#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j0j s ARG 2 N 0.00 3.16 0.20 0.03 0.52 -1.26 -4.92 118.95 116.68 1j0j s ARG 2 Ca 0.00 -0.81 -0.10 0.00 -0.52 0.00 0.00 55.73 54.30 1j0j s ARG 2 Cb 0.00 -4.14 0.18 0.00 0.52 0.00 0.00 34.95 31.51 1j0j s ARG 2 CO 0.00 -1.44 1.85 0.87 0.02 0.00 0.00 175.30 176.60 1j0j h LYS 3 N 9.20 0.81 0.00 3.54 1.57 -2.03 -2.27 116.57 127.38 1j0j h LYS 3 Ca -0.28 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 1j0j h LYS 3 Cb 1.08 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.21 1j0j h LYS 3 CO 1.05 0.54 0.07 -0.85 -0.57 0.00 0.00 179.45 179.69 1j0j n GLU 4 N -4.68 0.11 0.00 3.15 0.00 -1.26 -0.63 120.64 117.33 1j0j n GLU 4 Ca 0.07 0.60 0.10 0.00 0.00 0.00 0.00 57.16 57.93 1j0j n GLU 4 Cb 0.08 -1.93 -0.08 0.00 0.00 0.00 0.00 31.44 29.51 1j0j n GLU 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1j0j n ALA 5 N -1.69 4.34 -2.65 -1.84 0.00 -0.86 -4.90 120.51 112.91 1j0j n ALA 5 Ca -0.01 -0.56 -0.40 0.00 0.00 0.00 0.00 53.44 52.47 1j0j n ALA 5 Cb 0.10 -0.81 -0.04 0.00 0.00 0.00 0.00 19.45 18.69 1j0j n ALA 5 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1j0j s ILE 6 N -3.07 4.96 -0.17 0.00 1.01 0.20 -3.99 121.20 120.14 1j0j s ILE 6 Ca 0.06 1.57 -0.19 0.00 0.00 0.00 0.00 60.65 62.09 1j0j s ILE 6 Cb 0.16 -4.09 0.05 0.00 0.01 0.00 0.00 42.46 38.58 1j0j s ILE 6 CO 0.85 0.26 0.52 -0.47 0.00 0.00 0.00 174.94 176.10 1j0j s TYR 7 N 0.65 -0.55 -0.28 3.97 5.04 -0.68 -5.01 117.35 120.50 1j0j s TYR 7 Ca 0.40 1.28 -0.20 0.00 -2.44 0.00 0.00 57.07 56.11 1j0j s TYR 7 Cb -0.19 0.20 0.10 0.00 0.35 0.00 0.00 41.96 42.42 1j0j s TYR 7 CO 0.20 -0.31 0.80 -1.58 -1.34 0.00 0.00 175.55 173.32 1j0j s HIS 8 N 0.01 -0.81 -0.07 4.97 5.65 -1.26 -2.46 115.29 121.31 1j0j s HIS 8 Ca -0.02 1.75 -0.03 0.00 0.25 0.00 0.00 55.06 57.01 1j0j s HIS 8 Cb -0.03 0.45 0.04 0.00 -1.18 0.00 0.00 32.58 31.85 1j0j s HIS 8 CO 0.02 -0.40 0.15 0.50 -0.65 0.00 0.00 174.74 174.36 1j0j s ARG 9 N 1.05 0.07 0.00 2.88 3.52 -1.26 -5.03 118.95 120.17 1j0j s ARG 9 Ca -0.05 0.44 0.00 0.00 -0.13 0.00 0.00 55.73 55.99 1j0j s ARG 9 Cb -0.05 -0.22 0.00 0.00 -1.56 0.00 0.00 34.95 33.13 1j0j s ARG 9 CO -0.12 -0.22 0.11 -2.30 -0.81 0.00 0.00 175.30 171.96 1j0j n PRO 10 N 4.64 0.00 -3.95 5.12 -0.02 -1.26 -4.37 135.00 135.16 1j0j n PRO 10 Ca -0.18 -0.04 0.01 0.00 -2.02 0.00 0.00 63.50 61.27 1j0j n PRO 10 Cb 0.51 -0.90 0.01 0.00 -0.02 0.00 0.00 33.50 33.11 1j0j n PRO 10 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1j0j s ALA 11 N 1.02 -2.24 0.00 3.55 0.00 -1.25 -4.82 121.76 118.01 1j0j s ALA 11 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 51.91 1j0j s ALA 11 Cb 0.00 0.85 0.00 0.00 0.00 0.00 0.00 23.12 23.97 1j0j s ALA 11 CO 0.00 -1.13 0.00 -0.25 0.00 0.00 0.00 175.76 174.38 1j0j n ASP 12 N -1.10 0.00 0.14 0.00 8.00 -1.25 -0.42 116.55 121.93 1j0j n ASP 12 Ca 0.02 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.64 1j0j n ASP 12 Cb 0.59 0.00 0.51 0.00 -0.02 0.00 0.00 41.12 42.20 1j0j n ASP 12 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1j0j n ASN 13 N 1.28 0.71 -0.00 -2.24 6.94 -1.26 -3.29 115.26 117.39 1j0j n ASN 13 Ca 0.00 0.68 -0.08 0.00 -0.02 0.00 0.00 54.58 55.16 1j0j n ASN 13 Cb 0.00 -0.83 -0.14 0.00 -2.36 0.00 0.00 39.78 36.46 1j0j n ASN 13 CO 0.00 0.00 0.00 -0.26 -1.03 0.00 0.00 177.26 175.97 1j0j h PHE 14 N 0.00 0.01 -2.73 -2.53 -1.00 -0.97 -3.43 116.94 106.30 1j0j h PHE 14 Ca 0.00 -0.01 -0.17 0.00 2.81 0.00 0.00 57.97 60.60 1j0j h PHE 14 Cb 0.35 -0.00 -0.30 0.00 3.61 0.00 0.00 35.95 39.61 1j0j h PHE 14 CO 0.00 1.01 -0.47 0.00 -1.61 0.00 0.00 178.31 177.24 1j0j s ALA 15 N -2.62 -0.79 0.10 2.45 0.00 -0.90 -1.00 121.76 119.00 1j0j s ALA 15 Ca -0.04 1.16 -0.23 0.00 0.00 0.00 0.00 51.96 52.85 1j0j s ALA 15 Cb 0.08 -1.13 0.06 0.00 0.00 0.00 0.00 23.12 22.13 1j0j s ALA 15 CO 0.82 -0.68 0.56 1.52 0.00 0.00 0.00 175.76 177.99 1j0j s TYR 16 N 2.48 -0.48 -0.07 0.00 -0.85 -1.02 -3.81 117.35 113.60 1j0j s TYR 16 Ca -0.00 0.41 -0.24 0.00 -0.52 0.00 0.00 57.07 56.72 1j0j s TYR 16 Cb -0.12 0.44 -0.03 0.00 0.38 0.00 0.00 41.96 42.63 1j0j s TYR 16 CO -0.10 -0.74 0.73 0.00 -1.52 0.00 0.00 175.55 173.91 1j0j s ALA 17 N -3.08 3.34 -0.09 9.51 0.00 -1.26 -0.38 121.76 129.79 1j0j s ALA 17 Ca -0.02 0.14 -0.04 0.00 0.00 0.00 0.00 51.96 52.04 1j0j s ALA 17 Cb -0.00 -3.00 -0.26 0.00 0.00 0.00 0.00 23.12 19.85 1j0j s ALA 17 CO -0.07 -0.17 0.47 -0.92 0.00 0.00 0.00 175.76 175.08 1j0j h TYR 18 N 6.83 0.43 -4.16 0.00 3.20 -1.39 -3.42 116.97 118.46 1j0j h TYR 18 Ca -0.40 -0.32 -0.23 0.00 3.14 0.00 0.00 58.73 60.92 1j0j h TYR 18 Cb 1.19 -0.02 -0.10 0.00 1.54 0.00 0.00 36.73 39.34 1j0j h TYR 18 CO 0.66 1.63 -0.28 0.16 -1.64 0.00 0.00 178.16 178.69 1j0j s ASP 19 N -6.92 0.59 0.00 -2.11 3.84 -1.21 -4.92 116.67 105.95 1j0j s ASP 19 Ca -0.18 -1.36 0.00 0.00 -0.00 0.00 0.00 52.55 51.01 1j0j s ASP 19 Cb 0.07 0.58 0.00 0.00 -1.38 0.00 0.00 42.92 42.19 1j0j s ASP 19 CO 0.79 -1.15 0.70 -1.20 -0.00 0.00 0.00 175.17 174.31 1j0j n SER 20 N -0.95 0.00 0.00 2.11 7.64 -1.26 -2.29 113.62 118.87 1j0j n SER 20 Ca 0.01 0.24 0.00 0.00 1.01 0.00 0.00 58.87 60.13 1j0j n SER 20 Cb 0.63 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 1j0j n SER 20 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1j0j n GLU 21 N -1.20 0.00 -5.05 1.43 0.28 -1.26 -4.81 120.64 110.03 1j0j n GLU 21 Ca 0.00 -0.32 -0.29 0.00 -0.16 0.00 0.00 57.16 56.39 1j0j n GLU 21 Cb 0.13 -0.32 -0.16 0.00 1.43 0.00 0.00 31.44 32.52 1j0j n GLU 21 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1j0j s THR 22 N 0.00 1.75 0.02 3.84 2.01 -0.97 -4.29 115.64 118.00 1j0j s THR 22 Ca 0.00 -0.89 0.06 0.00 0.31 0.00 0.00 61.69 61.18 1j0j s THR 22 Cb 0.00 -1.50 -0.03 0.00 0.01 0.00 0.00 72.50 70.98 1j0j s THR 22 CO 0.00 0.49 -0.18 -0.22 -0.69 0.00 0.00 174.62 174.02 1j0j s LEU 23 N 0.03 2.59 -0.19 4.42 2.96 0.63 -0.95 118.68 128.16 1j0j s LEU 23 Ca -0.06 -0.38 -0.02 0.00 -0.22 0.00 0.00 54.13 53.45 1j0j s LEU 23 Cb -0.14 -1.51 -0.00 0.00 0.50 0.00 0.00 46.19 45.04 1j0j s LEU 23 CO 0.04 0.28 -0.09 -1.00 -1.32 0.00 0.00 176.35 174.25 1j0j s HIS 24 N -0.86 2.89 -0.06 5.38 3.76 0.49 -1.06 115.29 125.83 1j0j s HIS 24 Ca 0.14 -1.04 0.05 0.00 -0.15 0.00 0.00 55.06 54.05 1j0j s HIS 24 Cb -0.10 -2.02 -0.02 0.00 1.11 0.00 0.00 32.58 31.55 1j0j s HIS 24 CO 0.04 -0.54 -0.20 -0.51 -0.85 0.00 0.00 174.74 172.68 1j0j s LEU 25 N 1.23 2.40 -0.03 0.89 1.43 0.05 -2.42 118.68 122.23 1j0j s LEU 25 Ca 0.03 -0.36 0.04 0.00 -1.03 0.00 0.00 54.13 52.80 1j0j s LEU 25 Cb -0.14 -1.47 -0.01 0.00 0.03 0.00 0.00 46.19 44.60 1j0j s LEU 25 CO -0.04 0.28 -0.15 -0.60 0.23 0.00 0.00 176.35 176.07 1j0j s ARG 26 N -0.37 1.42 0.08 1.70 3.52 -0.17 -2.05 118.95 123.08 1j0j s ARG 26 Ca 0.03 -0.55 0.08 0.00 -0.13 0.00 0.00 55.73 55.16 1j0j s ARG 26 Cb -0.12 -1.31 -0.03 0.00 -1.56 0.00 0.00 34.95 31.92 1j0j s ARG 26 CO 0.02 0.28 -0.21 -1.17 -0.81 0.00 0.00 175.30 173.40 1j0j s LEU 27 N -0.15 2.24 -0.09 -0.88 2.96 -0.60 -4.81 118.68 117.34 1j0j s LEU 27 Ca 0.01 -0.61 0.04 0.00 -0.22 0.00 0.00 54.13 53.35 1j0j s LEU 27 Cb -0.08 -0.96 -0.00 0.00 0.50 0.00 0.00 46.19 45.64 1j0j s LEU 27 CO 0.01 0.12 -0.23 -0.60 -1.32 0.00 0.00 176.35 174.32 1j0j s ARG 28 N -1.57 2.93 0.08 1.98 3.52 -1.03 -0.23 118.95 124.62 1j0j s ARG 28 Ca 0.08 -0.85 -0.02 0.00 -0.13 0.00 0.00 55.73 54.80 1j0j s ARG 28 Cb -0.09 -2.23 -0.04 0.00 -1.56 0.00 0.00 34.95 31.03 1j0j s ARG 28 CO 0.03 0.19 0.02 0.95 -0.81 0.00 0.00 175.30 175.68 1j0j s THR 29 N 0.32 0.18 0.34 4.11 -4.23 -0.43 -1.68 115.64 114.25 1j0j s THR 29 Ca -0.17 -1.77 -0.29 0.00 -1.18 0.00 0.00 61.69 58.28 1j0j s THR 29 Cb -0.17 -1.65 -0.12 0.00 1.34 0.00 0.00 72.50 71.90 1j0j s THR 29 CO 0.08 -0.81 1.46 1.17 -0.54 0.00 0.00 174.62 175.98 1j0j n LYS 30 N 0.03 2.52 -1.62 3.99 4.81 -1.26 0.28 118.16 126.91 1j0j n LYS 30 Ca -0.12 0.89 -0.51 0.00 -0.87 0.00 0.00 58.31 57.70 1j0j n LYS 30 Cb 0.62 -2.59 -0.06 0.00 0.02 0.00 0.00 35.03 33.02 1j0j n LYS 30 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1j0j n LYS 31 N 0.95 1.38 -1.22 1.64 4.81 -0.46 -1.41 118.16 123.86 1j0j n LYS 31 Ca 0.04 0.50 -0.11 0.00 -0.87 0.00 0.00 58.31 57.88 1j0j n LYS 31 Cb 0.37 -2.18 -0.05 0.00 0.02 0.00 0.00 35.03 33.20 1j0j n LYS 31 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1j0j n ASP 32 N 3.24 -4.19 0.04 3.14 8.00 -1.26 -4.80 116.55 120.73 1j0j n ASP 32 Ca 0.19 0.26 -0.06 0.00 0.71 0.00 0.00 54.79 55.90 1j0j n ASP 32 Cb 0.21 -3.41 -0.11 0.00 -0.02 0.00 0.00 41.12 37.79 1j0j n ASP 32 CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 1j0j h ASP 33 N 0.00 0.00 -3.57 -2.24 3.58 -1.59 -3.45 116.42 109.15 1j0j h ASP 33 Ca -0.22 0.00 -0.67 0.00 0.42 0.00 0.00 57.03 56.57 1j0j h ASP 33 Cb 0.92 0.00 -0.23 0.00 1.72 0.00 0.00 39.33 41.74 1j0j h ASP 33 CO 0.32 0.92 -0.73 -0.63 -2.88 0.00 0.00 179.24 176.23 1j0j s ILE 34 N -2.72 3.37 -0.07 2.25 -1.09 -1.26 -4.72 121.20 116.96 1j0j s ILE 34 Ca -0.01 -0.58 -0.17 0.00 -2.23 0.00 0.00 60.65 57.67 1j0j s ILE 34 Cb 0.09 -2.39 -0.13 0.00 -1.58 0.00 0.00 42.46 38.45 1j0j s ILE 34 CO 0.81 0.55 0.65 0.44 -1.23 0.00 0.00 174.94 176.17 1j0j h ASP 35 N 6.03 -0.17 -5.13 3.58 3.45 -1.03 -3.48 116.42 119.67 1j0j h ASP 35 Ca -0.37 -0.31 -0.11 0.00 0.43 0.00 0.00 57.03 56.67 1j0j h ASP 35 Cb 1.18 0.04 -0.16 0.00 -0.56 0.00 0.00 39.33 39.84 1j0j h ASP 35 CO 0.55 0.42 -0.48 0.00 -1.57 0.00 0.00 179.24 178.15 1j0j s ARG 36 N -2.89 0.69 -0.02 3.56 1.70 -1.10 -5.02 118.95 115.88 1j0j s ARG 36 Ca -0.10 -0.88 0.02 0.00 -0.47 0.00 0.00 55.73 54.29 1j0j s ARG 36 Cb -0.00 0.27 0.01 0.00 -0.57 0.00 0.00 34.95 34.66 1j0j s ARG 36 CO 0.38 -0.19 -0.05 0.08 -1.08 0.00 0.00 175.30 174.44 1j0j s VAL 37 N -3.22 0.46 -0.06 4.99 1.01 -1.26 -1.03 120.40 121.30 1j0j s VAL 37 Ca 0.00 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.81 1j0j s VAL 37 Cb 0.02 -0.43 0.02 0.00 0.00 0.00 0.00 36.38 35.99 1j0j s VAL 37 CO -0.07 0.16 -0.08 -1.61 0.00 0.00 0.00 175.10 173.49 1j0j s GLU 38 N 0.23 1.25 0.03 2.72 2.02 -0.78 0.77 118.70 124.95 1j0j s GLU 38 Ca -0.03 -0.25 -0.30 0.00 0.02 0.00 0.00 54.97 54.41 1j0j s GLU 38 Cb -0.07 -1.12 -0.05 0.00 0.10 0.00 0.00 34.13 33.00 1j0j s GLU 38 CO -0.00 -0.04 1.17 -1.17 0.02 0.00 0.00 175.26 175.24 1j0j s LEU 39 N 0.82 4.35 -0.31 1.80 2.96 0.32 -1.61 118.68 127.01 1j0j s LEU 39 Ca -0.12 1.92 -0.12 0.00 -0.22 0.00 0.00 54.13 55.59 1j0j s LEU 39 Cb -0.15 -3.57 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 1j0j s LEU 39 CO 0.02 -0.46 0.20 -0.22 -1.32 0.00 0.00 176.35 174.57 1j0j s LEU 40 N 1.31 4.26 0.03 -0.68 0.20 -0.60 -0.46 118.68 122.74 1j0j s LEU 40 Ca 0.57 -0.31 -0.05 0.00 0.69 0.00 0.00 54.13 55.03 1j0j s LEU 40 Cb -0.27 -2.10 -0.01 0.00 -0.43 0.00 0.00 46.19 43.38 1j0j s LEU 40 CO 0.27 -0.17 0.08 -1.38 -0.29 0.00 0.00 176.35 174.87 1j0j s HIS 41 N 1.71 0.18 -0.09 5.38 -3.43 0.13 -0.96 115.29 118.21 1j0j s HIS 41 Ca 0.06 -0.44 -0.32 0.00 -0.80 0.00 0.00 55.06 53.56 1j0j s HIS 41 Cb -0.17 -0.14 0.12 0.00 -1.43 0.00 0.00 32.58 30.97 1j0j s HIS 41 CO 0.10 -0.32 1.11 0.20 -2.00 0.00 0.00 174.74 173.82 1j0j s GLY 42 N -1.88 -0.35 0.01 -1.38 0.00 -0.99 0.51 107.32 103.24 1j0j s GLY 42 Ca -0.09 1.20 -0.30 0.00 0.00 0.00 0.00 44.72 45.54 1j0j s GLY 42 CO -0.03 0.38 1.31 -0.35 0.00 0.00 0.00 173.10 174.42 1j0j s ASP 43 N -2.43 6.94 0.00 1.64 2.15 -1.26 -1.55 116.67 122.15 1j0j s ASP 43 Ca 0.09 2.05 0.00 0.00 0.43 0.00 0.00 52.55 55.12 1j0j s ASP 43 Cb -0.00 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 40.05 1j0j s ASP 43 CO -0.05 -0.63 0.71 -0.81 -0.17 0.00 0.00 175.17 174.21 1j0j n PRO 44 N 4.90 0.00 0.00 4.34 -0.04 -1.26 -2.07 135.00 140.86 1j0j n PRO 44 Ca 0.12 0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.83 1j0j n PRO 44 Cb 0.45 -1.60 0.00 0.00 -0.04 0.00 0.00 33.50 32.30 1j0j n PRO 44 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1j0j n TYR 45 N -1.21 0.00 -2.85 0.54 4.02 -1.26 -4.96 117.16 111.45 1j0j n TYR 45 Ca 0.00 -0.12 -0.43 0.00 -0.01 0.00 0.00 57.90 57.34 1j0j n TYR 45 Cb 0.10 -0.01 -0.04 0.00 -0.02 0.00 0.00 39.34 39.37 1j0j n TYR 45 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1j0j s ASP 46 N -0.24 6.23 -0.08 7.72 3.68 -0.88 -5.00 116.67 128.09 1j0j s ASP 46 Ca 0.00 -0.77 0.01 0.00 2.13 0.00 0.00 52.55 53.93 1j0j s ASP 46 Cb 0.00 -2.42 0.02 0.00 -1.45 0.00 0.00 42.92 39.06 1j0j s ASP 46 CO 0.00 -1.37 -0.10 0.26 0.13 0.00 0.00 175.17 174.10 1j0j s TRP 47 N 4.04 1.35 0.03 -5.34 0.52 -1.26 -0.89 118.94 117.38 1j0j s TRP 47 Ca 0.25 -0.54 0.09 0.00 0.02 0.00 0.00 56.10 55.91 1j0j s TRP 47 Cb -0.15 -1.05 -0.03 0.00 -1.15 0.00 0.00 33.47 31.09 1j0j s TRP 47 CO 0.13 -0.34 -0.25 -0.65 0.02 0.00 0.00 176.95 175.87 1j0j s GLN 48 N 1.03 1.77 -1.69 4.98 1.11 -0.06 -4.65 119.66 122.15 1j0j s GLN 48 Ca -0.08 -1.03 -0.18 0.00 0.01 0.00 0.00 55.36 54.09 1j0j s GLN 48 Cb -0.15 -1.88 0.15 0.00 -1.01 0.00 0.00 33.01 30.12 1j0j s GLN 48 CO -0.01 0.49 0.76 -1.71 0.01 0.00 0.00 175.29 174.84 1j0j n ASN 49 N 1.94 -3.10 -3.59 5.90 5.15 -1.26 -0.52 115.26 119.78 1j0j n ASN 49 Ca -0.17 -1.02 -0.25 0.00 -0.60 0.00 0.00 54.58 52.54 1j0j n ASN 49 Cb 0.52 -2.75 0.06 0.00 -0.53 0.00 0.00 39.78 37.08 1j0j n ASN 49 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1j0j n GLY 50 N -1.44 -0.53 3.05 8.20 0.00 -1.26 -5.00 105.19 108.21 1j0j n GLY 50 Ca 0.05 0.23 -0.13 0.00 0.00 0.00 0.00 46.02 46.17 1j0j n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j0j s ALA 51 N -3.29 -0.44 0.29 4.61 0.00 0.32 -5.03 121.76 118.22 1j0j s ALA 51 Ca 0.57 0.55 -0.29 0.00 0.00 0.00 0.00 51.96 52.79 1j0j s ALA 51 Cb -0.26 -0.33 -0.10 0.00 0.00 0.00 0.00 23.12 22.43 1j0j s ALA 51 CO 0.70 -0.10 1.37 -0.46 0.00 0.00 0.00 175.76 177.27 1j0j s TRP 52 N 0.25 3.04 -0.74 0.00 -0.00 -1.26 -0.88 118.94 119.35 1j0j s TRP 52 Ca -0.01 1.23 -0.16 0.00 -0.00 0.00 0.00 56.10 57.15 1j0j s TRP 52 Cb -0.03 -3.74 0.16 0.00 -0.00 0.00 0.00 33.47 29.86 1j0j s TRP 52 CO -0.01 -2.24 0.75 -0.65 -0.00 0.00 0.00 176.95 174.80 1j0j s GLN 53 N -1.07 3.36 0.42 5.86 -1.52 -0.07 -4.89 119.66 121.76 1j0j s GLN 53 Ca 0.54 -1.98 0.07 0.00 -1.95 0.00 0.00 55.36 52.04 1j0j s GLN 53 Cb -0.41 -4.44 -0.05 0.00 -0.22 0.00 0.00 33.01 27.89 1j0j s GLN 53 CO 0.48 -1.42 0.16 -0.59 -0.25 0.00 0.00 175.29 173.67 1j0j s PHE 54 N 1.33 2.55 0.06 0.91 -0.71 -1.26 -4.34 117.98 116.52 1j0j s PHE 54 Ca 0.16 -0.62 -0.00 0.00 -1.04 0.00 0.00 56.93 55.42 1j0j s PHE 54 Cb -0.16 -1.93 -0.04 0.00 -1.21 0.00 0.00 43.02 39.68 1j0j s PHE 54 CO -0.03 0.21 -0.03 -0.65 -1.34 0.00 0.00 175.22 173.37 1j0j s GLN 55 N -3.89 0.67 -0.13 1.99 -0.21 0.18 -4.94 119.66 113.33 1j0j s GLN 55 Ca 0.39 -1.25 -0.04 0.00 0.02 0.00 0.00 55.36 54.48 1j0j s GLN 55 Cb 0.05 0.13 -0.04 0.00 1.00 0.00 0.00 33.01 34.15 1j0j s GLN 55 CO 0.21 -0.10 0.03 -1.64 -2.12 0.00 0.00 175.29 171.67 1j0j s MET 56 N -3.91 3.45 -0.07 2.91 -1.94 -1.26 -0.69 119.30 117.78 1j0j s MET 56 Ca 0.09 -0.38 -0.01 0.00 -1.71 0.00 0.00 55.69 53.67 1j0j s MET 56 Cb 0.07 -2.98 0.03 0.00 2.01 0.00 0.00 34.83 33.96 1j0j s MET 56 CO -0.09 0.50 -0.01 1.41 -0.01 0.00 0.00 175.02 176.83 1j0j s MET 57 N -0.31 0.70 0.32 2.03 1.75 0.40 -4.97 119.30 119.21 1j0j s MET 57 Ca 0.07 0.07 -0.29 0.00 -1.25 0.00 0.00 55.69 54.29 1j0j s MET 57 Cb -0.12 -1.03 -0.11 0.00 2.84 0.00 0.00 34.83 36.42 1j0j s MET 57 CO 0.02 -0.30 1.46 -2.14 -0.65 0.00 0.00 175.02 173.41 1j0j s PRO 58 N 1.93 4.20 -0.08 4.11 0.02 -1.26 0.12 135.00 144.04 1j0j s PRO 58 Ca 0.05 2.43 -0.05 0.00 0.02 0.00 0.00 61.00 63.44 1j0j s PRO 58 Cb -0.12 -3.04 -0.04 0.00 0.02 0.00 0.00 34.50 31.32 1j0j s PRO 58 CO -0.05 -0.45 0.15 -1.64 -0.33 0.00 0.00 177.00 174.67 1j0j s MET 59 N -1.24 3.43 -0.10 5.54 -1.94 0.23 -4.78 119.30 120.44 1j0j s MET 59 Ca 0.56 -0.20 -0.13 0.00 -1.71 0.00 0.00 55.69 54.21 1j0j s MET 59 Cb -0.44 -3.15 -0.05 0.00 2.01 0.00 0.00 34.83 33.20 1j0j s MET 59 CO 0.53 0.74 0.30 0.50 -0.01 0.00 0.00 175.02 177.08 1j0j s ARG 60 N -1.33 3.98 -0.17 2.03 3.52 0.13 -4.53 118.95 122.58 1j0j s ARG 60 Ca 0.19 0.16 -0.29 0.00 -0.13 0.00 0.00 55.73 55.66 1j0j s ARG 60 Cb -0.12 -3.31 -0.01 0.00 -1.56 0.00 0.00 34.95 29.95 1j0j s ARG 60 CO 0.09 0.50 1.15 0.21 -0.81 0.00 0.00 175.30 176.44 1j0j s LYS 61 N -0.35 4.27 -0.01 5.12 2.20 -1.26 0.13 119.74 129.84 1j0j s LYS 61 Ca 0.19 1.53 0.18 0.00 -0.36 0.00 0.00 55.97 57.51 1j0j s LYS 61 Cb -0.14 -3.67 -0.25 0.00 -1.51 0.00 0.00 37.83 32.26 1j0j s LYS 61 CO 0.07 -0.61 0.58 0.25 -0.36 0.00 0.00 175.35 175.28 1j0j n THR 62 N 5.18 0.00 0.00 3.43 -2.24 -0.05 -4.93 114.28 115.66 1j0j n THR 62 Ca 0.12 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1j0j n THR 62 Cb 0.46 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.19 1j0j n THR 62 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j0j n GLY 63 N 1.44 -0.03 3.15 3.38 0.00 -1.24 -4.90 105.19 106.98 1j0j n GLY 63 Ca -0.00 -0.91 -0.12 0.00 0.00 0.00 0.00 46.02 44.99 1j0j n GLY 63 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1j0j s SER 64 N 0.00 -0.13 0.00 1.61 0.01 -1.26 -1.42 113.70 112.50 1j0j s SER 64 Ca 0.00 0.12 0.00 0.00 1.31 0.00 0.00 55.95 57.38 1j0j s SER 64 Cb 0.00 0.34 0.00 0.00 0.21 0.00 0.00 66.02 66.57 1j0j s SER 64 CO 0.00 -0.29 0.00 -0.90 0.41 0.00 0.00 173.24 172.46 1j0j n ASP 65 N 1.93 1.57 -0.30 2.44 5.68 -0.90 -4.41 116.55 122.56 1j0j n ASP 65 Ca -0.19 -0.53 0.09 0.00 -0.50 0.00 0.00 54.79 53.66 1j0j n ASP 65 Cb 0.57 0.00 0.21 0.00 -1.14 0.00 0.00 41.12 40.76 1j0j n ASP 65 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1j0j h GLU 66 N 0.00 0.07 0.00 0.11 4.39 -1.94 -3.31 114.58 113.91 1j0j h GLU 66 Ca 0.00 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 1j0j h GLU 66 Cb 0.00 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1j0j h GLU 66 CO 0.00 0.05 -1.37 1.28 -1.16 0.00 0.00 179.01 177.80 1j0j n LEU 67 N -5.40 0.00 -4.48 1.33 4.77 -1.26 -4.96 117.00 106.99 1j0j n LEU 67 Ca 0.18 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.93 1j0j n LEU 67 Cb 0.59 0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.63 1j0j n LEU 67 CO -0.00 0.05 -0.25 -0.36 -1.33 0.00 0.00 177.39 175.50 1j0j s PHE 68 N -2.40 1.93 -0.05 -1.77 0.08 -1.25 -1.35 117.98 113.18 1j0j s PHE 68 Ca -0.03 -1.02 0.03 0.00 0.12 0.00 0.00 56.93 56.03 1j0j s PHE 68 Cb 0.04 -1.29 -0.03 0.00 -0.57 0.00 0.00 43.02 41.18 1j0j s PHE 68 CO 0.30 -0.04 -0.12 -0.51 -0.10 0.00 0.00 175.22 174.74 1j0j s ASP 69 N -3.54 4.19 -0.09 1.36 1.01 0.14 -2.12 116.67 117.62 1j0j s ASP 69 Ca 0.32 -0.16 0.03 0.00 0.71 0.00 0.00 52.55 53.44 1j0j s ASP 69 Cb 0.07 -0.92 -0.01 0.00 1.01 0.00 0.00 42.92 43.07 1j0j s ASP 69 CO 0.15 0.34 -0.18 -0.31 0.21 0.00 0.00 175.17 175.38 1j0j s TYR 70 N -0.77 2.67 0.09 4.23 2.02 -0.51 -1.31 117.35 123.76 1j0j s TYR 70 Ca 0.12 -0.61 0.06 0.00 -0.37 0.00 0.00 57.07 56.27 1j0j s TYR 70 Cb -0.11 -1.72 -0.04 0.00 -0.40 0.00 0.00 41.96 39.69 1j0j s TYR 70 CO 0.01 -0.15 -0.07 -1.58 -1.57 0.00 0.00 175.55 172.19 1j0j s TRP 71 N -0.01 2.81 0.26 2.71 0.52 0.68 -0.88 118.94 125.03 1j0j s TRP 71 Ca -0.05 -0.12 0.08 0.00 0.02 0.00 0.00 56.10 56.03 1j0j s TRP 71 Cb -0.15 -1.47 -0.05 0.00 -1.15 0.00 0.00 33.47 30.65 1j0j s TRP 71 CO 0.05 0.43 -0.11 0.12 0.02 0.00 0.00 176.95 177.46 1j0j s PHE 72 N -1.22 1.92 -0.30 -1.98 5.36 0.34 -1.56 117.98 120.54 1j0j s PHE 72 Ca 0.22 -0.61 -0.16 0.00 -0.96 0.00 0.00 56.93 55.42 1j0j s PHE 72 Cb -0.11 -1.00 0.18 0.00 -0.34 0.00 0.00 43.02 41.75 1j0j s PHE 72 CO 0.14 0.37 1.15 0.00 -1.46 0.00 0.00 175.22 175.42 1j0j s ALA 73 N -2.93 -2.54 -0.09 11.12 0.00 -0.87 -0.69 121.76 125.76 1j0j s ALA 73 Ca 0.27 2.06 0.01 0.00 0.00 0.00 0.00 51.96 54.31 1j0j s ALA 73 Cb 0.01 -1.89 -0.02 0.00 0.00 0.00 0.00 23.12 21.22 1j0j s ALA 73 CO 0.11 -0.35 -0.13 -1.83 0.00 0.00 0.00 175.76 173.55 1j0j s GLU 74 N 1.21 2.97 0.13 0.00 -1.05 -1.26 -0.77 118.70 119.93 1j0j s GLU 74 Ca -0.08 -0.67 0.06 0.00 -0.15 0.00 0.00 54.97 54.12 1j0j s GLU 74 Cb -0.03 -2.53 -0.04 0.00 -0.44 0.00 0.00 34.13 31.09 1j0j s GLU 74 CO -0.12 0.42 -0.13 0.54 0.95 0.00 0.00 175.26 176.92 1j0j s VAL 75 N -0.20 1.29 -0.51 1.83 0.11 -0.23 -4.95 120.40 117.74 1j0j s VAL 