#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j6i s LYS 2 N 0.00 4.10 -0.12 0.00 2.20 -1.26 -0.64 119.74 124.02 2j6i s LYS 2 Ca 0.00 -0.23 0.03 0.00 -0.36 0.00 0.00 55.97 55.41 2j6i s LYS 2 Cb 0.00 -3.51 0.00 0.00 -1.51 0.00 0.00 37.83 32.81 2j6i s LYS 2 CO 0.00 0.11 -0.23 0.42 -0.36 0.00 0.00 175.35 175.29 2j6i s ILE 3 N 0.91 2.11 -0.27 5.43 1.09 0.43 -0.61 121.20 130.29 2j6i s ILE 3 Ca 0.08 -0.99 -0.06 0.00 -1.10 0.00 0.00 60.65 58.58 2j6i s ILE 3 Cb -0.13 -1.82 -0.00 0.00 -1.06 0.00 0.00 42.46 39.45 2j6i s ILE 3 CO 0.03 0.55 0.05 -0.69 -0.10 0.00 0.00 174.94 174.78 2j6i s VAL 4 N 0.52 3.89 -0.26 2.92 1.01 -0.31 -0.55 120.40 127.62 2j6i s VAL 4 Ca -0.14 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.24 2j6i s VAL 4 Cb -0.17 -2.92 -0.01 0.00 0.00 0.00 0.00 36.38 33.29 2j6i s VAL 4 CO 0.05 0.21 0.04 -0.22 0.00 0.00 0.00 175.10 175.19 2j6i s LEU 5 N 1.52 3.46 -0.25 3.92 2.96 0.87 -0.01 118.68 131.15 2j6i s LEU 5 Ca 0.04 -0.47 -0.04 0.00 -0.22 0.00 0.00 54.13 53.44 2j6i s LEU 5 Cb -0.16 -1.85 0.00 0.00 0.50 0.00 0.00 46.19 44.68 2j6i s LEU 5 CO 0.01 -0.10 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.25 2j6i s VAL 6 N 1.53 3.46 0.20 1.68 1.01 -0.09 -1.21 120.40 126.99 2j6i s VAL 6 Ca 0.05 -0.66 -0.05 0.00 0.00 0.00 0.00 61.98 61.31 2j6i s VAL 6 Cb -0.16 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 2j6i s VAL 6 CO 0.01 0.27 0.24 -0.76 0.00 0.00 0.00 175.10 174.87 2j6i s LEU 7 N 1.46 0.94 0.54 3.92 1.43 -0.73 -3.85 118.68 122.38 2j6i s LEU 7 Ca 0.04 -1.18 -0.08 0.00 -1.03 0.00 0.00 54.13 51.87 2j6i s LEU 7 Cb -0.16 0.88 -0.04 0.00 0.03 0.00 0.00 46.19 46.90 2j6i s LEU 7 CO -0.02 -0.93 0.90 -0.72 0.23 0.00 0.00 176.35 175.82 2j6i s TYR 8 N -4.09 3.59 -0.16 0.29 -0.85 -1.26 -3.41 117.35 111.46 2j6i s TYR 8 Ca 0.30 1.05 -0.27 0.00 -0.52 0.00 0.00 57.07 57.63 2j6i s TYR 8 Cb 0.04 -2.51 -0.01 0.00 0.38 0.00 0.00 41.96 39.87 2j6i s TYR 8 CO 0.09 -0.45 0.92 -0.51 -1.52 0.00 0.00 175.55 174.08 2j6i s ASP 9 N -4.06 7.06 0.00 -0.18 1.01 -1.26 -0.81 116.67 118.43 2j6i s ASP 9 Ca 0.51 1.31 0.26 0.00 0.71 0.00 0.00 52.55 55.34 2j6i s ASP 9 Cb -0.11 -2.50 0.75 0.00 1.01 0.00 0.00 42.92 42.08 2j6i s ASP 9 CO 0.48 -0.47 1.57 0.00 0.21 0.00 0.00 175.17 176.96 2j6i n ALA 10 N 5.40 3.08 -0.77 5.23 0.00 -1.26 -4.96 120.51 127.22 2j6i n ALA 10 Ca 0.07 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.11 2j6i n ALA 10 Cb 0.48 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2j6i n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j6i n GLY 11 N 1.34 2.62 0.34 0.00 0.00 -1.26 -1.78 105.19 106.45 2j6i n GLY 11 Ca 0.12 -0.34 0.17 0.00 0.00 0.00 0.00 46.02 45.98 2j6i n GLY 11 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2j6i h LYS 12 N 0.00 0.00 -0.20 1.61 1.57 -2.01 -2.44 116.57 115.10 2j6i h LYS 12 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 2j6i h LYS 12 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2j6i h LYS 12 CO 0.00 0.00 -0.10 0.45 -0.57 0.00 0.00 179.45 179.23 2j6i h HIS 13 N 0.00 0.32 -0.29 -1.35 3.86 -1.78 -1.13 115.15 114.79 2j6i h HIS 13 Ca 0.10 -0.04 -0.08 0.00 -1.16 0.00 0.00 60.37 59.20 2j6i h HIS 13 Cb 0.57 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 28.93 2j6i h HIS 13 CO 0.00 0.42 -0.16 0.00 0.86 0.00 0.00 177.93 179.04 2j6i h ALA 14 N 1.60 1.19 -0.15 2.45 0.00 -1.49 -2.35 119.26 120.52 2j6i h ALA 14 Ca 0.06 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.53 2j6i h ALA 14 Cb 0.37 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2j6i h ALA 14 CO 0.02 0.52 -0.52 0.00 0.00 0.00 0.00 179.25 179.27 2j6i h ALA 15 N 1.38 0.82 -0.07 0.00 0.00 -1.35 -3.16 119.26 116.87 2j6i h ALA 15 Ca 0.08 -0.49 -0.12 0.00 0.00 0.00 0.00 54.91 54.38 2j6i h ALA 15 Cb 0.55 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2j6i h ALA 15 CO 0.04 0.68 -0.48 -0.44 0.00 0.00 0.00 179.25 179.04 2j6i h ASP 16 N 0.34 0.19 -2.94 0.00 3.32 -1.06 -3.42 116.42 112.85 2j6i h ASP 16 Ca 0.01 -0.09 -0.54 0.00 0.02 0.00 0.00 57.03 56.43 2j6i h ASP 16 Cb 1.03 -0.05 -0.40 0.00 0.22 0.00 0.00 39.33 40.12 2j6i h ASP 16 CO 0.09 0.65 -0.77 -0.70 -1.72 0.00 0.00 179.24 176.79 2j6i s GLU 17 N -3.98 0.35 0.51 3.56 2.56 -0.90 -5.00 118.70 115.80 2j6i s GLU 17 Ca -0.04 -0.65 0.22 0.00 0.00 0.00 0.00 54.97 54.51 2j6i s GLU 17 Cb 0.13 -1.49 1.38 0.00 2.00 0.00 0.00 34.13 36.15 2j6i s GLU 17 CO 0.77 -0.97 2.10 1.05 -0.56 0.00 0.00 175.26 177.66 2j6i h GLU 18 N 8.31 0.00 0.00 4.30 4.11 -1.83 -1.54 114.58 127.93 2j6i h GLU 18 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.25 2j6i h GLU 18 Cb 1.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.28 2j6i h GLU 18 CO 0.43 0.10 0.00 1.63 0.07 0.00 0.00 179.01 181.24 2j6i n LYS 19 N -4.01 0.85 -2.15 1.06 5.02 -1.26 -4.39 118.16 113.27 2j6i n LYS 19 Ca -0.02 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.84 2j6i n LYS 19 Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 2j6i n LYS 19 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2j6i n LEU 20 N -1.00 6.08 0.20 -0.35 7.94 -0.58 -4.74 117.00 124.55 2j6i n LEU 20 Ca 0.20 -4.13 0.05 0.00 -1.11 0.00 0.00 56.01 51.02 2j6i n LEU 20 Cb 0.09 -1.67 0.40 0.00 0.53 0.00 0.00 43.42 42.77 2j6i n LEU 20 CO 0.15 0.78 0.74 1.88 -1.11 0.00 0.00 177.39 179.83 2j6i h TYR 21 N 6.59 0.00 -0.23 1.96 -1.99 -1.86 -3.34 116.97 118.09 2j6i h TYR 21 Ca 0.50 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 61.09 2j6i h TYR 21 Cb 0.73 0.00 -0.07 0.00 2.00 0.00 0.00 36.73 39.39 2j6i h TYR 21 CO 1.41 0.35 0.18 0.41 -0.00 0.00 0.00 178.16 180.51 2j6i n GLY 22 N -0.25 2.96 3.33 3.88 0.00 -1.26 -0.67 105.19 113.18 2j6i n GLY 22 Ca -0.01 -0.41 -0.17 0.00 0.00 0.00 0.00 46.02 45.43 2j6i n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j6i h THR 24 N 2.44 0.66 -0.19 0.00 1.35 -1.22 -0.25 112.91 115.71 2j6i h THR 24 Ca -0.38 -0.53 -0.21 0.00 -0.55 0.00 0.00 66.41 64.74 2j6i h THR 24 Cb 1.23 1.33 0.01 0.00 -1.73 0.00 0.00 68.15 68.98 2j6i h THR 24 CO 0.64 0.12 -0.72 -0.33 -0.25 0.00 0.00 175.52 174.99 2j6i h GLU 25 N 0.00 0.81 0.00 4.72 3.07 -1.93 -3.33 114.58 117.93 2j6i h GLU 25 Ca -0.00 -0.63 0.00 0.00 -0.50 0.00 0.00 59.36 58.23 2j6i h GLU 25 Cb 0.32 0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.35 2j6i h GLU 25 CO 0.02 1.24 -1.29 0.09 -1.40 0.00 0.00 179.01 177.66 2j6i n ASN 26 N -3.96 0.67 -3.46 1.42 3.02 -1.07 -5.01 115.26 106.86 2j6i n ASN 26 Ca -0.07 -0.63 -0.25 0.00 -0.03 0.00 0.00 54.58 53.60 2j6i