67 2d0h h THR 487 Ca 0.06 -1.88 0.01 0.00 0.77 0.00 0.00 66.41 65.37 2d0h h THR 487 Cb 0.23 1.86 -0.03 0.00 -1.74 0.00 0.00 68.15 68.47 2d0h h THR 487 CO 0.01 0.58 -0.32 1.88 0.37 0.00 0.00 175.52 178.04 2d0h h TYR 488 N 0.38 -0.87 -0.23 3.16 0.99 0.14 -0.40 116.97 120.14 2d0h h TYR 488 Ca -0.00 0.01 0.02 0.00 2.00 0.00 0.00 58.73 60.76 2d0h h TYR 488 Cb 1.14 0.35 -0.03 0.00 1.00 0.00 0.00 36.73 39.20 2d0h h TYR 488 CO 0.04 -0.44 0.07 1.25 -0.00 0.00 0.00 178.16 179.09 2d0h h LEU 489 N -0.61 0.08 -0.93 3.88 5.85 -1.15 -1.49 115.31 120.94 2d0h h LEU 489 Ca 0.00 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.84 2d0h h LEU 489 Cb 0.59 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.57 2d0h h LEU 489 CO -0.12 0.08 0.58 0.00 -0.34 0.00 0.00 178.44 178.63 2d0h h ALA 490 N 1.15 1.33 -0.37 1.25 0.00 -1.14 -0.70 119.26 120.78 2d0h h ALA 490 Ca 0.10 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2d0h h ALA 490 Cb 0.07 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2d0h h ALA 490 CO -0.11 0.26 -0.01 -0.07 0.00 0.00 0.00 179.25 179.32 2d0h h LEU 491 N 0.99 0.64 -0.09 0.00 3.38 -0.63 0.22 115.31 119.82 2d0h h LEU 491 Ca 0.43 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2d0h h LEU 491 Cb 0.31 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2d0h h LEU 491 CO -0.22 0.80 0.05 0.40 0.09 0.00 0.00 178.44 179.56 2d0h h ILE 492 N 0.47 1.07 0.16 1.22 2.04 -0.61 0.72 117.51 122.58 2d0h h ILE 492 Ca 0.10 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.77 2d0h h ILE 492 Cb 0.48 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2d0h h ILE 492 CO 0.02 0.06 -0.13 0.15 0.00 0.00 0.00 178.15 178.25 2d0h h PHE 493 N 0.07 -0.34 -0.44 1.37 3.57 -1.09 -2.67 116.94 117.40 2d0h h PHE 493 Ca 0.03 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.62 2d0h h PHE 493 Cb 0.06 0.13 -0.07 0.00 2.79 0.00 0.00 35.95 38.85 2d0h h PHE 493 CO -0.05 -0.21 -0.01 0.37 -2.23 0.00 0.00 178.31 176.18 2d0h h GLN 494 N -0.31 0.10 0.00 1.11 4.15 -0.75 -0.82 115.11 118.60 2d0h h GLN 494 Ca -0.01 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 2d0h h GLN 494 Cb 0.28 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 27.95 2d0h h GLN 494 CO -0.01 0.06 0.00 -1.33 -1.93 0.00 0.00 178.83 175.62 2d0h n MET 495 N -5.22 0.18 0.00 1.69 2.81 0.23 -3.09 117.12 113.72 2d0h n MET 495 Ca 0.04 0.14 0.00 0.00 -1.81 0.00 0.00 57.70 56.07 2d0h n MET 495 Cb 0.23 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.24 2d0h n MET 495 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2d0h n THR 496 N -1.35 0.57 -2.67 2.03 -2.24 -0.60 -4.67 114.28 105.35 2d0h n THR 496 Ca 0.07 -0.72 -0.17 0.00 -2.27 0.00 0.00 64.05 60.96 2d0h n THR 496 Cb 0.16 0.76 0.08 0.00 -2.10 0.00 0.00 70.33 69.23 2d0h n THR 496 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2d0h n TYR 497 N -0.28 -2.88 -3.11 4.78 9.36 -0.41 -4.95 117.16 119.66 2d0h n TYR 497 Ca 0.00 -1.44 -0.40 0.00 3.32 0.00 0.00 57.90 59.38 2d0h n TYR 497 Cb 0.19 -0.53 -0.06 0.00 -0.63 0.00 0.00 39.34 38.32 2d0h n TYR 497 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2d0h s VAL 498 N -2.19 5.03 0.00 2.97 1.01 -1.26 -4.77 120.40 121.19 2d0h s VAL 498 Ca 0.50 1.23 0.00 0.00 0.00 0.00 0.00 61.98 63.71 2d0h s VAL 498 Cb -0.03 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.39 2d0h s VAL 498 CO 0.33 0.15 0.00 0.61 0.00 0.00 0.00 175.10 176.19 2d0h n GLY 499 N 3.61 3.21 3.64 4.51 0.00 -1.18 -4.80 105.19 114.18 2d0h n GLY 499 Ca -0.02 -1.99 -0.43 0.00 0.00 0.00 0.00 46.02 43.59 2d0h n GLY 499 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d0h s THR 500 N -2.95 3.89 0.14 2.61 2.01 0.84 -4.87 115.64 117.31 2d0h s THR 500 Ca 0.00 1.02 -0.31 0.00 0.31 0.00 0.00 61.69 62.71 2d0h s THR 500 Cb 0.00 -3.85 -0.09 0.00 0.01 0.00 0.00 72.50 68.57 2d0h s THR 500 CO 0.00 -0.30 1.57 -2.84 -0.69 0.00 0.00 174.62 172.36 2d0h s PRO 501 N 4.32 4.22 -0.17 4.92 0.02 -1.26 -1.21 135.00 145.84 2d0h s PRO 501 Ca 0.65 2.33 0.00 0.00 0.02 0.00 0.00 61.00 64.00 2d0h s PRO 501 Cb -0.23 -3.27 0.04 0.00 0.02 0.00 0.00 34.50 31.06 2d0h s PRO 501 CO 0.26 -0.62 -0.09 0.99 -0.33 0.00 0.00 177.00 177.21 2d0h s THR 502 N 1.51 1.36 -0.32 0.99 2.01 0.22 -0.01 115.64 121.40 2d0h s THR 502 Ca 0.70 -0.74 -0.16 0.00 0.31 0.00 0.00 61.69 61.81 2d0h s THR 502 Cb -0.42 -1.45 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 2d0h s THR 502 CO 0.31 0.21 0.40 -0.63 -0.69 0.00 0.00 174.62 174.22 2d0h s ILE 503 N 1.53 5.14 -0.29 1.82 1.01 0.25 -4.08 121.20 126.58 2d0h s ILE 503 Ca 0.01 0.28 -0.29 0.00 0.00 0.00 0.00 60.65 60.66 2d0h s ILE 503 Cb -0.15 -3.81 0.01 0.00 0.01 0.00 0.00 42.46 38.52 2d0h s ILE 503 CO -0.08 -0.03 1.05 -0.47 0.00 0.00 0.00 174.94 175.40 2d0h s TYR 504 N 2.11 3.22 -0.20 3.97 5.04 -1.26 -0.19 117.35 130.04 2d0h s TYR 504 Ca 0.14 1.26 -0.26 0.00 -2.44 0.00 0.00 57.07 55.78 2d0h s TYR 504 Cb -0.16 -3.52 -0.12 0.00 0.35 0.00 0.00 41.96 38.51 2d0h s TYR 504 CO 0.11 -0.66 0.84 2.48 -1.34 0.00 0.00 175.55 176.98 2d0h n TYR 505 N 6.65 0.82 0.00 4.97 0.18 0.20 -1.13 117.16 128.84 2d0h n TYR 505 Ca 0.11 0.66 0.00 0.00 1.88 0.00 0.00 57.90 60.55 2d0h n TYR 505 Cb 0.47 -1.28 0.00 0.00 -0.38 