75 Ca 0.01 -1.78 0.03 0.00 -2.93 0.00 0.00 61.98 57.31 1j0j s VAL 75 Cb -0.13 -1.58 0.14 0.00 -1.53 0.00 0.00 36.38 33.28 1j0j s VAL 75 CO 0.03 -0.49 0.30 -0.54 -3.33 0.00 0.00 175.10 171.08 1j0j s LYS 76 N -2.88 1.67 0.28 1.54 1.02 -1.26 -0.27 119.74 119.84 1j0j s LYS 76 Ca 0.10 -2.45 -0.29 0.00 0.02 0.00 0.00 55.97 53.35 1j0j s LYS 76 Cb -0.03 -2.73 -0.14 0.00 -0.52 0.00 0.00 37.83 34.41 1j0j s LYS 76 CO 0.03 -1.19 1.17 -0.35 -0.92 0.00 0.00 175.35 174.09 1j0j n PRO 77 N 3.05 1.65 -0.07 -1.68 -0.04 -1.26 -4.88 135.00 131.77 1j0j n PRO 77 Ca 0.12 0.58 -0.07 0.00 -0.04 0.00 0.00 63.50 64.09 1j0j n PRO 77 Cb 0.35 -2.08 -0.01 0.00 -0.04 0.00 0.00 33.50 31.73 1j0j n PRO 77 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1j0j h PRO 78 N 2.72 -0.18 -0.31 0.54 0.11 -1.96 -2.86 132.00 130.05 1j0j h PRO 78 Ca -0.43 0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.53 1j0j h PRO 78 Cb 1.31 0.04 -0.10 0.00 0.11 0.00 0.00 31.00 32.37 1j0j h PRO 78 CO 0.65 -0.12 -0.14 0.66 -0.21 0.00 0.00 178.00 178.84 1j0j n TYR 79 N -5.37 0.96 -0.99 0.65 4.02 -1.26 -4.95 117.16 110.22 1j0j n TYR 79 Ca 0.00 -1.61 0.00 0.00 -0.01 0.00 0.00 57.90 56.28 1j0j n TYR 79 Cb 0.28 -0.47 0.00 0.00 -0.02 0.00 0.00 39.34 39.14 1j0j n TYR 79 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1j0j n ARG 80 N -1.13 -1.38 -4.89 -0.72 1.74 -1.08 -4.98 116.66 104.22 1j0j n ARG 80 Ca 0.32 0.34 -0.31 0.00 -0.77 0.00 0.00 57.85 57.43 1j0j n ARG 80 Cb 1.00 -4.41 -0.14 0.00 -1.02 0.00 0.00 32.46 27.88 1j0j n ARG 80 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1j0j s ARG 81 N -1.40 2.02 -0.20 5.56 0.52 -1.26 -2.49 118.95 121.69 1j0j s ARG 81 Ca 0.00 -0.99 -0.10 0.00 -0.52 0.00 0.00 55.73 54.12 1j0j s ARG 81 Cb 0.00 -2.10 0.07 0.00 0.52 0.00 0.00 34.95 33.44 1j0j s ARG 81 CO 0.00 0.54 0.48 -1.17 0.02 0.00 0.00 175.30 175.17 1j0j s LEU 82 N -1.15 -0.42 -0.07 2.53 2.96 -1.12 -4.27 118.68 117.15 1j0j s LEU 82 Ca 0.12 1.07 -0.01 0.00 -0.22 0.00 0.00 54.13 55.09 1j0j s LEU 82 Cb -0.10 1.60 -0.03 0.00 0.50 0.00 0.00 46.19 48.15 1j0j s LEU 82 CO 0.02 -0.21 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.70 1j0j s ARG 83 N 1.76 2.91 0.21 1.98 1.81 -0.60 -0.80 118.95 126.22 1j0j s ARG 83 Ca -0.08 -0.47 -0.21 0.00 -1.72 0.00 0.00 55.73 53.26 1j0j s ARG 83 Cb -0.09 -2.74 0.04 0.00 -0.45 0.00 0.00 34.95 31.71 1j0j s ARG 83 CO -0.14 0.68 0.62 1.52 -0.68 0.00 0.00 175.30 177.30 1j0j s TYR 84 N -0.92 -0.29 0.00 -0.53 1.13 -0.06 -2.34 117.35 114.34 1j0j s TYR 84 Ca 0.14 -0.04 0.00 0.00 -1.41 0.00 0.00 57.07 55.76 1j0j s TYR 84 Cb -0.11 0.56 0.00 0.00 -1.10 0.00 0.00 41.96 41.31 1j0j s TYR 84 CO 0.04 -1.01 0.00 0.41 -2.51 0.00 0.00 175.55 172.48 1j0j n GLY 85 N -0.40 2.67 2.98 5.49 0.00 -0.13 -0.79 105.19 115.01 1j0j n GLY 85 Ca -0.10 -1.22 -0.17 0.00 0.00 0.00 0.00 46.02 44.52 1j0j n GLY 85 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j0j s PHE 86 N -6.66 0.63 -0.20 1.61 0.08 -0.30 -1.56 117.98 111.57 1j0j s PHE 86 Ca 0.00 -0.12 -0.03 0.00 0.12 0.00 0.00 56.93 56.90 1j0j s PHE 86 Cb 0.00 -0.42 -0.01 0.00 -0.57 0.00 0.00 43.02 42.02 1j0j s PHE 86 CO 0.00 -0.03 -0.07 0.08 -0.10 0.00 0.00 175.22 175.10 1j0j s VAL 87 N -0.05 3.20 -0.11 -0.44 1.01 -0.64 0.11 120.40 123.48 1j0j s VAL 87 Ca 0.01 -0.56 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 1j0j s VAL 87 Cb -0.04 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.88 1j0j s VAL 87 CO -0.00 0.45 -0.05 -0.76 0.00 0.00 0.00 175.10 174.74 1j0j s LEU 88 N 1.29 3.23 -0.04 3.92 1.02 0.31 -1.86 118.68 126.55 1j0j s LEU 88 Ca 0.03 -0.07 0.05 0.00 0.02 0.00 0.00 54.13 54.17 1j0j s LEU 88 Cb -0.14 -1.74 -0.02 0.00 0.02 0.00 0.00 46.19 44.30 1j0j s LEU 88 CO -0.03 0.27 -0.18 -0.31 0.02 0.00 0.00 176.35 176.11 1j0j s TYR 89 N -0.23 2.58 -0.29 0.29 1.51 -0.19 -1.42 117.35 119.60 1j0j s TYR 89 Ca 0.04 -0.25 0.03 0.00 -1.01 0.00 0.00 57.07 55.87 1j0j s TYR 89 Cb -0.13 -1.59 0.20 0.00 -0.11 0.00 0.00 41.96 40.33 1j0j s TYR 89 CO 0.02 0.11 0.67 0.45 -1.11 0.00 0.00 175.55 175.69 1j0j s SER 90 N -0.68 -1.42 0.43 2.29 0.15 -1.06 -0.37 113.70 113.03 1j0j s SER 90 Ca 0.11 0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.97 1j0j s SER 90 Cb -0.10 1.92 0.00 0.00 -1.71 0.00 0.00 66.02 66.13 1j0j s SER 90 CO 0.00 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 174.79 1j0j n GLY 91 N 5.37 0.66 0.17 9.45 0.00 -1.26 -2.05 105.19 117.53 1j0j n GLY 91 Ca 0.05 -0.82 0.12 0.00 0.00 0.00 0.00 46.02 45.37 1j0j n GLY 91 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1j0j n GLU 92 N 4.54 1.23 -2.75 1.61 4.71 -1.26 -4.85 120.64 123.87 1j0j n GLU 92 Ca 0.00 -0.34 -0.36 0.00 -0.01 0.00 0.00 57.16 56.46 1j0j n GLU 92 Cb 0.00 -1.40 -0.06 0.00 -1.01 0.00 0.00 31.44 28.97 1j0j n GLU 92 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 1j0j s GLU 93 N -1.96 4.40 -0.05 3.49 2.12 -0.87 -5.07 118.70 120.77 1j0j s GLU 93 Ca 0.36 1.29 -0.03 0.00 0.36 0.00 0.00 54.97 56.96 1j0j s GLU 93 Cb 0.18 -2.56 0.02 0.00 0.26 0.00 0.00 34.13 32.02 1j0j s GLU 93 CO 0.29 0.11 0.11 0.21 -0.54 0.00 0.00 175.26 175.45 1j0j s LYS 94 N -2.48 0.11 -0.01 4.30 2.20 -1.26 -2.57 119.74 120.02 1j0j s LYS 94 Ca 0.55 0.22 0.02 0.00 -0.36 0.00 0.00 55.97 56.40 1j0j s LYS 94 Cb -0.16 -0.03 0.00 0.00 -1.51 0.00 0.00 37.83 36.13 1j0j s LYS 94 CO 0.21 -0.07 -0.05 -0.51 -0.36 0.00 0.00 175.35 174.57 1j0j s LEU 95 N 0.46 1.81 -0.29 5.43 1.43 -0.51 -4.65 118.68 122.35 1j0j s LEU 95 Ca -0.03 -0.11 -0.04 0.00 -1.03 0.00 0.00 54.13 52.92 1j0j s LEU 95 Cb -0.05 -0.34 0.03 0.00 0.03 0.00 0.00 46.19 45.86 1j0j s LEU 95 CO -0.02 0.04 0.03 -0.69 0.23 0.00 0.00 176.35 175.93 1j0j s VAL 96 N 0.16 3.41 -0.31 -1.59 1.01 0.14 0.11 120.40 123.34 1j0j s VAL 96 Ca -0.02 -1.02 -0.15 0.00 0.00 0.00 0.00 61.98 60.80 1j0j s VAL 96 Cb -0.06 -2.83 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 1j0j s VAL 96 CO -0.00 0.02 0.35 -0.47 0.00 0.00 0.00 175.10 175.00 1j0j s TYR 97 N 1.38 3.22 0.43 5.22 5.04 0.31 -0.54 117.35 132.41 1j0j s TYR 97 Ca -0.01 0.13 0.03 0.00 -2.44 0.00 0.00 57.07 54.79 1j0j s TYR 97 Cb -0.18 -2.61 -0.02 0.00 0.35 0.00 0.00 41.96 39.50 1j0j s TYR 97 CO -0.00 -0.34 0.12 0.95 -1.34 0.00 0.00 175.55 174.94 1j0j s THR 98 N 2.01 0.64 0.28 4.34 -4.23 -0.34 -1.15 115.64 117.19 1j0j s THR 98 Ca 0.12 -2.00 0.22 0.00 -1.18 0.00 0.00 61.69 58.85 1j0j s THR 98 Cb -0.16 -2.29 0.21 0.00 1.34 0.00 0.00 72.50 71.59 1j0j s THR 98 CO 0.11 0.00 1.89 -0.08 -0.54 0.00 0.00 174.62 176.00 1j0j h GLU 99 N 1.70 0.00 -0.00 3.99 4.81 -1.20 -2.00 114.58 121.88 1j0j h GLU 99 Ca -0.36 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 1j0j h GLU 99 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 1j0j h GLU 99 CO 0.58 0.25 -0.15 1.17 -0.73 0.00 0.00 179.01 180.14 1j0j n LYS 100 N -3.62 0.62 0.00 1.92 3.00 -0.55 -5.02 118.16 114.51 1j0j n LYS 100 Ca -0.01 -0.23 0.00 0.00 -0.00 0.00 0.00 58.31 58.07 1j0j n LYS 100 Cb 0.38 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.91 1j0j n LYS 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1j0j n GLY 101 N 1.31 0.48 3.87 3.14 0.00 -0.75 -5.06 105.19 108.18 1j0j n GLY 101 Ca 0.13 -2.27 -0.34 0.00 0.00 0.00 0.00 46.02 43.54 1j0j n GLY 101 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j0j s PHE 102 N -0.15 3.54 0.15 1.61 0.40 -1.26 -1.20 117.98 121.08 1j0j s PHE 102 Ca 0.00 0.81 0.00 0.00 -0.60 0.00 0.00 56.93 57.14 1j0j s PHE 102 Cb 0.00 -2.19 -0.04 0.00 0.51 0.00 0.00 43.02 41.30 1j0j s PHE 102 CO 0.00 0.45 0.04 0.71 0.70 0.00 0.00 175.22 177.12 1j0j s TYR 103 N -1.52 1.02 -1.39 0.36 1.51 0.30 -4.95 117.35 112.68 1j0j s TYR 103 Ca 0.37 -1.17 0.12 0.00 -1.01 0.00 0.00 57.07 55.38 1j0j s TYR 103 Cb -0.13 -0.58 0.14 0.00 -0.11 0.00 0.00 41.96 41.28 1j0j s TYR 103 CO 0.20 -0.41 0.96 1.19 -1.11 0.00 0.00 175.55 176.38 1j0j n PHE 104 N -0.17 0.11 -3.64 2.71 3.01 -1.26 0.28 117.46 118.49 1j0j n PHE 104 Ca -0.05 -0.11 -0.06 0.00 1.01 0.00 0.00 57.45 58.24 1j0j n PHE 104 Cb 0.64 -0.01 -0.07 0.00 -0.01 0.00 0.00 39.48 40.03 1j0j n PHE 104 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 1j0j s GLU 105 N -1.00 0.61 -0.41 -1.08 0.41 -1.26 -4.80 118.70 111.17 1j0j s GLU 105 Ca 0.16 1.00 -0.39 0.00 -0.41 0.00 0.00 54.97 55.33 1j0j s GLU 105 Cb 0.11 0.15 -0.15 0.00 -1.78 0.00 0.00 34.13 32.46 1j0j s GLU 105 CO 0.15 -0.12 2.15 0.28 -0.49 0.00 0.00 175.26 177.23 1j0j n VAL 106 N 3.87 0.11 -2.01 2.63 0.31 -1.26 -4.92 118.33 117.06 1j0j n VAL 106 Ca -0.19 -0.14 -0.33 0.00 -0.01 0.00 0.00 64.34 63.67 1j0j n VAL 106 Cb 0.58 -1.13 0.02 0.00 -0.91 0.00 0.00 33.84 32.40 1j0j n VAL 106 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1j0j s PRO 107 N 6.01 3.16 0.00 5.55 0.04 -1.26 -4.94 135.00 143.55 1j0j s PRO 107 Ca 1.14 1.37 0.00 0.00 0.04 0.00 0.00 61.00 63.54 1j0j s PRO 107 Cb -1.14 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 31.40 1j0j s PRO 107 CO 0.57 -0.96 0.00 0.25 0.04 0.00 0.00 177.00 176.90 1j0j n THR 108 N -1.96 0.00 1.99 1.26 -2.24 -1.26 -4.83 114.28 107.24 1j0j n THR 108 Ca 0.10 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.96 1j0j n THR 108 Cb 0.52 1.28 0.45 0.00 -2.10 0.00 0.00 70.33 70.47 1j0j n THR 108 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1j0j n ASP 109 N 0.00 0.02 -3.63 3.42 5.75 -1.26 -4.08 116.55 116.77 1j0j n ASP 109 Ca 0.00 -1.53 -0.07 0.00 -0.01 0.00 0.00 54.79 53.18 1j0j n ASP 109 Cb 0.17 -0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.19 1j0j n ASP 109 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1j0j s ASP 110 N -1.47 -0.27 0.00 -1.12 3.68 -1.26 -5.03 116.67 111.20 1j0j s ASP 110 Ca 0.23 0.44 0.22 0.00 2.13 0.00 0.00 52.55 55.57 1j0j s ASP 110 Cb 0.10 0.42 0.59 0.00 -1.45 0.00 0.00 42.92 42.58 1j0j s ASP 110 CO 0.18 -0.14 1.47 0.35 0.13 0.00 0.00 175.17 177.16 1j0j n THR 111 N 1.47 0.29 0.24 1.71 -2.24 -1.26 -4.26 114.28 110.23 1j0j n THR 111 Ca -0.10 -0.51 0.13 0.00 -2.27 0.00 0.00 64.05 61.31 1j0j n THR 111 Cb 0.57 0.73 0.40 0.00 -2.10 0.00 0.00 70.33 69.93 1j0j n THR 111 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j0j h ALA 112 N 4.31 0.98 0.00 6.98 0.00 -2.00 -3.19 119.26 126.35 1j0j h ALA 112 Ca 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1j0j h ALA 112 Cb 0.73 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1j0j h ALA 112 CO 0.00 0.07 -0.10 1.88 0.00 0.00 0.00 179.25 181.10 1j0j h TYR 113 N 0.00 0.00 -3.35 0.00 -1.99 -2.00 -3.44 116.97 106.19 1j0j h TYR 113 Ca -0.00 0.00 -0.53 0.00 2.00 0.00 0.00 58.73 60.20 1j0j h TYR 113 Cb 0.80 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.51 1j0j h TYR 113 CO 0.00 0.10 -0.11 0.71 -0.00 0.00 0.00 178.16 178.85 1j0j s TYR 114 N -4.46 3.45 0.84 4.88 1.51 -1.21 -0.73 117.35 121.64 1j0j s TYR 114 Ca -0.04 0.78 -0.12 0.00 -1.01 0.00 0.00 57.07 56.68 1j0j s TYR 114 Cb 0.14 -2.20 0.10 0.00 -0.11 0.00 0.00 41.96 39.90 1j0j s TYR 114 CO 0.61 0.21 1.18 -0.06 -1.11 0.00 0.00 175.55 176.37 1j0j s PHE 115 N -1.97 1.76 -0.00 2.71 0.08 0.03 -4.67 117.98 115.93 1j0j s PHE 115 Ca 0.46 1.71 0.00 0.00 0.12 0.00 0.00 56.93 59.22 1j0j s PHE 115 Cb -0.11 -3.43 0.00 0.00 -0.57 0.00 0.00 43.02 38.92 1j0j s PHE 115 CO 0.26 -2.81 0.00 0.00 -0.10 0.00 0.00 175.22 172.57 1j0j s PHE 117 N 0.15 3.44 0.12 0.00 5.36 0.02 -4.93 117.98 122.14 1j0j s PHE 117 Ca -0.01 -3.20 -0.12 0.00 -0.96 0.00 0.00 56.93 52.63 1j0j s PHE 117 Cb -0.02 -2.84 0.09 0.00 -0.34 0.00 0.00 43.02 39.91 1j0j s PHE 117 CO -0.00 -0.66 0.89 -2.30 -1.46 0.00 0.00 175.22 171.68 1j0j n PRO 118 N 2.56 -0.17 -3.48 10.12 -0.02 -1.26 -2.79 135.00 139.95 1j0j n PRO 118 Ca 0.13 0.88 -0.10 0.00 -2.02 0.00 0.00 63.50 62.39 1j0j n PRO 118 Cb 0.34 -1.30 -0.02 0.00 -0.02 0.00 0.00 33.50 32.50 1j0j n PRO 118 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1j0j s PHE 119 N -5.47 -0.42 -0.21 6.00 5.36 -1.26 -4.31 117.98 117.69 1j0j s PHE 119 Ca -0.08 0.29 -0.09 0.00 -0.96 0.00 0.00 56.93 56.10 1j0j s PHE 119 Cb 0.10 0.54 -0.05 0.00 -0.34 0.00 0.00 43.02 43.27 1j0j s PHE 119 CO 0.39 -0.63 0.11 -0.51 -1.46 0.00 0.00 175.22 173.12 1j0j s LEU 120 N -2.47 4.01 -0.05 6.12 1.43 -1.04 -5.01 118.68 121.67 1j0j s LEU 120 Ca 0.03 0.13 0.02 0.00 -1.03 0.00 0.00 54.13 53.28 1j0j s LEU 120 Cb -0.01 -2.04 0.01 0.00 0.03 0.00 0.00 46.19 44.18 1j0j s LEU 120 CO -0.09 0.14 -0.11 -1.00 0.23 0.00 0.00 176.35 175.51 1j0j s HIS 121 N 0.60 1.31 0.20 0.29 3.76 -1.26 -5.02 115.29 115.17 1j0j s HIS 121 Ca 0.06 -0.43 -0.11 0.00 -0.15 0.00 0.00 55.06 54.43 1j0j s HIS 121 Cb -0.12 -0.96 0.16 0.00 1.11 0.00 0.00 32.58 32.78 1j0j s HIS 121 CO 0.01 -0.22 1.85 -0.09 -0.85 0.00 0.00 174.74 175.44 1j0j h ARG 122 N 6.80 0.84 0.00 1.40 2.43 -1.95 -2.64 114.38 121.25 1j0j h ARG 122 Ca -0.32 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.79 1j0j h ARG 122 Cb 1.18 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 30.54 1j0j h ARG 122 CO 0.48 0.55 -0.03 -0.39 -1.51 0.00 0.00 179.97 179.07 1j0j h VAL 123 N 0.86 0.12 -0.15 0.20 -1.51 -2.03 -2.41 116.25 111.34 1j0j h VAL 123 Ca 0.27 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 65.36 1j0j h VAL 123 Cb -0.02 1.33 0.00 0.00 -2.13 0.00 0.00 31.29 30.47 1j0j h VAL 123 CO -0.09 0.03 0.00 0.47 -1.23 0.00 0.00 177.57 176.75 1j0j n ASP 124 N -3.20 2.38 -4.77 4.19 8.00 -1.00 -4.95 116.55 117.20 1j0j n ASP 124 Ca -0.01 -1.80 -0.34 0.00 0.71 0.00 0.00 54.79 53.35 1j0j n ASP 124 Cb 0.22 -0.09 0.03 0.00 -0.02 0.00 0.00 41.12 41.26 1j0j n ASP 124 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1j0j s LEU 125 N -1.76 3.53 -0.19 0.64 2.96 -0.91 -4.93 118.68 118.02 1j0j s LEU 125 Ca 0.34 2.07 -0.15 0.00 -0.22 0.00 0.00 54.13 56.17 1j0j s LEU 125 Cb 0.20 -4.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.29 1j0j s LEU 125 CO 0.30 -1.47 0.35 0.12 -1.32 0.00 0.00 176.35 174.33 1j0j s PHE 126 N -2.13 3.40 -0.20 5.38 2.19 -1.26 -4.85 117.98 120.52 1j0j s PHE 126 Ca 0.69 0.58 -0.04 0.00 0.33 0.00 0.00 56.93 58.49 1j0j s PHE 126 Cb -0.22 -2.45 0.10 0.00 -1.31 0.00 0.00 43.02 39.14 1j0j s PHE 126 CO 0.36 0.08 0.27 -2.00 1.83 0.00 0.00 175.22 175.76 1j0j s GLU 127 N 1.02 0.22 0.10 10.12 2.12 -1.26 -5.01 118.70 126.00 1j0j s GLU 127 Ca 0.17 0.43 -0.01 0.00 0.36 0.00 0.00 54.97 55.93 1j0j s GLU 127 Cb -0.14 -0.72 -0.04 0.00 0.26 0.00 0.00 34.13 33.48 1j0j s GLU 127 CO 0.07 -0.56 0.27 0.00 -0.54 0.00 0.00 175.26 174.50 1j0j s ALA 128 N 2.41 3.94 -0.08 6.30 0.00 -1.26 -4.99 121.76 128.09 1j0j s ALA 128 Ca 0.07 -0.79 -0.36 0.00 0.00 0.00 0.00 51.96 50.88 1j0j s ALA 128 Cb -0.15 -1.91 -0.14 0.00 0.00 0.00 0.00 23.12 20.93 1j0j s ALA 128 CO -0.12 0.74 1.71 -2.30 0.00 0.00 0.00 175.76 175.78 1j0j n PRO 129 N 0.10 1.72 0.26 0.00 -0.02 -1.26 -4.82 135.00 130.97 1j0j n PRO 129 Ca -0.05 0.63 0.09 0.00 -2.02 0.00 0.00 63.50 62.15 1j0j n PRO 129 Cb 0.52 -2.38 0.66 0.00 -0.02 0.00 0.00 33.50 32.28 1j0j n PRO 129 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1j0j h ASP 130 N 7.35 0.00 -0.85 2.55 1.82 -1.95 -2.91 116.42 122.44 1j0j h ASP 130 Ca -0.47 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.17 1j0j h ASP 130 Cb 1.29 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 41.26 1j0j h ASP 130 CO 0.92 0.07 0.52 4.11 -1.61 0.00 0.00 179.24 183.25 1j0j h TRP 131 N 0.00 1.11 -0.98 0.28 5.08 -1.95 -2.35 115.95 117.14 1j0j h TRP 131 Ca -0.00 0.00 0.24 0.00 1.08 0.00 0.00 58.89 60.21 1j0j h TRP 131 Cb 0.13 -0.37 -0.08 0.00 -3.00 0.00 0.00 29.16 25.85 1j0j h TRP 131 CO 0.00 0.73 0.65 -0.39 -1.28 0.00 0.00 178.44 178.15 1j0j h VAL 132 N 1.17 0.59 0.00 0.12 -1.51 -1.89 -0.73 116.25 114.00 1j0j h VAL 132 Ca 0.31 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 65.65 1j0j h VAL 132 Cb -0.07 0.19 0.00 0.00 -2.13 0.00 0.00 31.29 29.29 1j0j h VAL 132 CO -0.06 0.07 0.00 0.11 -1.23 0.00 0.00 177.57 176.46 1j0j h LYS 133 N 0.37 0.00 -0.16 5.19 1.57 -1.60 -1.27 116.57 120.67 1j0j h LYS 133 Ca 0.53 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.31 1j0j h LYS 133 Cb 1.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.70 1j0j h LYS 133 CO -0.21 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.42 1j0j n ASP 134 N -2.87 2.81 -4.88 0.86 8.00 -0.29 -4.72 116.55 115.46 1j0j n ASP 134 Ca -0.02 -2.51 -0.34 0.00 0.71 0.00 0.00 54.79 52.62 1j0j n ASP 134 Cb 0.07 -0.30 -0.05 0.00 -0.02 0.00 0.00 41.12 40.82 1j0j n ASP 134 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1j0j s THR 135 N -1.90 5.20 -0.23 -3.53 2.01 -0.48 -5.01 115.64 111.69 1j0j s THR 135 Ca 0.24 0.23 0.02 0.00 0.31 0.00 0.00 61.69 62.48 1j0j s THR 135 Cb 0.18 -3.61 0.05 0.00 0.01 0.00 0.00 72.50 69.14 1j0j s THR 135 CO 0.07 0.26 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.48 1j0j s VAL 136 N -1.42 1.78 0.61 3.82 1.01 -1.26 -4.05 120.40 120.89 1j0j s VAL 136 Ca 0.33 -1.30 -0.10 0.00 0.00 0.00 0.00 61.98 60.91 1j0j s VAL 136 Cb -0.13 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.28 1j0j s VAL 136 CO 0.19 0.00 0.99 0.26 0.00 0.00 0.00 175.10 176.55 1j0j s TRP 137 N 1.29 3.55 -0.21 5.22 0.52 0.74 -1.90 118.94 128.16 1j0j s TRP 137 Ca -0.06 1.13 -0.04 0.00 0.02 0.00 0.00 56.10 57.16 1j0j s TRP 137 Cb -0.18 -2.71 0.07 0.00 -1.15 0.00 0.00 33.47 29.50 1j0j s TRP 137 CO -0.06 -0.71 0.08 -0.47 0.02 0.00 0.00 176.95 175.80 1j0j s TYR 138 N -3.13 0.64 -0.23 -1.98 6.14 0.70 -0.75 117.35 118.74 1j0j s TYR 138 Ca 0.54 -0.71 -0.26 0.00 0.64 0.00 0.00 57.07 57.28 1j0j s TYR 138 Cb -0.11 -0.92 -0.00 0.00 0.42 0.00 0.00 41.96 41.35 1j0j s TYR 138 CO 0.52 -0.62 0.91 -1.14 0.64 0.00 0.00 175.55 175.85 1j0j s GLN 139 N 1.99 4.22 -0.05 4.97 0.74 0.51 -1.91 119.66 130.13 1j0j s GLN 139 Ca 0.02 1.11 0.06 0.00 0.05 0.00 0.00 55.36 56.60 1j0j s GLN 139 Cb -0.17 -3.64 -0.02 0.00 1.10 0.00 0.00 33.01 30.29 1j0j s GLN 139 CO -0.14 -0.54 -0.22 0.42 -0.55 0.00 0.00 175.29 174.26 1j0j s ILE 140 N 2.91 2.37 -0.73 -2.34 1.01 -0.36 -1.41 121.20 122.65 1j0j s ILE 140 Ca 0.39 -0.97 -0.08 0.00 0.00 0.00 0.00 60.65 59.99 1j0j s ILE 140 Cb -0.15 -1.87 0.19 0.00 0.01 0.00 0.00 42.46 40.63 1j0j s ILE 140 CO 0.07 0.58 0.60 0.12 0.00 0.00 0.00 174.94 176.31 1j0j s PHE 141 N -0.43 3.58 0.16 3.97 5.36 -1.26 -2.54 117.98 126.82 1j0j s PHE 141 Ca 0.04 -2.42 -0.08 0.00 -0.96 0.00 0.00 56.93 53.52 1j0j s PHE 141 Cb -0.12 -3.47 0.22 0.00 -0.34 0.00 0.00 43.02 39.31 1j0j s PHE 141 CO 0.01 -0.90 0.97 -2.30 -1.46 0.00 0.00 175.22 171.54 1j0j n PRO 142 N 3.63 -0.10 0.09 10.12 -0.02 -1.26 -0.07 135.00 147.39 1j0j n PRO 142 Ca 0.11 0.97 0.05 0.00 -2.02 0.00 0.00 63.50 62.60 1j0j n PRO 142 Cb 0.42 -1.44 0.24 0.00 -0.02 0.00 0.00 33.50 32.70 1j0j n PRO 142 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1j0j n GLU 143 N -4.97 0.06 -0.34 -0.52 0.00 -1.26 -2.19 120.64 111.42 1j0j n GLU 143 Ca 0.08 0.50 0.04 0.00 0.00 0.00 0.00 57.16 57.79 1j0j n GLU 143 Cb 0.28 -1.83 0.06 0.00 0.00 0.00 0.00 31.44 29.96 1j0j n GLU 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1j0j n ARG 144 N -1.79 0.58 -0.11 5.31 5.12 0.90 -2.84 116.66 123.82 1j0j n ARG 144 Ca -0.01 -1.73 -0.19 0.00 -1.93 0.00 0.00 57.85 53.99 1j0j n ARG 144 Cb 0.15 -0.94 -0.07 0.00 -1.16 0.00 0.00 32.46 30.44 1j0j n ARG 144 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1j0j n PHE 145 N -0.63 0.44 -3.31 -1.55 7.35 -0.93 -0.22 117.46 118.61 1j0j n PHE 145 Ca 0.07 0.19 0.03 0.00 -0.76 0.00 0.00 57.45 56.99 1j0j n PHE 145 Cb 0.68 -0.88 -0.05 0.00 0.35 0.00 0.00 39.48 39.58 1j0j n PHE 145 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1j0j s ALA 146 N -2.59 -3.13 -1.04 3.13 0.00 -1.26 -4.38 121.76 112.49 1j0j s ALA 146 Ca -0.30 1.83 -0.20 0.00 0.00 0.00 0.00 51.96 53.29 1j0j s ALA 146 Cb 0.08 -2.22 -0.08 0.00 0.00 0.00 0.00 23.12 20.90 1j0j s ALA 146 CO 0.46 -0.79 1.99 -1.71 0.00 0.00 0.00 175.76 175.70 1j0j n ASN 147 N 4.12 3.11 0.32 0.00 5.15 -1.26 -2.98 115.26 123.72 1j0j n ASN 147 Ca -0.09 -2.74 0.21 0.00 -0.60 0.00 0.00 54.58 51.35 1j0j n ASN 147 Cb 0.56 -1.38 1.07 0.00 -0.53 0.00 0.00 39.78 39.50 1j0j n ASN 147 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 1j0j h GLY 148 N 13.36 0.00 -7.11 8.20 0.00 -1.83 -3.35 103.07 112.34 1j0j h GLY 148 Ca 0.43 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 47.17 1j0j h GLY 148 CO 1.80 0.00 -0.76 0.21 0.00 0.00 0.00 176.54 177.80 1j0j s ASN 149 N -5.41 3.94 0.30 0.19 3.84 -1.26 -4.75 114.94 111.78 1j0j s ASN 149 Ca -0.04 -1.85 0.25 0.00 0.21 0.00 0.00 52.86 51.43 1j0j s ASN 149 Cb 0.13 -0.90 1.04 0.00 -0.55 0.00 0.00 41.25 40.97 1j0j s ASN 149 CO 0.46 -0.38 1.75 -0.65 -2.79 0.00 0.00 177.10 175.48 1j0j h PRO 150 N 7.79 0.00 0.00 0.43 0.11 -1.91 -3.22 132.00 135.20 1j0j h PRO 150 Ca -0.10 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.84 1j0j h PRO 150 Cb 1.