n ASN 26 Cb 0.72 1.27 0.05 0.00 -0.61 0.00 0.00 39.78 41.20 2j6i n ASN 26 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2j6i n LYS 27 N -1.76 -6.09 -1.06 3.52 5.02 -0.13 -1.15 118.16 116.51 2j6i n LYS 27 Ca 0.01 0.78 -0.05 0.00 -2.02 0.00 0.00 58.31 57.03 2j6i n LYS 27 Cb 0.41 -5.71 -0.02 0.00 -0.02 0.00 0.00 35.03 29.69 2j6i n LYS 27 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2j6i n LEU 28 N -4.52 0.27 -0.23 -0.35 4.77 0.15 -1.41 117.00 115.68 2j6i n LEU 28 Ca -0.02 0.13 -0.03 0.00 -0.03 0.00 0.00 56.01 56.05 2j6i n LEU 28 Cb 0.57 -2.36 -0.01 0.00 -2.33 0.00 0.00 43.42 39.28 2j6i n LEU 28 CO 0.60 -0.91 -0.03 0.61 -1.33 0.00 0.00 177.39 176.34 2j6i n GLY 29 N 0.55 0.53 0.58 -0.72 0.00 -0.30 -4.78 105.19 101.04 2j6i n GLY 29 Ca -0.05 -0.17 0.10 0.00 0.00 0.00 0.00 46.02 45.90 2j6i n GLY 29 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2j6i n ILE 30 N -2.57 0.00 0.13 -0.61 -5.35 -0.50 -4.67 119.36 105.79 2j6i n ILE 30 Ca -0.03 -0.36 -0.13 0.00 -0.27 0.00 0.00 62.75 61.96 2j6i n ILE 30 Cb 0.27 1.30 -0.06 0.00 -1.74 0.00 0.00 39.64 39.41 2j6i n ILE 30 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2j6i h ALA 31 N 3.71 -0.34 -0.69 -1.28 0.00 -1.87 -0.66 119.26 118.12 2j6i h ALA 31 Ca 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 2j6i h ALA 31 Cb 0.75 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 2j6i h ALA 31 CO 0.00 -0.72 0.16 -0.91 0.00 0.00 0.00 179.25 177.78 2j6i h ASN 32 N -0.38 1.06 -0.30 0.00 2.35 -1.96 -0.09 115.58 116.26 2j6i h ASN 32 Ca 0.01 -0.24 0.04 0.00 -0.55 0.00 0.00 56.30 55.56 2j6i h ASN 32 Cb 0.37 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.42 2j6i h ASN 32 CO -0.06 1.03 0.07 -0.25 -1.65 0.00 0.00 177.43 176.57 2j6i h TRP 33 N 1.05 0.12 -0.21 1.19 7.01 -1.82 0.25 115.95 123.54 2j6i h TRP 33 Ca 0.22 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.22 2j6i h TRP 33 Cb 0.39 -0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.43 2j6i h TRP 33 CO 0.03 0.04 0.07 -0.07 -2.79 0.00 0.00 178.44 175.72 2j6i h LEU 34 N 0.19 0.31 -0.16 0.65 3.38 -0.81 -2.59 115.31 116.29 2j6i h LEU 34 Ca 0.14 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.95 2j6i h LEU 34 Cb 0.14 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 2j6i h LEU 34 CO -0.17 0.43 -0.11 0.11 0.09 0.00 0.00 178.44 178.78 2j6i h LYS 35 N 0.18 -0.11 -0.02 1.13 1.57 -0.72 -1.19 116.57 117.42 2j6i h LYS 35 Ca 0.07 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2j6i h LYS 35 Cb 0.22 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 2j6i h LYS 35 CO -0.00 -0.08 0.02 -0.44 -0.57 0.00 0.00 179.45 178.38 2j6i h ASP 36 N -0.12 0.00 0.18 0.86 3.32 -0.44 0.64 116.42 120.86 2j6i h ASP 36 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2j6i h ASP 36 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 2j6i h ASP 36 CO -0.23 0.00 -0.09 0.00 -1.72 0.00 0.00 179.24 177.20 2j6i n GLN 37 N -4.05 1.04 -0.55 3.56 6.02 -0.87 -4.94 117.38 117.59 2j6i n GLN 37 Ca -0.03 -0.46 0.00 0.00 -0.01 0.00 0.00 57.00 56.50 2j6i n GLN 37 Cb 0.10 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.87 2j6i n GLN 37 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2j6i n GLY 38 N 1.22 0.73 3.89 1.08 0.00 0.22 -4.97 105.19 107.37 2j6i n GLY 38 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2j6i n GLY 38 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2j6i s HIS 39 N -2.21 3.51 -0.26 1.61 3.76 -0.50 -4.39 115.29 116.81 2j6i s HIS 39 Ca 0.00 0.87 -0.07 0.00 -0.15 0.00 0.00 55.06 55.71 2j6i s HIS 39 Cb 0.00 -2.32 -0.02 0.00 1.11 0.00 0.00 32.58 31.34 2j6i s HIS 39 CO 0.00 -0.14 0.07 -2.00 -0.85 0.00 0.00 174.74 171.82 2j6i s GLU 40 N -4.22 3.58 -0.25 1.40 2.12 0.18 -4.21 118.70 117.30 2j6i s GLU 40 Ca 0.48 -0.53 -0.06 0.00 0.36 0.00 0.00 54.97 55.23 2j6i s GLU 40 Cb -0.10 -3.34 -0.01 0.00 0.26 0.00 0.00 34.13 30.94 2j6i s GLU 40 CO 0.37 -0.23 0.03 -1.17 -0.54 0.00 0.00 175.26 173.72 2j6i s LEU 41 N 1.60 3.34 -0.34 2.70 2.96 -1.26 -0.43 118.68 127.25 2j6i s LEU 41 Ca 0.06 -0.42 -0.12 0.00 -0.22 0.00 0.00 54.13 53.43 2j6i s LEU 41 Cb -0.15 -1.84 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 2j6i s LEU 41 CO 0.04 -0.07 0.22 -0.63 -1.32 0.00 0.00 176.35 174.59 2j6i s ILE 42 N 1.53 5.10 -0.14 6.68 -1.09 0.29 -4.99 121.20 128.59 2j6i s ILE 42 Ca 0.05 -0.31 -0.03 0.00 -2.23 0.00 0.00 60.65 58.13 2j6i s ILE 42 Cb -0.15 -3.64 -0.03 0.00 -1.58 0.00 0.00 42.46 37.06 2j6i s ILE 42 CO 0.01 -0.02 -0.03 -0.89 -1.23 0.00 0.00 174.94 172.77 2j6i s THR 43 N 1.69 3.95 0.01 2.92 2.01 -1.26 -0.09 115.64 124.86 2j6i s THR 43 Ca 0.06 -0.35 -0.24 0.00 0.31 0.00 0.00 61.69 61.46 2j6i s THR 43 Cb -0.17 -2.71 0.05 0.00 0.01 0.00 0.00 72.50 69.68 2j6i s THR 43 CO 0.09 0.52 0.55 0.28 -0.69 0.00 0.00 174.62 175.38 2j6i s THR 44 N 0.04 0.02 -1.35 -0.82 -1.32 -0.35 -4.98 115.64 106.89 2j6i s THR 44 Ca 0.00 -0.18 0.17 0.00 -1.21 0.00 0.00 61.69 60.48 2j6i s THR 44 Cb -0.13 -0.93 -0.06 0.00 -1.51 0.00 0.00 72.50 69.87 2j6i s THR 44 CO 0.03 -0.10 0.85 -1.54 -2.21 0.00 0.00 174.62 171.64 2j6i n SER 45 N 0.69 1.43 -4.56 8.08 3.41 -1.22 -1.78 113.62 119.68 2j6i n SER 45 Ca -0.19 -1.22 -0.41 0.00 -0.26 0.00 0.00 58.87 56.79 2j6i n SER 45 Cb 0.59 0.63 -0.03 0.00 -0.26 0.00 0.00 64.21 65.14 2j6i n SER 45 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2j6i s ASP 46 N -2.19 6.37 0.00 4.04 2.15 -1.26 -4.75 116.67 121.02 2j6i s ASP 46 Ca 0.12 -1.08 0.00 0.00 0.43 0.00 0.00 52.55 52.02 2j6i s ASP 46 Cb 0.14 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 40.19 2j6i s ASP 46 CO 0.52 -1.64 0.24 2.29 -0.17 0.00 0.00 175.17 176.40 2j6i n LYS 47 N 9.07 2.29 -5.00 4.34 2.85 -1.26 -2.17 118.16 128.28 2j6i n LYS 47 Ca 0.22 -0.24 -0.32 0.00 -1.05 0.00 0.00 58.31 56.92 2j6i n LYS 47 Cb 0.50 -0.71 -0.14 0.00 -0.65 0.00 0.00 35.03 34.03 2j6i n LYS 47 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2j6i s GLU 48 N -0.40 2.55 0.00 -1.58 0.41 -1.26 -4.78 118.70 113.65 2j6i s GLU 48 Ca 0.00 -0.76 0.00 0.00 -0.41 0.00 0.00 54.97 53.80 2j6i s GLU 48 Cb 0.00 -2.32 0.00 0.00 -1.78 0.00 0.00 34.13 30.03 2j6i s GLU 48 CO 0.00 0.53 0.00 0.41 -0.49 0.00 0.00 175.26 175.71 2j6i n GLY 49 N 2.57 0.55 0.29 -1.39 0.00 -1.26 -4.43 105.19 101.52 2j6i n GLY 49 Ca -0.17 -1.53 0.15 0.00 0.00 0.00 0.00 46.02 44.47 2j6i n GLY 49 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2j6i h GLY 50 N 0.00 0.00 1.22 -0.02 0.00 -2.02 -0.92 103.07 101.34 2j6i h GLY 