0.00 0.00 39.34 38.15 2d0h n TYR 505 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2d0h n GLY 506 N 1.88 2.78 0.32 -7.48 0.00 -1.26 -4.90 105.19 96.53 2d0h n GLY 506 Ca 0.16 -0.57 0.15 0.00 0.00 0.00 0.00 46.02 45.76 2d0h n GLY 506 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2d0h h ASP 507 N 0.53 0.00 0.41 1.61 5.19 -1.43 -1.13 116.42 121.61 2d0h h ASP 507 Ca 0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 2d0h h ASP 507 Cb 0.00 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.51 2d0h h ASP 507 CO 0.00 0.00 -0.04 1.05 -3.12 0.00 0.00 179.24 177.13 2d0h h GLU 508 N 0.00 0.00 -0.02 3.56 9.09 -1.91 -2.73 114.58 122.57 2d0h h GLU 508 Ca 0.08 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.49 2d0h h GLU 508 Cb 0.36 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.46 2d0h h GLU 508 CO -0.00 0.04 0.00 2.48 0.05 0.00 0.00 179.01 181.57 2d0h n TYR 509 N -3.27 0.02 -0.33 2.06 0.18 -0.48 -1.93 117.16 113.40 2d0h n TYR 509 Ca -0.02 -0.02 0.00 0.00 1.88 0.00 0.00 57.90 59.74 2d0h n TYR 509 Cb 0.19 -0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.15 2d0h n TYR 509 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2d0h n GLY 510 N 0.44 1.07 3.69 -7.48 0.00 -1.03 -4.85 105.19 97.03 2d0h n GLY 510 Ca 0.05 -0.26 -0.44 0.00 0.00 0.00 0.00 46.02 45.37 2d0h n GLY 510 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2d0h n MET 511 N -1.87 2.16 -3.08 1.61 1.56 -0.86 -4.78 117.12 111.87 2d0h n MET 511 Ca 0.00 0.76 -0.19 0.00 -0.27 0.00 0.00 57.70 58.00 2d0h n MET 511 Cb 0.04 -2.41 0.05 0.00 2.15 0.00 0.00 33.22 33.05 2d0h n MET 511 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 2d0h s GLN 512 N -0.94 2.39 0.00 2.12 -0.21 -1.26 -4.23 119.66 117.52 2d0h s GLN 512 Ca 0.63 -1.60 0.00 0.00 0.02 0.00 0.00 55.36 54.41 2d0h s GLN 512 Cb -0.60 -2.64 0.00 0.00 1.00 0.00 0.00 33.01 30.77 2d0h s GLN 512 CO 0.54 -0.75 0.00 0.41 -2.12 0.00 0.00 175.29 173.37 2d0h n GLY 513 N -2.15 4.14 0.00 3.09 0.00 -1.26 -4.86 105.19 104.15 2d0h n GLY 513 Ca 0.14 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2d0h n GLY 513 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d0h n GLY 514 N -1.17 1.41 3.81 -0.02 0.00 -1.25 -1.11 105.19 106.87 2d0h n GLY 514 Ca 0.00 -1.65 -0.32 0.00 0.00 0.00 0.00 46.02 44.05 2d0h n GLY 514 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d0h s ALA 515 N -3.50 2.68 -0.05 4.61 0.00 -1.26 -2.84 121.76 121.41 2d0h s ALA 515 Ca 0.00 0.23 -0.32 0.00 0.00 0.00 0.00 51.96 51.87 2d0h s ALA 515 Cb 0.00 -3.21 -0.16 0.00 0.00 0.00 0.00 23.12 19.76 2d0h s ALA 515 CO 0.00 -1.07 0.89 -3.47 0.00 0.00 0.00 175.76 172.11 2d0h n ASP 516 N -2.66 0.10 -0.84 0.00 4.64 -1.26 -0.90 116.55 115.63 2d0h n ASP 516 Ca 0.08 0.92 0.10 0.00 -1.38 0.00 0.00 54.79 54.51 2d0h n ASP 516 Cb 0.53 -0.72 0.27 0.00 -1.04 0.00 0.00 41.12 40.16 2d0h n ASP 516 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 2d0h n PRO 517 N 1.41 2.08 0.00 -0.67 -0.04 -1.26 -4.91 135.00 131.61 2d0h n PRO 517 Ca 0.17 -1.64 0.06 0.00 -0.04 0.00 0.00 63.50 62.04 2d0h n PRO 517 Cb 0.05 -1.42 0.28 0.00 -0.04 0.00 0.00 33.50 32.37 2d0h n PRO 517 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2d0h n ASP 518 N 0.85 0.00 -0.65 3.54 2.03 -0.08 -1.45 116.55 120.79 2d0h n ASP 518 Ca 0.17 0.25 0.06 0.00 0.52 0.00 0.00 54.79 55.79 2d0h n ASP 518 Cb 0.43 -0.36 0.17 0.00 -0.72 0.00 0.00 41.12 40.64 2d0h n ASP 518 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2d0h n ASN 519 N -1.36 1.89 -2.42 1.67 0.23 -1.13 -3.78 115.26 110.36 2d0h n ASN 519 Ca 0.05 -1.99 -0.16 0.00 -0.53 0.00 0.00 54.58 51.95 2d0h n ASN 519 Cb 0.11 -0.23 0.03 0.00 -2.08 0.00 0.00 39.78 37.60 2d0h n ASN 519 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2d0h n ARG 520 N 0.53 2.73 -1.24 -3.83 1.74 -0.53 -4.76 116.66 111.30 2d0h n ARG 520 Ca 0.12 -3.93 -0.32 0.00 -0.77 0.00 0.00 57.85 52.96 2d0h n ARG 520 Cb 0.30 -1.95 0.10 0.00 -1.02 0.00 0.00 32.46 29.89 2d0h n ARG 520 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2d0h s ARG 521 N -3.59 2.06 0.33 5.56 0.52 -1.26 -4.87 118.95 117.71 2d0h s ARG 521 Ca 0.41 1.36 -0.28 0.00 -0.52 0.00 0.00 55.73 56.70 2d0h s ARG 521 Cb 0.39 -1.86 -0.10 0.00 0.52 0.00 0.00 34.95 33.90 2d0h s ARG 521 CO -0.02 -1.82 1.22 -1.54 0.02 0.00 0.00 175.30 173.15 2d0h s SER 522 N -2.92 6.86 -0.01 0.23 1.04 -1.26 -4.88 113.70 112.76 2d0h s SER 522 Ca 0.65 2.50 -0.30 0.00 0.48 0.00 0.00 55.95 59.28 2d0h s SER 522 Cb -0.20 -2.64 -0.05 0.00 0.10 0.00 0.00 66.02 63.23 2d0h s SER 522 CO 0.53 -0.45 1.42 0.12 0.98 0.00 0.00 173.24 175.83 2d0h s PHE 523 N -1.20 2.79 -0.83 5.02 2.19 -0.40 -4.82 117.98 120.74 2d0h s PHE 523 Ca 0.49 0.78 -0.22 0.00 0.33 0.00 0.00 56.93 58.31 2d0h s PHE 523 Cb -0.36 -3.68 0.08 0.00 -1.31 0.00 0.00 43.02 37.75 2d0h s PHE 523 CO 0.47 -2.53 1.18 0.34 1.83 0.00 0.00 175.22 176.51 2d0h s ASP 524 N 1.98 6.38 0.43 6.13 -1.08 -1.26 -4.89 116.67 124.35 2d0h s ASP 524 Ca 0.64 -1.30 0.30 0.00 -0.52 0.00 0.00 52.55 51.67 2d0h s ASP 524 Cb -0.31 -2.47 1.50 0.00 -1.46 0.00 0.00 42.92 40.17 2d0h s ASP 524 CO 0.26 -1.42 1.90 -0.50 0.52 0.00 0.00 175.17 175.93 2d0h h TRP 525 N 9.50 0.00 0.00 -5.34 4.06 -1.94 -1.51 115.95 120.72 2d0h h TRP 525 Ca -0.05 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.90 2d0h h TRP 525 Cb 1.04 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.20 2d0h h TRP 525 CO 1.13 0.00 0.00 -1.13 -3.56 0.00 0.00 178.44 174.88 2d0h n SER 526 N -2.57 0.00 0.00 -3.49 3.41 -1.26 -1.96 113.62 107.75 2d0h n SER 526 Ca -0.01 0.38 0.11 0.00 -0.26 0.00 0.00 58.87 59.09 2d0h n SER 526 Cb 0.11 -0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 63.60 2d0h n SER 526 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2d0h n GLN 527 N -1.45 0.07 -1.04 4.33 -0.06 -0.57 -4.65 117.38 114.01 2d0h n GLN 527 Ca 0.05 -0.01 -0.20 0.00 -2.00 0.00 0.00 57.00 54.85 2d0h n GLN 527 Cb 0.19 -1.51 -0.12 0.00 -4.06 0.00 0.00 30.24 24.74 2d0h n GLN 527 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2d0h n ALA 528 N -1.58 6.48 -2.75 1.69 0.00 -0.83 -4.55 120.51 118.98 2d0h n ALA 528 Ca 0.04 -2.26 -0.10 0.00 0.00 0.00 0.00 53.44 51.12 2d0h n ALA 528 Cb 0.36 -2.64 -0.06 0.00 0.00 0.00 0.00 19.45 17.10 2d0h n ALA 528 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2d0h s THR 529 N 1.49 0.11 0.49 0.00 -4.23 -1.26 -5.02 115.64 107.22 2d0h s THR 529 Ca 0.65 -0.93 0.23 0.00 -1.18 0.00 0.00 61.69 60.46 2d0h s THR 529 Cb 0.26 -1.24 0.23 0.00 1.34 0.00 0.00 72.50 73.09 2d0h s THR 529 CO -0.02 -0.51 1.69 -0.65 -0.54 0.00 0.00 174.62 174.59 2d0h h PRO 530 N 2.66 0.00 -0.24 3.99 0.11 -1.91 0.12 132.00 136.74 2d0h h PRO 530 Ca -0.34 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.83 2d0h h PRO 530 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2d0h h PRO 530 CO 0.52 0.00 0.17 0.77 -0.21 0.00 0.00 178.00 179.25 2d0h h SER 531 N 0.00 0.03 -3.32 -2.05 0.02 -1.95 -3.35 113.55 102.93 2d0h h SER 531 Ca 0.00 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.36 2d0h h SER 531 Cb 0.73 -0.01 -0.08 0.00 0.14 0.00 0.00 62.40 63.18 2d0h h SER 531 CO 0.00 0.02 0.56 0.21 -1.14 0.00 0.00 176.83 176.48 2d0h s ASN 532 N -6.70 6.83 0.51 3.07 3.84 0.43 -4.93 114.94 117.99 2d0h s ASN 532 Ca -0.05 0.95 0.16 0.00 0.21 0.00 0.00 52.86 54.13 2d0h s ASN 532 Cb 0.18 -2.46 1.24 0.00 -0.55 0.00 0.00 41.25 39.66 2d0h s ASN 532 CO 0.70 -0.65 2.11 0.77 -2.79 0.00 0.00 177.10 177.25 2d0h h SER 533 N 7.89 0.06 0.09 -4.21 4.64 -1.86 -1.62 113.55 118.55 2d0h h SER 533 Ca -0.22 -0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 60.90 2d0h h SER 533 Cb 1.08 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2d0h h SER 533 CO 0.92 0.04 -0.73 0.00 -0.87 0.00 0.00 176.83 176.19 2d0h h ALA 534 N 1.93 0.50 -0.47 5.18 0.00 -1.89 -1.63 119.26 122.88 2d0h h ALA 534 Ca 0.06 -0.60 -0.07 0.00 0.00 0.00 0.00 54.91 54.30 2d0h h ALA 534 Cb 0.16 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2d0h h ALA 534 CO -0.01 0.73 0.01 0.28 0.00 0.00 0.00 179.25 180.27 2d0h h VAL 535 N 0.38 1.26 -0.81 0.00 2.07 -0.71 -0.53 116.25 117.92 2d0h h VAL 535 Ca -0.04 -1.04 -0.04 0.00 0.82 0.00 0.00 66.70 66.40 2d0h h VAL 535 Cb 1.32 0.99 -0.04 0.00 -1.52 0.00 0.00 31.29 32.05 2d0h h VAL 535 CO 0.14 0.36 0.33 0.00 0.02 0.00 0.00 177.57 178.42 2d0h h ALA 536 N 0.93 1.05 -0.27 1.67 0.00 -1.23 -1.77 119.26 119.64 2d0h h ALA 536 Ca 0.14 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2d0h h ALA 536 Cb 0.49 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2d0h h ALA 536 CO 0.02 0.66 -0.11 1.25 0.00 0.00 0.00 179.25 181.08 2d0h h LEU 537 N 1.17 0.56 -0.40 0.00 5.85 -1.11 -2.84 115.31 118.54 2d0h h LEU 537 Ca 0.27 -0.40 0.07 0.00 0.84 0.00 0.00 57.88 58.67 2d0h h LEU 537 Cb 0.20 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.02 2d0h h LEU 537 CO -0.02 0.83 0.02 0.74 -0.34 0.00 0.00 178.44 179.67 2d0h h THR 538 N 0.29 0.72 -0.65 1.05 2.02 -0.82 0.65 112.91 116.17 2d0h h THR 538 Ca 0.06 -0.05 0.06 0.00 0.77 0.00 0.00 66.41 67.26 2d0h h THR 538 Cb 0.61 0.58 -0.05 0.00 -1.74 0.00 0.00 68.15 67.54 2d0h h THR 538 CO 0.04 0.02 0.35 -0.61 0.37 0.00 0.00 175.52 175.69 2d0h h GLN 539 N 0.13 0.63 -0.32 6.66 4.15 -1.29 -1.30 115.11 123.77 2d0h h GLN 539 Ca 0.20 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.52 2d0h h GLN 539 Cb 0.27 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 2d0h h GLN 539 CO -0.31 0.42 -0.01 -0.22 -1.93 0.00 0.00 178.83 176.78 2d0h h LYS 540 N 0.65 0.57 -0.64 1.69 1.63 -1.10 -2.87 116.57 116.50 2d0h h LYS 540 Ca 0.29 -0.18 -0.06 0.00 -0.85 0.00 0.00 60.65 59.85 2d0h h LYS 540 Cb 0.19 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.75 2d0h h LYS 540 CO -0.19 0.71 0.15 -0.07 -3.45 0.00 0.00 179.45 176.60 2d0h h LEU 541 N 0.37 0.95 -0.75 5.20 3.38 -0.52 -2.12 115.31 121.81 2d0h h LEU 541 Ca 0.09 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 2d0h h LEU 541 Cb 0.45 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2d0h h LEU 541 CO 0.02 0.92 0.25 0.40 0.09 0.00 0.00 178.44 180.12 2d0h h ILE 542 N 0.96 1.26 -0.62 1.22 2.04 -1.26 -0.94 117.51 120.18 2d0h h ILE 542 Ca 0.20 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 65.15 2d0h h ILE 542 Cb 0.35 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 2d0h h ILE 542 CO 0.00 0.35 0.26 0.74 0.00 0.00 0.00 178.15 179.50 2d0h h THR 543 N 1.11 