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 1j0j h PRO 150 CO 0.47 0.00 -0.82 0.66 -0.21 0.00 0.00 178.00 178.10 1j0j h SER 151 N 0.00 0.01 0.35 -2.05 4.64 -1.95 -3.28 113.55 111.27 1j0j h SER 151 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1j0j h SER 151 Cb 0.37 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1j0j h SER 151 CO 0.00 0.82 -0.93 2.30 -0.87 0.00 0.00 176.83 178.15 1j0j n ILE 152 N -3.57 0.09 -1.57 0.95 -5.35 -1.22 -4.96 119.36 103.73 1j0j n ILE 152 Ca -0.01 -0.15 -0.47 0.00 -0.27 0.00 0.00 62.75 61.86 1j0j n ILE 152 Cb 0.78 0.38 -0.03 0.00 -1.74 0.00 0.00 39.64 39.03 1j0j n ILE 152 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1j0j n SER 153 N -1.78 1.15 -4.73 7.28 7.64 -1.24 -4.30 113.62 117.64 1j0j n SER 153 Ca 0.03 1.16 -0.36 0.00 1.01 0.00 0.00 58.87 60.71 1j0j n SER 153 Cb 0.40 -1.24 0.07 0.00 -1.01 0.00 0.00 64.21 62.43 1j0j n SER 153 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1j0j s PRO 154 N -1.01 2.52 0.38 1.43 0.04 -1.26 -4.95 135.00 132.15 1j0j s PRO 154 Ca 0.65 1.87 -0.27 0.00 0.04 0.00 0.00 61.00 63.29 1j0j s PRO 154 Cb -0.78 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 31.80 1j0j s PRO 154 CO 0.56 -1.57 1.30 -1.21 0.04 0.00 0.00 177.00 176.12 1j0j s GLU 155 N -3.58 4.11 0.00 4.56 0.41 -1.26 -2.37 118.70 120.57 1j0j s GLU 155 Ca 0.78 2.16 0.00 0.00 -0.41 0.00 0.00 54.97 57.50 1j0j s GLU 155 Cb -0.32 -2.87 0.00 0.00 -1.78 0.00 0.00 34.13 29.16 1j0j s GLU 155 CO 0.40 -0.37 0.00 0.41 -0.49 0.00 0.00 175.26 175.21 1j0j n GLY 156 N 0.71 1.23 3.48 -1.39 0.00 -1.26 -4.98 105.19 102.97 1j0j n GLY 156 Ca 0.02 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.56 1j0j n GLY 156 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1j0j n SER 157 N 0.00 2.31 -4.73 1.61 2.88 -1.00 -4.82 113.62 109.87 1j0j n SER 157 Ca 0.00 0.34 -0.33 0.00 -1.33 0.00 0.00 58.87 57.54 1j0j n SER 157 Cb 0.00 -1.32 0.09 0.00 -0.75 0.00 0.00 64.21 62.23 1j0j n SER 157 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1j0j s ARG 158 N 6.36 2.16 0.42 -1.46 1.81 -0.88 -4.88 118.95 122.48 1j0j s ARG 158 Ca 1.08 1.59 -0.25 0.00 -1.72 0.00 0.00 55.73 56.43 1j0j s ARG 158 Cb -0.74 -1.85 -0.10 0.00 -0.45 0.00 0.00 34.95 31.80 1j0j s ARG 158 CO 0.46 -1.78 1.13 -2.30 -0.68 0.00 0.00 175.30 172.12 1j0j n PRO 159 N -2.92 1.60 -1.60 3.54 -0.02 -1.26 -4.67 135.00 129.67 1j0j n PRO 159 Ca 0.12 0.57 -0.49 0.00 -2.02 0.00 0.00 63.50 61.68 1j0j n PRO 159 Cb 0.51 -2.18 -0.05 0.00 -0.02 0.00 0.00 33.50 31.75 1j0j n PRO 159 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 1j0j n TRP 160 N -0.35 2.04 -0.83 6.00 -0.00 -1.26 -0.38 117.44 122.66 1j0j n TRP 160 Ca 0.08 0.10 0.00 0.00 -0.00 0.00 0.00 57.50 57.69 1j0j n TRP 160 Cb 0.39 -2.62 0.00 0.00 -0.00 0.00 0.00 31.31 29.08 1j0j n TRP 160 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1j0j n GLY 161 N 5.23 1.08 0.00 5.87 0.00 -1.26 -4.95 105.19 111.16 1j0j n GLY 161 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.32 1j0j n GLY 161 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1j0j n SER 162 N 0.00 0.00 -0.57 1.61 2.88 0.49 -4.84 113.62 113.18 1j0j n SER 162 Ca 0.00 0.88 0.00 0.00 -1.33 0.00 0.00 58.87 58.42 1j0j n SER 162 Cb 0.00 -0.41 0.00 0.00 -0.75 0.00 0.00 64.21 63.05 1j0j n SER 162 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1j0j n GLU 163 N -2.69 0.10 -2.53 -1.46 0.00 -1.26 -5.09 120.64 107.71 1j0j n GLU 163 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 57.16 56.80 1j0j n GLU 163 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 31.44 31.40 1j0j n GLU 163 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1j0j s ASP 164 N -0.10 6.63 0.50 -1.84 1.11 -1.26 -4.89 116.67 116.83 1j0j s ASP 164 Ca 0.00 2.02 -0.20 0.00 0.18 0.00 0.00 52.55 54.55 1j0j s ASP 164 Cb 0.00 -2.58 -0.07 0.00 1.07 0.00 0.00 42.92 41.34 1j0j s ASP 164 CO 0.00 -0.58 1.10 -2.84 1.18 0.00 0.00 175.17 174.03 1j0j s PRO 165 N -2.69 3.60 0.30 8.23 0.02 -1.26 -5.04 135.00 138.16 1j0j s PRO 165 Ca 0.60 1.55 0.10 0.00 0.02 0.00 0.00 61.00 63.28 1j0j s PRO 165 Cb -0.21 -2.12 -0.05 0.00 0.02 0.00 0.00 34.50 32.14 1j0j s PRO 165 CO 0.26 -0.63 -0.07 0.95 -0.33 0.00 0.00 177.00 177.17 1j0j s THR 166 N -1.80 2.80 -1.74 0.99 -4.23 -1.26 -4.64 115.64 105.75 1j0j s THR 166 Ca 0.69 -2.12 0.00 0.00 -1.18 0.00 0.00 61.69 59.08 1j0j s THR 166 Cb -0.22 -2.63 0.00 0.00 1.34 0.00 0.00 72.50 70.99 1j0j s THR 166 CO 0.26 -0.32 0.44 -0.81 -0.54 0.00 0.00 174.62 173.65 1j0j n PRO 167 N -0.81 0.00 0.00 3.99 -0.04 -1.26 -2.12 135.00 134.76 1j0j n PRO 167 Ca -0.05 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1j0j n PRO 167 Cb 0.61 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 1j0j n PRO 167 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1j0j n THR 168 N -0.94 0.02 -1.89 0.52 -2.24 -1.26 -4.80 114.28 103.68 1j0j n THR 168 Ca 0.00 -0.02 -0.29 0.00 -2.27 0.00 0.00 64.05 61.47 1j0j n THR 168 Cb 0.00 1.30 0.08 0.00 -2.10 0.00 0.00 70.33 69.61 1j0j n THR 168 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1j0j s SER 169 N -0.02 4.63 0.02 3.42 1.04 -0.90 -4.91 113.70 116.99 1j0j s SER 169 Ca 0.00 0.83 0.00 0.00 0.48 0.00 0.00 55.95 57.27 1j0j s SER 169 Cb 0.00 -1.37 -0.02 0.00 0.10 0.00 0.00 66.02 64.73 1j0j s SER 169 CO 0.00 -1.83 -0.03 -0.36 0.98 0.00 0.00 173.24 172.00 1j0j s PHE 170 N -3.54 0.28 -0.02 5.02 0.08 -1.26 -4.73 117.98 113.80 1j0j s PHE 170 Ca 0.61 -0.52 0.10 0.00 0.12 0.00 0.00 56.93 57.24 1j0j s PHE 170 Cb -0.11 -0.20 0.17 0.00 -0.57 0.00 0.00 43.02 42.31 1j0j s PHE 170 CO 0.49 -0.18 1.07 1.19 -0.10 0.00 0.00 175.22 177.70 1j0j n PHE 171 N 1.61 0.00 -1.96 0.36 3.01 -1.26 -2.07 117.46 117.15 1j0j n PHE 171 Ca -0.24 -0.32 -0.16 0.00 1.01 0.00 0.00 57.45 57.74 1j0j n PHE 171 Cb 0.55 -0.10 -0.04 0.00 -0.01 0.00 0.00 39.48 39.88 1j0j n PHE 171 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1j0j n GLY 172 N -0.07 0.52 3.77 1.37 0.00 -1.26 -4.72 105.19 104.79 1j0j n GLY 172 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1j0j n GLY 172 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1j0j s GLY 173 N -2.21 2.89 0.28 -0.02 0.00 -1.13 -4.16 107.32 102.96 1j0j s GLY 173 Ca 0.00 1.11 -0.09 0.00 0.00 0.00 0.00 44.72 45.74 1j0j s GLY 173 CO 0.00 1.65 0.47 0.51 0.00 0.00 0.00 173.10 175.73 1j0j s ASP 174 N -0.97 0.23 0.44 1.64 1.47 -1.16 -4.12 116.67 114.20 1j0j s ASP 174 Ca 0.59 -1.14 0.16 0.00 1.18 0.00 0.00 52.55 53.34 1j0j s ASP 174 Cb -0.34 0.61 1.08 0.00 -0.34 0.00 0.00 42.92 43.93 1j0j s ASP 174 CO 0.43 -1.19 1.95 -0.07 0.68 0.00 0.00 175.17 176.97 1j0j h LEU 175 N 2.23 0.34 0.01 2.11 3.38 -1.73 -2.06 115.31 119.59 1j0j h LEU 175 Ca -0.28 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1j0j h LEU 175 Cb 1.25 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1j0j h LEU 175 CO 0.38 0.19 -0.00 -0.61 0.09 0.00 0.00 178.44 178.48 1j0j h GLN 176 N 0.37 -0.01 -0.94 1.13 5.75 -1.87 -2.28 115.11 117.25 1j0j h GLN 176 Ca 0.33 0.00 0.26 0.00 -0.15 0.00 0.00 58.65 59.09 1j0j h GLN 176 Cb 0.77 0.00 -0.14 0.00 1.07 0.00 0.00 27.48 29.18 1j0j h GLN 176 CO -0.09 0.15 0.42 0.78 -2.65 0.00 0.00 178.83 177.43 1j0j h GLY 177 N -0.17 1.69 0.85 2.39 0.00 -1.28 0.99 103.07 107.54 1j0j h GLY 177 Ca -0.00 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 1j0j h GLY 177 CO 0.00 -0.37 0.01 -2.22 0.00 0.00 0.00 176.54 173.97 1j0j h ILE 178 N 0.33 1.13 -0.56 2.60 2.04 -1.44 -1.80 117.51 119.81 1j0j h ILE 178 Ca 0.62 -0.38 0.06 0.00 1.00 0.00 0.00 64.86 66.15 1j0j h ILE 178 Cb 1.29 1.34 -0.05 0.00 -0.74 0.00 0.00 36.82 38.65 1j0j h ILE 178 CO -0.59 0.10 0.28 0.40 0.00 0.00 0.00 178.15 178.35 1j0j h ILE 179 N -0.11 0.93 0.00 -0.67 2.04 0.21 -1.37 117.51 118.54 1j0j h ILE 179 Ca 0.01 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1j0j h ILE 179 Cb 0.16 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1j0j h ILE 179 CO -0.00 0.10 0.00 0.44 0.00 0.00 0.00 178.15 178.69 1j0j h ASP 180 N 0.54 0.00 -0.02 1.72 3.32 0.12 -2.94 116.42 119.16 1j0j h ASP 180 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 1j0j h ASP 180 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1j0j h ASP 180 CO -0.18 0.00 0.00 1.41 -1.72 0.00 0.00 179.24 178.75 1j0j n HIS 181 N -2.68 0.02 -0.42 4.55 8.25 -0.64 -4.66 115.22 119.63 1j0j n HIS 181 Ca -0.01 -0.06 0.35 0.00 -0.26 0.00 0.00 57.72 57.73 1j0j n HIS 181 Cb 0.12 -0.01 0.64 0.00 1.12 0.00 0.00 29.99 31.87 1j0j n HIS 181 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1j0j h LEU 182 N 0.71 0.24 -1.06 2.41 3.38 -1.10 1.10 115.31 120.99 1j0j h LEU 182 Ca 0.00 0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.11 1j0j h LEU 182 Cb 0.21 0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.97 1j0j h LEU 182 CO 0.00 -0.08 0.63 0.44 0.09 0.00 0.00 178.44 179.52 1j0j h ASP 183 N 0.14 1.04 -0.79 -0.43 3.32 -1.83 0.53 116.42 118.41 1j0j h ASP 183 Ca 0.75 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.75 1j0j h ASP 183 Cb 2.39 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 41.67 1j0j h ASP 183 CO -0.30 0.70 0.34 0.22 -1.72 0.00 0.00 179.24 178.48 1j0j h TYR 184 N 1.20 1.18 -0.14 4.55 3.20 0.92 -2.22 116.97 125.65 1j0j h TYR 184 Ca 0.39 -0.08 -0.22 0.00 3.14 0.00 0.00 58.73 61.97 1j0j h TYR 184 Cb 0.05 -0.36 0.01 0.00 1.54 0.00 0.00 36.73 37.97 1j0j h TYR 184 CO -0.00 0.88 -0.76 -0.07 -1.64 0.00 0.00 178.16 176.57 1j0j h LEU 185 N 1.13 0.91 -0.47 2.82 3.38 -1.22 -1.89 115.31 119.97 1j0j h LEU 185 Ca 0.27 -0.64 0.02 0.00 0.09 0.00 0.00 57.88 57.62 1j0j h LEU 185 Cb 0.18 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1j0j h LEU 185 CO -0.03 1.40 0.28 0.58 0.09 0.00 0.00 178.44 180.77 1j0j h VAL 186 N 0.49 1.05 0.24 1.22 2.07 -0.87 -0.66 116.25 119.78 1j0j h VAL 186 Ca -0.06 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.28 1j0j h VAL 186 Cb 1.40 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 1j0j h VAL 186 CO 0.16 0.10 -0.27 -0.78 0.02 0.00 0.00 177.57 176.79 1j0j h ASP 187 N 0.56 -0.75 -1.02 0.57 3.58 -1.38 -2.04 116.42 115.94 1j0j h ASP 187 Ca 0.19 0.07 0.25 0.00 0.42 0.00 0.00 57.03 57.96 1j0j h ASP 187 Cb 0.02 0.26 -0.09 0.00 1.72 0.00 0.00 39.33 41.24 1j0j h ASP 187 CO -0.09 -0.39 0.65 0.25 -2.88 0.00 0.00 179.24 176.78 1j0j h LEU 188 N -0.56 0.48 0.00 2.28 5.85 -0.75 -3.45 115.31 119.17 1j0j h LEU 188 Ca -0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1j0j h LEU 188 Cb 0.53 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.56 1j0j h LEU 188 CO -0.08 0.11 0.00 0.61 -0.34 0.00 0.00 178.44 178.74 1j0j n GLY 189 N -1.46 1.00 3.76 3.75 0.00 -0.33 -4.48 105.19 107.43 1j0j n GLY 189 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1j0j n GLY 189 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j0j s ILE 190 N -2.00 2.12 -0.06 -0.61 -1.09 -0.77 -4.83 121.20 113.96 1j0j s ILE 190 Ca 0.00 0.11 0.09 0.00 -2.23 0.00 0.00 60.65 58.61 1j0j s ILE 190 Cb 0.00 -3.07 0.13 0.00 -1.58 0.00 0.00 42.46 37.94 1j0j s ILE 190 CO 0.00 0.02 1.02 0.35 -1.23 0.00 0.00 174.94 175.10 1j0j n THR 191 N 1.63 1.09 -3.64 2.92 -2.24 -0.80 -4.58 114.28 108.65 1j0j n THR 191 Ca 0.06 -1.26 -0.07 0.00 -2.27 0.00 0.00 64.05 60.51 1j0j n THR 191 Cb 0.38 0.21 -0.07 0.00 -2.10 0.00 0.00 70.33 68.76 1j0j n THR 191 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1j0j s GLY 192 N -1.76 -0.18 -0.14 3.38 0.00 -1.19 -2.18 107.32 105.25 1j0j s GLY 192 Ca 0.15 2.75 0.02 0.00 0.00 0.00 0.00 44.72 47.64 1j0j s GLY 192 CO 0.01 2.13 -0.22 -0.42 0.00 0.00 0.00 173.10 174.61 1j0j s ILE 193 N 0.75 2.05 -0.21 0.90 1.01 0.61 -0.21 121.20 126.09 1j0j s ILE 193 Ca -0.02 -0.97 -0.05 0.00 0.00 0.00 0.00 60.65 59.61 1j0j s ILE 193 Cb -0.05 -1.81 -0.02 0.00 0.01 0.00 0.00 42.46 40.59 1j0j s ILE 193 CO -0.10 0.55 -0.01 -0.47 0.00 0.00 0.00 174.94 174.91 1j0j s TYR 194 N 0.84 3.01 -0.07 3.97 5.04 -0.80 0.06 117.35 129.40 1j0j s TYR 194 Ca -0.06 -0.62 0.01 0.00 -2.44 0.00 0.00 57.07 53.95 1j0j s TYR 194 Cb -0.15 -2.11 -0.03 0.00 0.35 0.00 0.00 41.96 40.02 1j0j s TYR 194 CO -0.03 -0.36 -0.06 -0.51 -1.34 0.00 0.00 175.55 173.25 1j0j s LEU 195 N 1.24 3.19 1.18 6.97 1.43 -0.02 -1.23 118.68 131.44 1j0j s LEU 195 Ca 0.03 -0.02 -0.20 0.00 -1.03 0.00 0.00 54.13 52.92 1j0j s LEU 195 Cb -0.15 -1.70 0.29 0.00 0.03 0.00 0.00 46.19 44.66 1j0j s LEU 195 CO 0.01 0.36 1.18 0.42 0.23 0.00 0.00 176.35 178.54 1j0j s THR 196 N -0.78 1.64 0.10 5.49 -4.23 -1.05 -2.26 115.64 114.54 1j0j s THR 196 Ca 0.12 0.00 -0.35 0.00 -1.18 0.00 0.00 61.69 60.28 1j0j s THR 196 Cb -0.11 -2.63 -0.18 0.00 1.34 0.00 0.00 72.50 70.93 1j0j s THR 196 CO 0.01 0.00 1.04 -2.65 -0.54 0.00 0.00 174.62 172.49 1j0j n PRO 197 N -4.62 0.53 0.00 3.99 -0.02 -1.26 -4.46 135.00 129.16 1j0j n PRO 197 Ca 0.16 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1j0j n PRO 197 Cb 0.60 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 1j0j n PRO 197 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1j0j n ILE 198 N 1.39 0.38 -2.24 4.25 -5.35 -1.26 -4.74 119.36 111.79 1j0j n ILE 198 Ca 0.18 -0.47 -0.24 0.00 -0.27 0.00 0.00 62.75 61.95 1j0j n ILE 198 Cb 0.18 0.95 0.15 0.00 -1.74 0.00 0.00 39.64 39.18 1j0j n ILE 198 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1j0j n PHE 199 N -0.19 -3.46 -1.92 4.28 3.72 -1.26 -0.98 117.46 117.64 1j0j n PHE 199 Ca 0.00 -1.38 -0.42 0.00 -0.05 0.00 0.00 57.45 55.59 1j0j n PHE 199 Cb 0.28 -0.82 -0.03 0.00 -0.94 0.00 0.00 39.48 37.98 1j0j n PHE 199 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 1j0j s ARG 200 N -5.31 4.17 -0.19 -1.08 3.52 0.08 -3.96 118.95 116.19 1j0j s ARG 200 Ca 0.66 2.30 -0.23 0.00 -0.13 0.00 0.00 55.73 58.33 1j0j s ARG 200 Cb -0.03 -4.02 0.06 0.00 -1.56 0.00 0.00 34.95 29.40 1j0j s ARG 200 CO 0.45 -0.87 0.63 0.45 -0.81 0.00 0.00 175.30 175.15 1j0j s SER 201 N 3.59 -0.64 0.50 -2.12 0.15 -1.26 0.66 113.70 114.58 1j0j s SER 201 Ca 0.77 1.10 0.27 0.00 0.70 0.00 0.00 55.95 58.79 1j0j s SER 201 Cb -0.36 1.09 1.29 0.00 -1.71 0.00 0.00 66.02 66.33 1j0j s SER 201 CO 0.33 -0.31 1.99 1.55 1.20 0.00 0.00 173.24 178.00 1j0j h PRO 202 N 4.63 0.00 -7.74 5.44 0.13 -1.94 -3.46 132.00 129.05 1j0j h PRO 202 Ca -0.28 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.40 1j0j h PRO 202 Cb 1.16 0.00 0.15 0.00 0.13 0.00 0.00 31.00 32.44 1j0j h PRO 202 CO 0.18 0.15 0.39 -1.54 -0.23 0.00 0.00 178.00 176.95 1j0j s SER 203 N -6.14 3.33 0.00 1.44 1.04 -1.26 -5.00 113.70 107.11 1j0j s SER 203 Ca -0.02 0.24 0.26 0.00 0.48 0.00 0.00 55.95 56.91 1j0j s SER 203 Cb 0.12 -0.35 0.61 0.00 0.10 0.00 0.00 66.02 66.50 1j0j s SER 203 CO 0.60 -2.59 1.48 -0.46 0.98 0.00 0.00 173.24 173.24 1j0j n ASN 204 N -3.65 1.18 -0.02 7.02 0.23 -1.26 -4.03 115.26 114.73 1j0j n ASN 204 Ca 0.15 -0.98 0.01 0.00 -0.53 0.00 0.00 54.58 53.23 1j0j n ASN 204 Cb 0.60 0.20 -0.07 0.00 -2.08 0.00 0.00 39.78 38.43 1j0j n ASN 204 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1j0j n HIS 205 N -0.57 0.00 -1.50 -2.53 1.44 -1.26 -4.70 115.22 106.10 1j0j n HIS 205 Ca 0.11 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.68 1j0j n HIS 205 Cb 0.37 -0.28 -0.05 0.00 0.12 0.00 0.00 29.99 30.15 1j0j n HIS 205 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1j0j n LYS 206 N -1.98 -0.99 0.00 -1.40 4.76 -1.26 -4.33 118.16 112.95 1j0j n LYS 206 Ca -0.06 0.96 0.15 0.00 -2.87 0.00 0.00 58.31 56.49 1j0j n LYS 206 Cb 0.42 -5.08 0.75 0.00 -1.84 0.00 0.00 35.03 29.28 1j0j n LYS 206 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1j0j n TYR 207 N -2.74 0.00 -3.36 2.13 4.01 -1.26 -3.97 117.16 111.98 1j0j n TYR 207 Ca -0.14 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.27 1j0j n TYR 207 Cb 0.48 -0.24 -0.05 0.00 -0.31 0.00 0.00 39.34 39.21 1j0j n TYR 207 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1j0j n ASP 208 N -1.20 4.59 -4.59 7.72 5.75 -1.26 -4.84 116.55 122.72 1j0j n ASP 208 Ca 0.15 -3.38 -0.45 0.00 -0.01 0.00 0.00 54.79 51.11 1j0j n ASP 208 Cb 0.24 -0.91 -0.02 0.00 -1.03 0.00 0.00 41.12 39.40 1j0j n ASP 208 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1j0j n THR 209 N 1.26 1.97 -0.03 2.12 -1.04 -1.25 -4.15 114.28 113.15 1j0j n THR 209 Ca 0.27 -0.49 -0.03 0.00 -2.04 0.00 0.00 64.05 61.76 1j0j n THR 209 Cb 0.38 -1.00 -0.05 0.00 -1.82 0.00 0.00 70.33 67.84 1j0j n THR 209 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1j0j n ALA 210 N 0.25 1.86 -3.22 2.41 0.00 0.21 0.13 120.51 122.15 1j0j n ALA 210 Ca 0.10 -0.40 -0.02 0.00 0.00 0.00 0.00 53.44 53.12 1j0j n ALA 210 Cb 0.32 0.11 -0.03 0.00 0.00 0.00 0.00 19.45 19.85 1j0j n ALA 210 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1j0j s ASP 211 N -3.73 -0.72 0.49 0.00 3.68 -1.14 -4.23 116.67 111.01 1j0j s ASP 211 Ca -0.03 0.05 0.33 0.00 2.13 0.00 0.00 52.55 55.03 1j0j s ASP 211 Cb 0.02 1.64 1.65 0.00 -1.45 0.00 0.00 42.92 44.78 1j0j s ASP 211 CO 0.25 -0.32 2.00 1.88 0.13 0.00 0.00 175.17 179.12 1j0j h TYR 212 N 8.07 0.00 -0.59 -5.34 -1.99 -1.93 -2.58 116.97 112.61 1j0j h TYR 212 Ca -0.07 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 60.52 1j0j h TYR 212 Cb 1.16 0.00 -0.08 0.00 2.00 0.00 0.00 36.73 39.81 1j0j h TYR 212 CO 0.24 0.00 0.15 1.19 -0.00 0.00 0.00 178.16 179.74 1j0j n PHE 213 N -2.73 2.01 -3.69 4.88 3.01 -1.26 -4.89 117.46 114.78 1j0j n PHE 213 Ca -0.01 -1.10 -0.20 0.00 1.01 0.00 0.00 57.45 57.15 1j0j n PHE 213 Cb 0.14 -0.58 -0.18 0.00 -0.01 0.00 0.00 39.48 38.85 1j0j n PHE 213 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 1j0j s GLU 214 N -2.96 0.00 0.41 -1.08 0.41 -0.97 -5.09 118.70 109.42 1j0j s GLU 214 Ca 0.52 0.33 -0.26 0.00 -0.41 0.00 0.00 54.97 55.15 1j0j s GLU 214 Cb 0.42 -0.54 -0.08 0.00 -1.78 0.00 0.00 34.13 32.15 1j0j s GLU 214 CO 0.12 -0.31 1.27 0.08 -0.49 0.00 0.00 175.26 175.93 1j0j s VAL 215 N 2.04 2.72 -0.07 2.63 1.01 -1.26 -0.74 120.40 126.73 1j0j s VAL 215 Ca 0.04 0.63 -0.30 0.00 0.00 0.00 0.00 61.98 62.35 1j0j s VAL 215 Cb -0.12 -3.37 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 1j0j s VAL 215 CO -0.03 0.08 1.51 -0.62 0.00 0.00 0.00 175.10 176.03 1j0j s ASP 216 N -0.83 6.77 0.36 3.32 2.15 -0.16 -4.49 116.67 123.79 1j0j s ASP 216 Ca 0.57 2.08 0.21 0.00 0.43 0.00 0.00 52.55 55.84 1j0j s ASP 216 Cb -0.36 -2.54 1.29 0.00 -0.30 0.00 0.00 42.92 41.00 1j0j s ASP 216 CO 0.46 -0.84 1.50 -2.65 -0.17 0.00 0.00 175.17 173.47 1j0j n PRO 217 N 6.59 -0.06 0.00 4.34 -0.02 -1.25 -0.27 135.00 144.33 1j0j n PRO 217 Ca 0.16 1.30 0.09 0.00 -2.02 0.00 0.00 63.50 63.03 1j0j n PRO 217 Cb 0.43 -2.35 0.46 0.00 -0.02 0.00 0.00 33.50 32.03 1j0j n PRO 217 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1j0j n HIS 218 N -5.11 0.00 -0.10 6.00 8.25 -1.26 -3.13 115.22 119.88 1j0j n HIS 218 Ca 0.36 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.65 1j0j n HIS 218 Cb 1.24 -0.29 -0.08 0.00 1.12 0.00 0.00 29.99 31.99 1j0j n HIS 218 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1j0j n PHE 219 N -1.29 0.00 0.00 4.41 3.01 0.63 -4.42 117.46 119.80 1j0j n PHE 219 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.55 1j0j n PHE 219 Cb 0.15 -0.71 0.00 0.00 -0.01 0.00 0.00 39.48 38.91 1j0j n PHE 219 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1j0j n GLY 220 N 2.22 -0.58 3.29 1.37 0.00 -1.07 -2.06 105.19 108.37 1j0j n GLY 220 Ca -0.35 -0.54 -0.16 0.00 0.00 0.00 0.00 46.02 44.97 1j0j n GLY 220 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1j0j s ASP 221 N -4.00 0.95 0.27 1.61 1.47 -1.26 -3.91 116.67 111.81 1j0j s ASP 221 Ca 0.00 -1.56 0.01 0.00 1.18 0.00 0.00 52.55 52.18 1j0j s ASP 221 Cb 0.00 0.50 0.62 0.00 -0.34 