50 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2j6i h GLY 50 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 176.54 177.70 2j6i n ASN 51 N -3.85 0.00 -4.75 0.19 6.94 -1.26 -4.69 115.26 107.85 2j6i n ASN 51 Ca -0.03 -0.63 -0.34 0.00 -0.02 0.00 0.00 54.58 53.56 2j6i n ASN 51 Cb 0.10 -0.11 0.07 0.00 -2.36 0.00 0.00 39.78 37.48 2j6i n ASN 51 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2j6i s SER 52 N -2.22 4.64 0.40 0.53 1.04 -0.35 -4.80 113.70 112.93 2j6i s SER 52 Ca 0.39 2.17 0.06 0.00 0.48 0.00 0.00 55.95 59.05 2j6i s SER 52 Cb 0.20 -2.57 0.80 0.00 0.10 0.00 0.00 66.02 64.56 2j6i s SER 52 CO 0.39 -1.95 2.05 0.58 0.98 0.00 0.00 173.24 175.28 2j6i h VAL 53 N -0.14 1.12 0.08 5.02 2.07 -1.88 0.10 116.25 122.61 2j6i h VAL 53 Ca -0.47 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 66.83 2j6i h VAL 53 Cb 1.27 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 2j6i h VAL 53 CO 0.52 0.12 -0.09 0.25 0.02 0.00 0.00 177.57 178.38 2j6i h LEU 54 N 0.63 -0.25 -1.24 2.57 5.85 -1.79 -2.63 115.31 118.45 2j6i h LEU 54 Ca 0.17 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.84 2j6i h LEU 54 Cb -0.07 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 2j6i h LEU 54 CO -0.04 -0.15 -0.37 0.44 -0.34 0.00 0.00 178.44 177.99 2j6i h ASP 55 N -0.20 0.00 -0.40 1.25 3.32 -1.70 -0.84 116.42 117.85 2j6i h ASP 55 Ca 0.01 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 2j6i h ASP 55 Cb 0.20 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 2j6i h ASP 55 CO -0.04 0.37 0.23 1.56 -1.72 0.00 0.00 179.24 179.65 2j6i h GLN 56 N 0.00 0.57 0.00 3.56 4.20 -0.65 -3.25 115.11 119.54 2j6i h GLN 56 Ca -0.00 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2j6i h GLN 56 Cb 0.70 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.36 2j6i h GLN 56 CO 0.05 0.42 -1.37 0.72 -0.67 0.00 0.00 178.83 177.97 2j6i n HIS 57 N -4.43 0.00 -0.22 2.96 8.25 -0.99 -4.54 115.22 116.24 2j6i n HIS 57 Ca 0.03 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.51 2j6i n HIS 57 Cb 0.09 -0.23 0.12 0.00 1.12 0.00 0.00 29.99 31.10 2j6i n HIS 57 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2j6i h ILE 58 N 0.00 0.48 -0.43 1.59 2.04 -1.19 -2.20 117.51 117.80 2j6i h ILE 58 Ca 0.00 -0.05 0.13 0.00 1.00 0.00 0.00 64.86 65.93 2j6i h ILE 58 Cb 0.64 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 2j6i h ILE 58 CO 0.00 0.03 0.34 -0.65 0.00 0.00 0.00 178.15 177.86 2j6i h PRO 59 N 0.15 0.00 0.00 2.37 0.11 -1.78 -2.62 132.00 130.24 2j6i h PRO 59 Ca 0.35 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.44 2j6i h PRO 59 Cb 0.58 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.63 2j6i h PRO 59 CO -0.54 0.00 -0.39 -0.40 -0.21 0.00 0.00 178.00 176.46 2j6i n ASP 60 N -4.25 1.53 -4.70 -2.05 5.75 -1.01 -3.15 116.55 108.69 2j6i n ASP 60 Ca 0.08 -2.98 -0.42 0.00 -0.01 0.00 0.00 54.79 51.45 2j6i n ASP 60 Cb 0.53 -0.40 -0.03 0.00 -1.03 0.00 0.00 41.12 40.20 2j6i n ASP 60 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2j6i s ALA 61 N -2.05 3.30 0.08 2.12 0.00 -0.86 -4.66 121.76 119.69 2j6i s ALA 61 Ca 0.28 0.53 -0.00 0.00 0.00 0.00 0.00 51.96 52.77 2j6i s ALA 61 Cb 0.27 -3.40 -0.26 0.00 0.00 0.00 0.00 23.12 19.73 2j6i s ALA 61 CO -0.04 -0.44 1.15 -0.44 0.00 0.00 0.00 175.76 176.00 2j6i h ASP 62 N 6.97 0.28 -3.76 0.00 5.19 -1.04 -2.67 116.42 121.39 2j6i h ASP 62 Ca -0.37 -0.31 -0.28 0.00 -0.62 0.00 0.00 57.03 55.45 2j6i h ASP 62 Cb 1.19 -0.09 -0.29 0.00 0.18 0.00 0.00 39.33 40.32 2j6i h ASP 62 CO 0.81 1.25 -0.74 -0.63 -3.12 0.00 0.00 179.24 176.81 2j6i s ILE 63 N -2.67 0.17 -0.09 0.35 1.01 -0.97 -0.65 121.20 118.34 2j6i s ILE 63 Ca -0.03 -0.06 0.03 0.00 0.00 0.00 0.00 60.65 60.59 2j6i s ILE 63 Cb 0.08 -0.16 0.01 0.00 0.01 0.00 0.00 42.46 42.39 2j6i s ILE 63 CO 0.86 0.06 -0.19 -0.63 0.00 0.00 0.00 174.94 175.04 2j6i s ILE 64 N 0.11 1.71 -0.13 2.92 1.01 -0.67 -1.16 121.20 124.99 2j6i s ILE 64 Ca -0.01 -0.81 -0.02 0.00 0.00 0.00 0.00 60.65 59.81 2j6i s ILE 64 Cb -0.03 -1.51 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 2j6i s ILE 64 CO -0.00 0.48 -0.06 -0.63 0.00 0.00 0.00 174.94 174.73 2j6i s ILE 65 N 0.50 3.72 0.31 2.92 1.01 0.98 -0.94 121.20 129.70 2j6i s ILE 65 Ca -0.17 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.09 2j6i s ILE 65 Cb -0.17 -2.59 -0.06 0.00 0.01 0.00 0.00 42.46 39.65 2j6i s ILE 65 CO 0.06 0.53 0.05 0.42 0.00 0.00 0.00 174.94 176.00 2j6i s THR 66 N 0.04 1.14 0.00 2.92 -4.23 0.36 -0.91 115.64 114.96 2j6i s THR 66 Ca -0.01 -2.01 0.01 0.00 -1.18 0.00 0.00 61.69 58.50 2j6i s THR 66 Cb -0.14 -2.71 -0.00 0.00 1.34 0.00 0.00 72.50 70.99 2j6i s THR 66 CO 0.03 -0.05 -0.02 0.28 -0.54 0.00 0.00 174.62 174.32 2j6i s THR 67 N -3.34 0.15 0.49 3.99 -1.32 -1.25 -1.09 115.64 113.28 2j6i s THR 67 Ca 0.35 -0.14 0.41 0.00 -1.21 0.00 0.00 61.69 61.10 2j6i s THR 67 Cb 0.08 -0.15 0.41 0.00 -1.51 0.00 0.00 72.50 71.34 2j6i s THR 67 CO 0.14 0.00 2.24 -0.65 -2.21 0.00 0.00 174.62 174.15 2j6i h PRO 68 N 5.99 0.00 -0.01 7.08 0.11 -1.86 -2.22 132.00 141.10 2j6i h PRO 68 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2j6i h PRO 68 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2j6i h PRO 68 CO 0.50 0.00 -0.05 1.19 -0.21 0.00 0.00 178.00 179.43 2j6i n PHE 69 N -2.97 0.00 -2.71 0.65 3.01 -1.26 -4.17 117.46 110.01 2j6i n PHE 69 Ca -0.02 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.37 2j6i n PHE 69 Cb 0.10 -0.06 0.08 0.00 -0.01 0.00 0.00 39.48 39.59 2j6i n PHE 69 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 2j6i n HIS 70 N -0.51 -2.03 -2.28 1.38 -0.00 -0.94 -4.88 115.22 105.96 2j6i n HIS 70 Ca 0.19 -1.44 -0.42 0.00 0.46 0.00 0.00 57.72 56.51 2j6i n HIS 70 Cb 0.27 1.41 -0.03 0.00 -0.12 0.00 0.00 29.99 31.52 2j6i n HIS 70 CO 0.00 0.00 0.00 -1.25 0.46 0.00 0.00 176.34 175.55 2j6i s PRO 71 N 0.31 4.27 -0.04 1.57 0.04 -0.88 -4.49 135.00 135.79 2j6i s PRO 71 Ca 0.25 1.88 -0.30 0.00 0.04 0.00 0.00 61.00 62.87 2j6i s PRO 71 Cb 0.26 -3.66 -0.03 0.00 0.04 0.00 0.00 34.50 31.10 2j6i s PRO 71 CO -0.15 -0.61 1.18 0.00 0.04 0.00 0.00 177.00 177.47 2j6i s ALA 72 N 2.77 3.46 -0.62 8.56 0.00 -1.26 -4.97 121.76 129.70 2j6i s ALA 72 Ca 0.62 0.64 -0.27 0.00 0.00 0.00 0.00 51.96 52.94 2j6i s ALA 72 Cb -0.28 -3.50 0.03 0.00 0.00 0.00 0.00 23.12 19.37 2j6i s ALA 72 CO 0.24 -0.69 1.19 0.71 0.00 0.00 0.00 175.76 177.21 2j6i s TYR 73 N 2.00 2.53 -1.16 0.00 1.51 -1.26 -4.70 117.35 116.28 2j6i s TYR 73 Ca 0.56 0.23 -0.15 0.00 -1.01 0.00 