1.21 -0.21 -0.27 2.02 -1.26 -0.31 112.91 115.21 2d0h h THR 543 Ca 0.24 -0.65 -0.05 0.00 0.77 0.00 0.00 66.41 66.72 2d0h h THR 543 Cb 0.28 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 2d0h h THR 543 CO -0.01 0.26 -0.08 0.40 0.37 0.00 0.00 175.52 176.46 2d0h h ILE 544 N 0.88 1.30 -0.45 3.11 2.04 -0.70 -2.36 117.51 121.34 2d0h h ILE 544 Ca 0.21 -1.12 -0.10 0.00 1.00 0.00 0.00 64.86 64.85 2d0h h ILE 544 Cb 0.15 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 2d0h h ILE 544 CO -0.02 0.34 -0.14 -0.09 0.00 0.00 0.00 178.15 178.24 2d0h h ARG 545 N 0.13 0.84 0.00 2.37 2.43 -0.98 -1.62 114.38 117.55 2d0h h ARG 545 Ca 0.05 -0.30 -0.01 0.00 -0.81 0.00 0.00 59.98 58.91 2d0h h ARG 545 Cb 0.56 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.05 2d0h h ARG 545 CO 0.03 0.93 -0.05 -0.91 -1.51 0.00 0.00 179.97 178.46 2d0h h ASN 546 N 0.75 0.00 0.69 -3.80 -0.26 -1.02 -2.91 115.58 109.02 2d0h h ASN 546 Ca 0.12 0.00 -0.26 0.00 -0.56 0.00 0.00 56.30 55.60 2d0h h ASN 546 Cb 0.65 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.88 2d0h h ASN 546 CO 0.05 0.05 -1.36 -0.61 -1.06 0.00 0.00 177.43 174.49 2d0h h GLN 547 N 0.00 0.08 -4.76 0.81 4.15 -0.75 -3.45 115.11 111.19 2d0h h GLN 547 Ca -0.00 -0.14 -0.68 0.00 0.77 0.00 0.00 58.65 58.60 2d0h h GLN 547 Cb 0.22 0.05 -0.34 0.00 0.21 0.00 0.00 27.48 27.62 2d0h h GLN 547 CO 0.01 0.90 -0.71 0.71 -1.93 0.00 0.00 178.83 177.81 2d0h s TYR 548 N -2.65 3.33 0.54 3.99 1.51 -0.92 -4.96 117.35 118.19 2d0h s TYR 548 Ca -0.04 -2.09 0.22 0.00 -1.01 0.00 0.00 57.07 54.15 2d0h s TYR 548 Cb 0.08 -2.23 1.40 0.00 -0.11 0.00 0.00 41.96 41.10 2d0h s TYR 548 CO 0.83 -0.85 2.08 -1.35 -1.11 0.00 0.00 175.55 175.16 2d0h h PRO 549 N 7.93 0.00 -0.22 -1.71 0.11 -1.87 -1.62 132.00 134.62 2d0h h PRO 549 Ca -0.19 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.97 2d0h h PRO 549 Cb 1.05 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2d0h h PRO 549 CO 0.53 0.00 0.15 0.00 -0.21 0.00 0.00 178.00 178.47 2d0h h ALA 550 N 1.85 2.10 0.00 -0.75 0.00 -1.93 0.11 119.26 120.64 2d0h h ALA 550 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2d0h h ALA 550 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2d0h h ALA 550 CO -0.00 -0.15 0.00 -0.07 0.00 0.00 0.00 179.25 179.03 2d0h h LEU 551 N 0.09 0.00 0.00 0.00 3.38 -1.62 -0.66 115.31 116.50 2d0h h LEU 551 Ca 0.10 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.68 2d0h h LEU 551 Cb 0.28 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.97 2d0h h LEU 551 CO -0.01 0.00 -2.45 0.54 0.09 0.00 0.00 178.44 176.61 2d0h n ARG 552 N -3.00 0.66 -0.12 1.13 3.00 -0.32 -4.62 116.66 113.39 2d0h n ARG 552 Ca 0.03 0.13 0.01 0.00 -0.01 0.00 0.00 57.85 58.02 2d0h n ARG 552 Cb 0.45 -1.53 0.01 0.00 0.00 0.00 0.00 32.46 31.39 2d0h n ARG 552 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2d0h n THR 553 N -3.20 0.41 -2.12 0.55 -2.24 0.22 -4.71 114.28 103.20 2d0h n THR 553 Ca -0.44 -0.45 -0.27 0.00 -2.27 0.00 0.00 64.05 60.62 2d0h n THR 553 Cb 1.01 0.65 0.11 0.00 -2.10 0.00 0.00 70.33 70.01 2d0h n THR 553 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2d0h s GLY 554 N -0.75 1.71 0.92 3.38 0.00 -0.25 -4.37 107.32 107.96 2d0h s GLY 554 Ca 0.03 -1.07 -0.12 0.00 0.00 0.00 0.00 44.72 43.56 2d0h s GLY 554 CO 0.00 -0.52 1.10 -0.56 0.00 0.00 0.00 173.10 173.12 2d0h s SER 555 N -4.68 3.29 -0.09 1.64 0.01 -0.06 -4.72 113.70 109.11 2d0h s SER 555 Ca 0.66 1.32 0.00 0.00 1.31 0.00 0.00 55.95 59.24 2d0h s SER 555 Cb -0.08 -2.00 0.02 0.00 0.21 0.00 0.00 66.02 64.18 2d0h s SER 555 CO 0.48 -2.73 -0.07 0.12 0.41 0.00 0.00 173.24 171.45 2d0h s PHE 556 N -3.00 1.26 -0.06 2.43 2.19 -1.26 -2.74 117.98 116.80 2d0h s PHE 556 Ca 0.64 -0.53 0.01 0.00 0.33 0.00 0.00 56.93 57.37 2d0h s PHE 556 Cb -0.17 -1.05 0.02 0.00 -1.31 0.00 0.00 43.02 40.51 2d0h s PHE 556 CO 0.57 -0.38 -0.05 1.41 1.83 0.00 0.00 175.22 178.59 2d0h s MET 557 N 1.37 0.99 0.08 10.12 1.75 -0.46 -4.97 119.30 128.18 2d0h s MET 557 Ca -0.02 -0.14 -0.31 0.00 -1.25 0.00 0.00 55.69 53.97 2d0h s MET 557 Cb -0.14 -1.00 -0.06 0.00 2.84 0.00 0.00 34.83 36.48 2d0h s MET 557 CO -0.04 -0.10 1.21 0.99 -0.65 0.00 0.00 175.02 176.42 2d0h s THR 558 N 1.06 3.95 -0.11 10.11 2.01 -1.26 0.31 115.64 131.71 2d0h s THR 558 Ca -0.09 1.42 -0.01 0.00 0.31 0.00 0.00 61.69 63.33 2d0h s THR 558 Cb -0.14 -3.91 -0.06 0.00 0.01 0.00 0.00 72.50 68.39 2d0h s THR 558 CO -0.01 0.12 -0.11 0.18 -0.69 0.00 0.00 174.62 174.12 2d0h n LEU 559 N 3.77 2.40 -3.75 4.42 4.77 0.55 -4.89 117.00 124.26 2d0h n LEU 559 Ca 0.09 -0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.92 2d0h n LEU 559 Cb 0.46 -0.37 -0.15 0.00 -2.33 0.00 0.00 43.42 41.03 2d0h n LEU 559 CO 0.56 0.56 -0.28 -0.63 -1.33 0.00 0.00 177.39 176.27 2d0h s ILE 560 N -2.21 -0.06 -0.45 -0.08 1.01 -0.11 -4.92 121.20 114.38 2d0h s ILE 560 Ca -0.15 0.20 0.03 0.00 0.00 0.00 0.00 60.65 60.73 2d0h s ILE 560 Cb 0.04 -0.18 0.16 0.00 0.01 0.00 0.00 42.46 42.49 2d0h s ILE 560 CO 0.24 0.08 0.31 0.42 0.00 0.00 0.00 174.94 175.99 2d0h s THR 561 N 1.17 0.93 -0.43 2.92 -4.23 -1.26 -0.66 115.64 114.08 2d0h s THR 561 Ca -0.09 -2.67 -0.10 0.00 -1.18 0.00 0.00 61.69 57.65 2d0h s THR 561 Cb -0.12 -1.64 0.08 0.00 1.34 0.00 0.00 72.50 72.16 2d0h s THR 561 CO -0.05 -1.07 0.29 -0.62 -0.54 0.00 0.00 174.62 172.63 2d0h s ASP 562 N 0.12 5.70 0.13 3.99 3.68 -0.45 -4.78 116.67 125.06 2d0h s ASP 562 Ca 0.25 -1.55 0.27 0.00 2.13 0.00 0.00 52.55 53.65 2d0h s ASP 562 Cb -0.10 -2.01 0.97 0.00 -1.45 0.00 0.00 42.92 40.33 2d0h s ASP 562 CO -0.10 -0.58 1.83 0.47 0.13 0.00 0.00 175.17 176.92 2d0h n ASP 563 N 4.95 0.51 -0.04 -0.34 8.00 -1.26 -1.14 116.55 127.22 2d0h n ASP 563 Ca -0.10 0.55 -0.14 0.00 0.71 0.00 0.00 54.79 55.81 2d0h n ASP 563 Cb 0.43 -0.68 -0.12 0.00 -0.02 0.00 0.00 41.12 40.73 2d0h n ASP 563 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2d0h h THR 564 N 0.00 1.60 -0.22 -3.53 2.02 -1.96 -3.35 112.91 107.47 2d0h h THR 564 Ca 0.00 -1.85 0.00 0.00 0.77 0.00 0.00 66.41 65.33 2d0h h THR 564 Cb 0.64 2.84 0.00 0.00 -1.74 0.00 0.00 68.15 69.89 2d0h h THR 564 CO 0.00 0.49 0.00 0.59 0.37 0.00 0.00 175.52 176.97 2d0h n ASN 565 N -4.66 3.25 -3.32 4.18 3.02 -1.24 -4.97 115.26 111.52 2d0h n ASN 565 Ca -0.09 -2.00 -0.22 0.00 -0.03 0.00 0.00 54.58 52.24 2d0h n ASN 565 Cb 0.41 -0.13 0.07 0.00 -0.61 0.00 0.00 39.78 39.52 2d0h n ASN 565 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2d0h n LYS 566 N 1.43 -7.22 -3.86 3.52 4.76 -0.30 -4.75 118.16 111.75 2d0h n LYS 566 Ca 0.17 0.76 -0.35 0.00 -2.87 0.00 0.00 58.31 56.02 2d0h n LYS 566 Cb 0.60 -5.60 -0.09 0.00 -1.84 0.00 0.00 35.03 28.10 2d0h n LYS 566 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2d0h s ILE 567 N -3.29 5.05 -0.17 -0.18 -1.09 -0.44 -1.09 121.20 119.99 2d0h s ILE 567 Ca 0.53 0.06 0.00 0.00 -2.23 0.00 0.00 60.65 59.01 2d0h s ILE 567 Cb -0.23 -3.30 0.03 0.00 -1.58 0.00 0.00 42.46 37.38 2d0h s ILE 567 CO 0.66 0.43 -0.10 -0.47 -1.23 0.00 0.00 174.94 174.22 2d0h s TYR 568 N 0.51 2.11 -0.02 3.97 6.04 -0.49 -1.34 117.35 128.13 2d0h s TYR 568 Ca 0.05 -1.29 0.04 0.00 0.04 0.00 0.00 57.07 55.92 2d0h s TYR 568 Cb -0.12 -1.53 -0.01 0.00 -1.04 0.00 0.00 41.96 39.26 2d0h s TYR 568 CO 0.00 -0.67 -0.15 0.45 -1.54 0.00 0.00 175.55 173.64 2d0h s SER 569 N 1.50 1.83 0.02 4.32 0.15 0.16 -0.62 113.70 121.06 2d0h s SER 569 Ca 0.02 -0.29 -0.12 0.00 0.70 0.00 0.00 55.95 56.26 2d0h s SER 569 Cb -0.15 -0.31 0.01 0.00 -1.71 0.00 0.00 66.02 63.87 2d0h s SER 569 CO -0.09 0.17 0.26 -0.72 1.20 0.00 0.00 173.24 174.05 2d0h s TYR 570 N -0.21 -0.06 0.04 3.44 1.13 -0.76 -0.33 117.35 120.60 2d0h s TYR 570 Ca 0.03 -0.04 0.02 0.00 -1.41 0.00 0.00 57.07 55.67 2d0h s TYR 570 Cb -0.08 0.04 -0.04 0.00 -1.10 0.00 0.00 41.96 40.79 2d0h s TYR 570 CO 0.00 -0.43 0.03 0.20 -2.51 0.00 0.00 175.55 172.84 2d0h s GLY 571 N -1.82 1.93 -0.10 5.49 0.00 0.15 -1.00 107.32 111.97 2d0h s GLY 571 Ca -0.08 -1.00 0.00 0.00 0.00 0.00 0.00 44.72 43.64 2d0h s GLY 571 CO -0.01 -0.92 -0.09 0.50 0.00 0.00 0.00 173.10 172.58 2d0h s ARG 572 N -1.95 1.59 0.04 2.90 1.81 -0.04 -1.35 118.95 121.94 2d0h s ARG 572 Ca 0.24 -0.30 -0.23 0.00 -1.72 0.00 0.00 55.73 53.72 2d0h s ARG 572 Cb -0.12 -1.56 0.05 0.00 -0.45 0.00 0.00 34.95 32.87 2d0h s ARG 572 CO 0.15 -0.20 0.54 -0.59 -0.68 0.00 0.00 175.30 174.52 2d0h s PHE 573 N 1.47 -0.45 0.00 -0.53 -0.12 -1.11 -0.90 117.98 116.34 2d0h s PHE 573 Ca 0.01 0.53 0.00 0.00 -0.05 0.00 0.00 56.93 57.42 2d0h s PHE 573 Cb -0.13 0.36 0.00 0.00 -0.63 0.00 0.00 43.02 42.62 2d0h s PHE 573 CO -0.06 -0.65 0.00 -0.40 -0.05 0.00 0.00 175.22 174.06 2d0h n ASP 574 N 0.42 0.37 0.27 1.98 5.68 -0.42 -0.88 116.55 123.97 2d0h n ASP 574 Ca -0.18 -0.31 0.14 0.00 -0.50 0.00 0.00 54.79 53.94 2d0h n ASP 574 Cb 0.60 0.00 0.77 0.00 -1.14 0.00 0.00 41.12 41.35 2d0h n ASP 574 CO 0.00 0.00 0.00 -1.13 -1.33 0.00 0.00 177.20 174.74 2d0h h ASN 575 N 0.00 0.00 0.00 -1.12 -1.24 -2.00 -3.34 115.58 107.88 2d0h h ASN 575 Ca 0.00 0.00 -0.28 0.00 0.71 0.00 0.00 56.30 56.73 2d0h h ASN 575 Cb 0.00 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.01 2d0h h ASN 575 CO 0.00 0.09 -1.92 0.52 -1.29 0.00 0.00 177.43 174.84 2d0h n VAL 576 N -3.52 1.44 -4.13 2.57 0.31 -1.26 -5.03 118.33 108.71 2d0h n VAL 576 Ca -0.02 -0.18 -0.31 0.00 -0.01 0.00 0.00 64.34 63.83 2d0h n VAL 576 Cb 0.23 -2.01 -0.08 0.00 -0.91 0.00 0.00 33.84 31.07 2d0h n VAL 576 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2d0h s ASN 577 N -6.83 5.16 -0.10 4.52 -0.87 -1.25 -5.01 114.94 110.55 2d0h s ASN 577 Ca -0.33 -0.11 0.00 0.00 -1.57 0.00 0.00 52.86 50.85 2d0h s ASN 577 Cb 0.10 -1.29 0.02 0.00 -0.02 0.00 0.00 41.25 40.07 2d0h s ASN 577 CO 0.44 0.19 -0.10 -0.13 -2.57 0.00 0.00 177.10 174.93 2d0h s ARG 578 N -2.22 1.64 -0.09 -0.60 0.52 -0.83 -1.30 118.95 116.06 2d0h s ARG 578 Ca 0.26 -0.33 0.01 0.00 -0.52 0.00 0.00 55.73 55.15 2d0h s ARG 578 Cb -0.12 -1.57 0.02 0.00 0.52 0.00 0.00 34.95 33.80 2d0h s ARG 578 CO 0.18 -0.17 -0.12 0.42 0.02 0.00 0.00 175.30 175.63 2d0h s ILE 579 N 1.35 1.25 -0.32 1.52 1.01 -0.08 -2.17 121.20 123.76 2d0h s ILE 579 Ca -0.01 -0.50 -0.06 0.00 0.00 0.00 0.00 60.65 60.08 2d0h s ILE 579 Cb -0.14 -1.17 0.03 0.00 0.01 0.00 0.00 42.46 41.20 2d0h s ILE 579 CO -0.05 0.39 0.08 0.00 0.00 0.00 0.00 174.94 175.37 2d0h s ALA 580 N 1.02 3.01 -0.11 9.38 0.00 0.68 -0.86 121.76 134.88 2d0h s ALA 580 Ca -0.07 -1.68 -0.18 0.00 0.00 