0.00 0.00 42.92 43.70 1j0j s ASP 221 CO 0.00 -1.01 1.72 0.11 0.68 0.00 0.00 175.17 176.67 1j0j h LYS 222 N 2.32 0.45 -0.93 2.11 1.57 -1.99 0.23 116.57 120.32 1j0j h LYS 222 Ca -0.29 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.54 1j0j h LYS 222 Cb 1.24 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.38 1j0j h LYS 222 CO 0.43 0.30 0.59 1.49 -0.57 0.00 0.00 179.45 181.68 1j0j h GLU 223 N 0.46 1.00 -0.18 3.15 4.81 -2.00 -0.72 114.58 121.11 1j0j h GLU 223 Ca 0.50 -0.06 -0.14 0.00 -0.13 0.00 0.00 59.36 59.53 1j0j h GLU 223 Cb 0.87 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 1j0j h GLU 223 CO -0.47 0.66 -0.49 1.15 -0.73 0.00 0.00 179.01 179.14 1j0j h THR 224 N 1.03 1.32 -0.47 0.32 2.02 -0.99 -2.42 112.91 113.71 1j0j h THR 224 Ca 0.42 -1.72 -0.14 0.00 0.77 0.00 0.00 66.41 65.75 1j0j h THR 224 Cb 0.24 1.72 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 1j0j h THR 224 CO -0.20 0.53 -0.23 0.25 0.37 0.00 0.00 175.52 176.24 1j0j h LEU 225 N 0.38 1.03 -0.23 2.58 5.85 -0.31 -1.84 115.31 122.76 1j0j h LEU 225 Ca 0.02 -0.40 -0.02 0.00 0.84 0.00 0.00 57.88 58.32 1j0j h LEU 225 Cb 1.00 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 1j0j h LEU 225 CO 0.09 1.20 0.08 0.50 -0.34 0.00 0.00 178.44 179.97 1j0j h LYS 226 N 0.85 0.36 -0.19 1.25 1.63 -1.11 -1.36 116.57 118.00 1j0j h LYS 226 Ca 0.11 -0.07 0.03 0.00 -0.85 0.00 0.00 60.65 59.86 1j0j h LYS 226 Cb 0.82 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 32.37 1j0j h LYS 226 CO 0.07 0.43 0.01 0.00 -3.45 0.00 0.00 179.45 176.51 1j0j h THR 227 N 0.21 0.88 0.22 1.00 1.03 -1.33 0.58 112.91 115.51 1j0j h THR 227 Ca 0.08 -0.03 0.01 0.00 -0.01 0.00 0.00 66.41 66.46 1j0j h THR 227 Cb 0.22 0.80 -0.02 0.00 -1.07 0.00 0.00 68.15 68.08 1j0j h THR 227 CO -0.00 0.01 -0.26 0.25 -0.01 0.00 0.00 175.52 175.51 1j0j h LEU 228 N 0.07 -0.71 0.41 0.00 5.85 -1.25 0.24 115.31 119.93 1j0j h LEU 228 Ca 0.09 0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 1j0j h LEU 228 Cb 0.10 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1j0j h LEU 228 CO -0.14 -0.37 -0.29 0.40 -0.34 0.00 0.00 178.44 177.70 1j0j h ILE 229 N -0.52 0.39 -0.64 4.05 2.04 -0.92 0.26 117.51 122.17 1j0j h ILE 229 Ca 0.00 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.97 1j0j h ILE 229 Cb 0.50 0.39 -0.08 0.00 -0.74 0.00 0.00 36.82 36.89 1j0j h ILE 229 CO -0.08 0.00 0.22 0.44 0.00 0.00 0.00 178.15 178.72 1j0j h ASP 230 N -0.69 0.18 -0.30 1.72 3.32 0.26 0.11 116.42 121.02 1j0j h ASP 230 Ca -0.04 0.09 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 1j0j h ASP 230 Cb 0.59 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.21 1j0j h ASP 230 CO 0.01 0.10 -0.01 -0.09 -1.72 0.00 0.00 179.24 177.53 1j0j h ARG 231 N 0.38 0.65 -0.63 3.56 9.65 -0.22 -2.51 114.38 125.26 1j0j h ARG 231 Ca 0.33 -0.16 -0.07 0.00 -1.10 0.00 0.00 59.98 58.99 1j0j h ARG 231 Cb 0.45 -0.08 -0.03 0.00 -1.39 0.00 0.00 29.97 28.92 1j0j h ARG 231 CO -0.35 0.67 0.13 0.00 2.80 0.00 0.00 179.97 183.22 1j0j h HIS 233 N 0.94 0.60 -1.00 0.00 3.86 -0.50 0.22 115.15 119.27 1j0j h HIS 233 Ca 0.20 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.46 1j0j h HIS 233 Cb 0.39 -0.19 -0.06 0.00 1.06 0.00 0.00 27.41 28.61 1j0j h HIS 233 CO 0.03 0.31 0.66 0.93 0.86 0.00 0.00 177.93 180.72 1j0j h GLU 234 N 0.63 1.24 -0.35 2.45 5.08 -1.37 0.27 114.58 122.53 1j0j h GLU 234 Ca 0.25 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1j0j h GLU 234 Cb 0.10 -0.28 0.00 0.00 0.50 0.00 0.00 28.75 29.07 1j0j h GLU 234 CO -0.14 0.82 0.00 1.63 -1.00 0.00 0.00 179.01 180.32 1j0j n LYS 235 N -4.44 1.28 -3.59 2.33 4.76 -0.86 -4.87 118.16 112.76 1j0j n LYS 235 Ca 0.13 -0.32 -0.22 0.00 -2.87 0.00 0.00 58.31 55.04 1j0j n LYS 235 Cb 0.09 -1.23 0.07 0.00 -1.84 0.00 0.00 35.03 32.12 1j0j n LYS 235 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1j0j n GLY 236 N 0.46 -0.42 2.83 0.72 0.00 0.95 -5.00 105.19 104.74 1j0j n GLY 236 Ca 0.03 0.16 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 1j0j n GLY 236 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j0j s ILE 237 N -3.40 1.72 0.47 -0.61 1.01 0.72 -4.70 121.20 116.40 1j0j s ILE 237 Ca 0.25 -2.43 -0.23 0.00 0.00 0.00 0.00 60.65 58.25 1j0j s ILE 237 Cb -0.12 -2.23 -0.09 0.00 0.01 0.00 0.00 42.46 40.03 1j0j s ILE 237 CO 0.76 -0.77 1.00 0.54 0.00 0.00 0.00 174.94 176.47 1j0j n ARG 238 N 3.88 1.27 -5.10 2.79 5.12 -0.93 -4.16 116.66 119.53 1j0j n ARG 238 Ca 0.05 0.46 -0.32 0.00 -1.93 0.00 0.00 57.85 56.11 1j0j n ARG 238 Cb 0.37 -2.08 -0.15 0.00 -1.16 0.00 0.00 32.46 29.44 1j0j n ARG 238 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1j0j s VAL 239 N -1.34 2.48 -0.04 1.55 1.01 -1.26 -0.29 120.40 122.51 1j0j s VAL 239 Ca 0.66 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.74 1j0j s VAL 239 Cb -0.52 -1.94 0.01 0.00 0.00 0.00 0.00 36.38 33.93 1j0j s VAL 239 CO 0.55 0.57 -0.11 -0.32 0.00 0.00 0.00 175.10 175.79 1j0j s MET 240 N -0.35 1.33 0.20 2.72 1.75 0.11 0.17 119.30 125.24 1j0j s MET 240 Ca 0.02 -0.37 0.05 0.00 -1.25 0.00 0.00 55.69 54.15 1j0j s MET 240 Cb -0.12 -1.17 -0.04 0.00 2.84 0.00 0.00 34.83 36.34 1j0j s MET 240 CO 0.02 0.09 0.20 -0.51 -0.65 0.00 0.00 175.02 174.18 1j0j s LEU 241 N 0.39 3.94 -0.13 4.11 1.43 -1.00 -0.84 118.68 126.56 1j0j s LEU 241 Ca -0.08 -0.11 -0.20 0.00 -1.03 0.00 0.00 54.13 52.71 1j0j s LEU 241 Cb -0.12 -2.50 -0.04 0.00 0.03 0.00 0.00 46.19 43.56 1j0j s LEU 241 CO 0.02 0.01 0.56 -0.62 0.23 0.00 0.00 176.35 176.55 1j0j s ASP 242 N -3.49 6.73 -0.38 2.29 3.68 -0.96 0.11 116.67 124.66 1j0j s ASP 242 Ca 0.32 0.88 -0.05 0.00 2.13 0.00 0.00 52.55 55.83 1j0j s ASP 242 Cb -0.09 -2.33 0.08 0.00 -1.45 0.00 0.00 42.92 39.13 1j0j s ASP 242 CO 0.25 -0.10 0.16 0.00 0.13 0.00 0.00 175.17 175.62 1j0j s ALA 243 N 1.03 3.11 -1.19 3.66 0.00 0.14 -4.59 121.76 123.92 1j0j s ALA 243 Ca 0.29 -2.12 -0.14 0.00 0.00 0.00 0.00 51.96 49.99 1j0j s ALA 243 Cb -0.16 -2.37 0.17 0.00 0.00 0.00 0.00 23.12 20.77 1j0j s ALA 243 CO 0.12 -1.56 1.40 0.08 0.00 0.00 0.00 175.76 175.79 1j0j s VAL 244 N 1.30 5.06 -0.39 0.00 1.01 -1.26 -2.31 120.40 123.81 1j0j s VAL 244 Ca 0.02 -2.61 0.23 0.00 0.00 0.00 0.00 61.98 59.62 1j0j s VAL 244 Cb -0.22 -4.89 -0.08 0.00 0.00 0.00 0.00 36.38 31.20 1j0j s VAL 244 CO -0.00 -1.59 1.00 0.49 0.00 0.00 0.00 175.10 174.99 1j0j n PHE 245 N 5.56 0.54 -0.22 5.22 3.72 -1.26 -4.26 117.46 126.76 1j0j n PHE 245 Ca 0.35 0.16 -0.08 0.00 -0.05 0.00 0.00 57.45 57.83 1j0j n PHE 245 Cb 0.43 -0.68 0.05 0.00 -0.94 0.00 0.00 39.48 38.35 1j0j n PHE 245 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 1j0j h ASN 246 N 0.00 1.04 -5.12 4.37 -1.24 -1.85 -3.43 115.58 109.35 1j0j h ASN 246 Ca 0.00 -0.26 -0.10 0.00 0.71 0.00 0.00 56.30 56.65 1j0j h ASN 246 Cb 0.87 -0.28 -0.16 0.00 0.73 0.00 0.00 38.32 39.49 1j0j h ASN 246 CO 0.00 1.04 -0.42 -1.38 -1.29 0.00 0.00 177.43 175.39 1j0j s HIS 247 N -5.16 0.15 0.06 0.67 -3.43 -1.26 -1.11 115.29 105.20 1j0j s HIS 247 Ca -0.12 -0.50 0.01 0.00 -0.80 0.00 0.00 55.06 53.66 1j0j s HIS 247 Cb 0.14 -0.08 0.01 0.00 -1.43 0.00 0.00 32.58 31.22 1j0j s HIS 247 CO 0.85 -0.47 0.06 0.00 -2.00 0.00 0.00 174.74 173.18 1j0j s GLY 249 N -2.04 1.96 0.34 0.00 0.00 0.12 -3.63 107.32 104.07 1j0j s GLY 249 Ca 0.05 -1.78 0.23 0.00 0.00 0.00 0.00 44.72 43.22 1j0j s GLY 249 CO 0.03 -1.65 1.70 -1.82 0.00 0.00 0.00 173.10 171.36 1j0j h TYR 250 N 1.20 0.00 -0.37 1.90 3.20 -1.41 -1.96 116.97 119.52 1j0j h TYR 250 Ca -0.43 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.27 1j0j h TYR 250 Cb 1.26 0.00 -0.10 0.00 1.54 0.00 0.00 36.73 39.43 1j0j h TYR 250 CO 0.54 0.00 -0.02 0.39 -1.64 0.00 0.00 178.16 177.43 1j0j n GLU 251 N -2.30 2.07 -2.84 1.82 1.02 -1.26 -4.61 120.64 114.54 1j0j n GLU 251 Ca -0.01 -3.10 -0.43 0.00 -0.02 0.00 0.00 57.16 53.59 1j0j n GLU 251 Cb 0.04 -1.84 -0.04 0.00 -0.02 0.00 0.00 31.44 29.58 1j0j n GLU 251 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1j0j s PHE 252 N -3.17 2.96 0.09 -0.32 5.36 -0.74 -4.67 117.98 117.49 1j0j s PHE 252 Ca 0.45 0.44 -0.09 0.00 -0.96 0.00 0.00 56.93 56.77 1j0j s PHE 252 Cb 0.40 -3.86 0.07 0.00 -0.34 0.00 0.00 43.02 39.28 1j0j s PHE 252 CO 0.02 -1.03 0.64 0.00 -1.46 0.00 0.00 175.22 173.40 1j0j n ALA 253 N 7.02 -0.11 -0.20 11.12 0.00 -1.26 0.16 120.51 137.24 1j0j n ALA 253 Ca 0.06 0.40 0.14 0.00 0.00 0.00 0.00 53.44 54.03 1j0j n ALA 253 Cb 0.48 -0.15 0.45 0.00 0.00 0.00 0.00 19.45 20.23 1j0j n ALA 253 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1j0j h PRO 254 N 0.00 0.51 -0.04 0.00 0.11 -1.94 -1.25 132.00 129.39 1j0j h PRO 254 Ca 0.12 -0.03 -0.23 0.00 0.11 0.00 0.00 66.00 65.98 1j0j h PRO 254 Cb 0.23 -0.12 0.02 0.00 0.11 0.00 0.00 31.00 31.24 1j0j h PRO 254 CO -0.41 0.34 -0.86 0.35 -0.21 0.00 0.00 178.00 177.21 1j0j h PHE 255 N 0.53 0.95 -0.42 0.65 3.57 0.11 -3.01 116.94 119.32 1j0j h PHE 255 Ca 0.39 -0.49 0.03 0.00 3.53 0.00 0.00 57.97 61.43 1j0j h PHE 255 Cb 0.77 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.37 1j0j h PHE 255 CO -0.00 1.31 0.28 1.96 -2.23 0.00 0.00 178.31 179.63 1j0j h GLN 256 N 0.31 0.45 -0.11 1.11 1.08 -0.51 0.27 115.11 117.71 1j0j h GLN 256 Ca -0.10 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.06 1j0j h GLN 256 Cb 1.52 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 28.84 1j0j h GLN 256 CO 0.17 0.30 0.01 0.22 -0.95 0.00 0.00 178.83 178.58 1j0j h ASP 257 N 0.47 0.18 -0.83 1.46 3.58 -1.23 -1.26 116.42 118.79 1j0j h ASP 257 Ca 0.17 -0.28 -0.01 0.00 0.42 0.00 0.00 57.03 57.32 1j0j h ASP 257 Cb 0.09 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 41.05 1j0j h ASP 257 CO -0.04 0.42 0.48 0.58 -2.88 0.00 0.00 179.24 177.80 1j0j h VAL 258 N -0.06 1.24 -0.95 2.25 2.07 -1.26 0.94 116.25 120.49 1j0j h VAL 258 Ca 0.03 -0.57 0.07 0.00 0.82 0.00 0.00 66.70 67.05 1j0j h VAL 258 Cb 0.32 0.10 -0.07 0.00 -1.52 0.00 0.00 31.29 30.12 1j0j h VAL 258 CO 0.00 0.26 0.60 -0.25 0.02 0.00 0.00 177.57 178.21 1j0j h TRP 259 N 1.15 1.12 0.12 1.57 2.91 -0.74 -0.35 115.95 121.73 1j0j h TRP 259 Ca 0.30 0.03 -0.36 0.00 1.13 0.00 0.00 58.89 59.99 1j0j h TRP 259 Cb 0.00 -0.36 -0.02 0.00 -0.51 0.00 0.00 29.16 28.27 1j0j h TRP 259 CO 0.00 0.56 -1.96 1.63 -1.03 0.00 0.00 178.44 177.64 1j0j n LYS 260 N -4.56 0.75 -0.10 2.65 4.76 -0.49 -4.47 118.16 116.70 1j0j n LYS 260 Ca 0.15 0.28 0.12 0.00 -2.87 0.00 0.00 58.31 55.98 1j0j n LYS 260 Cb 0.20 -1.71 0.28 0.00 -1.84 0.00 0.00 35.03 31.96 1j0j n LYS 260 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1j0j n ASN 261 N -3.54 2.60 0.00 4.39 3.02 0.32 -5.05 115.26 117.00 1j0j n ASN 261 Ca -0.32 -1.85 0.00 0.00 -0.03 0.00 0.00 54.58 52.38 1j0j n ASN 261 Cb 1.03 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 40.07 1j0j n ASN 261 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1j0j n GLY 262 N 1.32 2.43 0.18 7.41 0.00 -0.15 -2.56 105.19 113.83 1j0j n GLY 262 Ca 0.17 -0.37 0.13 0.00 0.00 0.00 0.00 46.02 45.95 1j0j n GLY 262 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1j0j h GLU 263 N 0.00 0.00 -0.00 1.61 4.81 -1.97 -1.45 114.58 117.58 1j0j h GLU 263 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1j0j h GLU 263 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1j0j h GLU 263 CO 0.00 0.00 -0.14 -1.13 -0.73 0.00 0.00 179.01 177.01 1j0j n SER 264 N -2.44 0.56 -4.78 1.04 3.41 -1.06 -4.89 113.62 105.46 1j0j n SER 264 Ca 0.01 -0.59 -0.41 0.00 -0.26 0.00 0.00 58.87 57.62 1j0j n SER 264 Cb 0.19 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.10 1j0j n SER 264 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1j0j n SER 265 N -0.93 3.73 0.07 4.04 2.88 -0.55 -4.87 113.62 118.00 1j0j n SER 265 Ca 0.14 1.21 0.10 0.00 -1.33 0.00 0.00 58.87 58.99 1j0j n SER 265 Cb 0.29 -1.62 0.43 0.00 -0.75 0.00 0.00 64.21 62.56 1j0j n SER 265 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1j0j n LYS 266 N 0.30 0.11 -0.05 -1.46 4.81 -1.26 -2.78 118.16 117.84 1j0j n LYS 266 Ca 0.02 0.29 0.02 0.00 -0.87 0.00 0.00 58.31 57.77 1j0j n LYS 266 Cb 0.39 -1.69 0.04 0.00 0.02 0.00 0.00 35.03 33.80 1j0j n LYS 266 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1j0j n TYR 267 N -1.90 0.12 0.17 5.64 4.01 -1.26 -4.72 117.16 119.22 1j0j n TYR 267 Ca 0.04 -0.52 0.19 0.00 -0.16 0.00 0.00 57.90 57.44 1j0j n TYR 267 Cb 0.24 -0.05 0.79 0.00 -0.31 0.00 0.00 39.34 40.02 1j0j n TYR 267 CO 0.00 0.00 0.00 1.57 -0.46 0.00 0.00 176.86 177.97 1j0j h LYS 268 N 0.52 0.00 -0.64 -0.72 5.09 -1.80 0.82 116.57 119.83 1j0j h LYS 268 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 1j0j h LYS 268 Cb 0.58 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.91 1j0j h LYS 268 CO 0.00 0.00 0.00 -3.47 -2.09 0.00 0.00 179.45 173.89 1j0j n ASP 269 N -3.61 4.87 -0.39 7.07 2.03 -1.26 -3.95 116.55 121.31 1j0j n ASP 269 Ca 0.04 -2.60 0.13 0.00 0.52 0.00 0.00 54.79 52.88 1j0j n ASP 269 Cb 0.48 -0.61 0.38 0.00 -0.72 0.00 0.00 41.12 40.66 1j0j n ASP 269 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 1j0j n TRP 270 N 0.86 0.00 -4.35 -0.67 7.02 0.28 -4.74 117.44 115.84 1j0j n TRP 270 Ca 0.25 0.00 -0.20 0.00 -1.02 0.00 0.00 57.50 56.53 1j0j n TRP 270 Cb 0.96 -0.06 -0.07 0.00 -2.42 0.00 0.00 31.31 29.72 1j0j n TRP 270 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1j0j n PHE 271 N -0.19 -0.27 -3.05 -5.99 3.72 -1.25 -1.09 117.46 109.34 1j0j n PHE 271 Ca 0.14 -2.41 -0.40 0.00 -0.05 0.00 0.00 57.45 54.74 1j0j n PHE 271 Cb 0.37 0.12 -0.01 0.00 -0.94 0.00 0.00 39.48 39.03 1j0j n PHE 271 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1j0j n HIS 272 N -0.70 2.54 -2.98 1.38 8.25 -1.23 -4.68 115.22 117.80 1j0j n HIS 272 Ca 0.01 -2.87 -0.40 0.00 -0.26 0.00 0.00 57.72 54.19 1j0j n HIS 272 Cb 0.54 -1.11 -0.04 0.00 1.12 0.00 0.00 29.99 30.50 1j0j n HIS 272 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1j0j s ILE 273 N -2.90 4.99 -0.26 1.59 1.01 -1.26 -2.08 121.20 122.28 1j0j s ILE 273 Ca 0.34 1.53 0.21 0.00 0.00 0.00 0.00 60.65 62.72 1j0j s ILE 273 Cb 0.08 -4.08 0.08 0.00 0.01 0.00 0.00 42.46 38.55 1j0j s ILE 273 CO 0.07 0.18 1.22 0.45 0.00 0.00 0.00 174.94 176.86 1j0j h HIS 274 N 6.94 0.00 0.00 3.97 3.86 -1.65 -3.49 115.15 124.79 1j0j h HIS 274 Ca -0.38 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.83 1j0j h HIS 274 Cb 1.18 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.65 1j0j h HIS 274 CO 0.67 0.16 0.00 -0.85 0.86 0.00 0.00 177.93 178.77 1j0j n GLU 275 N -2.90 0.00 -4.08 2.45 0.28 -1.26 -5.10 120.64 110.03 1j0j n GLU 275 Ca -0.00 0.00 -0.26 0.00 -0.16 0.00 0.00 57.16 56.74 1j0j n GLU 275 Cb 0.62 0.00 -0.05 0.00 1.43 0.00 0.00 31.44 33.44 1j0j n GLU 275 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1j0j s PHE 276 N -2.00 3.16 0.64 -1.84 0.08 -1.26 -4.26 117.98 112.50 1j0j s PHE 276 Ca 0.00 -0.03 -0.11 0.00 0.12 0.00 0.00 56.93 56.92 1j0j s PHE 276 Cb 0.00 -1.50 -0.02 0.00 -0.57 0.00 0.00 43.02 40.93 1j0j s PHE 276 CO 0.00 0.52 1.04 -1.25 -0.10 0.00 0.00 175.22 175.43 1j0j s PRO 277 N -3.22 3.34 0.55 0.24 0.04 -1.26 -5.06 135.00 129.63 1j0j s PRO 277 Ca 0.31 0.63 -0.20 0.00 0.04 0.00 0.00 61.00 61.78 1j0j s PRO 277 Cb -0.10 -2.07 -0.07 0.00 0.04 0.00 0.00 34.50 32.30 1j0j s PRO 277 CO 0.24 -0.72 0.93 1.28 0.04 0.00 0.00 177.00 178.77 1j0j n LEU 278 N -2.82 3.08 -3.81 -3.56 4.32 -1.26 -5.00 117.00 107.94 1j0j n LEU 278 Ca 0.06 0.86 -0.12 0.00 -0.02 0.00 0.00 56.01 56.79 1j0j n LEU 278 Cb 0.55 -1.36 -0.10 0.00 -1.62 0.00 0.00 43.42 40.90 1j0j n LEU 278 CO 0.58 -1.87 -0.08 -1.58 -1.22 0.00 0.00 177.39 173.22 1j0j s GLN 279 N -2.47 0.53 -0.06 3.23 0.74 -1.26 -5.05 119.66 115.32 1j0j s GLN 279 Ca 0.71 -0.19 0.12 0.00 0.05 0.00 0.00 55.36 56.05 1j0j s GLN 279 Cb -0.46 0.23 -0.18 0.00 1.10 0.00 0.00 33.01 33.71 1j0j s GLN 279 CO 0.51 -0.13 0.18 2.41 -0.55 0.00 0.00 175.29 177.71 1j0j n THR 280 N 1.61 0.35 -5.04 -0.34 -1.04 -1.26 -2.40 114.28 106.16 1j0j n THR 280 Ca -0.21 -0.39 -0.31 0.00 -2.04 0.00 0.00 64.05 61.11 1j0j n THR 280 Cb 0.56 -0.17 -0.15 0.00 -1.82 0.00 0.00 70.33 68.75 1j0j n THR 280 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1j0j s GLU 281 N -2.65 1.93 0.34 -2.82 0.41 -1.26 -2.77 118.70 111.88 1j0j s GLU 281 Ca -0.05 -1.04 0.02 0.00 -0.41 0.00 0.00 54.97 53.49 1j0j s GLU 281 Cb 0.06 -2.01 0.62 0.00 -1.78 0.00 0.00 34.13 31.02 1j0j s GLU 281 CO 0.52 0.53 1.97 -1.00 -0.49 0.00 0.00 175.26 176.79 1j0j h PRO 282 N 5.04 0.76 -3.56 0.39 0.13 -2.05 -3.47 132.00 129.22 1j0j h PRO 282 Ca -0.45 -0.08 -0.11 0.00 -0.87 0.00 0.00 66.00 64.49 1j0j h PRO 282 Cb 1.13 -0.16 -0.17 0.00 0.13 0.00 0.00 31.00 31.94 1j0j h PRO 282 CO 0.45 0.56 -0.39 -0.98 -0.23 0.00 0.00 178.00 177.41 1j0j s ARG 283 N -5.52 0.69 0.35 0.86 1.70 -1.13 -5.14 118.95 110.77 1j0j s ARG 283 Ca -0.09 -0.63 -0.25 0.00 -0.47 0.00 0.00 55.73 54.29 1j0j s ARG 283 Cb 0.17 0.29 -0.14 0.00 -0.57 0.00 0.00 34.95 34.70 1j0j s ARG 283 CO 0.77 -0.20 0.64 -2.30 -1.08 0.00 0.00 175.30 173.13 1j0j n PRO 284 N 0.68 0.66 -0.74 3.89 -0.02 -1.12 -4.56 135.00 133.80 1j0j n PRO 284 Ca -0.19 0.24 0.08 0.00 -2.02 0.00 0.00 63.50 61.61 1j0j n PRO 284 Cb 0.59 -1.50 0.37 0.00 -0.02 0.00 0.00 33.50 32.94 1j0j n PRO 284 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1j0j n ASN 285 N 1.40 5.16 -4.15 2.55 6.94 -1.01 -4.90 115.26 121.26 1j0j n ASN 285 Ca 0.12 -2.72 -0.10 0.00 -0.02 0.00 0.00 54.58 51.86 1j0j n ASN 285 Cb 0.35 -0.62 -0.10 0.00 -2.36 0.00 0.00 39.78 37.05 1j0j n ASN 285 CO 0.00 0.00 0.00 -0.72 -1.03 0.00 0.00 177.26 175.51 1j0j s TYR 286 N -2.35 0.82 0.44 -2.53 1.13 -1.26 -1.48 117.35 112.12 1j0j s TYR 286 Ca 0.52 -0.90 -0.22 0.00 -1.41 0.00 0.00 57.07 55.05 1j0j s TYR 286 Cb 0.37 -0.49 -0.09 0.00 -1.10 0.00 0.00 41.96 40.66 1j0j s TYR 286 CO 0.19 -0.18 1.06 -0.51 -2.51 0.00 0.00 175.55 173.60 1j0j s ASP 287 N -2.90 6.51 0.25 -0.18 1.01 -0.88 -4.97 116.67 115.51 1j0j s ASP 287 Ca 0.09 2.03 -0.01 0.00 0.71 0.00 0.00 52.55 55.38 1j0j s ASP 287 Cb 0.04 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.37 1j0j s ASP 287 CO -0.05 -0.66 0.25 0.42 0.21 0.00 0.00 175.17 175.33 1j0j s THR 288 N -1.77 0.00 -0.10 -1.27 -4.23 -1.26 -1.02 115.64 105.99 1j0j s THR 288 Ca 0.62 -1.88 -0.30 0.00 -1.18 0.00 0.00 61.69 58.96 1j0j s THR 288 Cb -0.21 -2.48 -0.03 0.00 1.34 0.00 0.00 72.50 71.12 1j0j s THR 288 CO 0.25 0.00 1.38 0.12 -0.54 0.00 0.00 174.62 175.83 1j0j s PHE 289 N -3.85 2.66 0.00 3.99 5.36 -0.19 -4.65 117.98 121.30 1j0j s PHE 289 Ca 0.36 0.79 0.00 0.00 -0.96 0.00 0.00 56.93 57.12 1j0j s PHE 289 Cb 0.04 -3.63 0.00 0.00 -0.34 0.00 0.00 43.02 39.10 1j0j s PHE 289 CO 0.16 -2.33 0.00 0.00 -1.46 0.00 0.00 175.22 171.60 1j0j n ALA 290 N 6.41 0.00 -2.23 11.12 0.00 -1.26 -1.42 120.51 133.13 1j0j n ALA 290 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.34 1j0j n ALA 290 Cb 0.44 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.91 1j0j n ALA 290 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1j0j n PHE 291 N 14.00 2.92 -3.45 0.00 3.01 -1.26 -5.00 117.46 127.67 1j0j n PHE 291 Ca 0.00 -2.56 -0.41 0.00 1.01 0.00 0.00 57.45 55.48 1j0j n PHE 291 Cb 0.00 -0.24 -0.10 0.00 -0.01 0.00 0.00 39.48 39.13 1j0j n PHE 291 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1j0j s VAL 292 N -4.89 5.23 0.41 -4.37 1.01 -0.51 -4.95 120.40 112.33 1j0j s VAL 292 Ca 0.49 -0.27 0.32 0.00 0.00 0.00 0.00 61.98 62.52 1j0j s VAL 292 Cb 0.40 -3.83 0.34 0.00 0.00 0.00 0.00 36.38 33.29 1j0j s VAL 292 CO -0.05 -0.15 2.12 -0.65 0.00 0.00 0.00 175.10 176.36 1j0j h PRO 293 N 8.55 0.00 0.00 2.72 0.11 -1.94 -2.34 132.00 139.09 1j0j h PRO 293 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1j0j h PRO 293 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1j0j h PRO 293 CO 0.69 0.07 0.00 1.04 -0.21 0.00 0.00 178.00 179.60 1j0j n GLN 294 N -3.44 0.19 -3.62 1.05 3.00 -1.26 -4.30 117.38 108.99 1j0j n GLN 294 Ca -0.02 0.01 -0.27 0.00 -0.01 0.00 0.00 57.00 56.71 1j0j n GLN 294 Cb 0.22 -1.50 -0.10 0.00 0.00 0.00 0.00 30.24 28.86 1j0j n GLN 294 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 1j0j n MET 295 N -1.40 1.89 -2.05 -1.09 2.81 -0.88 -1.19 117.12 115.20 1j0j n MET 295 Ca 0.10 -4.36 -0.42 0.00 -1.81 0.00 0.00 57.70 51.21 1j0j n