0.00 57.07 56.69 2j6i s TYR 73 Cb -0.25 -4.51 0.15 0.00 -0.11 0.00 0.00 41.96 37.25 2j6i s TYR 73 CO 0.23 -1.71 1.40 0.42 -1.11 0.00 0.00 175.55 174.78 2j6i s ILE 74 N 5.07 4.88 0.71 2.71 -1.09 0.82 -4.91 121.20 129.39 2j6i s ILE 74 Ca 0.39 -2.34 -0.10 0.00 -2.23 0.00 0.00 60.65 56.37 2j6i s ILE 74 Cb -0.08 -4.91 0.04 0.00 -1.58 0.00 0.00 42.46 35.92 2j6i s ILE 74 CO 0.22 -1.64 1.07 0.42 -1.23 0.00 0.00 174.94 173.78 2j6i s THR 75 N 2.08 2.98 0.20 2.92 -4.23 -1.26 -1.01 115.64 117.31 2j6i s THR 75 Ca 0.42 0.18 -0.14 0.00 -1.18 0.00 0.00 61.69 60.96 2j6i s THR 75 Cb -0.03 -3.29 0.19 0.00 1.34 0.00 0.00 72.50 70.72 2j6i s THR 75 CO -0.01 -0.36 1.64 0.50 -0.54 0.00 0.00 174.62 175.85 2j6i h LYS 76 N -0.67 0.00 -0.71 3.99 3.64 -1.93 0.24 116.57 121.13 2j6i h LYS 76 Ca -0.45 -0.00 0.05 0.00 -1.27 0.00 0.00 60.65 58.97 2j6i h LYS 76 Cb 1.28 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 33.05 2j6i h LYS 76 CO 0.63 0.00 0.42 0.93 -2.27 0.00 0.00 179.45 179.17 2j6i h GLU 77 N 0.00 0.78 -0.27 1.90 3.07 -1.98 0.31 114.58 118.40 2j6i h GLU 77 Ca 0.27 -0.05 -0.19 0.00 -0.50 0.00 0.00 59.36 58.90 2j6i h GLU 77 Cb 0.42 -0.18 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 2j6i h GLU 77 CO -0.58 0.51 -0.57 0.00 -1.40 0.00 0.00 179.01 176.98 2j6i h ARG 78 N 0.80 0.83 -0.54 2.33 3.08 -1.72 -2.77 114.38 116.40 2j6i h ARG 78 Ca 0.30 -0.54 0.01 0.00 0.07 0.00 0.00 59.98 59.82 2j6i h ARG 78 Cb 0.11 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 2j6i h ARG 78 CO -0.15 1.17 0.35 0.82 -1.07 0.00 0.00 179.97 181.10 2j6i h ILE 79 N 0.63 1.13 -0.72 2.04 2.04 -0.01 -0.65 117.51 121.97 2j6i h ILE 79 Ca 0.01 -0.25 0.01 0.00 1.00 0.00 0.00 64.86 65.63 2j6i h ILE 79 Cb 1.17 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 37.56 2j6i h ILE 79 CO 0.12 0.13 0.48 0.44 0.00 0.00 0.00 178.15 179.32 2j6i h ASP 80 N 0.72 0.83 1.76 1.72 3.32 -0.91 -1.94 116.42 121.91 2j6i h ASP 80 Ca 0.20 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2j6i h ASP 80 Cb -0.07 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.28 2j6i h ASP 80 CO -0.05 0.60 -0.02 0.11 -1.72 0.00 0.00 179.24 178.16 2j6i h LYS 81 N 0.97 0.00 -4.57 3.56 1.57 -1.12 -3.40 116.57 113.58 2j6i h LYS 81 Ca 0.26 0.00 -0.73 0.00 -1.87 0.00 0.00 60.65 58.32 2j6i h LYS 81 Cb -0.11 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.06 2j6i h LYS 81 CO -0.06 0.00 1.92 0.00 -0.57 0.00 0.00 179.45 180.74 2j6i n ALA 82 N -1.97 4.39 0.27 3.86 0.00 -0.30 -3.95 120.51 122.81 2j6i n ALA 82 Ca 0.05 -4.14 0.15 0.00 0.00 0.00 0.00 53.44 49.50 2j6i n ALA 82 Cb 0.49 -3.21 0.73 0.00 0.00 0.00 0.00 19.45 17.46 2j6i n ALA 82 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2j6i h LYS 83 N 6.73 0.00 -0.02 0.00 1.79 -1.76 -2.73 116.57 120.59 2j6i h LYS 83 Ca 0.40 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.87 2j6i h LYS 83 Cb 0.78 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.43 2j6i h LYS 83 CO 1.46 0.09 -0.05 1.63 -1.08 0.00 0.00 179.45 181.50 2j6i n LYS 84 N -3.33 1.36 -1.76 3.15 5.02 -1.24 -5.01 118.16 116.35 2j6i n LYS 84 Ca -0.01 -1.39 -0.42 0.00 -2.02 0.00 0.00 58.31 54.48 2j6i n LYS 84 Cb 0.28 -1.31 -0.03 0.00 -0.02 0.00 0.00 35.03 33.95 2j6i n LYS 84 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2j6i s LEU 85 N -1.47 4.39 0.00 -0.35 2.96 -1.01 -4.29 118.68 118.92 2j6i s LEU 85 Ca 0.18 2.72 0.00 0.00 -0.22 0.00 0.00 54.13 56.81 2j6i s LEU 85 Cb 0.14 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.26 2j6i s LEU 85 CO 0.23 -0.98 0.00 0.29 -1.32 0.00 0.00 176.35 174.58 2j6i n LYS 86 N 5.47 2.83 -3.73 1.98 5.02 0.17 -4.75 118.16 125.15 2j6i n LYS 86 Ca 0.17 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.34 2j6i n LYS 86 Cb 0.38 -0.91 -0.13 0.00 -0.02 0.00 0.00 35.03 34.35 2j6i n LYS 86 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2j6i s LEU 87 N -3.26 0.46 -0.13 -0.35 2.96 -1.07 -1.35 118.68 115.94 2j6i s LEU 87 Ca 0.00 0.55 0.02 0.00 -0.22 0.00 0.00 54.13 54.47 2j6i s LEU 87 Cb 0.00 0.79 -0.00 0.00 0.50 0.00 0.00 46.19 47.48 2j6i s LEU 87 CO 0.00 -0.16 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.99 2j6i s VAL 88 N 1.12 2.40 -0.02 1.68 1.01 0.36 -1.67 120.40 125.28 2j6i s VAL 88 Ca -0.08 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.06 2j6i s VAL 88 Cb -0.09 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 2j6i s VAL 88 CO -0.08 0.54 -0.13 -0.69 0.00 0.00 0.00 175.10 174.74 2j6i s VAL 89 N 0.58 3.17 -0.28 2.92 1.01 -0.11 -1.29 120.40 126.39 2j6i s VAL 89 Ca -0.11 -0.84 -0.06 0.00 0.00 0.00 0.00 61.98 60.97 2j6i s VAL 89 Cb -0.16 -2.30 0.01 0.00 0.00 0.00 0.00 36.38 33.92 2j6i s VAL 89 CO 0.04 0.48 0.06 -0.69 0.00 0.00 0.00 175.10 174.99 2j6i s VAL 90 N -0.85 3.85 -1.39 2.92 1.01 0.46 -0.49 120.40 125.92 2j6i s VAL 90 Ca 0.14 -0.69 -0.15 0.00 0.00 0.00 0.00 61.98 61.28 2j6i s VAL 90 Cb -0.11 -2.96 0.06 0.00 0.00 0.00 0.00 36.38 33.37 2j6i s VAL 90 CO 0.03 0.12 2.02 0.00 0.00 0.00 0.00 175.10 177.28 2j6i n ALA 91 N 4.85 4.80 0.00 5.51 0.00 -0.25 -3.19 120.51 132.23 2j6i n ALA 91 Ca -0.15 -3.91 0.00 0.00 0.00 0.00 0.00 53.44 49.39 2j6i n ALA 91 Cb 0.48 -3.52 0.00 0.00 0.00 0.00 0.00 19.45 16.41 2j6i n ALA 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j6i n GLY 92 N 4.48 0.53 2.81 0.00 0.00 -1.26 -4.77 105.19 106.98 2j6i n GLY 92 Ca 0.50 -1.51 -0.16 0.00 0.00 0.00 0.00 46.02 44.84 2j6i n GLY 92 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j6i s VAL 93 N -3.69 0.12 0.00 1.61 1.01 -1.26 -1.24 120.40 116.95 2j6i s VAL 93 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.10 2j6i s VAL 93 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 36.38 36.16 2j6i s VAL 93 CO 0.00 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.84 2j6i n GLY 94 N 4.12 3.89 0.33 4.51 0.00 -1.26 -4.85 105.19 111.94 2j6i n GLY 94 Ca -0.27 -1.01 0.02 0.00 0.00 0.00 0.00 46.02 44.76 2j6i n GLY 94 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2j6i n SER 95 N 0.00 0.46 0.28 1.61 3.41 -1.26 -4.67 113.62 113.45 2j6i n SER 95 Ca 0.00 -2.03 0.13 0.00 -0.26 0.00 0.00 58.87 56.71 2j6i n SER 95 Cb 0.00 -0.20 0.80 0.00 -0.26 0.00 0.00 64.21 64.55 2j6i n SER 95 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2j6i h ASP 96 N 0.00 0.00 0.33 4.04 5.19 -2.01 -1.27 116.42 122.70 2j6i h ASP 96 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2j6i h ASP 96 Cb 1.24 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.75 2j6i h ASP 96 CO 