0.00 0.00 51.96 50.04 2d0h s ALA 580 Cb -0.15 -2.19 -0.04 0.00 0.00 0.00 0.00 23.12 20.74 2d0h s ALA 580 CO -0.01 -1.23 0.46 0.08 0.00 0.00 0.00 175.76 175.06 2d0h s VAL 581 N 1.40 5.17 -0.24 0.00 1.01 -0.17 -1.52 120.40 126.06 2d0h s VAL 581 Ca -0.01 0.92 0.02 0.00 0.00 0.00 0.00 61.98 62.91 2d0h s VAL 581 Cb -0.19 -3.80 0.06 0.00 0.00 0.00 0.00 36.38 32.45 2d0h s VAL 581 CO 0.02 0.36 -0.09 -0.69 0.00 0.00 0.00 175.10 174.70 2d0h s VAL 582 N 0.43 1.81 0.10 2.92 1.01 -0.61 -1.83 120.40 124.23 2d0h s VAL 582 Ca 0.25 -1.35 0.05 0.00 0.00 0.00 0.00 61.98 60.94 2d0h s VAL 582 Cb -0.15 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 2d0h s VAL 582 CO 0.10 -0.02 -0.00 -0.76 0.00 0.00 0.00 175.10 174.42 2d0h s LEU 583 N 1.28 3.44 -0.17 3.92 1.43 0.21 -1.15 118.68 127.63 2d0h s LEU 583 Ca -0.06 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 2d0h s LEU 583 Cb -0.19 -2.16 0.04 0.00 0.03 0.00 0.00 46.19 43.90 2d0h s LEU 583 CO -0.06 0.17 -0.09 0.21 0.23 0.00 0.00 176.35 176.81 2d0h s ASN 584 N -2.37 2.93 0.00 2.29 3.84 -0.58 -1.40 114.94 119.65 2d0h s ASN 584 Ca 0.26 -0.67 0.00 0.00 0.21 0.00 0.00 52.86 52.66 2d0h s ASN 584 Cb -0.11 -1.05 0.00 0.00 -0.55 0.00 0.00 41.25 39.53 2d0h s ASN 584 CO 0.18 -0.14 0.00 -3.20 -2.79 0.00 0.00 177.10 171.15 2d0h n ASN 585 N 4.80 0.00 -4.15 -4.21 4.05 -0.25 -0.29 115.26 115.22 2d0h n ASN 585 Ca -0.14 0.00 -0.40 0.00 0.45 0.00 0.00 54.58 54.49 2d0h n ASN 585 Cb 0.48 0.00 -0.03 0.00 1.23 0.00 0.00 39.78 41.46 2d0h n ASN 585 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 177.26 173.31 2d0h n ASP 586 N 0.00 5.07 -3.49 1.20 5.75 -1.26 -0.95 116.55 122.87 2d0h n ASP 586 Ca 0.00 -3.16 -0.10 0.00 -0.01 0.00 0.00 54.79 51.53 2d0h n ASP 586 Cb 0.00 -1.20 -0.02 0.00 -1.03 0.00 0.00 41.12 38.87 2d0h n ASP 586 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2d0h s SER 587 N 0.06 -0.42 1.18 -1.12 0.15 -1.26 -4.93 113.70 107.36 2d0h s SER 587 Ca 0.30 0.03 -0.13 0.00 0.70 0.00 0.00 55.95 56.85 2d0h s SER 587 Cb -0.05 0.43 0.29 0.00 -1.71 0.00 0.00 66.02 64.98 2d0h s SER 587 CO -0.07 -0.69 1.03 0.68 1.20 0.00 0.00 173.24 175.39 2d0h s VAL 588 N -3.13 1.96 0.51 4.45 -7.23 -1.26 -3.50 120.40 112.20 2d0h s VAL 588 Ca 0.03 0.00 -0.22 0.00 -1.81 0.00 0.00 61.98 59.99 2d0h s VAL 588 Cb -0.01 -2.12 -0.08 0.00 0.56 0.00 0.00 36.38 34.73 2d0h s VAL 588 CO -0.09 0.00 1.03 -0.24 -0.31 0.00 0.00 175.10 175.49 2d0h n SER 589 N -4.91 1.25 -3.97 4.85 2.88 -1.26 -4.36 113.62 108.10 2d0h n SER 589 Ca 0.03 0.94 -0.11 0.00 -1.33 0.00 0.00 58.87 58.40 2d0h n SER 589 Cb 0.55 -1.40 -0.12 0.00 -0.75 0.00 0.00 64.21 62.50 2d0h n SER 589 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2d0h s HIS 590 N -1.38 0.29 -0.29 0.66 4.02 -0.75 -4.97 115.29 112.87 2d0h s HIS 590 Ca 0.69 -0.40 -0.10 0.00 1.02 0.00 0.00 55.06 56.26 2d0h s HIS 590 Cb -0.48 -0.20 -0.04 0.00 -1.02 0.00 0.00 32.58 30.85 2d0h s HIS 590 CO 0.52 -0.13 0.17 0.99 1.02 0.00 0.00 174.74 177.32 2d0h s THR 591 N -1.10 5.03 -0.10 1.30 2.01 -1.26 -1.20 115.64 120.32 2d0h s THR 591 Ca -0.11 -0.02 -0.01 0.00 0.31 0.00 0.00 61.69 61.86 2d0h s THR 591 Cb -0.08 -3.44 -0.03 0.00 0.01 0.00 0.00 72.50 68.97 2d0h s THR 591 CO -0.01 0.21 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.39 2d0h s VAL 592 N 1.71 3.83 -0.57 3.82 1.01 0.20 -4.93 120.40 125.47 2d0h s VAL 592 Ca 0.06 -0.41 -0.18 0.00 0.00 0.00 0.00 61.98 61.45 2d0h s VAL 592 Cb -0.16 -2.61 0.10 0.00 0.00 0.00 0.00 36.38 33.71 2d0h s VAL 592 CO 0.09 0.56 0.65 0.20 0.00 0.00 0.00 175.10 176.60 2d0h s ASN 593 N -0.39 6.19 -0.19 3.32 0.01 -1.26 -1.22 114.94 121.40 2d0h s ASN 593 Ca 0.06 -1.44 -0.27 0.00 -0.71 0.00 0.00 52.86 50.50 2d0h s ASN 593 Cb -0.12 -2.28 -0.01 0.00 0.41 0.00 0.00 41.25 39.25 2d0h s ASN 593 CO 0.02 -1.03 0.90 -0.69 -1.51 0.00 0.00 177.10 174.79 2d0h s VAL 594 N 2.45 4.81 -1.33 1.60 1.01 0.11 -4.89 120.40 124.16 2d0h s VAL 594 Ca 0.10 1.77 -0.14 0.00 0.00 0.00 0.00 61.98 63.70 2d0h s VAL 594 Cb -0.25 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 31.91 2d0h s VAL 594 CO 0.06 -0.04 2.30 -0.81 0.00 0.00 0.00 175.10 176.60 2d0h n PRO 595 N 5.60 2.71 0.02 2.72 -0.04 -1.26 -2.24 135.00 142.50 2d0h n PRO 595 Ca 0.07 -2.33 0.06 0.00 -0.04 0.00 0.00 63.50 61.26 2d0h n PRO 595 Cb 0.48 -3.09 0.24 0.00 -0.04 0.00 0.00 33.50 31.09 2d0h n PRO 595 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2d0h n VAL 596 N 4.95 1.28 0.24 0.52 0.24 -1.14 -2.00 118.33 122.42 2d0h n VAL 596 Ca 0.56 0.34 0.10 0.00 -2.04 0.00 0.00 64.34 63.30 2d0h n VAL 596 Cb 0.35 -1.19 0.61 0.00 -1.47 0.00 0.00 33.84 32.15 2d0h n VAL 596 CO 0.00 0.00 0.00 4.11 -2.14 0.00 0.00 176.83 178.80 2d0h h TRP 597 N 0.00 0.00 0.00 6.34 5.08 -1.72 -0.64 115.95 125.00 2d0h h TRP 597 Ca 0.00 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.95 2d0h h TRP 597 Cb 0.18 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.33 2d0h h TRP 597 CO 0.00 0.18 -0.09 1.96 -1.28 0.00 0.00 178.44 179.21 2d0h h GLN 598 N 0.00 0.00 -0.20 0.12 1.08 -1.71 -1.13 115.11 113.27 2d0h h GLN 598 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2d0h h GLN 598 Cb 0.44 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.87 