MET 295 Cb 0.29 -2.14 -0.03 0.00 -0.71 0.00 0.00 33.22 30.62 1j0j n MET 295 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1j0j s PRO 296 N -1.72 4.27 0.15 0.03 0.04 -1.24 -1.02 135.00 135.51 1j0j s PRO 296 Ca 0.32 2.22 -0.31 0.00 0.04 0.00 0.00 61.00 63.27 1j0j s PRO 296 Cb 0.06 -3.20 -0.09 0.00 0.04 0.00 0.00 34.50 31.31 1j0j s PRO 296 CO -0.11 -0.52 1.44 0.21 0.04 0.00 0.00 177.00 178.06 1j0j s LYS 297 N 1.07 4.29 0.37 4.56 2.20 -0.19 -2.31 119.74 129.73 1j0j s LYS 297 Ca 0.67 2.17 -0.22 0.00 -0.36 0.00 0.00 55.97 58.23 1j0j s LYS 297 Cb -0.40 -3.21 -0.10 0.00 -1.51 0.00 0.00 37.83 32.61 1j0j s LYS 297 CO 0.31 -0.47 0.91 -0.51 -0.36 0.00 0.00 175.35 175.23 1j0j s LEU 298 N 0.88 4.12 -1.05 5.43 1.43 -0.27 -3.53 118.68 125.69 1j0j s LEU 298 Ca 0.65 1.68 -0.12 0.00 -1.03 0.00 0.00 54.13 55.31 1j0j s LEU 298 Cb -0.39 -4.24 0.23 0.00 0.03 0.00 0.00 46.19 41.82 1j0j s LEU 298 CO 0.32 -0.21 1.10 0.21 0.23 0.00 0.00 176.35 177.99 1j0j s ASN 299 N -1.96 7.08 0.00 2.29 2.47 -0.25 -4.87 114.94 119.71 1j0j s ASN 299 Ca 0.56 -3.13 0.01 0.00 0.42 0.00 0.00 52.86 50.72 1j0j s ASN 299 Cb -0.13 -2.26 0.06 0.00 -1.45 0.00 0.00 41.25 37.46 1j0j s ASN 299 CO 0.18 -0.51 0.67 0.35 -3.72 0.00 0.00 177.10 174.06 1j0j n THR 300 N 3.62 0.46 0.08 -5.21 -2.24 -1.26 -0.38 114.28 109.35 1j0j n THR 300 Ca 0.24 0.11 0.10 0.00 -2.27 0.00 0.00 64.05 62.24 1j0j n THR 300 Cb 0.43 -1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 67.53 1j0j n THR 300 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j0j n ALA 301 N -1.12 2.48 -2.24 6.98 0.00 -1.26 -4.46 120.51 120.90 1j0j n ALA 301 Ca 0.01 -0.30 -0.42 0.00 0.00 0.00 0.00 53.44 52.72 1j0j n ALA 301 Cb 0.01 -1.05 -0.03 0.00 0.00 0.00 0.00 19.45 18.38 1j0j n ALA 301 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1j0j s ASN 302 N -5.31 6.86 0.53 0.00 3.84 0.49 -4.90 114.94 116.45 1j0j s ASN 302 Ca -0.02 2.06 0.28 0.00 0.21 0.00 0.00 52.86 55.39 1j0j s ASN 302 Cb 0.10 -2.56 1.42 0.00 -0.55 0.00 0.00 41.25 39.67 1j0j s ASN 302 CO 0.81 -0.73 1.94 1.55 -2.79 0.00 0.00 177.10 177.87 1j0j h PRO 303 N 8.01 0.02 0.17 0.43 0.13 -1.86 -0.90 132.00 137.99 1j0j h PRO 303 Ca -0.36 -0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.46 1j0j h PRO 303 Cb 1.17 -0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.31 1j0j h PRO 303 CO 0.91 0.01 -1.39 0.93 -0.23 0.00 0.00 178.00 178.23 1j0j h GLU 304 N 0.02 0.36 -0.44 0.86 5.08 -1.93 -1.79 114.58 116.74 1j0j h GLU 304 Ca 0.35 -0.61 -0.10 0.00 -1.00 0.00 0.00 59.36 57.99 1j0j h GLU 304 Cb 1.36 0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.82 1j0j h GLU 304 CO -0.01 1.28 -0.14 0.28 -1.00 0.00 0.00 179.01 179.41 1j0j h VAL 305 N 0.10 1.26 0.06 3.13 2.07 -1.67 -0.62 116.25 120.57 1j0j h VAL 305 Ca -0.20 -1.24 -0.00 0.00 0.82 0.00 0.00 66.70 66.08 1j0j h VAL 305 Cb 2.05 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 32.90 1j0j h VAL 305 CO 0.22 0.42 -0.03 0.50 0.02 0.00 0.00 177.57 178.70 1j0j h LYS 306 N 0.73 -0.08 -0.01 1.57 3.64 -1.22 -1.16 116.57 120.05 1j0j h LYS 306 Ca 0.12 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1j0j h LYS 306 Cb 0.65 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.48 1j0j h LYS 306 CO 0.05 0.23 -0.04 -0.09 -2.27 0.00 0.00 179.45 177.32 1j0j h ARG 307 N -0.38 0.01 0.06 1.90 9.65 -1.25 -1.39 114.38 122.97 1j0j h ARG 307 Ca -0.01 -0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1j0j h ARG 307 Cb 0.34 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.92 1j0j h ARG 307 CO 0.01 0.05 -0.03 -0.92 2.80 0.00 0.00 179.97 181.88 1j0j h TYR 308 N 0.01 -0.07 -0.19 2.20 5.03 -0.81 -2.82 116.97 120.32 1j0j h TYR 308 Ca 0.00 -0.00 -0.08 0.00 2.58 0.00 0.00 58.73 61.23 1j0j h TYR 308 Cb 0.07 0.02 -0.01 0.00 1.55 0.00 0.00 36.73 38.36 1j0j h TYR 308 CO 0.00 0.46 -0.21 -0.07 -1.32 0.00 0.00 178.16 177.02 1j0j h LEU 309 N -0.66 0.33 -0.52 2.82 3.38 -0.97 -1.20 115.31 118.49 1j0j h LEU 309 Ca -0.01 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1j0j h LEU 309 Cb 0.57 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1j0j h LEU 309 CO 0.01 0.56 0.16 -0.07 0.09 0.00 0.00 178.44 179.19 1j0j h LEU 310 N 0.31 0.76 -0.83 1.67 3.38 -1.33 0.06 115.31 119.33 1j0j h LEU 310 Ca 0.05 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.78 1j0j h LEU 310 Cb 0.55 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 1j0j h LEU 310 CO 0.04 0.77 0.40 0.44 0.09 0.00 0.00 178.44 180.18 1j0j h ASP 311 N 0.72 1.08 -0.57 -0.43 5.19 -1.18 0.82 116.42 122.05 1j0j h ASP 311 Ca 0.17 -0.13 -0.04 0.00 -0.62 0.00 0.00 57.03 56.41 1j0j h ASP 311 Cb 0.28 -0.28 -0.03 0.00 0.18 0.00 0.00 39.33 39.49 1j0j h ASP 311 CO -0.00 0.90 0.22 0.58 -3.12 0.00 0.00 179.24 177.82 1j0j h VAL 312 N 1.17 1.22 -0.29 -1.35 2.07 -0.72 0.44 116.25 118.79 1j0j h VAL 312 Ca 0.28 -0.73 -0.14 0.00 0.82 0.00 0.00 66.70 66.93 1j0j h VAL 312 Cb 0.11 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1j0j h VAL 312 CO -0.04 0.29 -0.40 0.00 0.02 0.00 0.00 177.57 177.44 1j0j h ALA 313 N 1.36 0.74 0.00 1.67 0.00 0.03 -3.20 119.26 119.86 1j0j h ALA 313 Ca 0.20 -0.45 -0.09 0.00 0.00 0.00 0.00 54.91 54.57 1j0j h ALA 313 Cb 0.21 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1j0j h ALA 313 CO -0.01 0.66 -0.92 1.79 0.00 0.00 0.00 179.25 180.76 1j0j h THR 314 N 0.58 0.42 0.99 0.00 1.35 -0.50 -3.33 112.91 112.42 1j0j h THR 314 Ca 0.05 -1.70 -0.05 0.00 -0.55 0.00 0.00 66.41 64.16 1j0j h THR 314 Cb 0.94 2.00 0.01 0.00 -1.73 0.00 0.00 68.15 69.37 1j0j h THR 314 CO 0.09 0.24 -0.48 0.22 -0.25 0.00 0.00 175.52 175.34 1j0j h TYR 315 N 0.00 -1.24 0.00 4.73 3.20 -0.11 0.26 116.97 123.81 1j0j h TYR 315 Ca -0.06 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.77 1j0j h TYR 315 Cb 1.33 0.41 -0.00 0.00 1.54 0.00 0.00 36.73 40.01 1j0j h TYR 315 CO 0.00 -0.77 -0.04 -1.49 -1.64 0.00 0.00 178.16 174.22 1j0j h TRP 316 N -1.35 0.00 0.11 -3.82 4.06 -1.75 0.20 115.95 113.40 1j0j h TRP 316 Ca -0.14 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.81 1j0j h TRP 316 Cb 1.02 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.18 1j0j h TRP 316 CO -0.00 0.04 -0.05 0.82 -3.56 0.00 0.00 178.44 175.68 1j0j h ILE 317 N 0.00 0.43 -0.57 1.49 2.04 -1.61 -2.07 117.51 117.21 1j0j h ILE 317 Ca -0.00 -1.14 0.04 0.00 1.00 0.00 0.00 64.86 64.76 1j0j h ILE 317 Cb 0.14 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 1j0j h ILE 317 CO 0.01 0.13 0.32 -0.09 0.00 0.00 0.00 178.15 178.52 1j0j h ARG 318 N -1.00 0.61 0.00 2.37 2.43 -0.15 0.17 114.38 118.80 1j0j h ARG 318 Ca -0.02 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1j0j h ARG 318 Cb 0.33 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1j0j h ARG 318 CO 0.03 0.40 -0.86 0.39 -1.51 0.00 0.00 179.97 178.42 1j0j n GLU 319 N -4.81 0.39 0.00 0.20 -0.58 0.66 -4.48 120.64 112.02 1j0j n GLU 319 Ca 0.06 0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.86 1j0j n GLU 319 Cb 0.12 -1.70 0.00 0.00 -0.57 0.00 0.00 31.44 29.29 1j0j n GLU 319 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1j0j n PHE 320 N -2.24 0.00 -3.59 -0.32 3.72 -0.79 -5.04 117.46 109.20 1j0j n PHE 320 Ca 0.02 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.18 1j0j n PHE 320 Cb 0.47 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.09 1j0j n PHE 320 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1j0j n ASP 321 N -0.33 -5.83 -4.76 4.37 4.64 0.58 -4.87 116.55 110.34 1j0j n ASP 321 Ca 0.00 -0.56 -0.34 0.00 -1.38 0.00 0.00 54.79 52.51 1j0j n ASP 321 Cb 0.04 -5.01 0.04 0.00 -1.04 0.00 0.00 41.12 35.16 1j0j n ASP 321 CO 0.00 0.00 0.00 0.27 -0.82 0.00 0.00 177.20 176.65 1j0j s ILE 322 N -3.33 3.04 -0.97 5.18 -4.36 -1.23 -4.92 121.20 114.61 1j0j s ILE 322 Ca 0.52 0.54 0.24 0.00 -0.26 0.00 0.00 60.65 61.68 1j0j s ILE 322 Cb -0.23 -3.09 -0.08 0.00 1.25 0.00 0.00 42.46 40.31 1j0j s ILE 322 CO 0.73 -0.25 1.22 0.47 0.24 0.00 0.00 174.94 177.36 1j0j n ASP 323 N -2.13 0.67 -3.72 4.36 9.92 0.13 -4.87 116.55 120.90 1j0j n ASP 323 Ca 0.11 -0.49 -0.04 0.00 -0.53 0.00 0.00 54.79 53.85 1j0j n ASP 323 Cb 0.51 0.53 -0.01 0.00 -0.64 0.00 0.00 41.12 41.51 1j0j n ASP 323 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1j0j s GLY 324 N -3.05 -0.18 -0.05 0.44 0.00 -1.09 -0.83 107.32 102.56 1j0j s GLY 324 Ca 0.09 0.03 0.01 0.00 0.00 0.00 0.00 44.72 44.86 1j0j s GLY 324 CO 0.76 0.15 -0.07 -0.98 0.00 0.00 0.00 173.10 172.96 1j0j s TRP 325 N -3.24 0.96 -0.47 1.90 0.23 -0.30 -2.39 118.94 115.64 1j0j s TRP 325 Ca 0.13 -0.31 -0.11 0.00 -2.03 0.00 0.00 56.10 53.78 1j0j s TRP 325 Cb -0.02 -0.79 0.11 0.00 0.03 0.00 0.00 33.47 32.80 1j0j s TRP 325 CO 0.03 -0.23 0.36 0.50 0.96 0.00 0.00 176.95 178.57 1j0j s ARG 326 N 0.88 2.62 -0.48 4.98 3.00 0.12 -1.67 118.95 128.40 1j0j s ARG 326 Ca -0.11 -1.67 -0.29 0.00 -1.00 0.00 0.00 55.73 52.66 1j0j s ARG 326 Cb -0.15 -3.98 0.03 0.00 0.00 0.00 0.00 34.95 30.85 1j0j s ARG 326 CO 0.01 -1.16 1.21 -0.51 0.00 0.00 0.00 175.30 174.84 1j0j s LEU 327 N 1.43 3.60 0.16 -0.88 1.43 -0.23 0.23 118.68 124.42 1j0j s LEU 327 Ca 0.05 0.49 -0.30 0.00 -1.03 0.00 0.00 54.13 53.33 1j0j s LEU 327 Cb -0.26 -3.50 -0.08 0.00 0.03 0.00 0.00 46.19 42.39 1j0j s LEU 327 CO 0.01 -1.33 1.23 -0.62 0.23 0.00 0.00 176.35 175.87 1j0j s ASP 328 N 2.87 7.03 -1.59 2.29 2.15 -0.98 -0.92 116.67 127.52 1j0j s ASP 328 Ca 0.50 2.24 -0.16 0.00 0.43 0.00 0.00 52.55 55.56 1j0j s ASP 328 Cb -0.08 -2.60 0.13 0.00 -0.30 0.00 0.00 42.92 40.06 1j0j s ASP 328 CO 0.31 -0.44 0.80 0.52 -0.17 0.00 0.00 175.17 176.19 1j0j n VAL 329 N 2.88 -1.27 -0.15 1.11 0.31 -1.25 -4.45 118.33 115.51 1j0j n VAL 329 Ca 0.06 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.57 1j0j n VAL 329 Cb 0.44 -2.01 0.57 0.00 -0.91 0.00 0.00 33.84 31.94 1j0j n VAL 329 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1j0j h ALA 330 N 0.94 2.29 0.00 3.52 0.00 -1.51 -2.27 119.26 122.23 1j0j h ALA 330 Ca -0.56 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1j0j h ALA 330 Cb 1.36 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1j0j h ALA 330 CO 0.71 -0.50 0.00 0.27 0.00 0.00 0.00 179.25 179.73 1j0j n ASN 331 N -4.44 0.00 -0.84 0.00 2.04 -1.26 -2.67 115.26 108.09 1j0j n ASN 331 Ca 0.15 0.40 0.12 0.00 -0.44 0.00 0.00 54.58 54.81 1j0j n ASN 331 Cb 0.62 -0.45 0.24 0.00 -2.53 0.00 0.00 39.78 37.66 1j0j n ASN 331 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1j0j n GLU 332 N -1.45 2.15 -4.16 -3.83 1.02 -0.85 -4.88 120.64 108.63 1j0j n GLU 332 Ca 0.04 -1.69 -0.33 0.00 -0.02 0.00 0.00 57.16 55.17 1j0j n GLU 332 Cb 0.16 -1.47 -0.08 0.00 -0.02 0.00 0.00 31.44 30.04 1j0j n GLU 332 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1j0j s ILE 333 N -1.91 4.55 0.49 -3.67 1.01 -1.09 -5.08 121.20 115.51 1j0j s ILE 333 Ca 0.32 -0.45 -0.24 0.00 0.00 0.00 0.00 60.65 60.29 1j0j s ILE 333 Cb 0.20 -3.06 -0.07 0.00 0.01 0.00 0.00 42.46 39.55 1j0j s ILE 333 CO 0.31 0.37 1.40 1.51 0.00 0.00 0.00 174.94 178.53 1j0j s ASP 334 N -1.64 5.59 0.50 3.58 -4.77 -1.26 -4.90 116.67 113.77 1j0j s ASP 334 Ca 0.21 2.87 0.20 0.00 -3.30 0.00 0.00 52.55 52.53 1j0j s ASP 334 Cb -0.12 -2.65 1.26 0.00 -1.09 0.00 0.00 42.92 40.33 1j0j s ASP 334 CO 0.12 -1.36 2.01 0.45 0.70 0.00 0.00 175.17 177.09 1j0j h HIS 335 N 1.94 0.14 -0.18 2.11 3.86 -1.96 -1.95 115.15 119.10 1j0j h HIS 335 Ca -0.51 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 58.69 1j0j h HIS 335 Cb 1.28 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 29.70 1j0j h HIS 335 CO 0.48 0.06 0.07 1.49 0.86 0.00 0.00 177.93 180.89 1j0j h GLU 336 N 0.13 0.28 -0.55 2.45 4.81 -2.00 -0.88 114.58 118.82 1j0j h GLU 336 Ca 0.23 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1j0j h GLU 336 Cb 0.75 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.05 1j0j h GLU 336 CO -0.03 0.36 0.34 0.35 -0.73 0.00 0.00 179.01 179.30 1j0j h PHE 337 N 0.14 0.64 -0.36 0.92 3.04 -1.68 -2.12 116.94 117.52 1j0j h PHE 337 Ca 0.06 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.03 1j0j h PHE 337 Cb 0.19 -0.21 -0.02 0.00 2.56 0.00 0.00 35.95 38.47 1j0j h PHE 337 CO -0.01 0.38 0.23 -1.49 -2.02 0.00 0.00 178.31 175.41 1j0j h TRP 338 N 0.69 0.45 -0.10 0.41 -0.00 -1.21 0.12 115.95 116.30 1j0j h TRP 338 Ca 0.21 0.01 -0.11 0.00 -0.00 0.00 0.00 58.89 59.00 1j0j h TRP 338 Cb -0.02 -0.15 -0.01 0.00 -0.00 0.00 0.00 29.16 28.97 1j0j h TRP 338 CO -0.05 0.29 -0.44 0.00 -0.00 0.00 0.00 178.44 178.24 1j0j h ARG 339 N 0.49 0.25 0.01 0.49 3.08 -0.50 -2.07 114.38 116.12 1j0j h ARG 339 Ca 0.13 -0.12 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 1j0j h ARG 339 Cb -0.05 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.02 1j0j h ARG 339 CO -0.03 0.65 -0.68 0.93 -1.07 0.00 0.00 179.97 179.77 1j0j h GLU 340 N 0.20 0.45 -0.82 0.04 5.08 -0.91 -2.97 114.58 115.64 1j0j h GLU 340 Ca 0.01 -0.49 0.14 0.00 -1.00 0.00 0.00 59.36 58.03 1j0j h GLU 340 Cb 0.86 0.14 -0.09 0.00 0.50 0.00 0.00 28.75 30.16 1j0j h GLU 340 CO 0.07 1.14 0.41 0.35 -1.00 0.00 0.00 179.01 179.98 1j0j h PHE 341 N -0.05 0.71 -0.39 4.33 3.57 -0.66 -0.03 116.94 124.43 1j0j h PHE 341 Ca -0.09 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.37 1j0j h PHE 341 Cb 1.39 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.92 1j0j h PHE 341 CO 0.14 0.16 -0.06 -0.09 -2.23 0.00 0.00 178.31 176.24 1j0j h ARG 342 N 0.59 0.72 0.29 1.11 2.43 -1.42 -1.71 114.38 116.39 1j0j h ARG 342 Ca 0.45 -0.26 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1j0j h ARG 342 Cb 0.63 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 1j0j h ARG 342 CO -0.36 0.85 -0.14 1.96 -1.51 0.00 0.00 179.97 180.77 1j0j h GLN 343 N 0.53 -0.37 0.24 0.20 4.20 -1.03 -0.09 115.11 118.79 1j0j h GLN 343 Ca 0.10 0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.84 1j0j h GLN 343 Cb 0.56 0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.40 1j0j h GLN 343 CO 0.03 -0.23 -0.30 0.93 -0.67 0.00 0.00 178.83 178.59 1j0j h GLU 344 N -0.42 -0.58 0.44 1.46 4.39 -1.07 -1.86 114.58 116.94 1j0j h GLU 344 Ca -0.04 0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1j0j h GLU 344 Cb 0.32 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.09 1j0j h GLU 344 CO 0.06 -0.39 -0.32 0.28 -1.16 0.00 0.00 179.01 177.49 1j0j h VAL 345 N -0.60 0.35 0.00 3.13 2.07 -1.28 -2.62 116.25 117.30 1j0j h VAL 345 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 1j0j h VAL 345 Cb 0.57 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1j0j h VAL 345 CO -0.10 0.00 -0.07 0.11 0.02 0.00 0.00 177.57 177.53 1j0j h LYS 346 N -0.74 0.00 -0.31 1.57 1.79 -1.00 -0.08 116.57 117.80 1j0j h LYS 346 Ca -0.04 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.35 1j0j h LYS 346 Cb 0.63 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.27 1j0j h LYS 346 CO 0.01 0.07 -0.10 0.00 -1.08 0.00 0.00 179.45 178.36 1j0j h ALA 347 N 1.93 0.42 0.01 3.86 0.00 -1.21 -1.78 119.26 122.49 1j0j h ALA 347 Ca -0.00 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 1j0j h ALA 347 Cb 0.13 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1j0j h ALA 347 CO 0.01 0.28 -0.00 1.25 0.00 0.00 0.00 179.25 180.78 1j0j h LEU 348 N 0.37 -0.01 -6.02 0.00 5.85 -0.96 -3.41 115.31 111.13 1j0j h LEU 348 Ca 0.07 -0.32 -0.36 0.00 0.84 0.00 0.00 57.88 58.11 1j0j h LEU 348 Cb 0.60 0.00 -0.29 0.00 0.37 0.00 0.00 40.66 41.35 1j0j h LEU 348 CO 0.04 0.31 -0.71 -0.75 -0.34 0.00 0.00 178.44 176.99 1j0j s LYS 349 N -4.90 0.83 0.23 1.25 2.20 -0.12 -5.05 119.74 114.18 1j0j s LYS 349 Ca -0.15 -1.23 -0.01 0.00 -0.36 0.00 0.00 55.97 54.23 1j0j s LYS 349 Cb 0.03 -0.71 0.50 0.00 -1.51 0.00 0.00 37.83 36.14 1j0j s LYS 349 CO 0.67 -1.28 1.17 -2.30 -0.36 0.00 0.00 175.35 173.25 1j0j n PRO 350 N 3.56 -0.06 -0.12 4.03 -0.02 -0.67 -1.16 135.00 140.55 1j0j n PRO 350 Ca 0.18 1.14 0.01 0.00 -2.02 0.00 0.00 63.50 62.81 1j0j n PRO 350 Cb 0.49 -1.77 0.05 0.00 -0.02 0.00 0.00 33.50 32.25 1j0j n PRO 350 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1j0j n ASP 351 N -5.10 1.56 -4.71 2.55 3.85 -1.26 -4.78 116.55 108.66 1j0j n ASP 351 Ca 0.16 -2.12 -0.42 0.00 -0.71 0.00 0.00 54.79 51.70 1j0j n ASP 351 Cb 0.51 -0.49 -0.03 0.00 -1.35 0.00 0.00 41.12 39.77 1j0j n ASP 351 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1j0j s VAL 352 N -1.29 4.59 -0.34 2.12 1.01 -0.31 -4.75 120.40 121.43 1j0j s VAL 352 Ca 0.07 1.86 -0.29 0.00 0.00 0.00 0.00 61.98 63.62 1j0j s VAL 352 Cb 0.05 -4.19 0.01 0.00 0.00 0.00 0.00 36.38 32.26 1j0j s VAL 352 CO 0.02 0.12 1.15 -0.47 0.00 0.00 0.00 175.10 175.93 1j0j s TYR 353 N 1.21 2.96 -0.48 5.22 5.04 -0.01 -4.79 117.35 126.49 1j0j s TYR 353 Ca 0.54 1.02 -0.14 0.00 -2.44 0.00 0.00 57.07 56.04 1j0j s TYR 353 Cb -0.23 -3.89 0.09 0.00 0.35 0.00 0.00 41.96 38.28 1j0j s TYR 353 CO 0.27 -1.13 0.39 0.42 -1.34 0.00 0.00 175.55 174.17 1j0j s ILE 354 N 4.01 5.01 -0.24 3.14 1.01 -1.26 -1.15 121.20 131.72 1j0j s ILE 354 Ca 0.49 -1.25 -0.04 0.00 0.00 0.00 0.00 60.65 59.85 1j0j s ILE 354 Cb -0.12 -4.07 0.00 0.00 0.01 0.00 0.00 42.46 38.28 1j0j s ILE 354 CO 0.21 -0.64 -0.02 -0.22 0.00 0.00 0.00 174.94 174.27 1j0j s LEU 355 N 1.58 3.16 0.00 2.97 2.96 -0.67 -0.26 118.68 128.42 1j0j s LEU 355 Ca 0.04 -0.54 -0.12 0.00 -0.22 0.00 0.00 54.13 53.29 1j0j s LEU 355 Cb -0.25 -1.76 -0.05 0.00 0.50 0.00 0.00 46.19 44.62 1j0j s LEU 355 CO 0.05 -0.08 0.36 -0.83 -1.32 0.00 0.00 176.35 174.53 1j0j s GLY 356 N 1.46 2.39 -0.82 7.98 0.00 -0.30 -1.06 107.32 116.96 1j0j s GLY 356 Ca 0.04 -0.34 -0.19 0.00 0.00 0.00 0.00 44.72 44.24 1j0j s GLY 356 CO -0.02 -0.03 0.98 1.62 0.00 0.00 0.00 173.10 175.64 1j0j s GLN 357 N -1.30 3.44 -0.21 2.90 0.74 -0.10 -1.37 119.66 123.75 1j0j s GLN 357 Ca 0.25 -1.67 0.01 0.00 0.05 0.00 0.00 55.36 54.00 1j0j s GLN 357 Cb -0.15 -4.64 0.05 0.00 1.10 0.00 0.00 33.01 29.37 1j0j s GLN 357 CO 0.13 -1.67 -0.09 0.42 -0.55 0.00 0.00 175.29 173.54 1j0j s ILE 358 N 2.49 1.63 0.00 -2.34 1.01 -1.26 -3.12 121.20 119.60 1j0j s ILE 358 Ca 0.25 -1.11 0.00 0.00 0.00 0.00 0.00 60.65 59.79 1j0j s ILE 358 Cb -0.11 -1.77 0.00 0.00 0.01 0.00 0.00 42.46 40.59 1j0j s ILE 358 CO -0.04 0.06 1.45 1.87 0.00 0.00 0.00 174.94 178.28 1j0j n TRP 359 N 4.67 0.00 -3.93 3.97 -0.00 -1.26 -4.64 117.44 116.24 1j0j n TRP 359 Ca -0.14 -0.72 0.01 0.00 -0.00 0.00 0.00 57.50 56.65 1j0j n TRP 359 Cb 0.45 -0.37 0.01 0.00 -0.00 0.00 0.00 31.31 31.41 1j0j n TRP 359 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 177.69 175.30 1j0j n HIS 360 N 1.02 -0.62 -1.72 5.87 1.44 -1.26 -4.91 115.22 115.04 1j0j n HIS 360 Ca 0.00 -0.74 -0.61 0.00 -2.01 0.00 0.00 57.72 54.36 1j0j n HIS 360 Cb 0.48 0.34 -0.08 0.00 0.12 0.00 0.00 29.99 30.86 1j0j n HIS 360 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 1j0j n ASP 361 N -1.00 1.98 -0.49 4.39 4.64 -1.26 -4.85 116.55 119.96 1j0j n ASP 361 Ca 0.02 1.11 0.04 0.00 -1.38 0.00 0.00 54.79 54.59 1j0j n ASP 361 Cb 0.48 -1.05 0.11 0.00 -1.04 0.00 0.00 41.12 39.62 1j0j n ASP 361 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1j0j n ALA 362 N 4.90 2.17 -0.26 -1.67 0.00 -1.26 -4.81 120.51 119.58 1j0j n ALA 362 Ca 0.28 -1.06 0.20 0.00 0.00 0.00 0.00 53.44 52.86 1j0j n ALA 362 Cb 0.07 -0.34 0.37 0.00 0.00 0.00 0.00 19.45 19.55 1j0j n ALA 362 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1j0j n MET 363 N 0.32 -0.05 0.28 0.00 0.00 -1.26 -0.31 117.12 116.10 1j0j n MET 363 Ca 0.09 1.11 0.13 0.00 0.00 0.00 0.00 57.70 59.02 1j0j n MET 363 Cb 0.37 -1.90 0.80 0.00 0.00 0.00 0.00 33.22 32.50 1j0j n MET 363 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 175.97 174.62 1j0j h PRO 364 N 0.00 0.00 -0.01 2.12 0.11 -2.01 -2.29 132.00 129.92 1j0j h PRO 364 Ca 0.59 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.70 1j0j h PRO 364 Cb 1.46 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.57 1j0j h PRO 364 CO -0.65 0.04 -0.42 0.91 -0.21 0.00 0.00 178.00 177.67 1j0j n TRP 365 N -3.95 0.00 -1.79 0.65 8.01 0.58 -4.45 117.44 116.48 1j0j n TRP 365 Ca -0.03 0.00 -0.28 0.00 -1.31 0.00 0.00 57.50 55.88 1j0j n TRP 365 Cb 0.13 -0.03 0.04 0.00 -2.01 0.00 0.00 31.31 29.43 1j0j n TRP 365 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 1j0j n LEU 366 N -0.20 5.97 -1.53 -0.99 