0.00 0.05 0.00 0.00 -3.12 0.00 0.00 179.24 176.17 2j6i n HIS 97 N -3.92 0.00 -4.63 4.55 1.44 -1.26 -4.67 115.22 106.73 2j6i n HIS 97 Ca -0.03 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.35 2j6i n HIS 97 Cb 0.13 -0.24 -0.13 0.00 0.12 0.00 0.00 29.99 29.87 2j6i n HIS 97 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2j6i s ILE 98 N -2.47 3.40 -1.27 0.61 1.01 -0.48 -0.13 121.20 121.86 2j6i s ILE 98 Ca 0.22 -0.54 -0.18 0.00 0.00 0.00 0.00 60.65 60.15 2j6i s ILE 98 Cb 0.14 -2.45 0.02 0.00 0.01 0.00 0.00 42.46 40.17 2j6i s ILE 98 CO 0.31 0.51 1.92 -0.67 0.00 0.00 0.00 174.94 177.01 2j6i n ASP 99 N 3.52 4.14 -0.37 3.58 -0.08 -0.18 -4.69 116.55 122.47 2j6i n ASP 99 Ca -0.18 -2.84 -0.02 0.00 -1.51 0.00 0.00 54.79 50.24 2j6i n ASP 99 Cb 0.53 -1.67 0.11 0.00 2.34 0.00 0.00 41.12 42.43 2j6i n ASP 99 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2j6i h LEU 100 N 12.85 1.15 -0.15 -2.67 3.38 -1.88 -2.51 115.31 125.48 2j6i h LEU 100 Ca 0.44 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.38 2j6i h LEU 100 Cb 0.80 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2j6i h LEU 100 CO 1.58 0.85 0.06 -0.78 0.09 0.00 0.00 178.44 180.24 2j6i h ASP 101 N 1.34 0.08 -0.65 -0.43 1.82 -1.99 -0.34 116.42 116.24 2j6i h ASP 101 Ca 0.36 0.01 0.03 0.00 -0.39 0.00 0.00 57.03 57.04 2j6i h ASP 101 Cb -0.12 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 39.85 2j6i h ASP 101 CO -0.07 0.07 0.39 0.22 -1.61 0.00 0.00 179.24 178.24 2j6i h TYR 102 N 0.14 0.74 -0.32 0.28 3.20 -1.90 0.20 116.97 119.30 2j6i h TYR 102 Ca 0.06 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 2j6i h TYR 102 Cb 0.03 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 2j6i h TYR 102 CO -0.10 0.41 0.15 0.82 -1.64 0.00 0.00 178.16 177.80 2j6i h ILE 103 N 0.77 1.15 -0.36 1.81 2.04 -1.00 -2.00 117.51 119.92 2j6i h ILE 103 Ca 0.26 -0.44 -0.15 0.00 1.00 0.00 0.00 64.86 65.53 2j6i h ILE 103 Cb 0.05 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 2j6i h ILE 103 CO -0.12 0.16 -0.39 -1.13 0.00 0.00 0.00 178.15 176.68 2j6i h ASN 104 N 0.38 0.92 0.06 1.72 -0.73 -0.65 -1.54 115.58 115.74 2j6i h ASN 104 Ca 0.11 -0.42 -0.15 0.00 1.87 0.00 0.00 56.30 57.71 2j6i h ASN 104 Cb 0.11 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 38.44 2j6i h ASN 104 CO -0.01 1.20 -0.51 1.56 -0.37 0.00 0.00 177.43 179.29 2j6i h GLN 105 N 0.71 0.50 0.01 6.67 4.20 -0.55 -3.02 115.11 123.64 2j6i h GLN 105 Ca 0.06 -0.30 -0.20 0.00 0.06 0.00 0.00 58.65 58.27 2j6i h GLN 105 Cb 0.96 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.76 2j6i h GLN 105 CO 0.09 0.89 -0.90 1.79 -0.67 0.00 0.00 178.83 180.04 2j6i h THR 106 N 0.39 1.52 0.00 -0.54 1.35 -1.33 -3.48 112.91 110.82 2j6i h THR 106 Ca 0.02 -2.72 0.00 0.00 -0.55 0.00 0.00 66.41 63.15 2j6i h THR 106 Cb 1.03 2.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.97 2j6i h THR 106 CO 0.09 0.79 0.00 0.61 -0.25 0.00 0.00 175.52 176.76 2j6i n GLY 107 N 0.94 0.50 3.74 5.82 0.00 -0.60 -5.03 105.19 110.55 2j6i n GLY 107 Ca -0.03 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 2j6i n GLY 107 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2j6i n LYS 108 N -2.83 2.33 -2.16 1.61 5.02 -1.08 -4.87 118.16 116.18 2j6i n LYS 108 Ca 0.00 0.82 -0.42 0.00 -2.02 0.00 0.00 58.31 56.68 2j6i n LYS 108 Cb 0.00 -2.51 0.00 0.00 -0.02 0.00 0.00 35.03 32.50 2j6i n LYS 108 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2j6i n LYS 109 N 0.31 3.20 -4.19 1.97 4.81 -1.26 -3.18 118.16 119.83 2j6i n LYS 109 Ca 0.04 -3.12 -0.25 0.00 -0.87 0.00 0.00 58.31 54.11 2j6i n LYS 109 Cb 0.38 -3.17 -0.17 0.00 0.02 0.00 0.00 35.03 32.09 2j6i n LYS 109 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2j6i s ILE 110 N 2.26 0.99 0.20 3.15 1.01 -1.26 -4.70 121.20 122.84 2j6i s ILE 110 Ca 0.45 -0.33 -0.14 0.00 0.00 0.00 0.00 60.65 60.63 2j6i s ILE 110 Cb 0.10 -0.97 -0.07 0.00 0.01 0.00 0.00 42.46 41.52 2j6i s ILE 110 CO -0.03 0.34 0.60 -0.44 0.00 0.00 0.00 174.94 175.42 2j6i s SER 111 N 1.23 6.81 -0.09 3.58 0.01 -0.46 -0.61 113.70 124.17 2j6i s SER 111 Ca -0.04 1.12 -0.01 0.00 1.31 0.00 0.00 55.95 58.33 2j6i s SER 111 Cb -0.14 -2.31 0.03 0.00 0.21 0.00 0.00 66.02 63.81 2j6i s SER 111 CO -0.03 0.01 -0.03 -0.69 0.41 0.00 0.00 173.24 172.92 2j6i s VAL 112 N -1.62 0.64 0.10 3.43 1.01 0.58 -0.48 120.40 124.05 2j6i s VAL 112 Ca 0.43 -0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.44 2j6i s VAL 112 Cb -0.14 -0.74 -0.03 0.00 0.00 0.00 0.00 36.38 35.47 2j6i s VAL 112 CO 0.20 0.30 -0.18 -0.76 0.00 0.00 0.00 175.10 174.66 2j6i s LEU 113 N 1.87 2.31 0.17 3.92 1.02 -0.41 -0.48 118.68 127.08 2j6i s LEU 113 Ca 0.05 -0.69 -0.00 0.00 0.02 0.00 0.00 54.13 53.51 2j6i s LEU 113 Cb -0.12 -0.73 -0.04 0.00 0.02 0.00 0.00 46.19 45.32 2j6i s LEU 113 CO -0.06 -0.01 0.08 -1.83 0.02 0.00 0.00 176.35 174.54 2j6i s GLU 114 N -2.00 1.10 -1.20 1.70 -1.05 -0.48 -0.40 118.70 116.36 2j6i s GLU 114 Ca 0.05 -1.55 -0.10 0.00 -0.15 0.00 0.00 54.97 53.21 2j6i s GLU 114 Cb -0.09 0.11 0.21 0.00 -0.44 0.00 0.00 34.13 33.91 2j6i s GLU 114 CO 0.04 -0.28 1.52 0.28 0.95 0.00 0.00 175.26 177.77 2j6i n VAL 115 N -0.22 4.49 -1.73 1.83 0.31 -0.37 -4.48 118.33 118.16 2j6i n VAL 115 Ca -0.03 -4.91 -0.42 0.00 -0.01 0.00 0.00 64.34 58.97 2j6i n VAL 115 Cb 0.65 -2.40 -0.02 0.00 -0.91 0.00 0.00 33.84 31.16 2j6i n VAL 115 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2j6i n THR 116 N 3.44 1.10 0.00 2.52 -1.04 -1.26 -2.33 114.28 116.71 2j6i n THR 116 Ca 0.34 -0.27 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 2j6i n THR 116 Cb 0.39 -1.86 0.00 0.00 -1.82 0.00 0.00 70.33 67.04 2j6i n THR 116 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2j6i n GLY 117 N 2.02 1.51 0.21 3.41 0.00 -1.26 -4.91 105.19 106.16 2j6i n GLY 117 Ca 0.09 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.22 2j6i n GLY 117 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2j6i h SER 118 N 0.00 0.00 0.59 1.61 4.64 -1.86 -3.26 113.55 115.28 2j6i h SER 118 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2j6i h SER 118 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2j6i h SER 118 CO 0.00 0.10 -1.42 -0.46 -0.87 0.00 0.00 176.83 174.18 2j6i n ASN 119 N -3.14 0.52 0.06 4.97 6.94 -1.26 -4.72 115.26 118.63 2j6i n ASN 119 Ca 0.03 0.20 -0.13 0.00 -0.02 0.00 0.00 54.58 54.66 2j6i n ASN 119 Cb 0.53 1.03 -0.08 0.00 -2.36 0.00 0.00 39.78 38.89 2j6i n ASN 119 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 