2d0h h GLN 598 CO 0.02 0.09 0.00 1.28 -0.95 0.00 0.00 178.83 179.27 2d0h n LEU 599 N -3.35 2.86 -1.32 1.46 4.77 -0.28 -4.95 117.00 116.19 2d0h n LEU 599 Ca -0.01 -1.11 -0.12 0.00 -0.03 0.00 0.00 56.01 54.74 2d0h n LEU 599 Cb 0.27 -0.12 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 2d0h n LEU 599 CO 0.28 0.56 -0.15 -1.20 -1.33 0.00 0.00 177.39 175.55 2d0h n SER 600 N 1.15 -4.03 -4.66 -1.43 7.64 -0.43 -4.97 113.62 106.90 2d0h n SER 600 Ca 0.17 0.05 -0.43 0.00 1.01 0.00 0.00 58.87 59.67 2d0h n SER 600 Cb 0.54 -3.11 -0.02 0.00 -1.01 0.00 0.00 64.21 60.61 2d0h n SER 600 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2d0h s MET 601 N -4.30 4.23 0.41 1.43 -1.94 -1.01 -4.77 119.30 113.35 2d0h s MET 601 Ca 0.00 1.70 -0.26 0.00 -1.71 0.00 0.00 55.69 55.42 2d0h s MET 601 Cb 0.00 -3.78 -0.09 0.00 2.01 0.00 0.00 34.83 32.97 2d0h s MET 601 CO 0.00 -0.72 1.32 -2.14 -0.01 0.00 0.00 175.02 173.47 2d0h s PRO 602 N 3.54 3.92 0.35 2.03 0.02 -1.26 -4.55 135.00 139.05 2d0h s PRO 602 Ca 0.56 2.20 -0.28 0.00 0.02 0.00 0.00 61.00 63.49 2d0h s PRO 602 Cb -0.22 -2.73 -0.11 0.00 0.02 0.00 0.00 34.50 31.45 2d0h s PRO 602 CO 0.16 -0.55 1.46 -0.80 -0.33 0.00 0.00 177.00 176.94 2d0h s ASN 603 N -0.70 6.44 0.00 2.53 0.02 -1.26 -1.76 114.94 120.20 2d0h s ASN 603 Ca 0.58 2.96 0.00 0.00 -1.02 0.00 0.00 52.86 55.38 2d0h s ASN 603 Cb -0.39 -2.66 0.00 0.00 0.02 0.00 0.00 41.25 38.22 2d0h s ASN 603 CO 0.50 -0.81 0.00 0.61 0.02 0.00 0.00 177.10 177.42 2d0h n GLY 604 N 0.76 2.42 3.89 0.66 0.00 0.71 -4.99 105.19 108.63 2d0h n GLY 604 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 2d0h n GLY 604 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d0h s SER 605 N -1.77 5.46 0.15 1.61 1.04 -0.72 -4.74 113.70 114.72 2d0h s SER 605 Ca 0.00 1.08 0.09 0.00 0.48 0.00 0.00 55.95 57.60 2d0h s SER 605 Cb 0.00 -1.90 -0.04 0.00 0.10 0.00 0.00 66.02 64.18 2d0h s SER 605 CO 0.00 -1.31 -0.13 0.42 0.98 0.00 0.00 173.24 173.20 2d0h s THR 606 N -3.32 3.10 0.13 2.02 -4.23 -1.26 -0.68 115.64 111.39 2d0h s THR 606 Ca 0.58 -1.54 0.07 0.00 -1.18 0.00 0.00 61.69 59.61 2d0h s THR 606 Cb -0.11 -2.48 -0.04 0.00 1.34 0.00 0.00 72.50 71.21 2d0h s THR 606 CO 0.51 0.00 -0.15 0.68 -0.54 0.00 0.00 174.62 175.12 2d0h s VAL 607 N -1.43 1.45 -0.05 2.29 -7.23 -0.36 -4.71 120.40 110.36 2d0h s VAL 607 Ca 0.22 -1.71 0.02 0.00 -1.81 0.00 0.00 61.98 58.69 2d0h s VAL 607 Cb -0.10 -1.56 0.02 0.00 0.56 0.00 0.00 36.38 35.30 2d0h s VAL 607 CO 0.13 -0.35 -0.07 -0.89 -0.31 0.00 0.00 175.10 173.61 2d0h s THR 608 N -1.97 0.76 -0.52 5.32 2.01 -0.45 -0.54 115.64 120.26 2d0h s THR 608 Ca 0.09 -0.26 -0.28 0.00 0.31 0.00 0.00 61.69 61.55 2d0h s THR 608 Cb -0.06 -0.74 0.01 0.00 0.01 0.00 0.00 72.50 71.72 2d0h s THR 608 CO 0.04 0.27 1.50 -0.62 -0.69 0.00 0.00 174.62 175.12 2d0h s ASP 609 N 0.80 6.05 0.00 3.53 2.15 -0.07 -1.94 116.67 127.20 2d0h s ASP 609 Ca -0.13 0.48 0.03 0.00 0.43 0.00 0.00 52.55 53.36 2d0h s ASP 609 Cb -0.15 -2.54 0.12 0.00 -0.30 0.00 0.00 42.92 40.05 2d0h s ASP 609 CO 0.02 -1.73 1.07 0.29 -0.17 0.00 0.00 175.17 174.65 2d0h n LYS 610 N 8.59 0.00 -0.06 4.34 4.76 -0.67 0.28 118.16 135.40 2d0h n LYS 610 Ca 0.15 0.44 -0.22 0.00 -2.87 0.00 0.00 58.31 55.81 2d0h n LYS 610 Cb 0.49 -1.50 -0.12 0.00 -1.84 0.00 0.00 35.03 32.06 2d0h n LYS 610 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 2d0h n ILE 611 N -1.48 1.63 -0.08 -0.18 5.41 -1.26 -4.61 119.36 118.79 2d0h n ILE 611 Ca 0.01 -0.27 -0.08 0.00 1.00 0.00 0.00 62.75 63.40 2d0h n ILE 611 Cb 0.03 -1.92 -0.16 0.00 -0.71 0.00 0.00 39.64 36.88 2d0h n ILE 611 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2d0h n THR 612 N -4.07 1.33 -0.01 1.39 -2.24 -1.08 -5.00 114.28 104.61 2d0h n THR 612 Ca -0.33 -0.82 0.00 0.00 -2.27 0.00 0.00 64.05 60.63 2d0h n THR 612 Cb 0.83 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 2d0h n THR 612 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2d0h n GLY 613 N 1.68 0.29 3.75 3.38 0.00 0.14 -5.05 105.19 109.38 2d0h n GLY 613 Ca -0.28 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.33 2d0h n GLY 613 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2d0h s HIS 614 N -2.09 2.93 0.14 1.61 3.76 -1.25 -4.72 115.29 115.67 2d0h s HIS 614 Ca 0.00 1.07 0.05 0.00 -0.15 0.00 0.00 55.06 56.03 2d0h s HIS 614 Cb 0.00 -3.86 -0.04 0.00 1.11 0.00 0.00 32.58 29.79 2d0h s HIS 614 CO 0.00 -2.72 0.12 -1.12 -0.85 0.00 0.00 174.74 170.18 2d0h s SER 615 N 0.18 5.51 0.13 1.40 0.01 -1.26 -0.89 113.70 118.78 2d0h s SER 615 Ca 0.57 -0.10 -0.04 0.00 1.31 0.00 0.00 55.95 57.69 2d0h s SER 615 Cb -0.43 -1.44 -0.03 0.00 0.21 0.00 0.00 66.02 64.33 2d0h s SER 615 CO 0.48 0.09 0.11 -0.31 0.41 0.00 0.00 173.24 174.03 2d0h s TYR 616 N -1.66 0.64 -0.07 2.43 2.02 0.30 -4.99 117.35 116.01 2d0h s TYR 616 Ca 0.30 -1.04 0.05 0.00 -0.37 0.00 0.00 57.07 56.02 2d0h s TYR 616 Cb -0.11 -0.32 -0.01 0.00 -0.40 0.00 0.00 41.96 41.12 2d0h s TYR 616 CO 0.23 -0.55 -0.24 0.99 -1.57 0.00 0.00 175.55 174.40 2d0h s THR 617 N -4.00 2.01 -0.10 -0.71 2.01 -1.26 -1.22 115.64 112.38 2d0h s THR 617 Ca 0.18 -1.02 -0.30 0.00 0.31 0.00 0.00 61.69 60.87 2d0h s THR 617 Cb 0.06 -1.72 -0.04 0.00 0.01 0.00 0.00 72.50 70.82 2d0h