4.77 -0.86 -1.75 117.00 122.41 1j0j n LEU 366 Ca 0.10 -4.61 0.08 0.00 -0.03 0.00 0.00 56.01 51.55 1j0j n LEU 366 Cb 0.43 -0.59 0.33 0.00 -2.33 0.00 0.00 43.42 41.27 1j0j n LEU 366 CO 0.28 1.88 0.78 0.54 -1.33 0.00 0.00 177.39 179.54 1j0j n ARG 367 N -0.77 3.68 0.00 3.23 1.74 -1.25 -4.91 116.66 118.38 1j0j n ARG 367 Ca 0.51 -2.64 0.00 0.00 -0.77 0.00 0.00 57.85 54.94 1j0j n ARG 367 Cb 0.83 -1.91 0.00 0.00 -1.02 0.00 0.00 32.46 30.36 1j0j n ARG 367 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1j0j n GLY 368 N 0.98 1.96 1.16 -0.13 0.00 -1.26 -4.78 105.19 103.12 1j0j n GLY 368 Ca 0.24 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.35 1j0j n GLY 368 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1j0j n ASP 369 N 0.00 3.74 0.00 1.61 5.75 -1.26 -4.80 116.55 121.58 1j0j n ASP 369 Ca 0.00 -2.07 0.00 0.00 -0.01 0.00 0.00 54.79 52.71 1j0j n ASP 369 Cb 0.00 -0.42 0.00 0.00 -1.03 0.00 0.00 41.12 39.67 1j0j n ASP 369 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1j0j n GLN 370 N 1.21 0.00 -3.12 0.11 6.02 -1.26 -4.32 117.38 116.01 1j0j n GLN 370 Ca 0.21 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.87 1j0j n GLN 370 Cb 0.60 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.80 1j0j n GLN 370 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1j0j s PHE 371 N 1.20 3.38 -0.02 1.08 0.08 -0.71 -4.76 117.98 118.23 1j0j s PHE 371 Ca 0.00 1.20 0.11 0.00 0.12 0.00 0.00 56.93 58.36 1j0j s PHE 371 Cb 0.00 -2.52 -0.08 0.00 -0.57 0.00 0.00 43.02 39.85 1j0j s PHE 371 CO 0.00 0.08 1.36 -0.44 -0.10 0.00 0.00 175.22 176.12 1j0j h ASP 372 N 2.18 0.00 -5.39 1.36 3.32 -0.95 -3.42 116.42 113.53 1j0j h ASP 372 Ca -0.48 0.00 0.18 0.00 0.02 0.00 0.00 57.03 56.75 1j0j h ASP 372 Cb 1.18 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.66 1j0j h ASP 372 CO 0.65 0.76 0.54 0.00 -1.72 0.00 0.00 179.24 179.47 1j0j s ALA 373 N -2.83 -1.65 0.00 3.45 0.00 -1.14 -4.81 121.76 114.78 1j0j s ALA 373 Ca 0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 51.96 51.94 1j0j s ALA 373 Cb 0.09 0.67 -0.01 0.00 0.00 0.00 0.00 23.12 23.87 1j0j s ALA 373 CO 0.78 -1.05 0.03 0.14 0.00 0.00 0.00 175.76 175.66 1j0j s VAL 374 N -2.78 0.06 -0.02 0.00 -7.23 -1.26 -1.15 120.40 108.02 1j0j s VAL 374 Ca 0.16 -0.49 -0.33 0.00 -1.81 0.00 0.00 61.98 59.50 1j0j s VAL 374 Cb -0.01 -0.21 -0.11 0.00 0.56 0.00 0.00 36.38 36.60 1j0j s VAL 374 CO 0.03 -0.27 1.86 0.23 -0.31 0.00 0.00 175.10 176.64 1j0j n MET 375 N 2.19 2.35 -2.23 4.82 2.81 -0.47 -3.83 117.12 122.76 1j0j n MET 375 Ca -0.19 0.86 -0.42 0.00 -1.81 0.00 0.00 57.70 56.14 1j0j n MET 375 Cb 0.57 -2.72 -0.00 0.00 -0.71 0.00 0.00 33.22 30.36 1j0j n MET 375 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1j0j n ASN 376 N 6.35 4.48 0.00 7.83 2.85 -0.64 -4.56 115.26 131.57 1j0j n ASN 376 Ca 0.21 -2.88 -0.08 0.00 -0.11 0.00 0.00 54.58 51.72 1j0j n ASN 376 Cb 0.32 -1.71 0.10 0.00 1.24 0.00 0.00 39.78 39.73 1j0j n ASN 376 CO 0.00 0.00 0.00 1.88 -2.11 0.00 0.00 177.26 177.03 1j0j h TYR 377 N 6.98 0.66 -0.90 1.20 -1.99 -1.87 -2.58 116.97 118.47 1j0j h TYR 377 Ca 0.49 -0.20 0.16 0.00 2.00 0.00 0.00 58.73 61.18 1j0j h TYR 377 Cb 0.78 -0.14 -0.07 0.00 2.00 0.00 0.00 36.73 39.30 1j0j h TYR 377 CO 1.44 0.90 0.58 -1.35 -0.00 0.00 0.00 178.16 179.72 1j0j h PRO 378 N 0.44 0.62 0.10 4.88 0.11 -1.91 0.02 132.00 136.27 1j0j h PRO 378 Ca 0.03 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1j0j h PRO 378 Cb 0.95 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.91 1j0j h PRO 378 CO 0.08 0.41 -0.10 0.35 -0.21 0.00 0.00 178.00 178.54 1j0j h PHE 379 N 0.64 -0.25 -0.54 0.65 3.04 -1.84 -1.81 116.94 116.83 1j0j h PHE 379 Ca 0.46 0.00 0.08 0.00 3.98 0.00 0.00 57.97 62.50 1j0j h PHE 379 Cb 0.82 0.10 -0.07 0.00 2.56 0.00 0.00 35.95 39.36 1j0j h PHE 379 CO -0.00 -0.15 0.18 1.15 -2.02 0.00 0.00 178.31 177.46 1j0j h THR 380 N -0.22 0.77 0.17 4.41 2.02 -0.91 -0.68 112.91 118.48 1j0j h THR 380 Ca 0.00 -0.12 0.01 0.00 0.77 0.00 0.00 66.41 67.08 1j0j h THR 380 Cb 0.21 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 66.98 1j0j h THR 380 CO -0.02 0.06 -0.36 -0.78 0.37 0.00 0.00 175.52 174.79 1j0j h ASP 381 N 0.34 -1.02 -0.24 4.18 3.58 -0.87 -0.72 116.42 121.67 1j0j h ASP 381 Ca 0.27 0.11 0.02 0.00 0.42 0.00 0.00 57.03 57.85 1j0j h ASP 381 Cb 0.33 0.38 -0.02 0.00 1.72 0.00 0.00 39.33 41.74 1j0j h ASP 381 CO -0.29 -0.45 0.12 1.23 -2.88 0.00 0.00 179.24 176.96 1j0j h GLY 382 N -0.62 0.32 0.97 -0.78 0.00 -0.83 -1.35 103.07 100.78 1j0j h GLY 382 Ca 0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 1j0j h GLY 382 CO -0.18 0.07 0.18 -2.08 0.00 0.00 0.00 176.54 174.54 1j0j h VAL 383 N 0.26 1.12 -0.30 4.60 2.07 -1.01 -2.89 116.25 120.09 1j0j h VAL 383 Ca 0.10 -0.29 -0.11 0.00 0.82 0.00 0.00 66.70 67.23 1j0j h VAL 383 Cb 0.03 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 1j0j h VAL 383 CO -0.07 0.12 -0.26 -0.07 0.02 0.00 0.00 177.57 177.31 1j0j h LEU 384 N 0.40 0.60 -1.78 2.57 3.38 -0.99 -1.24 115.31 118.25 1j0j h LEU 384 Ca 0.11 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1j0j h LEU 384 Cb 0.03 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1j0j h LEU 384 CO -0.02 0.84 -0.13 0.03 0.09 0.00 0.00 178.44 179.26 1j0j h ARG 385 N 0.52 0.00 0.00 1.13 3.08 -1.11 0.36 114.38 118.36 1j0j h ARG 385 Ca 0.07 0.00 -0.45 0.00 0.07 0.00 0.00 59.98 59.67 1j0j h ARG 385 Cb 0.72 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.70 1j0j h ARG 385 CO 0.06 0.13 -2.50 0.34 -1.07 0.00 0.00 179.97 176.92 1j0j n PHE 386 N -3.53 0.04 0.04 3.04 7.35 -1.10 0.97 117.46 124.26 1j0j n PHE 386 Ca -0.01 0.02 -0.21 0.00 -0.76 0.00 0.00 57.45 56.48 1j0j n PHE 386 Cb 0.27 -1.00 -0.14 0.00 0.35 0.00 0.00 39.48 38.95 1j0j n PHE 386 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 1j0j h PHE 387 N -0.88 0.54 0.00 -5.13 0.04 -1.34 -3.19 116.94 106.98 1j0j h PHE 387 Ca -0.68 -0.39 -0.09 0.00 2.80 0.00 0.00 57.97 59.61 1j0j h PHE 387 Cb 1.64 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 39.76 1j0j h PHE 387 CO -0.07 1.48 -0.63 0.00 -0.60 0.00 0.00 178.31 178.49 1j0j h ALA 388 N 0.02 0.10 0.00 2.45 0.00 -1.55 -3.40 119.26 116.88 1j0j h ALA 388 Ca -0.25 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 53.95 1j0j h ALA 388 Cb 1.78 0.43 0.00 0.00 0.00 0.00 0.00 17.79 20.00 1j0j h ALA 388 CO 0.11 0.42 -0.56 1.63 0.00 0.00 0.00 179.25 180.85 1j0j n LYS 389 N -4.57 0.12 -4.07 0.00 4.76 0.12 -4.53 118.16 110.00 1j0j n LYS 389 Ca -0.16 0.03 -0.30 0.00 -2.87 0.00 0.00 58.31 55.01 1j0j n LYS 389 Cb 0.43 -1.57 -0.02 0.00 -1.84 0.00 0.00 35.03 32.02 1j0j n LYS 389 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1j0j n GLU 390 N -1.75 -3.25 -0.04 1.97 1.02 -0.88 -4.87 120.64 112.84 1j0j n GLU 390 Ca 0.05 0.39 -0.13 0.00 -0.02 0.00 0.00 57.16 57.45 1j0j n GLU 390 Cb 0.38 -4.75 -0.14 0.00 -0.02 0.00 0.00 31.44 26.91 1j0j n GLU 390 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1j0j n GLU 391 N -4.42 0.68 -4.24 3.49 1.02 0.27 -4.96 120.64 112.48 1j0j n GLU 391 Ca -0.15 0.22 -0.25 0.00 -0.02 0.00 0.00 57.16 56.96 1j0j n GLU 391 Cb 0.61 -1.70 -0.08 0.00 -0.02 0.00 0.00 31.44 30.25 1j0j n GLU 391 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1j0j s ILE 392 N -2.56 3.62 0.87 -3.67 -4.36 -1.15 -5.05 121.20 108.90 1j0j s ILE 392 Ca -0.13 -1.61 -0.12 0.00 -0.26 0.00 0.00 60.65 58.53 1j0j s ILE 392 Cb 0.07 -2.86 0.11 0.00 1.25 0.00 0.00 42.46 41.03 1j0j s ILE 392 CO 0.79 -0.21 1.15 -0.94 0.24 0.00 0.00 174.94 175.97 1j0j s SER 393 N -3.22 3.95 0.12 4.36 1.04 -1.26 -4.72 113.70 113.95 1j0j s SER 393 Ca 0.29 0.92 -0.20 0.00 0.48 0.00 0.00 55.95 57.44 1j0j s SER 393 Cb -0.08 -1.49 -0.08 0.00 0.10 0.00 0.00 66.02 64.47 1j0j s SER 393 CO 0.19 -2.27 1.77 0.00 0.98 0.00 0.00 173.24 173.90 1j0j h ALA 394 N -1.31 0.22 -0.39 5.32 0.00 -1.34 -0.26 119.26 121.50 1j0j h ALA 394 Ca -0.49 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.49 1j0j h ALA 394 Cb 1.33 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.97 1j0j h ALA 394 CO 0.63 -0.30 -0.15 -0.09 0.00 0.00 0.00 179.25 179.34 1j0j h ARG 395 N 0.23 -0.07 0.10 0.00 2.43 -1.76 -0.15 114.38 115.16 1j0j h ARG 395 Ca 0.06 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1j0j h ARG 395 Cb -0.02 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1j0j h ARG 395 CO -0.01 -0.05 -0.05 1.96 -1.51 0.00 0.00 179.97 180.31 1j0j h GLN 396 N -0.08 -0.13 -0.84 0.20 4.20 -1.79 -1.08 115.11 115.60 1j0j h GLN 396 Ca 0.19 0.01 0.19 0.00 0.06 0.00 0.00 58.65 59.10 1j0j h GLN 396 Cb 0.37 0.03 -0.06 0.00 0.30 0.00 0.00 27.48 28.12 1j0j h GLN 396 CO -0.44 -0.07 0.56 0.35 -0.67 0.00 0.00 178.83 178.56 1j0j h PHE 397 N -0.15 0.45 -0.12 2.96 3.57 -0.35 0.51 116.94 123.80 1j0j h PHE 397 Ca -0.01 0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.33 1j0j h PHE 397 Cb 0.12 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 1j0j h PHE 397 CO -0.07 0.14 -0.63 0.00 -2.23 0.00 0.00 178.31 175.52 1j0j h ALA 398 N 1.62 0.68 -0.18 2.41 0.00 -0.38 -1.99 119.26 121.43 1j0j h ALA 398 Ca 0.43 -0.55 -0.16 0.00 0.00 0.00 0.00 54.91 54.63 1j0j h ALA 398 Cb 1.12 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1j0j h ALA 398 CO -0.14 0.72 -0.54 -0.91 0.00 0.00 0.00 179.25 178.39 1j0j h ASN 399 N 0.33 0.57 -0.26 0.00 2.35 0.11 -0.81 115.58 117.88 1j0j h ASN 399 Ca -0.01 -0.30 -0.15 0.00 -0.55 0.00 0.00 56.30 55.29 1j0j h ASN 399 Cb 1.18 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 39.39 1j0j h ASN 399 CO 0.11 1.00 -0.43 -0.61 -1.65 0.00 0.00 177.43 175.85 1j0j h GLN 400 N 0.40 0.75 -0.52 0.81 5.75 -0.78 0.71 115.11 122.23 1j0j h GLN 400 Ca 0.01 -0.46 -0.04 0.00 -0.15 0.00 0.00 58.65 58.02 1j0j h GLN 400 Cb 1.07 0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.64 1j0j h GLN 400 CO 0.10 1.08 0.19 0.52 -2.65 0.00 0.00 178.83 178.07 1j0j h MET 401 N 0.49 0.80 -0.57 1.69 2.86 -1.30 -1.67 114.93 117.22 1j0j h MET 401 Ca 0.02 -0.16 -0.09 0.00 -2.06 0.00 0.00 59.70 57.42 1j0j h MET 401 Cb 1.03 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.54 1j0j h MET 401 CO 0.10 0.72 0.02 0.52 1.06 0.00 0.00 176.91 179.32 1j0j h MET 402 N 0.71 0.98 0.49 1.72 2.86 -1.06 -2.26 114.93 118.37 1j0j h MET 402 Ca 0.17 -0.29 -0.02 0.00 -2.06 0.00 0.00 59.70 57.50 1j0j h MET 402 Cb 0.23 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1j0j h MET 402 CO -0.01 0.96 -0.23 1.25 1.06 0.00 0.00 176.91 179.93 1j0j h HIS 403 N 0.91 -0.61 -0.72 -0.22 6.17 -0.52 -1.44 115.15 118.71 1j0j h HIS 403 Ca 0.17 -0.01 -0.07 0.00 0.71 0.00 0.00 60.37 61.17 1j0j h HIS 403 Cb 0.51 0.20 -0.03 0.00 2.52 0.00 0.00 27.41 30.61 1j0j h HIS 403 CO 0.03 -0.36 0.18 -0.39 0.71 0.00 0.00 177.93 178.11 1j0j h VAL 404 N -0.70 1.26 -0.30 5.26 -1.51 -1.34 -2.66 116.25 116.26 1j0j h VAL 404 Ca -0.07 -0.97 -0.01 0.00 -1.23 0.00 0.00 66.70 64.42 1j0j h VAL 404 Cb 0.52 0.52 -0.01 0.00 -2.13 0.00 0.00 31.29 30.19 1j0j h VAL 404 CO 0.11 0.37 0.13 -0.07 -1.23 0.00 0.00 177.57 176.88 1j0j h LEU 405 N 1.09 0.41 0.00 4.19 3.38 -1.36 -2.21 115.31 120.80 1j0j h LEU 405 Ca 0.23 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1j0j h LEU 405 Cb 0.37 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1j0j h LEU 405 CO 0.00 0.45 0.00 1.41 0.09 0.00 0.00 178.44 180.39 1j0j n HIS 406 N -4.75 0.00 0.32 1.13 8.25 -0.55 -2.82 115.22 116.81 1j0j n HIS 406 Ca -0.02 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.56 1j0j n HIS 406 Cb 0.12 0.00 0.17 0.00 1.12 0.00 0.00 29.99 31.41 1j0j n HIS 406 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1j0j h SER 407 N 0.00 0.00 -3.53 0.41 4.64 -1.04 -3.46 113.55 110.57 1j0j h SER 407 Ca 0.00 -0.03 -0.41 0.00 -0.47 0.00 0.00 61.79 60.87 1j0j h SER 407 Cb 0.00 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 61.95 1j0j h SER 407 CO 0.00 0.02 -0.68 -0.31 -0.87 0.00 0.00 176.83 174.99 1j0j s TYR 408 N -3.22 1.65 0.49 4.77 2.02 -1.13 -4.52 117.35 117.42 1j0j s TYR 408 Ca 0.06 -0.80 -0.20 0.00 -0.37 0.00 0.00 57.07 55.76 1j0j s TYR 408 Cb 0.09 -0.92 -0.08 0.00 -0.40 0.00 0.00 41.96 40.64 1j0j s TYR 408 CO 0.69 0.11 1.04 -1.25 -1.57 0.00 0.00 175.55 174.57 1j0j s PRO 409 N -3.78 3.78 0.24 -1.71 0.04 -1.26 -4.80 135.00 127.50 1j0j s PRO 409 Ca 0.27 1.33 -0.11 0.00 0.04 0.00 0.00 61.00 62.52 1j0j s PRO 409 Cb 0.04 -2.09 0.33 0.00 0.04 0.00 0.00 34.50 32.82 1j0j s PRO 409 CO 0.08 -0.45 1.59 -0.91 0.04 0.00 0.00 177.00 177.36 1j0j h ASN 410 N 1.46 -0.77 0.17 6.66 2.35 -1.92 0.41 115.58 123.94 1j0j h ASN 410 Ca -0.49 0.24 -0.00 0.00 -0.55 0.00 0.00 56.30 55.50 1j0j h ASN 410 Cb 1.22 0.51 -0.00 0.00 0.05 0.00 0.00 38.32 40.09 1j0j h ASN 410 CO 0.59 -0.27 -0.01 -0.55 -1.65 0.00 0.00 177.43 175.55 1j0j h ASN 411 N -0.00 0.00 0.00 5.81 7.08 -1.97 -2.00 115.58 124.51 1j0j h ASN 411 Ca 0.38 0.00 -0.00 0.00 -3.08 0.00 0.00 56.30 53.60 1j0j h ASN 411 Cb 0.59 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.83 1j0j h ASN 411 CO -0.83 0.01 -0.00 0.58 -2.08 0.00 0.00 177.43 175.11 1j0j h VAL 412 N 0.00 1.57 -0.48 6.14 2.07 -1.30 -3.31 116.25 120.94 1j0j h VAL 412 Ca -0.00 -2.17 0.14 0.00 0.82 0.00 0.00 66.70 65.49 1j0j h VAL 412 Cb 0.09 2.97 -0.02 0.00 -1.52 0.00 0.00 31.29 32.81 1j0j h VAL 412 CO 0.00 0.53 0.47 0.78 0.02 0.00 0.00 177.57 179.37 1j0j h ASN 413 N -0.99 0.00 1.10 0.57 2.35 -0.91 -0.13 115.58 117.57 1j0j h ASN 413 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1j0j h ASN 413 Cb 0.87 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.24 1j0j h ASN 413 CO 0.00 0.00 0.00 -0.33 -1.65 0.00 0.00 177.43 175.45 1j0j h GLU 414 N 0.00 0.00 -0.09 0.81 5.08 -1.49 -3.13 114.58 115.76 1j0j h GLU 414 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1j0j h GLU 414 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1j0j h GLU 414 CO -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 1j0j n ALA 415 N -1.88 2.37 -1.81 3.43 0.00 -0.07 -4.26 120.51 118.29 1j0j n ALA 415 Ca 0.03 -2.12 -0.41 0.00 0.00 0.00 0.00 53.44 50.94 1j0j n ALA 415 Cb 0.32 -0.39 -0.02 0.00 0.00 0.00 0.00 19.45 19.37 1j0j n ALA 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j0j s ALA 416 N -2.35 3.52 -1.07 0.00 0.00 -1.18 -4.63 121.76 116.06 1j0j s ALA 416 Ca 0.27 1.26 -0.17 0.00 0.00 0.00 0.00 51.96 53.32 1j0j s ALA 416 Cb 0.23 -3.49 0.14 0.00 0.00 0.00 0.00 23.12 19.99 1j0j s ALA 416 CO 0.05 -0.65 1.31 0.12 0.00 0.00 0.00 175.76 176.59 1j0j s PHE 417 N -0.80 3.23 -0.25 0.00 5.36 -1.25 0.79 117.98 125.07 1j0j s PHE 417 Ca 0.52 -1.70 -0.29 0.00 -0.96 0.00 0.00 56.93 54.50 1j0j s PHE 417 Cb -0.40 -4.34 0.01 0.00 -0.34 0.00 0.00 43.02 37.94 1j0j s PHE 417 CO 0.50 -1.49 1.14 -0.80 -1.46 0.00 0.00 175.22 173.10 1j0j s ASN 418 N 3.39 6.96 0.12 6.13 0.02 -1.01 -1.63 114.94 128.92 1j0j s ASN 418 Ca 0.39 1.34 0.06 0.00 -1.02 0.00 0.00 52.86 53.63 1j0j s ASN 418 Cb -0.03 -2.54 -0.04 0.00 0.02 0.00 0.00 41.25 38.66 1j0j s ASN 418 CO -0.04 -0.81 -0.16 -1.48 0.02 0.00 0.00 177.10 174.63 1j0j s LEU 419 N 3.56 2.37 -0.01 0.60 2.34 -1.26 -0.41 118.68 125.86 1j0j s LEU 419 Ca 0.49 -0.76 0.14 0.00 0.06 0.00 0.00 54.13 54.06 1j0j s LEU 419 Cb -0.16 -0.63 -0.19 0.00 -0.56 0.00 0.00 46.19 44.64 1j0j s LEU 419 CO 0.13 -0.09 0.44 0.18 -1.06 0.00 0.00 176.35 175.96 1j0j n LEU 420 N 0.72 0.30 -3.61 1.48 4.77 -1.26 -4.13 117.00 115.26 1j0j n LEU 420 Ca -0.17 -0.22 -0.03 0.00 -0.03 0.00 0.00 56.01 55.57 1j0j n LEU 420 Cb 0.56 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.64 1j0j n LEU 420 CO 0.26 0.07 0.98 -0.83 -1.33 0.00 0.00 177.39 176.54 1j0j s GLY 421 N -3.09 -0.35 0.00 -0.72 0.00 -1.26 -4.82 107.32 97.09 1j0j s GLY 421 Ca -0.01 1.11 0.00 0.00 0.00 0.00 0.00 44.72 45.82 1j0j s GLY 421 CO 0.60 0.33 0.00 -1.14 0.00 0.00 0.00 173.10 172.88 1j0j n SER 422 N -0.28 0.00 0.00 1.64 3.41 -1.26 -4.45 113.62 112.68 1j0j n SER 422 Ca -0.04 -0.98 0.10 0.00 -0.26 0.00 0.00 58.87 57.70 1j0j n SER 422 Cb 0.60 0.00 0.62 0.00 -0.26 0.00 0.00 64.21 65.18 1j0j n SER 422 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1j0j n HIS 423 N 0.00 0.00 -0.45 7.33 1.44 -1.26 -2.80 115.22 119.48 1j0j n HIS 423 Ca 0.00 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.79 1j0j n HIS 423 Cb 0.00 0.00 0.23 0.00 0.12 0.00 0.00 29.99 30.34 1j0j n HIS 423 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1j0j n ASP 424 N -0.94 3.59 -3.96 4.39 8.00 -1.26 -4.55 116.55 121.83 1j0j n ASP 424 Ca 0.16 -2.30 -0.09 0.00 0.71 0.00 0.00 54.79 53.27 1j0j n ASP 424 Cb 0.07 -0.39 -0.05 0.00 -0.02 0.00 0.00 41.12 40.73 1j0j n ASP 424 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1j0j s THR 425 N -1.54 0.01 1.00 -3.53 -4.23 -1.12 -4.72 115.64 101.50 1j0j s THR 425 Ca 0.35 -1.32 -0.11 0.00 -1.18 0.00 0.00 61.69 59.43 1j0j s THR 425 Cb 0.22 -2.08 0.19 0.00 1.34 0.00 0.00 72.50 72.17 1j0j s THR 425 CO 0.18 -0.05 1.10 -0.44 -0.54 0.00 0.00 174.62 174.87 1j0j s SER 426 N -2.99 2.31 0.53 3.99 0.01 -1.26 -4.43 113.70 111.86 1j0j s SER 426 Ca 0.20 1.88 -0.18 0.00 1.31 0.00 0.00 55.95 59.16 1j0j s SER 426 Cb -0.00 -2.44 -0.07 0.00 0.21 0.00 0.00 66.02 63.71 1j0j s SER 426 CO 0.06 -3.43 1.04 -0.13 0.41 0.00 0.00 173.24 171.19 1j0j s ARG 427 N -4.61 3.65 0.23 12.44 1.81 0.30 -4.77 118.95 128.00 1j0j s ARG 427 Ca 0.67 1.26 0.01 0.00 -1.72 0.00 0.00 55.73 55.95 1j0j s ARG 427 Cb -0.23 -2.08 0.23 0.00 -0.45 0.00 0.00 34.95 32.42 1j0j s ARG 427 CO 0.60 -0.54 1.57 -0.84 -0.68 0.00 0.00 175.30 175.41 1j0j h ILE 428 N 1.11 1.34 -0.16 1.52 3.07 -1.87 -1.03 117.51 121.48 1j0j h ILE 428 Ca -0.48 -1.78 -0.04 0.00 1.55 0.00 0.00 64.86 64.11 1j0j h ILE 428 Cb 1.22 1.80 -0.01 0.00 -0.27 0.00 0.00 36.82 39.56 1j0j h ILE 428 CO 0.59 0.54 -0.08 0.25 -1.05 0.00 0.00 178.15 178.40 1j0j h LEU 429 N 0.31 0.23 -0.08 0.16 5.85 -1.93 -0.29 115.31 119.56 1j0j h LEU 429 Ca 0.01 -0.04 -0.25 0.00 0.84 0.00 0.00 57.88 58.44 1j0j h LEU 429 Cb 1.02 -0.06 0.01 0.00 0.37 0.00 0.00 40.66 42.00 1j0j h LEU 429 CO 0.09 0.35 -0.99 0.74 -0.34 0.00 0.00 178.44 178.28 1j0j h THR 430 N 0.24 1.33 0.00 1.05 2.02 -1.76 0.56 112.91 116.34 1j0j h THR 430 Ca 0.05 -2.32 -0.03 0.00 0.77 0.00 0.00 66.41 64.88 1j0j h THR 430 Cb 0.30 2.38 -0.00 0.00 -1.74 0.00 0.00 68.15 69.08 1j0j h THR 430 CO 0.01 0.71 -0.16 0.58 0.37 0.00 0.00 175.52 177.03 1j0j h VAL 431 N 0.33 0.88 -0.19 3.16 2.07 -0.55 0.26 116.25 122.22 1j0j h VAL 431 Ca -0.11 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 66.83 1j0j h VAL 431 Cb 1.64 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 32.75 1j0j h VAL 431 CO 0.19 0.15 0.00 0.00 0.02 0.00 0.00 177.57 177.93 1j0j n GLY 433 N 0.90 0.05 1.90 0.00 0.00 0.91 -2.20 105.19 106.75 1j0j n GLY 433 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1j0j n GLY 433 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j0j n GLY 434 N -0.90 1.28 3.57 -0.02 0.00 0.19 -4.99 105.19 104.32 1j0j n GLY 434 Ca -0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 1j0j n GLY 434 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1j0j s ASP 435 N -3.11 6.26 0.38 1.61 -1.08 -0.94 -4.90 116.67 114.90 1j0j s ASP 435 Ca 0.00 0.06 0.07 0.00 -0.52 0.00 0.00 52.55 52.16 1j0j s ASP 435 Cb 0.00 -2.55 0.80 0.00 -1.46 0.00 0.00 42.92 39.70 1j0j s ASP 435 CO 0.00 -1.64 1.98 0.40 0.52 0.00 0.00 175.17 176.43 1j0j h ILE 436 N 6.22 1.02 -0.47 4.11 1.08 -1.91 -2.58 117.51 124.99 1j0j h ILE 436 Ca -0.26 -0.23 0.07 0.00 -0.39 0.00 0.00 64.86 64.04 1j0j h ILE 436 Cb 1.07 0.28 -0.06 0.00 -3.07 0.00 0.00 36.82 35.04 1j0j h ILE 436 CO 1.20 0.12 0.14 0.03 -0.69 0.00 0.00 178.15 178.95 1j0j h ARG 437 N 0.68 0.28 -0.16 2.37 3.08 -1.96 -1.17 114.38 117.50 1j0j h ARG 437 Ca 0.28 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.33 1j0j h ARG 437 Cb 0.24 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1j0j h ARG 437 CO -0.09 0.19 0.05 0.87 -1.07 0.00 0.00 179.97 179.92 1j0j h LYS 438 N 0.29 0.12 -0.21 0.04 1.57 -1.78 -2.80 116.57 113.80 1j0j h LYS 438 Ca 0.23 -0.01 0.05 0.00 -1.87 0.00 0.00 60.65 59.05 1j0j h LYS 438 Cb 0.26 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.50 1j0j h LYS 438 CO -0.26 0.08 -0.08 0.28 -0.57 0.00 0.00 179.45 178.90 1j0j h VAL 439 