2j6i h VAL 120 N 0.00 1.04 -0.77 3.53 2.07 -1.96 -2.27 116.25 117.89 2j6i h VAL 120 Ca -0.02 -0.49 0.02 0.00 0.82 0.00 0.00 66.70 67.03 2j6i h VAL 120 Cb 1.05 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 32.13 2j6i h VAL 120 CO 0.00 0.12 0.50 0.58 0.02 0.00 0.00 177.57 178.79 2j6i h VAL 121 N -0.35 1.16 -0.32 2.57 2.07 -1.84 -0.97 116.25 118.57 2j6i h VAL 121 Ca -0.01 -0.34 0.01 0.00 0.82 0.00 0.00 66.70 67.17 2j6i h VAL 121 Cb 0.29 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 2j6i h VAL 121 CO 0.02 0.18 0.21 0.28 0.02 0.00 0.00 177.57 178.28 2j6i h SER 122 N 1.00 0.36 -0.24 0.57 0.02 -1.79 0.36 113.55 113.83 2j6i h SER 122 Ca 0.29 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 61.14 2j6i h SER 122 Cb -0.06 -0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.39 2j6i h SER 122 CO -0.08 0.26 -0.21 0.58 -1.14 0.00 0.00 176.83 176.24 2j6i h VAL 123 N 0.43 1.32 -0.83 2.27 2.07 -1.32 -2.35 116.25 117.84 2j6i h VAL 123 Ca 0.12 -1.35 0.07 0.00 0.82 0.00 0.00 66.70 66.35 2j6i h VAL 123 Cb -0.04 1.67 -0.06 0.00 -1.52 0.00 0.00 31.29 31.33 2j6i h VAL 123 CO -0.03 0.42 0.50 0.00 0.02 0.00 0.00 177.57 178.48 2j6i h ALA 124 N 0.68 1.15 -0.64 1.67 0.00 -0.89 -0.05 119.26 121.18 2j6i h ALA 124 Ca 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2j6i h ALA 124 Cb 0.75 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2j6i h ALA 124 CO 0.05 0.21 0.39 0.93 0.00 0.00 0.00 179.25 180.84 2j6i h GLU 125 N 0.90 0.87 -0.45 0.00 5.08 -0.92 -2.00 114.58 118.06 2j6i h GLU 125 Ca 0.37 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.62 2j6i h GLU 125 Cb 0.21 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 2j6i h GLU 125 CO -0.19 0.61 0.12 1.25 -1.00 0.00 0.00 179.01 179.80 2j6i h HIS 126 N 0.87 0.68 0.25 4.33 2.76 -0.65 0.84 115.15 124.23 2j6i h HIS 126 Ca 0.23 -0.05 -0.01 0.00 -2.20 0.00 0.00 60.37 58.34 2j6i h HIS 126 Cb -0.04 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 28.72 2j6i h HIS 126 CO -0.02 0.58 -0.12 0.28 -1.30 0.00 0.00 177.93 177.34 2j6i h VAL 127 N 0.65 0.80 -0.76 5.26 2.07 -0.75 0.17 116.25 123.70 2j6i h VAL 127 Ca 0.15 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 2j6i h VAL 127 Cb 0.23 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 2j6i h VAL 127 CO -0.00 0.11 0.47 0.58 0.02 0.00 0.00 177.57 178.74 2j6i h VAL 128 N -0.60 1.21 -0.41 2.57 2.07 -1.04 0.58 116.25 120.62 2j6i h VAL 128 Ca -0.03 -0.44 0.05 0.00 0.82 0.00 0.00 66.70 67.09 2j6i h VAL 128 Cb 0.43 0.14 -0.05 0.00 -1.52 0.00 0.00 31.29 30.30 2j6i h VAL 128 CO 0.06 0.22 0.14 -0.03 0.02 0.00 0.00 177.57 177.97 2j6i h MET 129 N 1.04 0.29 -0.59 1.57 -1.53 -0.76 -0.88 114.93 114.06 2j6i h MET 129 Ca 0.27 -0.02 -0.10 0.00 -3.44 0.00 0.00 59.70 56.41 2j6i h MET 129 Cb -0.06 -0.07 -0.02 0.00 -0.55 0.00 0.00 31.60 30.91 2j6i h MET 129 CO -0.05 0.19 -0.03 1.15 0.14 0.00 0.00 176.91 178.31 2j6i h THR 130 N 0.30 1.27 -0.10 -0.77 2.02 -0.07 0.38 112.91 115.93 2j6i h THR 130 Ca 0.19 -1.19 0.04 0.00 0.77 0.00 0.00 66.41 66.22 2j6i h THR 130 Cb 0.18 0.84 -0.05 0.00 -1.74 0.00 0.00 68.15 67.38 2j6i h THR 130 CO -0.20 0.43 -0.20 0.24 0.37 0.00 0.00 175.52 176.16 2j6i h MET 131 N 0.96 -0.26 -0.40 6.66 2.86 -0.57 -1.11 114.93 123.08 2j6i h MET 131 Ca 0.16 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 2j6i h MET 131 Cb 0.60 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.30 2j6i h MET 131 CO 0.04 -0.17 0.25 -0.07 1.06 0.00 0.00 176.91 178.02 2j6i h LEU 132 N -0.27 0.47 -0.69 1.22 3.38 -0.69 0.12 115.31 118.85 2j6i h LEU 132 Ca 0.09 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.10 2j6i h LEU 132 Cb 0.40 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.97 2j6i h LEU 132 CO -0.26 0.36 0.37 0.58 0.09 0.00 0.00 178.44 179.58 2j6i h VAL 133 N 0.53 0.92 0.06 1.22 2.07 -0.77 0.17 116.25 120.46 2j6i h VAL 133 Ca 0.14 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 2j6i h VAL 133 Cb -0.04 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 29.94 2j6i h VAL 133 CO -0.03 0.12 -0.03 -0.07 0.02 0.00 0.00 177.57 177.58 2j6i h LEU 134 N 0.66 -0.06 -0.79 2.57 3.38 -0.62 -0.40 115.31 120.05 2j6i h LEU 134 Ca 0.32 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2j6i h LEU 134 Cb 0.26 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 2j6i h LEU 134 CO -0.22 0.62 0.51 0.58 0.09 0.00 0.00 178.44 180.02 2j6i h VAL 135 N -0.83 1.21 -0.05 1.22 2.07 -0.71 -1.98 116.25 117.20 2j6i h VAL 135 Ca -0.01 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2j6i h VAL 135 Cb 0.64 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 2j6i h VAL 135 CO 0.01 0.21 0.00 0.54 0.02 0.00 0.00 177.57 178.36 2j6i n ARG 136 N -4.50 1.44 -3.49 1.57 1.74 0.04 -0.48 116.66 112.98 2j6i n ARG 136 Ca 0.08 -0.65 -0.24 0.00 -0.77 0.00 0.00 57.85 56.28 2j6i n ARG 136 Cb 0.03 -1.44 0.07 0.00 -1.02 0.00 0.00 32.46 30.11 2j6i n ARG 136 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2j6i n ASN 137 N -0.19 -6.34 -0.24 0.55 5.15 -0.71 -4.69 115.26 108.80 2j6i n ASN 137 Ca 0.19 -0.49 -0.06 0.00 -0.60 0.00 0.00 54.58 53.62 2j6i n ASN 137 Cb 0.25 -5.00 0.04 0.00 -0.53 0.00 0.00 39.78 34.54 2j6i n ASN 137 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 2j6i h PHE 138 N -2.46 0.92 0.33 1.20 3.57 -1.37 -3.23 116.94 115.91 2j6i h PHE 138 Ca -0.56 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 60.91 2j6i h PHE 138 Cb 1.37 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.80 2j6i h PHE 138 CO 0.50 0.67 -0.29 0.28 -2.23 0.00 0.00 178.31 177.24 2j6i h VAL 139 N 0.91 0.39 0.00 1.41 2.07 -1.92 0.69 116.25 119.80 2j6i h VAL 139 Ca 0.23 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.71 2j6i h VAL 139 Cb 0.07 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.22 2j6i h VAL 139 CO -0.03 0.00 -0.22 1.55 0.02 0.00 0.00 177.57 178.89 2j6i h PRO 140 N -0.64 0.00 0.30 1.57 0.13 -1.93 -0.78 132.00 130.65 2j6i h PRO 140 Ca -0.02 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 2j6i h PRO 140 Cb 0.57 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 2j6i h PRO 140 CO -0.03 0.22 -0.15 0.00 -0.23 0.00 0.00 178.00 177.80 2j6i h ALA 141 N 1.78 -0.41 -0.73 -0.56 0.00 -1.38 -0.27 119.26 117.70 2j6i h ALA 141 Ca -0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2j6i h ALA 141 Cb 0.48 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 2j6i h ALA 141 CO 0.03 -0.73 0.34 1.25 0.00 0.00 0.00 179.25 180.14 2j6i h HIS 142 N -0.41 1.03 -0.88 0.00 -0.00 -0.61 -2.75 115.15 111.53 2j6i h HIS 142 Ca -0.04 -0.04 -0.02 0.00 -0.00 0.00 0.00 60.37 60.27 2j6i h HIS 142 Cb 0.32 -0.32 -0.04 0.00 -0.00 0.00 0.00 27.41 27.36 2j6i h HIS 142 CO -0.06 0.75 0.48 0.93 -0.00 0.00 0.00 177.93 180.04 2j6i h GLU 143 N 1.03 1.24 -0.39 5.26 5.08 -0.82 -1.86 114.58 124.11 2j6i h GLU 143 Ca 0.25 -0.15 0.06 0.00 -1.00 0.00 0.00 59.36 58.53 2j6i h GLU 143 Cb 0.11 -0.24 -0.06 0.00 0.50 0.00 0.00 28.75 29.06 2j6i h GLU 143 CO -0.03 0.91 0.06 1.96 -1.00 0.00 0.00 179.01 180.91 2j6i h GLN 144 N 1.24 0.18 -0.03 2.33 4.20 -0.76 -0.92 115.11 121.35 2j6i h GLN 144 Ca 0.31 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.01 2j6i h GLN 144 Cb 0.03 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 27.77 2j6i h GLN 144 CO -0.05 0.12 0.02 0.82 -0.67 0.00 0.00 178.83 179.07 2j6i h ILE 145 N 0.18 1.01 0.00 2.54 1.08 -1.21 0.75 117.51 121.86 2j6i h ILE 145 Ca 0.19 -0.03 -0.00 0.00 -0.39 0.00 0.00 64.86 64.62 2j6i h ILE 145 Cb 0.24 0.97 -0.00 0.00 -3.07 0.00 0.00 36.82 34.96 2j6i h ILE 145 CO -0.27 0.01 -0.01 0.16 -0.69 0.00 0.00 178.15 177.35 2j6i h ILE 146 N 0.04 0.03 -0.06 -0.67 3.07 -1.31 -2.41 117.51 116.20 2j6i h ILE 146 Ca 0.01 -0.70 0.00 0.00 1.55 0.00 0.00 64.86 65.72 2j6i h ILE 146 Cb 0.00 1.68 0.00 0.00 -0.27 0.00 0.00 36.82 38.23 2j6i h ILE 146 CO -0.00 0.01 0.00 0.59 -1.05 0.00 0.00 178.15 177.70 2j6i n ASN 147 N -3.11 1.13 -0.96 2.16 4.13 -0.36 -4.92 115.26 113.34 2j6i n ASN 147 Ca 0.02 -1.48 -0.10 0.00 1.68 0.00 0.00 54.58 54.70 2j6i n ASN 147 Cb 0.38 -0.03 -0.02 0.00 -1.54 0.00 0.00 39.78 38.57 2j6i n ASN 147 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2j6i n HIS 148 N -0.08 -0.25 -3.17 3.10 8.25 -0.91 -5.03 115.22 117.14 2j6i n HIS 148 Ca 0.18 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.45 2j6i n HIS 148 Cb 0.27 -2.18 0.03 0.00 1.12 0.00 0.00 29.99 29.23 2j6i n HIS 148 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2j6i s ASP 149 N -2.72 5.22 -0.31 0.41 1.01 0.22 -5.03 116.67 115.48 2j6i s ASP 149 Ca 0.00 -0.74 -0.01 0.00 0.71 0.00 0.00 52.55 52.50 2j6i s ASP 149 Cb 0.00 -0.08 0.19 0.00 1.01 0.00 0.00 42.92 44.04 2j6i s ASP 149 CO 0.00 -1.07 0.80 0.86 0.21 0.00 0.00 175.17 175.97 2j6i s TRP 150 N -2.56 -1.22 -0.38 4.23 -0.11 -1.26 -4.30 118.94 113.34 2j6i s TRP 150 Ca 0.55 0.61 0.02 0.00 1.22 0.00 0.00 56.10 58.50 2j6i s TRP 150 Cb -0.06 0.21 0.16 0.00 -1.50 0.00 0.00 33.47 32.27 2j6i s TRP 150 CO 0.34 -0.73 0.31 -2.00 -4.62 0.00 0.00 176.95 170.25 2j6i s GLU 151 N 2.68 0.71 0.24 5.86 2.12 -1.26 -5.03 118.70 124.01 2j6i s GLU 151 Ca 0.18 -1.47 -0.07 0.00 0.36 0.00 0.00 54.97 53.97 2j6i s GLU 151 Cb -0.05 -1.15 0.23 0.00 0.26 0.00 0.00 34.13 33.42 2j6i s GLU 151 CO -0.22 -1.27 1.91 0.28 -0.54 0.00 0.00 175.26 175.42 2j6i h VAL 152 N 4.89 1.25 -0.28 3.70 2.07 -2.01 -2.01 116.25 123.87 2j6i h VAL 152 Ca 0.13 -0.48 0.04 0.00 0.82 0.00 0.00 66.70 67.21 2j6i h VAL 152 Cb 0.98 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 2j6i h VAL 152 CO 0.27 0.25 0.19 0.00 0.02 0.00 0.00 177.57 178.30 2j6i h ALA 153 N 1.34 2.01 0.00 1.67 0.00 -1.97 0.16 119.26 122.46 2j6i h ALA 153 Ca 0.35 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 2j6i h ALA 153 Cb -0.12 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2j6i h ALA 153 CO -0.07 -0.06 -0.14 0.00 0.00 0.00 0.00 179.25 178.98 2j6i h ALA 154 N 1.85 1.20 0.00 0.00 0.00 -1.80 -2.41 119.26 118.10 2j6i h ALA 154 Ca 0.12 -0.13 -0.41 0.00 0.00 0.00 0.00 54.91 54.49 2j6i h ALA 154 Cb 0.23 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 2j6i h ALA 154 CO -0.02 0.17 -2.27 -0.89 0.00 0.00 0.00 179.25 176.24 2j6i n ILE 155 N -3.55 1.53 -0.25 0.00 2.08 -0.46 -4.48 119.36 114.24 2j6i n ILE 155 Ca -0.01 -0.34 0.18 0.00 0.56 0.00 0.00 62.75 63.14 2j6i n ILE 155 Cb 0.28 -1.87 0.49 0.00 -0.75 0.00 0.00 39.64 37.78 2j6i n ILE 155 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2j6i h ALA 156 N -0.79 2.13 0.00 -1.39 0.00 -0.73 -2.27 119.26 116.21 2j6i h ALA 156 Ca -0.62 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2j6i h ALA 156 Cb 1.59 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.34 2j6i h ALA 156 CO -0.35 -0.42 0.00 0.36 0.00 0.00 0.00 179.25 178.85 2j6i n LYS 157 N -4.53 0.13 -1.33 0.00 2.85 -0.91 -2.04 118.16 112.32 2j6i n LYS 157 Ca 0.19 0.55 0.04 0.00 -1.05 0.00 0.00 58.31 58.05 2j6i n LYS 157 Cb 0.66 -1.85 0.06 0.00 -0.65 0.00 0.00 35.03 33.25 2j6i n LYS 157 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 2j6i n ASP 158 N -2.11 1.15 -4.39 -5.58 4.64 -0.86 -5.06 116.55 104.34 2j6i n ASP 158 Ca -0.00 -2.37 -0.33 0.00 -1.38 0.00 0.00 54.79 50.70 2j6i n ASP 158 Cb 0.08 -0.35 -0.14 0.00 -1.04 0.00 0.00 41.12 39.68 2j6i n ASP 158 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2j6i s ALA 159 N -0.65 2.72 0.33 -1.67 0.00 -0.87 -4.42 121.76 117.21 2j6i s ALA 159 Ca 0.35 -0.90 0.05 0.00 0.00 0.00 0.00 51.96 51.46 2j6i s ALA 159 Cb 0.39 -1.34 -0.07 0.00 0.00 0.00 0.00 23.12 22.10 2j6i s ALA 159 CO -0.15 0.17 0.01 0.71 0.00 0.00 0.00 175.76 176.50 2j6i s TYR 160 N 0.48 2.10 0.26 0.00 1.51 0.36 -4.98 117.35 117.07 2j6i s TYR 160 Ca -0.08 -0.81 -0.08 0.00 -1.01 0.00 0.00 57.07 55.09 2j6i s TYR 160 Cb -0.15 -1.36 -0.06 0.00 -0.11 0.00 0.00 41.96 40.28 2j6i s TYR 160 CO 0.04 0.19 0.55 -0.51 -1.11 0.00 0.00 175.55 174.72 2j6i s ASP 161 N -3.53 6.55 0.26 2.29 1.01 -1.26 -3.63 116.67 118.36 2j6i s ASP 161 Ca 0.34 0.85 0.08 0.00 0.71 0.00 0.00 52.55 54.53 2j6i s ASP 161 Cb 0.08 -2.20 0.31 0.00 1.01 0.00 0.00 42.92 42.12 2j6i s ASP 161 CO 0.15 -0.13 1.59 -0.29 0.21 0.00 0.00 175.17 176.70 2j6i h ILE 162 N 1.73 1.43 -1.94 0.77 2.10 -1.92 -3.44 117.51 116.24 2j6i h ILE 162 Ca -0.47 -2.09 -0.64 0.00 1.08 0.00 0.00 64.86 62.74 2j6i h ILE 162 Cb 1.18 2.11 0.10 0.00 -1.09 0.00 0.00 36.82 39.11 2j6i h ILE 162 CO 0.68 0.60 0.01 1.21 -1.08 0.00 0.00 178.15 179.58 2j6i n GLU 163 N -3.82 0.95 -0.96 2.19 2.13 -1.24 -1.97 120.64 117.92 2j6i n GLU 163 Ca -0.02 0.33 0.00 0.00 0.66 0.00 0.00 57.16 58.14 2j6i n GLU 163 Cb 0.62 -1.66 0.00 0.00 0.27 0.00 0.00 31.44 30.67 2j6i n GLU 163 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2j6i n GLY 164 N 1.62 0.63 3.87 8.31 0.00 -0.61 -4.87 105.19 114.13 2j6i n GLY 164 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 2j6i n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j6i s LYS 165 N -0.25 3.86 -0.19 1.61 -0.14 -0.83 -4.13 119.74 119.67 2j6i s LYS 165 Ca 