s THR 617 CO -0.01 0.56 1.43 -0.69 -0.69 0.00 0.00 174.62 175.22 2d0h s VAL 618 N 0.07 3.94 -0.09 3.82 1.01 0.15 -4.75 120.40 124.55 2d0h s VAL 618 Ca -0.10 1.16 0.00 0.00 0.00 0.00 0.00 61.98 63.05 2d0h s VAL 618 Cb -0.15 -3.75 0.02 0.00 0.00 0.00 0.00 36.38 32.50 2d0h s VAL 618 CO 0.06 -0.09 -0.08 -1.10 0.00 0.00 0.00 175.10 173.89 2d0h s GLN 619 N 3.58 1.43 -1.43 2.72 -1.52 -0.32 -0.21 119.66 123.92 2d0h s GLN 619 Ca 0.63 -0.26 -0.07 0.00 -1.95 0.00 0.00 55.36 53.71 2d0h s GLN 619 Cb -0.27 -1.40 0.04 0.00 -0.22 0.00 0.00 33.01 31.16 2d0h s GLN 619 CO 0.22 -0.16 0.85 0.09 -0.25 0.00 0.00 175.29 176.04 2d0h n ASN 620 N 4.51 -3.13 -1.11 5.90 3.02 -1.26 -1.24 115.26 121.95 2d0h n ASN 620 Ca -0.17 -0.80 -0.14 0.00 -0.03 0.00 0.00 54.58 53.44 2d0h n ASN 620 Cb 0.51 -3.97 -0.06 0.00 -0.61 0.00 0.00 39.78 35.64 2d0h n ASN 620 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2d0h n GLY 621 N -1.66 1.50 3.19 7.41 0.00 -1.26 -4.99 105.19 109.37 2d0h n GLY 621 Ca -0.12 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.46 2d0h n GLY 621 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2d0h s MET 622 N -3.22 0.92 -0.05 1.61 -1.94 -0.37 -2.48 119.30 113.76 2d0h s MET 622 Ca 0.00 -1.40 0.00 0.00 -1.71 0.00 0.00 55.69 52.58 2d0h s MET 622 Cb 0.00 -0.17 0.02 0.00 2.01 0.00 0.00 34.83 36.69 2d0h s MET 622 CO 0.00 -0.07 -0.02 0.08 -0.01 0.00 0.00 175.02 174.99 2d0h s VAL 623 N -3.68 0.42 -0.31 -6.03 1.01 -0.95 -1.17 120.40 109.69 2d0h s VAL 623 Ca 0.16 -0.02 -0.08 0.00 0.00 0.00 0.00 61.98 62.04 2d0h s VAL 623 Cb 0.06 -0.49 0.01 0.00 0.00 0.00 0.00 36.38 35.96 2d0h s VAL 623 CO -0.02 0.21 0.12 -0.89 0.00 0.00 0.00 175.10 174.52 2d0h s THR 624 N 1.19 4.22 0.12 3.92 2.01 -1.26 0.06 115.64 125.89 2d0h s THR 624 Ca -0.07 -0.65 0.07 0.00 0.31 0.00 0.00 61.69 61.34 2d0h s THR 624 Cb -0.14 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 2d0h s THR 624 CO -0.02 0.03 -0.17 0.54 -0.69 0.00 0.00 174.62 174.31 2d0h s VAL 625 N 1.53 1.49 -0.19 3.82 0.11 -0.36 -4.93 120.40 121.87 2d0h s VAL 625 Ca 0.03 -1.64 -0.05 0.00 -2.93 0.00 0.00 61.98 57.38 2d0h s VAL 625 Cb -0.17 -1.52 -0.03 0.00 -1.53 0.00 0.00 36.38 33.13 2d0h s VAL 625 CO 0.04 -0.27 0.01 0.00 -3.33 0.00 0.00 175.10 171.55 2d0h s ALA 626 N -1.72 3.11 -0.11 1.54 0.00 -1.26 0.62 121.76 123.95 2d0h s ALA 626 Ca 0.08 -0.93 0.01 0.00 0.00 0.00 0.00 51.96 51.13 2d0h s ALA 626 Cb -0.07 -1.79 0.02 0.00 0.00 0.00 0.00 23.12 21.27 2d0h s ALA 626 CO 0.04 -0.05 -0.14 0.08 0.00 0.00 0.00 175.76 175.69 2d0h s VAL 627 N 0.82 1.40 0.81 0.00 1.01 -0.34 -4.98 120.40 119.11 2d0h s VAL 627 Ca 0.01 -0.58 -0.12 0.00 0.00 0.00 0.00 61.98 61.30 2d0h s VAL 627 Cb -0.14 -1.29 0.08 0.00 0.00 0.00 0.00 36.38 35.02 2d0h s VAL 627 CO 0.02 0.42 1.13 -0.62 0.00 0.00 0.00 175.10 176.05 2d0h s ASP 628 N 1.05 4.47 0.48 3.32 -1.08 -1.26 -1.82 116.67 121.83 2d0h s ASP 628 Ca -0.06 1.02 -0.24 0.00 -0.52 0.00 0.00 52.55 52.75 2d0h s ASP 628 Cb -0.15 -1.65 -0.08 0.00 -1.46 0.00 0.00 42.92 39.58 2d0h s ASP 628 CO -0.02 -1.95 1.39 0.61 0.52 0.00 0.00 175.17 175.72 2d0h n GLY 629 N -2.71 0.88 3.84 2.66 0.00 -1.23 -3.16 105.19 105.46 2d0h n GLY 629 Ca 0.07 0.14 -0.24 0.00 0.00 0.00 0.00 46.02 45.99 2d0h n GLY 629 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2d0h n HIS 630 N -0.46 -1.82 -3.56 1.61 8.25 0.61 -4.96 115.22 114.89 2d0h n HIS 630 Ca 0.07 0.80 -0.05 0.00 -0.26 0.00 0.00 57.72 58.28 2d0h n HIS 630 Cb 0.42 -4.05 -0.00 0.00 1.12 0.00 0.00 29.99 27.48 2d0h n HIS 630 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 2d0h n TYR 631 N -4.36 -1.25 -3.68 4.41 4.19 -1.03 -3.95 117.16 111.49 2d0h n TYR 631 Ca -0.27 -0.92 -0.06 0.00 3.31 0.00 0.00 57.90 59.96 2d0h n TYR 631 Cb 0.67 0.33 -0.02 0.00 0.49 0.00 0.00 39.34 40.80 2d0h n TYR 631 CO 0.00 0.00 0.00 0.20 0.91 0.00 0.00 176.86 177.97 2d0h s GLY 632 N -1.93 -0.30 0.09 2.98 0.00 -1.26 -1.53 107.32 105.38 2d0h s GLY 632 Ca 0.10 0.30 0.09 0.00 0.00 0.00 0.00 44.72 45.20 2d0h s GLY 632 CO 0.07 0.08 -0.23 0.00 0.00 0.00 0.00 173.10 173.02 2d0h s ALA 633 N -3.37 1.99 -0.59 3.20 0.00 -0.30 -4.97 121.76 117.72 2d0h s ALA 633 Ca 0.10 -1.27 0.04 0.00 0.00 0.00 0.00 51.96 50.83 2d0h s ALA 633 Cb -0.02 -0.32 0.15 0.00 0.00 0.00 0.00 23.12 22.92 2d0h s ALA 633 CO -0.01 0.43 0.36 0.08 0.00 0.00 0.00 175.76 176.62 2d0h s VAL 634 N -1.03 2.67 -0.52 0.00 1.01 -1.26 -1.58 120.40 119.69 2d0h s VAL 634 Ca 0.09 -3.69 -0.29 0.00 0.00 0.00 0.00 61.98 58.09 2d0h s VAL 634 Cb -0.10 -2.81 0.03 0.00 0.00 0.00 0.00 36.38 33.50 2d0h s VAL 634 CO 0.04 -0.89 1.21 -0.76 0.00 0.00 0.00 175.10 174.70 2d0h s LEU 635 N -0.75 3.53 0.15 3.92 1.43 -0.57 -1.67 118.68 124.71 2d0h s LEU 635 Ca 0.20 0.32 0.07 0.00 -1.03 0.00 0.00 54.13 53.69 2d0h s LEU 635 Cb -0.17 -3.35 -0.04 0.00 0.03 0.00 0.00 46.19 42.66 2d0h s LEU 635 CO -0.07 -1.41 -0.15 0.00 0.23 0.00 0.00 176.35 174.96 2d0h s ALA 636 N 4.88 1.72 0.00 4.21 0.00 -0.82 -0.23 121.76 131.52 2d0h s ALA 636 Ca 0.47 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 51.00 2d0h s ALA 636 Cb -0.08 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 22.94 2d0h s ALA 636 CO 0.29 0.11 0.00 0.00 0.00 0.00 0.00 175.76 176.16