N 0.13 0.72 -0.95 0.50 2.07 -1.37 0.50 116.25 117.85 1j0j h VAL 439 Ca 0.07 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.82 1j0j h VAL 439 Cb 0.04 0.72 -0.07 0.00 -1.52 0.00 0.00 31.29 30.47 1j0j h VAL 439 CO -0.07 0.00 0.64 0.11 0.02 0.00 0.00 177.57 178.26 1j0j h LYS 440 N -0.04 0.29 -0.30 1.57 1.57 -1.08 0.65 116.57 119.22 1j0j h LYS 440 Ca 0.11 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.79 1j0j h LYS 440 Cb 0.21 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1j0j h LYS 440 CO -0.25 0.19 -0.13 -0.07 -0.57 0.00 0.00 179.45 178.63 1j0j h LEU 441 N 0.30 0.64 -0.15 2.94 3.38 -0.67 -1.38 115.31 120.37 1j0j h LEU 441 Ca 0.49 -0.40 0.05 0.00 0.09 0.00 0.00 57.88 58.12 1j0j h LEU 441 Cb 1.41 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.93 1j0j h LEU 441 CO -0.16 0.89 -0.23 -0.07 0.09 0.00 0.00 178.44 178.96 1j0j h LEU 442 N 0.38 -0.73 -1.23 1.67 3.38 0.11 -1.43 115.31 117.46 1j0j h LEU 442 Ca 0.07 0.12 0.05 0.00 0.09 0.00 0.00 57.88 58.21 1j0j h LEU 442 Cb 0.64 0.33 -0.05 0.00 0.09 0.00 0.00 40.66 41.67 1j0j h LEU 442 CO 0.04 -0.28 0.54 -0.26 0.09 0.00 0.00 178.44 178.57 1j0j h PHE 443 N -0.29 0.96 -0.08 1.13 -1.00 -1.06 -1.85 116.94 114.76 1j0j h PHE 443 Ca 0.11 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.91 1j0j h PHE 443 Cb 0.45 -0.32 -0.00 0.00 3.61 0.00 0.00 35.95 39.68 1j0j h PHE 443 CO -0.35 0.53 0.05 1.25 -1.61 0.00 0.00 178.31 178.19 1j0j h LEU 444 N 0.97 0.10 -0.61 1.54 5.85 -0.24 -0.52 115.31 122.41 1j0j h LEU 444 Ca 0.34 -0.04 -0.15 0.00 0.84 0.00 0.00 57.88 58.87 1j0j h LEU 444 Cb 0.12 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1j0j h LEU 444 CO -0.11 0.11 -0.49 0.15 -0.34 0.00 0.00 178.44 177.76 1j0j h PHE 445 N 0.07 0.63 -0.41 1.25 3.57 -1.06 -1.42 116.94 119.58 1j0j h PHE 445 Ca 0.03 -0.21 -0.12 0.00 3.53 0.00 0.00 57.97 61.20 1j0j h PHE 445 Cb 0.03 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.64 1j0j h PHE 445 CO -0.06 0.91 -0.22 0.37 -2.23 0.00 0.00 178.31 177.08 1j0j h GLN 446 N 0.41 0.87 0.00 1.11 4.15 -1.28 -1.73 115.11 118.65 1j0j h GLN 446 Ca 0.02 -0.39 0.00 0.00 0.77 0.00 0.00 58.65 59.05 1j0j h GLN 446 Cb 1.01 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.68 1j0j h GLN 446 CO 0.09 1.03 0.00 -0.07 -1.93 0.00 0.00 178.83 177.95 1j0j h LEU 447 N 0.69 0.00 -1.37 -2.39 3.38 -1.01 -2.97 115.31 111.64 1j0j h LEU 447 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1j0j h LEU 447 Cb 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1j0j h LEU 447 CO 0.06 0.00 -0.22 0.35 0.09 0.00 0.00 178.44 178.72 1j0j n THR 448 N -2.36 0.00 -3.37 0.22 -2.24 -0.54 -4.77 114.28 101.21 1j0j n THR 448 Ca 0.05 -0.35 -0.38 0.00 -2.27 0.00 0.00 64.05 61.09 1j0j n THR 448 Cb 0.43 1.25 -0.06 0.00 -2.10 0.00 0.00 70.33 69.85 1j0j n THR 448 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1j0j s PHE 449 N -2.24 3.73 0.25 4.78 5.36 -0.66 -4.76 117.98 124.43 1j0j s PHE 449 Ca 0.24 1.10 -0.30 0.00 -0.96 0.00 0.00 56.93 57.01 1j0j s PHE 449 Cb 0.19 -2.42 -0.10 0.00 -0.34 0.00 0.00 43.02 40.35 1j0j s PHE 449 CO 0.44 0.54 1.38 0.99 -1.46 0.00 0.00 175.22 177.11 1j0j s THR 450 N -0.81 2.83 -3.87 0.12 2.01 -1.24 -4.72 115.64 109.96 1j0j s THR 450 Ca 0.26 0.71 0.00 0.00 0.31 0.00 0.00 61.69 62.98 1j0j s THR 450 Cb -0.18 -3.45 0.00 0.00 0.01 0.00 0.00 72.50 68.88 1j0j s THR 450 CO 0.15 0.12 0.00 0.61 -0.69 0.00 0.00 174.62 174.81 1j0j n GLY 451 N 2.05 0.45 2.64 4.40 0.00 -1.22 -4.82 105.19 108.68 1j0j n GLY 451 Ca 0.06 -1.37 -0.28 0.00 0.00 0.00 0.00 46.02 44.43 1j0j n GLY 451 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1j0j s SER 452 N -4.00 3.18 0.65 1.61 0.15 0.24 -4.64 113.70 110.88 1j0j s SER 452 Ca 0.00 -2.99 -0.17 0.00 0.70 0.00 0.00 55.95 53.49 1j0j s SER 452 Cb 0.00 -0.93 -0.01 0.00 -1.71 0.00 0.00 66.02 63.37 1j0j s SER 452 CO 0.00 -0.20 1.21 -2.16 1.20 0.00 0.00 173.24 173.29 1j0j s PRO 453 N -0.07 2.65 -0.04 5.44 0.04 -1.26 -2.41 135.00 139.35 1j0j s PRO 453 Ca 0.24 1.81 0.01 0.00 0.04 0.00 0.00 61.00 63.09 1j0j s PRO 453 Cb -0.11 -1.89 0.02 0.00 0.04 0.00 0.00 34.50 32.56 1j0j s PRO 453 CO -0.09 -1.46 -0.02 0.00 0.04 0.00 0.00 177.00 175.47 1j0j s ILE 455 N 0.99 4.86 -0.15 0.00 1.01 0.07 -4.19 121.20 123.79 1j0j s ILE 455 Ca -0.10 -0.02 -0.24 0.00 0.00 0.00 0.00 60.65 60.28 1j0j s ILE 455 Cb -0.14 -3.13 -0.02 0.00 0.01 0.00 0.00 42.46 39.18 1j0j s ILE 455 CO -0.01 0.56 0.78 -0.47 0.00 0.00 0.00 174.94 175.80 1j0j s TYR 456 N -0.46 3.46 0.00 3.97 5.04 -1.26 -0.36 117.35 127.74 1j0j s TYR 456 Ca 0.10 1.23 -0.37 0.00 -2.44 0.00 0.00 57.07 55.59 1j0j s TYR 456 Cb -0.12 -2.95 -0.18 0.00 0.35 0.00 0.00 41.96 39.06 1j0j s TYR 456 CO 0.02 -0.16 0.97 2.48 -1.34 0.00 0.00 175.55 177.53 1j0j n TYR 457 N 4.86 0.57 0.00 4.97 4.11 -0.50 -1.13 117.16 130.04 1j0j n TYR 457 Ca 0.03 0.97 0.00 0.00 -0.00 0.00 0.00 57.90 58.90 1j0j n TYR 457 Cb 0.49 -1.92 0.00 0.00 -0.00 0.00 0.00 39.34 37.91 1j0j n TYR 457 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1j0j n GLY 458 N 1.39 2.55 0.37 -7.48 0.00 -1.26 -4.87 105.19 95.89 1j0j n GLY 458 Ca 0.18 -0.38 0.26 0.00 0.00 0.00 0.00 46.02 46.09 1j0j n GLY 458 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1j0j h ASP 459 N 0.00 0.47 0.31 1.61 5.19 -1.45 0.29 116.42 122.84 1j0j h ASP 459 Ca 0.00 0.17 -0.02 0.00 -0.62 0.00 0.00 57.03 56.56 1j0j h ASP 459 Cb 0.00 0.12 -0.00 0.00 0.18 0.00 0.00 39.33 39.62 1j0j h ASP 459 CO 0.00 -0.11 -0.10 1.05 -3.12 0.00 0.00 179.24 176.96 1j0j h GLU 460 N 0.30 0.00 -0.28 3.56 9.09 -1.89 -2.86 114.58 122.50 1j0j h GLU 460 Ca 0.73 0.00 -0.13 0.00 0.05 0.00 0.00 59.36 60.01 1j0j h GLU 460 Cb 1.79 0.00 -0.08 0.00 -1.65 0.00 0.00 28.75 28.82 1j0j h GLU 460 CO -0.53 0.10 -0.13 0.44 0.05 0.00 0.00 179.01 178.94 1j0j n ILE 461 N -3.67 2.45 -2.66 -1.06 -5.35 1.00 -1.45 119.36 108.62 1j0j n ILE 461 Ca -0.02 -2.73 -0.15 0.00 -0.27 0.00 0.00 62.75 59.58 1j0j n ILE 461 Cb 0.21 -0.30 0.02 0.00 -1.74 0.00 0.00 39.64 37.83 1j0j n ILE 461 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1j0j n GLY 462 N -1.08 -0.14 3.77 3.28 0.00 -1.08 -1.61 105.19 108.32 1j0j n GLY 462 Ca 0.29 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 1j0j n GLY 462 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1j0j s MET 463 N -5.18 3.88 0.42 1.61 -1.94 -1.18 -4.88 119.30 112.02 1j0j s MET 463 Ca 0.16 1.92 0.07 0.00 -1.71 0.00 0.00 55.69 56.14 1j0j s MET 463 Cb -0.07 -2.58 -0.05 0.00 2.01 0.00 0.00 34.83 34.13 1j0j s MET 463 CO 0.20 -0.49 0.17 0.99 -0.01 0.00 0.00 175.02 175.87 1j0j s THR 464 N -1.41 2.24 0.00 2.05 2.01 -1.26 -4.63 115.64 114.65 1j0j s THR 464 Ca 0.60 -1.72 0.00 0.00 0.31 0.00 0.00 61.69 60.88 1j0j s THR 464 Cb -0.32 -2.96 0.00 0.00 0.01 0.00 0.00 72.50 69.22 1j0j s THR 464 CO 0.40 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.94 1j0j n GLY 465 N -1.23 4.40 0.00 4.40 0.00 -1.26 -4.82 105.19 106.67 1j0j n GLY 465 Ca -0.02 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.84 1j0j n GLY 465 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j0j n GLY 466 N -1.80 0.13 3.76 -0.02 0.00 -1.26 -0.54 105.19 105.46 1j0j n GLY 466 Ca 0.00 -1.78 -0.31 0.00 0.00 0.00 0.00 46.02 43.93 1j0j n GLY 466 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1j0j s ASN 467 N -1.00 4.51 -0.05 1.61 3.84 -1.26 -1.35 114.94 121.23 1j0j s ASN 467 Ca 0.00 1.87 -0.13 0.00 0.21 0.00 0.00 52.86 54.81 1j0j s ASN 467 Cb 0.00 -2.53 -0.06 0.00 -0.55 0.00 0.00 41.25 38.11 1j0j s ASN 467 CO 0.00 -2.04 0.39 -0.67 -2.79 0.00 0.00 177.10 172.00 1j0j n ASP 468 N -3.40 0.12 -0.76 -4.21 4.64 -1.26 -2.04 116.55 109.65 1j0j n ASP 468 Ca 0.09 0.37 0.13 0.00 -1.38 0.00 0.00 54.79 54.00 1j0j n ASP 468 Cb 0.53 -0.29 0.31 0.00 -1.04 0.00 0.00 41.12 40.63 1j0j n ASP 468 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 1j0j n PRO 469 N 0.72 2.03 0.07 -0.67 -0.04 -1.26 -4.90 135.00 130.95 1j0j n PRO 469 Ca 0.07 -1.51 0.20 0.00 -0.04 0.00 0.00 63.50 62.23 1j0j n PRO 469 Cb 0.01 -1.47 0.74 0.00 -0.04 0.00 0.00 33.50 32.75 1j0j n PRO 469 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1j0j h GLU 470 N 3.50 0.00 0.00 0.54 4.81 -1.57 0.16 114.58 122.02 1j0j h GLU 470 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1j0j h GLU 470 Cb 0.75 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.13 1j0j h GLU 470 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.28 1j0j n ARG 472 N -1.31 2.24 -0.89 0.00 1.74 0.56 -4.91 116.66 114.09 1j0j n ARG 472 Ca 0.13 -3.19 -0.31 0.00 -0.77 0.00 0.00 57.85 53.71 1j0j n ARG 472 Cb 0.25 -2.07 0.14 0.00 -1.02 0.00 0.00 32.46 29.76 1j0j n ARG 472 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1j0j s LYS 473 N -3.38 1.44 0.33 5.56 1.02 -1.25 -4.84 119.74 118.62 1j0j s LYS 473 Ca 0.53 1.43 -0.29 0.00 0.02 0.00 0.00 55.97 57.66 1j0j s LYS 473 Cb 0.45 -1.79 -0.11 0.00 -0.52 0.00 0.00 37.83 35.87 1j0j s LYS 473 CO 0.05 -2.29 1.47 0.00 -0.92 0.00 0.00 175.35 173.65 1j0j n MET 475 N 1.26 1.55 -3.18 0.00 1.56 0.69 -4.90 117.12 114.09 1j0j n MET 475 Ca 0.03 0.55 -0.41 0.00 -0.27 0.00 0.00 57.70 57.61 1j0j n MET 475 Cb 0.39 -2.14 -0.07 0.00 2.15 0.00 0.00 33.22 33.55 1j0j n MET 475 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 1j0j s VAL 476 N -1.23 4.97 -0.02 1.12 1.01 -1.26 -4.90 120.40 120.09 1j0j s VAL 476 Ca 0.62 0.52 0.12 0.00 0.00 0.00 0.00 61.98 63.24 1j0j s VAL 476 Cb -0.56 -3.99 -0.18 0.00 0.00 0.00 0.00 36.38 31.65 1j0j s VAL 476 CO 0.58 -0.22 0.26 0.79 0.00 0.00 0.00 175.10 176.51 1j0j n TRP 477 N 5.84 0.00 -2.07 5.22 7.02 -1.26 -4.94 117.44 127.25 1j0j n TRP 477 Ca -0.03 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 56.02 1j0j n TRP 477 Cb 0.49 -0.27 -0.03 0.00 -2.42 0.00 0.00 31.31 29.08 1j0j n TRP 477 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 1j0j s ASP 478 N -3.36 6.27 0.25 -0.99 -1.08 -1.26 -4.90 116.67 111.60 1j0j s ASP 478 Ca -0.04 1.59 -0.05 0.00 -0.52 0.00 0.00 52.55 53.53 1j0j s ASP 478 Cb 0.08 -2.53 0.32 0.00 -1.46 0.00 0.00 42.92 39.33 1j0j s ASP 478 CO 0.49 -1.35 1.88 -0.65 0.52 0.00 0.00 175.17 176.06 1j0j h PRO 479 N 11.22 1.11 0.00 4.34 0.11 -1.92 -0.80 132.00 146.06 1j0j h PRO 479 Ca -0.34 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1j0j h PRO 479 Cb 1.16 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1j0j h PRO 479 CO 1.00 0.74 0.00 -1.33 -0.21 0.00 0.00 178.00 178.20 1j0j n MET 480 N -4.51 0.03 0.00 1.05 2.81 -1.26 -1.78 117.12 113.46 1j0j n MET 480 Ca 0.13 0.13 0.00 0.00 -1.81 0.00 0.00 57.70 56.15 1j0j n MET 480 Cb 0.12 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.13 1j0j n MET 480 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1j0j n GLN 481 N -1.13 0.82 -5.21 0.03 1.13 -0.32 -5.03 117.38 107.67 1j0j n GLN 481 Ca 0.01 -0.79 -0.32 0.00 -1.94 0.00 0.00 57.00 53.96 1j0j n GLN 481 Cb 0.01 -0.82 -0.17 0.00 0.11 0.00 0.00 30.24 29.38 1j0j n GLN 481 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 1j0j s GLN 482 N -0.36 2.87 -0.09 -1.09 -2.07 -0.73 -5.00 119.66 113.19 1j0j s GLN 482 Ca 0.00 -0.88 -0.29 0.00 -1.82 0.00 0.00 55.36 52.37 1j0j s GLN 482 Cb 0.00 -2.27 -0.06 0.00 -1.09 0.00 0.00 33.01 29.59 1j0j s GLN 482 CO 0.00 0.27 1.96 1.21 -1.32 0.00 0.00 175.29 177.40 1j0j s ASN 483 N 0.13 6.15 0.15 12.60 3.84 -0.64 -4.88 114.94 132.30 1j0j s ASN 483 Ca -0.12 2.23 0.12 0.00 0.21 0.00 0.00 52.86 55.30 1j0j s ASN 483 Cb -0.16 -2.52 -0.10 0.00 -0.55 0.00 0.00 41.25 37.92 1j0j s ASN 483 CO 0.07 -1.35 1.18 0.50 -2.79 0.00 0.00 177.10 174.70 1j0j h LYS 484 N 11.88 0.00 0.67 0.43 1.63 -1.92 -3.13 116.57 126.13 1j0j h LYS 484 Ca -0.44 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.34 1j0j h LYS 484 Cb 1.22 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.84 1j0j h LYS 484 CO 0.96 0.62 -0.48 1.49 -3.45 0.00 0.00 179.45 178.58 1j0j h GLU 485 N 0.00 -1.06 -0.10 1.90 4.81 -1.94 -2.28 114.58 115.91 1j0j h GLU 485 Ca -0.07 0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.27 1j0j h GLU 485 Cb 1.62 0.24 -0.04 0.00 0.63 0.00 0.00 28.75 31.20 1j0j h GLU 485 CO 0.08 -0.71 -0.14 -0.07 -0.73 0.00 0.00 179.01 177.44 1j0j h LEU 486 N -1.10 -0.44 -0.54 1.64 3.38 -1.80 -2.09 115.31 114.36 1j0j h LEU 486 Ca -0.09 0.08 0.11 0.00 0.09 0.00 0.00 57.88 58.07 1j0j h LEU 486 Cb 0.91 0.21 -0.11 0.00 0.09 0.00 0.00 40.66 41.76 1j0j h LEU 486 CO 0.04 -0.19 -0.24 -0.74 0.09 0.00 0.00 178.44 177.40 1j0j h HIS 487 N -0.19 -0.60 -0.28 1.13 2.76 -1.16 0.17 115.15 116.98 1j0j h HIS 487 Ca 0.08 0.06 -0.11 0.00 -2.20 0.00 0.00 60.37 58.21 1j0j h HIS 487 Cb 0.31 0.35 -0.01 0.00 1.55 0.00 0.00 27.41 29.60 1j0j h HIS 487 CO -0.25 -0.32 -0.27 1.96 -1.30 0.00 0.00 177.93 177.75 1j0j h GLN 488 N -0.11 0.55 -0.48 5.26 1.08 -1.31 -0.41 115.11 119.70 1j0j h GLN 488 Ca 0.25 -0.22 0.02 0.00 -1.45 0.00 0.00 58.65 57.24 1j0j h GLN 488 Cb 0.49 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.87 1j0j h GLN 488 CO -0.61 0.77 0.29 1.25 -0.95 0.00 0.00 178.83 179.59 1j0j h HIS 489 N 0.48 0.55 -0.30 2.96 2.76 -0.31 0.56 115.15 121.86 1j0j h HIS 489 Ca 0.07 0.02 -0.17 0.00 -2.20 0.00 0.00 60.37 58.08 1j0j h HIS 489 Cb 0.72 -0.18 -0.00 0.00 1.55 0.00 0.00 27.41 29.50 1j0j h HIS 489 CO 0.03 0.33 -0.48 0.28 -1.30 0.00 0.00 177.93 176.78 1j0j h VAL 490 N 0.59 1.28 -0.38 5.26 2.07 -0.56 -1.55 116.25 122.97 1j0j h VAL 490 Ca 0.19 -1.67 -0.07 0.00 0.82 0.00 0.00 66.70 65.96 1j0j h VAL 490 Cb -0.01 1.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1j0j h VAL 490 CO -0.07 0.55 -0.08 0.50 0.02 0.00 0.00 177.57 178.49 1j0j h LYS 491 N 0.65 0.64 0.16 1.57 3.64 -0.65 -0.27 116.57 122.31 1j0j h LYS 491 Ca 0.03 -0.18 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 1j0j h LYS 491 Cb 1.07 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1j0j h LYS 491 CO 0.11 0.71 -0.08 0.37 -2.27 0.00 0.00 179.45 178.29 1j0j h GLN 492 N 0.59 -0.20 -0.42 1.90 4.15 0.38 -2.73 115.11 118.77 1j0j h GLN 492 Ca 0.11 0.01 -0.10 0.00 0.77 0.00 0.00 58.65 59.44 1j0j h GLN 492 Cb 0.49 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.22 1j0j h GLN 492 CO 0.03 -0.01 -0.13 -0.07 -1.93 0.00 0.00 178.83 176.71 1j0j h LEU 493 N -0.37 0.84 -1.54 -2.39 3.38 -1.14 -1.75 115.31 112.35 1j0j h LEU 493 Ca -0.02 -0.38 0.10 0.00 0.09 0.00 0.00 57.88 57.67 1j0j h LEU 493 Cb 0.29 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 1j0j h LEU 493 CO 0.04 1.03 0.44 0.40 0.09 0.00 0.00 178.44 180.43 1j0j h ILE 494 N 0.65 0.92 0.52 1.22 2.04 -1.07 0.11 117.51 121.89 1j0j h ILE 494 Ca 0.10 -0.18 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1j0j h ILE 494 Cb 0.68 0.35 0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1j0j h ILE 494 CO 0.05 0.09 -0.25 0.00 0.00 0.00 0.00 178.15 178.05 1j0j h ALA 495 N 1.66 -0.69 -0.82 1.87 0.00 -1.15 -2.72 119.26 117.42 1j0j h ALA 495 Ca 0.30 -0.19 0.21 0.00 0.00 0.00 0.00 54.91 55.23 1j0j h ALA 495 Cb 0.50 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 1j0j h ALA 495 CO -0.10 -0.71 0.57 -0.07 0.00 0.00 0.00 179.25 178.94 1j0j h LEU 496 N -1.05 0.19 -0.95 0.00 3.38 -0.55 0.31 115.31 116.64 1j0j h LEU 496 Ca -0.07 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1j0j h LEU 496 Cb 0.61 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1j0j h LEU 496 CO 0.12 0.08 0.13 -0.09 0.09 0.00 0.00 178.44 178.77 1j0j h ARG 497 N 0.19 0.90 -0.19 1.13 2.43 -0.65 -0.94 114.38 117.24 1j0j h ARG 497 Ca 0.41 -0.19 -0.17 0.00 -0.81 0.00 0.00 59.98 59.21 1j0j h ARG 497 Cb 1.30 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1j0j h ARG 497 CO -0.08 0.81 -0.55 -0.22 -1.51 0.00 0.00 179.97 178.41 1j0j h LYS 498 N 0.86 0.71 -0.45 0.20 3.64 -0.10 -3.29 116.57 118.14 1j0j h LYS 498 Ca 0.19 -0.51 -0.08 0.00 -1.27 0.00 0.00 60.65 58.98 1j0j h LYS 498 Cb 0.32 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 1j0j h LYS 498 CO 0.00 1.13 -0.02 1.96 -2.27 0.00 0.00 179.45 180.26 1j0j h GLN 499 N 0.42 0.80 -4.53 1.90 4.20 -1.19 -3.41 115.11 113.31 1j0j h GLN 499 Ca -0.01 -0.26 -0.72 0.00 0.06 0.00 0.00 58.65 57.72 1j0j h GLN 499 Cb 1.17 -0.07 -0.23 0.00 0.30 0.00 0.00 27.48 28.66 1j0j h GLN 499 CO 0.12 0.87 -0.46 0.71 -0.67 0.00 0.00 178.83 179.40 1j0j s TYR 500 N -4.97 3.25 0.16 2.96 1.51 -0.38 -4.96 117.35 114.92 1j0j s TYR 500 Ca -0.13 -0.81 -0.15 0.00 -1.01 0.00 0.00 57.07 54.98 1j0j s TYR 500 Cb 0.11 -2.56 0.04 0.00 -0.11 0.00 0.00 41.96 39.43 1j0j s TYR 500 CO 0.81 -0.64 1.81 -0.09 -1.11 0.00 0.00 175.55 176.33 1j0j h ARG 501 N 8.54 0.62 -0.39 -0.62 2.43 -1.80 -1.81 114.38 121.36 1j0j h ARG 501 Ca -0.26 -0.05 0.11 0.00 -0.81 0.00 0.00 59.98 58.97 1j0j h ARG 501 Cb 1.11 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.51 1j0j h ARG 501 CO 0.71 0.44 0.65 0.66 -1.51 0.00 0.00 179.97 180.93 1j0j h SER 502 N 0.62 0.00 1.36 -3.80 4.64 -1.92 1.04 113.55 115.49 1j0j h SER 502 Ca 0.17 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.45 1j0j h SER 502 Cb -0.03 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.05 1j0j h SER 502 CO -0.03 0.00 -0.20 -0.07 -0.87 0.00 0.00 176.83 175.66 1j0j h LEU 503 N 0.00 0.00 0.00 5.97 3.38 -1.62 -2.04 115.31 121.00 1j0j h LEU 503 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1j0j h LEU 503 Cb 1.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.24 1j0j h LEU 503 CO -0.00 0.20 -0.20 -2.11 0.09 0.00 0.00 178.44 176.42 1j0j n ARG 504 N -3.23 5.66 0.00 1.13 1.85 0.34 -3.63 116.66 118.78 1j0j n ARG 504 Ca 0.02 -0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.86 1j0j n ARG 504 Cb 0.51 -0.65 0.00 0.00 -1.05 0.00 0.00 32.46 31.28 1j0j n ARG 504 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1j0j n ARG 505 N -1.10 1.17 -1.48 2.89 3.00 -0.13 -3.44 116.66 117.57 1j0j n ARG 505 Ca 0.00 -0.08 -0.31 0.00 -0.01 0.00 0.00 57.85 57.45 1j0j n ARG 505 Cb 0.04 -0.41 0.07 0.00 0.00 0.00 0.00 32.46 32.15 1j0j n ARG 505 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1j0j s GLY 506 N -0.19 1.79 0.49 -0.13 0.00 -0.77 -4.76 107.32 103.75 1j0j s GLY 506 Ca 0.00 0.28 -0.15 0.00 0.00 0.00 0.00 44.72 44.85 1j0j s GLY 506 CO 0.00 0.62 0.94 1.85 0.00 0.00 0.00 173.10 176.51 1j0j s GLU 507 N -4.73 3.92 0.12 2.90 2.12 -0.52 -4.65 118.70 117.86 1j0j s GLU 507 Ca 0.62 0.85 0.09 0.00 0.36 0.00 0.00 54.97 56.89 1j0j s GLU 507 Cb -0.17 -2.19 -0.04 0.00 0.26 0.00 0.00 34.13 31.99 1j0j s GLU 507 CO 0.52 -0.21 -0.22 -1.50 -0.54 0.00 0.00 175.26 173.31 1j0j s ILE 508 N -2.55 1.91 -0.17 -3.70 2.07 -1.26 -0.87 121.20 116.62 1j0j s ILE 508 Ca 0.57 -1.68 -0.26 0.00 -1.41 0.00 0.00 60.65 57.87 1j0j s ILE 508 Cb -0.10 -1.74 0.07 0.00 0.13 0.00 0.00 42.46 40.81 1j0j s ILE 508 CO 0.31 -0.06 0.67 -0.94 -1.91 0.00 0.00 174.94 173.01 1j0j s SER 509 N -2.09 -0.67 -0.12 4.50 1.04 -1.11 -5.00 113.70 110.25 1j0j s SER 509 Ca 0.10 1.08 -0.06 0.00 0.48 0.00 0.00 55.95 57.56 1j0j s SER 509 Cb -0.09 1.03 -0.04 0.00 0.10 0.00 0.00 66.02 67.02 1j0j s SER 509 CO 0.05 -0.39 0.09 -0.36 0.98 0.00 0.00 173.24 173.62 1j0j s PHE 510 N -0.29 3.42 0.15 5.02 0.40 -1.26 -1.60 117.98 123.81 1j0j s PHE 510 Ca -0.05 0.37 -0.04 0.00 -0.60 0.00 0.00 56.93 56.61 1j0j s PHE 510 Cb -0.03 -1.92 -0.05 0.00 0.51 0.00 0.00 43.02 41.53 1j0j s PHE 510 CO 0.05 0.57 0.36 -0.51 0.70 0.00 0.00 175.22 176.39 1j0j s LEU 511 N -0.76 4.27 -0.23 -0.37 1.02 0.13 -4.97 118.68 117.77 1j0j s LEU 511 Ca 0.13 0.53 -0.09 0.00 0.02 0.00 0.00 54.13 54.72 1j0j s LEU 511 Cb -0.12 -3.26 -0.04 0.00 0.02 0.00 0.00 46.19 42.79 1j0j s LEU 511 CO 0.03 0.05 0.11 -1.00 0.02 0.00 0.00 176.35 175.56 1j0j s HIS 512 N -1.68 3.21 0.16 0.29 3.76 -1.26 -4.31 115.29 115.45 1j0j s HIS 512 Ca 0.40 -0.02 -0.08 0.00 -0.15 0.00 0.00 55.06 55.21 1j0j s HIS 512 Cb -0.12 -2.23 -0.06 0.00 1.11 0.00 0.00 32.58 31.28 1j0j s HIS 512 CO 0.26 -0.08 0.44 0.00 -0.85 0.00 0.00 174.74 174.51 1j0j s ALA 513 N 1.17 3.70 0.53 -1.40 0.00 -1.26 -4.95 121.76 119.56 1j0j s ALA 513 Ca 0.06 -0.42 0.26 0.00 0.00 0.00 0.00 51.96 51.86 1j0j s ALA 513 Cb -0.14 -2.26 1.42 0.00 0.00 0.00 0.00 23.12 22.13 1j0j s ALA 513 CO 0.04 0.59 1.98 -0.44 0.00 0.00 0.00 175.76 177.94 1j0j h ASP 514 N 2.92 0.00 -3.39 0.00 5.19 -1.98 -2.94 116.42 116.22 1j0j h ASP 514 Ca -0.47 0.00 -0.73 0.00 -0.62 0.00 0.00 57.03 55.21 1j0j h ASP 514 Cb 1.17 0.00 -0.33 0.00 0.18 0.00 0.00 39.33 40.35 1j0j h ASP 514 CO 0.70 0.00 0.08 -0.62 -3.12 0.00 0.00 179.24 176.28 1j0j s ASP 515 N -6.10 6.42 -0.03 6.45 2.15 -1.26 -4.89 116.67 119.40 1j0j s ASP 515 Ca -0.05 -3.70 -0.01 0.00 0.43 0.00 0.00 52.55 49.21 1j0j s ASP 515 Cb 0.20 -2.00 -0.03 0.00 -0.30 0.00 0.00 42.92 40.79 1j0j s ASP 515 CO 0.73 -0.21 2.30 -0.62 -0.17 0.00 0.00 175.17 177.20 1j0j n GLU 516 N 2.42 1.26 -0.10 4.34 1.02 -1.11 -3.77 120.64 124.69 1j0j n GLU 516 Ca 0.22 -0.33 -0.14 0.00 -0.02 0.00 0.00 57.16 56.89 1j0j n GLU 516 Cb 0.38 -1.24 -0.05 0.00 -0.02 0.00 0.00 31.44 30.50 1j0j n GLU 516 CO 0.00 0.00 0.00 -0.12 1.18 0.00 0.00 177.13 178.19 1j0j n MET 517 N 1.58 0.53 0.00 3.49 1.56 -1.26 -2.19 117.12 120.83 1j0j n MET 517 Ca 0.11 0.34 0.00 0.00 -0.27 0.00 0.00 57.70 57.87 1j0j n MET 517 Cb 0.58 -1.54 0.00 0.00 2.15 0.00 0.00 33.22 34.41 1j0j n MET 517 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 175.97 175.33 1j0j n ASN 518 N -4.45 1.44 -4.59 6.12 3.02 -1.26 -2.85 115.26 112.70 1j0j n ASN 518 Ca -0.24 -0.33 -0.40 0.00 -0.03 0.00 0.00 54.58 53.58 1j0j n ASN 518 Cb 0.56 0.95 -0.09 0.00 -0.61 0.00 0.00 39.78 40.60 1j0j n ASN 518 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1j0j s TYR 519 N -1.24 3.23 -0.24 3.10 4.12 -1.25 -0.57 117.35 124.50 1j0j s TYR 519 Ca 0.00 0.32 -0.04 0.00 0.02 0.00 0.00 57.07 57.36 1j0j s TYR 519 Cb 0.00 -2.69 -0.00 0.00 -1.52 0.00 0.00 41.96 37.74 1j0j s TYR 519 CO 0.00 -0.34 -0.01 -1.17 0.02 0.00 0.00 175.55 174.05 1j0j s LEU 520 N 2.17 3.13 -0.13 -1.29 2.96 -0.73 -4.72 118.68 120.07 1j0j s LEU 520 Ca 0.16 -0.46 0.01 0.00 -0.22 0.00 0.00 54.13 53.62 1j0j s LEU 520 Cb -0.16 -1.78 0.02 0.00 0.50 0.00 0.00 46.19 44.78 1j0j s LEU 520 CO 0.11 -0.06 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.31 1j0j s ILE 521 N 1.48 1.49 0.25 6.68 1.01 -1.26 -0.92 121.20 129.93 1j0j s ILE 521 Ca 0.05 -0.60 -0.06 0.00 0.00 0.00 0.00 60.65 60.04 1j0j s ILE 521 Cb -0.15 -1.40 -0.02 0.00 0.01 0.00 0.00 42.46 40.90 1j0j s ILE 521 CO -0.02 0.44 0.33 -0.72 0.00 0.00 0.00 174.94 174.98 1j0j s TYR 522 N 1.36 0.86 -0.14 3.97 -0.85 -0.89 0.21 117.35 121.87 1j0j s TYR 522 Ca 0.02 -1.12 -0.16 0.00 -0.52 0.00 0.00 57.07 55.28 1j0j s TYR 522 Cb -0.13 -0.19 0.04 0.00 0.38 0.00 0.00 41.96 42.06 1j0j s TYR 522 CO -0.08 -0.87 0.44 -1.59 -1.52 0.00 0.00 175.55 171.93 1j0j s LYS 523 N -3.89 0.57 0.09 -3.49 -2.85 -0.63 -0.93 119.74 108.61 1j0j s LYS 523 Ca 0.31 0.48 -0.05 0.00 -1.00 0.00 0.00 55.97 55.71 1j0j s LYS 523 Cb 0.03 0.27 -0.05 0.00 -2.06 0.00 0.00 37.83 36.02 1j0j s LYS 523 CO 0.13 -0.09 0.33 0.15 0.10 0.00 0.00 175.35 175.97 1j0j s LYS 524 N -0.07 3.60 -0.28 1.78 -0.14 -0.71 -2.76 119.74 121.17 1j0j s LYS 524 Ca -0.03 -0.10 -0.01 0.00 -1.36 0.00 0.00 55.97 54.48 1j0j s LYS 524 Cb -0.03 -2.95 0.13 0.00 -1.68 0.00 0.00 37.83 33.30 1j0j s LYS 524 CO 0.02 0.54 0.30 0.99 -0.76 0.00 0.00 175.35 176.44 1j0j s THR 525 N -1.51 -0.42 -1.44 2.17 2.01 -0.05 -2.51 115.64 113.89 1j0j s THR 525 Ca 0.36 -0.43 0.17 0.00 0.31 0.00 0.00 61.69 62.09 1j0j s THR 525 Cb -0.13 -0.96 0.30 0.00 0.01 0.00 0.00 72.50 71.72 1j0j s THR 525 CO 0.22 -0.43 1.50 -0.90 -0.69 0.00 0.00 174.62 174.33 1j0j n ASP 526 N 5.32 0.00 0.00 3.53 3.85 -1.21 -1.44 116.55 126.60 1j0j n ASP 526 Ca -0.02 0.03 0.00 0.00 -0.71 0.00 0.00 54.79 54.09 1j0j n ASP 526 Cb 0.47 -0.28 0.00 0.00 -1.35 0.00 0.00 41.12 39.96 1j0j n ASP 526 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1j0j n GLY 527 N 0.17 3.34 0.03 6.12 0.00 -1.26 -4.84 105.19 108.75 1j0j n GLY 527 Ca 0.08 -0.86 -0.02 0.00 0.00 0.00 0.00 46.02 45.22 1j0j n GLY 527 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1j0j n ASP 528 N 0.00 0.63 -4.57 1.61 2.03 -1.26 -4.97 116.55 110.01 1j0j n ASP 528 Ca 0.00 0.21 -0.35 0.00 0.52 0.00 0.00 54.79 55.17 1j0j n ASP 528 Cb 0.00 -0.60 0.10 0.00 -0.72 0.00 0.00 41.12 39.90 1j0j n ASP 528 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1j0j n GLU 529 N -3.11 0.29 -3.15 -0.67 2.13 -1.26 -5.01 120.64 109.85 1j0j n GLU 529 Ca -0.04 0.15 0.04 0.00 0.66 0.00 0.00 57.16 57.98 1j0j n GLU 529 Cb 0.14 -2.14 -0.00 0.00 0.27 0.00 0.00 31.44 29.71 1j0j n GLU 529 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1j0j s THR 530 N -1.98 -0.99 -0.02 6.31 2.01 -1.26 -3.28 115.64 116.43 1j0j s THR 530 Ca 0.70 0.00 -0.02 0.00 0.31 0.00 0.00 61.69 62.67 1j0j s THR 530 Cb -0.32 -0.99 -0.04 0.00 0.01 0.00 0.00 72.50 71.16 1j0j s THR 530 CO 0.54 0.00 0.14 -0.69 -0.69 0.00 0.00 174.62 173.92 1j0j s VAL 531 N 2.83 5.14 -0.03 3.82 1.01 -1.04 0.26 120.40 132.39 1j0j s VAL 531 Ca 0.11 -0.24 0.07 0.00 0.00 0.00 0.00 61.98 61.93 1j0j s VAL 531 Cb -0.10 -3.37 -0.02 0.00 0.00 0.00 0.00 36.38 32.89 1j0j s VAL 531 CO -0.25 0.36 -0.25 -0.22 0.00 0.00 0.00 175.10 174.73 1j0j s LEU 532 N -1.78 2.10 0.03 3.92 2.96 0.25 -1.73 118.68 124.43 1j0j s LEU 532 Ca 0.24 -0.46 0.06 0.00 -0.22 0.00 0.00 54.13 53.76 1j0j s LEU 532 Cb -0.12 -1.36 -0.02 0.00 0.50 0.00 0.00 46.19 45.18 1j0j s LEU 532 CO 0.16 0.30 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.62 1j0j s VAL 533 N -0.51 1.46 -0.03 1.68 1.01 -0.11 0.05 120.40 123.94 1j0j s VAL 533 Ca 0.07 -1.04 0.00 0.00 0.00 0.00 0.00 61.98 61.01 1j0j s VAL 533 Cb -0.11 -1.26 0.03 0.00 0.00 0.00 0.00 36.38 35.03 1j0j s VAL 533 CO 0.00 0.19 -0.00 -0.63 0.00 0.00 0.00 175.10 174.66 1j0j s ILE 534 N -0.72 0.21 -0.05 2.22 1.01 -0.84 -2.09 121.20 120.94 1j0j s ILE 534 Ca 0.06 0.08 0.03 0.00 0.00 0.00 0.00 60.65 60.81 1j0j s ILE 534 Cb -0.08 -0.31 0.01 0.00 0.01 0.00 0.00 42.46 42.09 1j0j s ILE 534 CO 0.01 0.16 -0.12 -0.63 0.00 0.00 0.00 174.94 174.36 1j0j s ILE 535 N 1.08 1.07 -0.78 2.92 1.01 -0.10 -1.53 121.20 124.87 1j0j s ILE 535 Ca -0.09 -0.47 -0.15 0.00 0.00 0.00 0.00 60.65 59.94 1j0j s ILE 535 Cb -0.14 -0.96 0.20 0.00 0.01 0.00 0.00 42.46 41.57 1j0j s ILE 535 CO -0.02 0.33 0.75 0.21 0.00 0.00 0.00 174.94 176.22 1j0j s ASN 536 N 0.44 6.65 -1.21 3.58 2.47 0.12 -1.76 114.94 125.22 1j0j s ASN 536 Ca -0.09 -2.47 -0.15 0.00 0.42 0.00 0.00 52.86 50.57 1j0j s ASN 536 Cb -0.13 -2.23 0.15 0.00 -1.45 0.00 0.00 41.25 37.59 1j0j s ASN 536 CO 0.02 -0.67 1.48 -0.60 -3.72 0.00 0.00 177.10 173.61 1j0j s ARG 537 N 0.65 4.05 -0.09 0.43 3.52 0.27 -2.24 118.95 125.54 1j0j s ARG 537 Ca 0.17 -2.43 -0.31 0.00 -0.13 0.00 0.00 55.73 53.02 1j0j s ARG 537 Cb -0.13 -5.15 0.12 0.00 -1.56 0.00 0.00 34.95 28.23 1j0j s ARG 537 CO -0.07 -1.86 1.03 -1.54 -0.81 0.00 0.00 175.30 172.05 1j0j s SER 538 N 3.13 -0.27 -0.02 -2.12 1.04 -1.26 -4.58 113.70 109.62 1j0j s SER 538 Ca 0.44 0.00 0.04 0.00 0.48 0.00 0.00 55.95 56.92 1j0j s SER 538 Cb -0.02 0.28 0.16 0.00 0.10 0.00 0.00 66.02 66.54 1j0j s SER 538 CO 0.01 -0.45 0.99 -0.90 0.98 0.00 0.00 173.24 173.87 1j0j n ASP 539 N -0.17 1.30 -4.16 7.02 3.85 -1.26 -1.61 116.55 121.53 1j0j n ASP 539 Ca -0.05 -2.08 -0.19 0.00 -0.71 0.00 0.00 54.79 51.76 1j0j n ASP 539 Cb 0.60 -0.27 -0.13 0.00 -1.35 0.00 0.00 41.12 39.98 1j0j n ASP 539 CO 0.00 0.00 0.00 -1.10 -1.01 0.00 0.00 177.20 175.09 1j0j s GLN 540 N -1.64 0.88 0.73 0.11 -0.21 -1.26 -4.70 119.66 113.58 1j0j s GLN 540 Ca 0.11 -0.85 -0.16 0.00 0.02 0.00 0.00 55.36 54.48 1j0j s GLN 540 Cb 0.07 -0.89 -0.03 0.00 1.00 0.00 0.00 33.01 33.16 1j0j s GLN 540 CO 0.06 0.21 0.59 0.36 -2.12 0.00 0.00 175.29 174.39 1j0j n LYS 541 N 1.62 0.30 -3.69 2.91 2.85 -1.26 -4.16 118.16 116.73 1j0j n LYS 541 Ca -0.19 0.15 -0.14 0.00 -1.05 0.00 0.00 58.31 57.07 1j0j n LYS 541 Cb 0.54 -1.89 -0.08 0.00 -0.65 0.00 0.00 35.03 32.95 1j0j n LYS 541 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1j0j s ALA 542 N -1.92 -1.11 -0.48 0.58 0.00 -0.31 -4.92 121.76 113.61 1j0j s ALA 542 Ca 0.66 0.83 -0.07 0.00 0.00 0.00 0.00 51.96 53.38 1j0j s ALA 542 Cb -0.34 -0.18 0.12 0.00 0.00 0.00 0.00 23.12 22.72 1j0j s ALA 542 CO 0.57 -0.27 0.33 -0.51 0.00 0.00 0.00 175.76 175.88 1j0j s ASP 543 N -0.85 5.59 -0.40 0.00 -0.00 -1.26 -1.56 116.67 118.19 1j0j s ASP 543 Ca -0.09 -2.04 -0.15 0.00 -0.00 0.00 0.00 52.55 50.27 1j0j s ASP 543 Cb -0.03 -1.96 0.01 0.00 -0.00 0.00 0.00 42.92 40.94 1j0j s ASP 543 CO 0.05 -0.63 0.32 -0.63 -0.00 0.00 0.00 175.17 174.27 1j0j s ILE 544 N 1.16 5.23 0.21 0.77 1.01 0.74 -4.94 121.20 125.38 1j0j s ILE 544 Ca 0.08 -0.53 -0.31 0.00 0.00 0.00 0.00 60.65 59.89 1j0j s ILE 544 Cb -0.24 -3.92 -0.10 0.00 0.01 0.00 0.00 42.46 38.21 1j0j s ILE 544 CO -0.02 -0.28 1.52 -2.84 0.00 0.00 0.00 174.94 173.32 1j0j s PRO 545 N 1.77 4.23 -0.41 2.79 0.02 -1.26 -1.25 135.00 140.88 1j0j s PRO 545 Ca 0.07 2.36 -0.06 0.00 0.02 0.00 0.00 61.00 63.39 1j0j s PRO 545 Cb -0.18 -3.13 0.10 0.00 0.02 0.00 0.00 34.50 31.31 1j0j s PRO 545 CO 0.11 -0.54 0.22 0.96 -0.33 0.00 0.00 177.00 177.42 1j0j s ILE 546 N 0.60 3.69 0.04 2.83 -4.36 -0.90 -4.90 121.20 118.20 1j0j s ILE 546 Ca 0.65 -1.75 -0.31 0.00 -0.26 0.00 0.00 60.65 58.99 1j0j s ILE 546 Cb -0.43 -3.39 -0.07 0.00 1.25 0.00 0.00 42.46 39.82 1j0j s ILE 546 CO 0.37 -0.59 1.45 -2.84 0.24 0.00 0.00 174.94 173.57 1j0j s PRO 547 N 1.27 4.27 -0.29 0.37 0.02 -1.26 -4.48 135.00 134.91 1j0j s PRO 547 Ca 0.05 2.07 -0.26 0.00 0.02 0.00 0.00 61.00 62.88 1j0j s PRO 547 Cb -0.23 -3.50 0.17 0.00 0.02 0.00 0.00 34.50 30.96 1j0j s PRO 547 CO -0.01 -0.57 1.31 -1.17 -0.33 0.00 0.00 177.00 176.23 1j0j s LEU 548 N 2.13 -0.16 -0.55 -5.54 2.96 -1.26 -5.10 118.68 111.16 1j0j s LEU 548 Ca 0.66 0.30 -0.26 0.00 -0.22 0.00 0.00 54.13 54.60 1j0j s LEU 548 Cb -0.34 1.33 -0.07 0.00 0.50 0.00 0.00 46.19 47.60 1j0j s LEU 548 CO 0.29 -0.07 2.33 -1.81 -1.32 0.00 0.00 176.35 175.77 1j0j s ASP 549 N -0.09 4.49 0.15 3.68 -0.00 -1.26 -4.82 116.67 118.83 1j0j s ASP 549 Ca 0.06 0.84 0.10 0.00 -0.00 0.00 0.00 52.55 53.55 1j0j s ASP 549 Cb -0.04 -2.51 0.54 0.00 -0.00 0.00 0.00 42.92 40.91 1j0j s ASP 549 CO -0.12 -2.92 1.30 0.00 -0.00 0.00 0.00 175.17 173.43 1j0j n ALA 550 N 15.77 1.01 -2.26 5.23 0.00 -1.26 -4.43 120.51 134.57 1j0j n ALA 550 Ca 0.36 0.09 -0.39 0.00 0.00 0.00 0.00 53.44 53.50 1j0j n ALA 550 Cb 0.53 -1.13 -0.03 0.00 0.00 0.00 0.00 19.45 18.82 1j0j n ALA 550 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1j0j s ARG 551 N -3.25 2.88 -0.13 0.00 3.00 -1.26 -3.15 118.95 117.04 1j0j s ARG 551 Ca -0.01 0.17 -0.00 0.00 0.00 0.00 0.00 55.73 55.88 1j0j s ARG 551 Cb 0.03 -4.37 0.00 0.00 0.00 0.00 0.00 34.95 30.61 1j0j s ARG 551 CO 0.09 -2.51 0.06 0.41 0.00 0.00 0.00 175.30 173.34 1j0j n GLY 552 N 5.67 0.61 3.30 -3.53 0.00 -1.26 -4.79 105.19 105.19 1j0j n GLY 552 Ca 0.15 -0.69 -0.34 0.00 0.00 0.00 0.00 46.02 45.14 1j0j n GLY 552 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1j0j s THR 553 N -2.64 2.93 -0.03 2.61 2.01 -1.19 0.90 115.64 120.23 1j0j s THR 553 Ca 0.03 -0.67 0.05 0.00 0.31 0.00 0.00 61.69 61.40 1j0j s THR 553 Cb -0.01 -2.26 -0.01 0.00 0.01 0.00 0.00 72.50 70.23 1j0j s THR 553 CO 0.03 0.50 -0.17 0.26 -0.69 0.00 0.00 174.62 174.55 1j0j s TRP 554 N 0.85 1.64 0.06 4.92 0.52 0.88 -2.32 118.94 125.49 1j0j s TRP 554 Ca -0.04 -0.42 0.07 0.00 0.02 0.00 0.00 56.10 55.74 1j0j s TRP 554 Cb -0.15 -1.09 -0.03 0.00 -1.15 0.00 0.00 33.47 31.04 1j0j s TRP 554 CO 0.00 -0.12 -0.17 -0.51 0.02 0.00 0.00 176.95 176.17 1j0j s LEU 555 N -0.09 2.69 -0.27 2.99 1.43 -0.72 0.91 118.68 125.62 1j0j s LEU 555 Ca -0.01 -0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 52.64 1j0j s LEU 555 Cb -0.10 -1.56 0.08 0.00 0.03 0.00 0.00 46.19 44.64 1j0j s LEU 555 CO 0.01 0.23 0.05 -0.69 0.23 0.00 0.00 176.35 176.19 1j0j s VAL 556 N -1.00 0.98 -0.28 -1.59 1.01 -0.06 -2.41 120.40 117.04 1j0j s VAL 556 Ca 0.16 -1.20 -0.29 0.00 0.00 0.00 0.00 61.98 60.64 1j0j s VAL 556 Cb -0.11 -1.58 -0.07 0.00 0.00 0.00 0.00 36.38 34.62 1j0j s VAL 556 CO 0.07 -0.45 2.24 -3.20 0.00 0.00 0.00 175.10 173.77 1j0j n ASN 557 N 4.84 2.88 0.00 3.32 2.85 -0.72 -1.29 115.26 127.13 1j0j n ASN 557 Ca -0.05 0.17 0.07 0.00 -0.11 0.00 0.00 54.58 54.66 1j0j n ASN 557 Cb 0.44 -1.49 0.35 0.00 1.24 0.00 0.00 39.78 40.32 1j0j n ASN 557 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1j0j n LEU 558 N 11.72 0.00 -0.12 1.20 4.77 0.64 0.14 117.00 135.36 1j0j n LEU 558 Ca 0.34 0.28 -0.23 0.00 -0.03 0.00 0.00 56.01 56.37 1j0j n LEU 558 Cb 0.40 -0.28 -0.09 0.00 -2.33 0.00 0.00 43.42 41.13 1j0j n LEU 558 CO 0.69 -0.15 -0.93 0.18 -1.33 0.00 0.00 177.39 175.85 1j0j n LEU 559 N -1.28 1.91 -0.01 2.23 4.32 -1.26 -4.66 117.00 118.24 1j0j n LEU 559 Ca 0.07 0.40 -0.09 0.00 -0.02 0.00 0.00 56.01 56.37 1j0j n LEU 559 Cb 0.11 -0.87 -0.14 0.00 -1.62 0.00 0.00 43.42 40.90 1j0j n LEU 559 CO 0.11 0.28 -0.47 0.71 -1.22 0.00 0.00 177.39 176.80 1j0j h THR 560 N -1.00 0.92 0.00 -5.08 1.35 -1.94 -3.48 112.91 103.68 1j0j h THR 560 Ca -0.44 -2.76 0.00 0.00 -0.55 0.00 0.00 66.41 62.66 1j0j h THR 560 Cb 1.34 2.46 0.00 0.00 -1.73 0.00 0.00 68.15 70.21 1j0j h THR 560 CO -0.27 0.53 0.00 0.61 -0.25 0.00 0.00 175.52 176.14 1j0j n GLY 561 N 1.54 3.07 3.11 5.82 0.00 0.12 -5.05 105.19 113.80 1j0j n GLY 561 Ca -0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 1j0j n GLY 561 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1j0j n GLU 562 N -0.64 -0.04 -4.04 1.61 2.13 -1.25 -4.55 120.64 113.86 1j0j n GLU 562 Ca 0.00 -0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.72 1j0j n GLU 562 Cb 0.00 -1.18 -0.08 0.00 0.27 0.00 0.00 31.44 30.45 1j0j n GLU 562 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1j0j s ARG 563 N -2.25 0.99 -0.10 5.31 3.52 -1.26 -1.76 118.95 123.40 1j0j s ARG 563 Ca 0.45 -1.26 -0.33 0.00 -0.13 0.00 0.00 55.73 54.46 1j0j s ARG 563 Cb -0.21 0.31 0.14 0.00 -1.56 0.00 0.00 34.95 33.62 1j0j s ARG 563 CO 0.78 -0.32 1.44 -0.59 -0.81 0.00 0.00 175.30 175.80 1j0j s PHE 564 N -3.99 -0.00 0.44 5.12 -0.12 -1.01 -5.02 117.98 113.40 1j0j s PHE 564 Ca 0.18 -0.00 0.07 0.00 -0.05 0.00 0.00 56.93 57.13 1j0j s PHE 564 Cb 0.05 0.50 -0.02 0.00 -0.63 0.00 0.00 43.02 42.93 1j0j s PHE 564 CO -0.01 -0.01 0.34 0.00 -0.05 0.00 0.00 175.22 175.49 1j0j s ALA 565 N -2.01 4.03 -0.09 1.99 0.00 -1.26 -1.75 121.76 122.67 1j0j s ALA 565 Ca 0.18 -1.82 0.03 0.00 0.00 0.00 0.00 51.96 50.35 1j0j s ALA 565 Cb 0.07 -0.80 -0.01 0.00 0.00 0.00 0.00 23.12 22.37 1j0j s ALA 565 CO -0.06 -0.27 -0.18 0.00 0.00 0.00 0.00 175.76 175.25 1j0j s ALA 566 N -2.57 2.43 0.18 0.00 0.00 -0.98 -4.94 121.76 115.89 1j0j s ALA 566 Ca 0.44 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.43 1j0j s ALA 566 Cb -0.01 -0.94 0.00 0.00 0.00 0.00 0.00 23.12 22.17 1j0j s ALA 566 CO 0.25 0.38 0.00 0.39 0.00 0.00 0.00 175.76 176.78 1j0j n GLU 567 N 3.07 1.56 -0.38 0.00 4.71 -1.26 -4.57 120.64 123.77 1j0j n GLU 567 Ca -0.18 -1.32 -0.03 0.00 -0.01 0.00 0.00 57.16 55.62 1j0j n GLU 567 Cb 0.52 0.35 0.01 0.00 -1.01 0.00 0.00 31.44 31.32 1j0j n GLU 567 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1j0j h ALA 568 N 1.09 0.02 -1.56 0.62 0.00 -1.99 -3.11 119.26 114.33 1j0j h ALA 568 Ca -0.15 0.24 -0.63 0.00 0.00 0.00 0.00 54.91 54.37 1j0j h ALA 568 Cb 0.46 1.07 -0.14 0.00 0.00 0.00 0.00 17.79 19.18 1j0j h ALA 568 CO 0.25 -0.69 0.99 -1.21 0.00 0.00 0.00 179.25 178.59 1j0j s GLU 569 N -5.87 3.44 -0.06 0.00 8.01 -1.26 -4.94 118.70 118.02 1j0j s GLU 569 Ca -0.14 -1.20 -0.38 0.00 0.01 0.00 0.00 54.97 53.27 1j0j s GLU 569 Cb 0.18 -4.82 -0.16 0.00 -4.31 0.00 0.00 34.13 25.03 1j0j s GLU 569 CO 0.70 -1.95 1.51 0.25 0.01 0.00 0.00 175.26 175.77 1j0j n THR 570 N 6.10 0.13 -1.07 3.63 -2.24 -1.17 -4.87 114.28 114.79 1j0j n THR 570 Ca 0.18 -0.02 -0.36 0.00 -2.27 0.00 0.00 64.05 61.58 1j0j n THR 570 Cb 0.49 -0.99 0.07 0.00 -2.10 0.00 0.00 70.33 67.79 1j0j n THR 570 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1j0j n LEU 571 N 3.72 -1.59 -4.02 3.22 7.99 -1.26 -4.64 117.00 120.42 1j0j n LEU 571 Ca 0.22 0.43 -0.31 0.00 -0.01 0.00 0.00 56.01 56.34 1j0j n LEU 571 Cb 0.17 -1.07 -0.16 0.00 -0.11 0.00 0.00 43.42 42.25 1j0j n LEU 571 CO 0.70 -4.14 -0.47 0.00 -1.51 0.00 0.00 177.39 171.97 1j0j s THR 573 N 1.37 4.35 -0.17 0.00 2.01 -0.38 -4.84 115.64 117.98 1j0j s THR 573 Ca -0.01 1.86 -0.04 0.00 0.31 0.00 0.00 61.69 63.81 1j0j s THR 573 Cb -0.16 -4.22 -0.03 0.00 0.01 0.00 0.00 72.50 68.11 1j0j s THR 573 CO -0.09 0.47 -0.02 -0.44 -0.69 0.00 0.00 174.62 173.85 1j0j s SER 574 N -0.85 4.82 0.05 3.53 0.01 -1.26 -0.19 113.70 119.82 1j0j s SER 574 Ca 0.39 -0.15 0.04 0.00 1.31 0.00 0.00 55.95 57.55 1j0j s SER 574 Cb -0.24 -1.80 -0.03 0.00 0.21 0.00 0.00 66.02 64.17 1j0j s SER 574 CO 0.28 0.14 -0.12 -0.76 0.41 0.00 0.00 173.24 173.18 1j0j s LEU 575 N 0.55 2.23 0.92 2.44 1.43 -0.60 -5.00 118.68 120.65 1j0j s LEU 575 Ca -0.02 -0.54 -0.15 0.00 -1.03 0.00 0.00 54.13 52.39 1j0j s LEU 575 Cb -0.14 -0.45 0.17 0.00 0.03 0.00 0.00 46.19 45.80 1j0j s LEU 575 CO 0.02 -0.07 1.28 -2.16 0.23 0.00 0.00 176.35 175.65 1j0j s PRO 576 N -1.48 0.98 0.08 1.29 0.04 -1.26 -1.16 135.00 133.49 1j0j s PRO 576 Ca -0.03 -0.31 -0.34 0.00 0.04 0.00 0.00 61.00 60.36 1j0j s PRO 576 Cb -0.09 -1.89 -0.13 0.00 0.04 0.00 0.00 34.50 32.43 1j0j s PRO 576 CO 0.01 -2.19 1.71 -2.30 0.04 0.00 0.00 177.00 174.27 1j0j n PRO 577 N -3.63 2.25 -1.90 0.56 -0.02 -1.26 -0.78 135.00 130.22 1j0j n PRO 577 Ca 0.14 0.82 -0.14 0.00 -2.02 0.00 0.00 63.50 62.29 1j0j n PRO 577 Cb 0.60 -2.63 -0.03 0.00 -0.02 0.00 0.00 33.50 31.42 1j0j n PRO 577 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1j0j n TYR 578 N 4.72 -0.39 -2.16 6.00 4.01 -0.63 -4.92 117.16 123.78 1j0j n TYR 578 Ca 0.19 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.65 1j0j n TYR 578 Cb 0.30 -2.85 0.04 0.00 -0.31 0.00 0.00 39.34 36.52 1j0j n TYR 578 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1j0j s GLY 579 N -2.56 1.62 0.26 2.72 0.00 0.04 -4.83 107.32 104.56 1j0j s GLY 579 Ca 0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 44.72 44.17 1j0j s GLY 579 CO 0.00 -0.22 0.36 1.97 0.00 0.00 0.00 173.10 175.21 1j0j n PHE 580 N -2.79 -1.18 -3.65 1.90 -1.74 -1.26 -0.70 117.46 108.05 1j0j n PHE 580 Ca 0.06 -1.75 -0.02 0.00 -0.56 0.00 0.00 57.45 55.17 1j0j n PHE 580 Cb 0.57 0.41 -0.07 0.00 1.52 0.00 0.00 39.48 41.91 1j0j n PHE 580 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 1j0j s VAL 581 N -2.72 0.00 -0.20 1.97 0.11 -0.59 -4.97 120.40 114.00 1j0j s VAL 581 Ca 0.22 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.25 1j0j s VAL 581 Cb -0.01 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 1j0j s VAL 581 CO 0.16 0.00 -0.11 -0.76 -3.33 0.00 0.00 175.10 171.06 1j0j s LEU 582 N 0.42 2.59 -0.05 2.54 1.02 -1.26 -1.98 118.68 121.96 1j0j s LEU 582 Ca 0.02 -0.51 0.02 0.00 0.02 0.00 0.00 54.13 53.67 1j0j s LEU 582 Cb -0.04 -1.63 -0.03 0.00 0.02 0.00 0.00 46.19 44.51 1j0j s LEU 582 CO -0.13 -0.02 -0.08 -0.31 0.02 0.00 0.00 176.35 175.84 1j0j s TYR 583 N 1.40 2.90 -0.28 0.29 4.12 0.11 -0.26 117.35 125.62 1j0j s TYR 583 Ca 0.05 -0.01 -0.12 0.00 0.02 0.00 0.00 57.07 57.01 1j0j s TYR 583 Cb -0.14 -1.67 -0.05 0.00 -1.52 0.00 0.00 41.96 38.58 1j0j s TYR 583 CO -0.07 0.33 0.23 0.00 0.02 0.00 0.00 175.55 176.05 1j0j s ALA 584 N -0.86 3.53 -0.14 3.71 0.00 -0.41 0.85 121.76 128.45 1j0j s ALA 584 Ca 0.14 -1.06 -0.17 0.00 0.00 0.00 0.00 51.96 50.87 1j0j s ALA 584 Cb -0.11 -2.53 -0.04 0.00 0.00 0.00 0.00 23.12 20.44 1j0j s ALA 584 CO 0.03 -0.59 0.45 0.42 0.00 0.00 0.00 175.76 176.06 1j0j s ILE 585 N 1.82 5.20 -0.07 0.00 -1.09 0.14 -0.88 121.20 126.31 1j0j s ILE 585 Ca 0.08 0.86 0.04 0.00 -2.23 0.00 0.00 60.65 59.41 1j0j s ILE 585 Cb -0.16 -3.78 0.00 0.00 -1.58 0.00 0.00 42.46 36.94 1j0j s ILE 585 CO 0.11 0.31 -0.19 -1.61 -1.23 0.00 0.00 174.94 172.33 1j0j s GLU 586 N 0.80 2.33 -0.36 2.79 2.02 0.26 -4.45 118.70 122.10 1j0j s GLU 586 Ca 0.24 -0.68 -0.08 0.00 0.02 0.00 0.00 54.97 54.46 1j0j s GLU 586 Cb -0.15 -1.86 0.04 0.00 0.10 0.00 0.00 34.13 32.26 1j0j s GLU 586 CO 0.09 0.16 0.16 -1.01 0.02 0.00 0.00 175.26 174.69 1j0j s HIS 587 N 0.34 3.27 -1.16 1.61 3.76 -1.24 -0.09 115.29 121.78 1j0j s HIS 587 Ca -0.13 -1.29 0.09 0.00 -0.15 0.00 0.00 55.06 53.58 1j0j s HIS 587 Cb -0.16 -2.44 0.07 0.00 1.11 0.00 0.00 32.58 31.17 1j0j s HIS 587 CO 0.06 -0.72 0.79 0.91 -0.85 0.00 0.00 174.74 174.93