0.00 0.36 -0.18 0.00 -1.36 0.00 0.00 55.97 54.79 2j6i s LYS 165 Cb 0.00 -2.68 -0.03 0.00 -1.68 0.00 0.00 37.83 33.44 2j6i s LYS 165 CO 0.00 0.33 0.49 0.99 -0.76 0.00 0.00 175.35 176.40 2j6i s THR 166 N -1.77 5.14 -0.15 2.17 2.01 -1.26 -0.52 115.64 121.25 2j6i s THR 166 Ca 0.46 0.90 0.01 0.00 0.31 0.00 0.00 61.69 63.38 2j6i s THR 166 Cb -0.12 -3.82 0.01 0.00 0.01 0.00 0.00 72.50 68.58 2j6i s THR 166 CO 0.20 0.21 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.53 2j6i s ILE 167 N 1.43 2.34 -0.12 1.82 1.01 -0.20 -0.03 121.20 127.45 2j6i s ILE 167 Ca 0.23 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 60.02 2j6i s ILE 167 Cb -0.15 -1.97 -0.01 0.00 0.01 0.00 0.00 42.46 40.34 2j6i s ILE 167 CO 0.09 0.53 -0.18 0.00 0.00 0.00 0.00 174.94 175.39 2j6i s ALA 168 N 0.88 2.43 -0.15 9.38 0.00 0.11 -0.81 121.76 133.61 2j6i s ALA 168 Ca -0.05 -0.94 -0.05 0.00 0.00 0.00 0.00 51.96 50.92 2j6i s ALA 168 Cb -0.15 -1.06 -0.04 0.00 0.00 0.00 0.00 23.12 21.87 2j6i s ALA 168 CO -0.02 0.24 0.04 -0.08 0.00 0.00 0.00 175.76 175.93 2j6i s THR 169 N 0.39 4.58 -0.54 0.00 -1.32 -0.20 -0.42 115.64 118.13 2j6i s THR 169 Ca -0.13 -0.12 -0.20 0.00 -1.21 0.00 0.00 61.69 60.02 2j6i s THR 169 Cb -0.17 -3.01 0.06 0.00 -1.51 0.00 0.00 72.50 67.88 2j6i s THR 169 CO 0.06 0.52 0.71 -0.63 -2.21 0.00 0.00 174.62 173.07 2j6i s ILE 170 N -0.10 4.76 0.00 5.08 1.01 0.43 -1.41 121.20 130.96 2j6i s ILE 170 Ca 0.06 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.24 2j6i s ILE 170 Cb -0.12 -4.39 0.00 0.00 0.01 0.00 0.00 42.46 37.95 2j6i s ILE 170 CO 0.02 -0.95 0.00 0.61 0.00 0.00 0.00 174.94 174.61 2j6i n GLY 171 N 5.19 0.89 1.71 6.18 0.00 0.58 -0.44 105.19 119.31 2j6i n GLY 171 Ca -0.06 -1.27 -0.09 0.00 0.00 0.00 0.00 46.02 44.60 2j6i n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j6i n ALA 172 N 2.53 3.97 -1.00 4.61 0.00 -1.26 -4.47 120.51 124.89 2j6i n ALA 172 Ca 0.00 -3.34 0.00 0.00 0.00 0.00 0.00 53.44 50.10 2j6i n ALA 172 Cb 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 18.99 2j6i n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j6i n GLY 173 N -0.68 -2.60 0.18 0.00 0.00 -1.26 -4.22 105.19 96.60 2j6i n GLY 173 Ca 0.27 -1.33 -0.05 0.00 0.00 0.00 0.00 46.02 44.91 2j6i n GLY 173 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2j6i h ARG 174 N 0.00 0.32 -0.07 1.61 3.08 -1.96 -1.03 114.38 116.32 2j6i h ARG 174 Ca 0.00 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 2j6i h ARG 174 Cb 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2j6i h ARG 174 CO 0.00 0.21 -0.16 0.82 -1.07 0.00 0.00 179.97 179.77 2j6i h ILE 175 N 0.33 1.41 -0.56 2.04 2.04 -1.91 -2.42 117.51 118.44 2j6i h ILE 175 Ca 0.20 -1.48 0.09 0.00 1.00 0.00 0.00 64.86 64.67 2j6i h ILE 175 Cb 0.18 2.20 -0.07 0.00 -0.74 0.00 0.00 36.82 38.39 2j6i h ILE 175 CO -0.19 0.41 0.19 1.23 0.00 0.00 0.00 178.15 179.79 2j6i h GLY 176 N -0.24 0.75 1.29 5.37 0.00 -1.73 -0.48 103.07 108.03 2j6i h GLY 176 Ca 0.00 -0.09 -0.09 0.00 0.00 0.00 0.00 47.33 47.15 2j6i h GLY 176 CO 0.04 -0.02 -0.06 -1.82 0.00 0.00 0.00 176.54 174.67 2j6i h TYR 177 N 0.36 0.92 0.00 5.60 3.20 -1.24 -1.57 116.97 124.24 2j6i h TYR 177 Ca 0.28 -0.16 -0.11 0.00 3.14 0.00 0.00 58.73 61.88 2j6i h TYR 177 Cb 0.34 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 2j6i h TYR 177 CO -0.18 0.87 -0.52 0.00 -1.64 0.00 0.00 178.16 176.69 2j6i h ARG 178 N 0.77 0.00 0.35 1.82 3.08 -0.83 -0.43 114.38 119.14 2j6i h ARG 178 Ca 0.14 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 2j6i h ARG 178 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.60 2j6i h ARG 178 CO 0.03 0.52 -0.17 0.28 -1.07 0.00 0.00 179.97 179.56 2j6i h VAL 179 N 0.00 0.66 -0.68 2.04 2.07 -0.92 -1.98 116.25 117.43 2j6i h VAL 179 Ca -0.01 -0.37 0.12 0.00 0.82 0.00 0.00 66.70 67.26 2j6i h VAL 179 Cb 0.92 0.85 -0.09 0.00 -1.52 0.00 0.00 31.29 31.45 2j6i h VAL 179 CO 0.07 0.07 0.25 -0.07 0.02 0.00 0.00 177.57 177.91 2j6i h LEU 180 N -0.68 0.23 -0.73 2.57 3.38 -1.04 0.04 115.31 119.07 2j6i h LEU 180 Ca -0.05 0.10 0.09 0.00 0.09 0.00 0.00 57.88 58.11 2j6i h LEU 180 Cb 0.48 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.24 2j6i h LEU 180 CO 0.08 0.11 0.38 -0.33 0.09 0.00 0.00 178.44 178.76 2j6i h GLU 181 N 0.41 0.62 0.00 1.13 5.08 -1.05 -1.80 114.58 118.96 2j6i h GLU 181 Ca 0.36 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.64 2j6i h GLU 181 Cb 0.51 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2j6i h GLU 181 CO -0.37 0.41 -0.23 0.00 -1.00 0.00 0.00 179.01 177.82 2j6i h ARG 182 N 0.64 0.00 0.00 2.33 3.08 -0.27 -3.11 114.38 117.04 2j6i h ARG 182 Ca 0.36 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.36 2j6i h ARG 182 Cb 0.37 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 2j6i h ARG 182 CO -0.26 0.23 -0.50 -0.07 -1.07 0.00 0.00 179.97 178.29 2j6i h LEU 183 N 0.00 0.00 -0.39 3.04 3.38 -0.26 -3.39 115.31 117.69 2j6i h LEU 183 Ca -0.00 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2j6i h LEU 183 Cb 0.76 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.42 2j6i h LEU 183 CO 0.03 0.19 -0.46 0.58 0.09 0.00 0.00 178.44 178.87 2j6i h VAL 184 N 0.00 0.08 0.00 1.22 2.07 -1.37 -1.24 116.25 117.02 2j6i h VAL 184 Ca -0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2j6i h VAL 184 Cb 1.17 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 2j6i h VAL 184 CO 0.02 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.80 2j6i n PRO 185 N -5.41 0.69 0.00 1.57 -0.04 -1.26 -1.79 135.00 128.76 2j6i n PRO 185 Ca -0.01 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.60 2j6i n PRO 185 Cb 0.35 -1.50 0.80 0.00 -0.04 0.00 0.00 33.50 33.11 2j6i n PRO 185 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2j6i n PHE 186 N -1.00 0.00 -3.61 0.54 3.01 -0.47 -4.95 117.46 110.99 2j6i n PHE 186 Ca 0.17 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.39 2j6i n PHE 186 Cb 0.08 -0.01 0.04 0.00 -0.01 0.00 0.00 39.48 39.58 2j6i n PHE 186 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2j6i n ASN 187 N -0.64 -3.63 -4.70 4.37 5.15 -0.74 -3.59 115.26 111.48 2j6i n ASN 187 Ca 0.22 -0.87 -0.31 0.00 -0.60 0.00 0.00 54.58 53.03 2j6i n ASN 187 Cb 0.20 -4.06 0.14 0.00 -0.53 0.00 0.00 39.78 35.53 2j6i n ASN 187 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2j6i s PRO 188 N -5.66 1.36 0.12 1.20 0.04 -1.26 -1.57 135.00 129.23 2j6i s PRO 188 Ca 0.25 1.33 -0.20 0.00 0.04 0.00 0.00 61.00 62.43 2j6i s PRO 188 Cb -0.07 -1.78 -0.05 0.00 0.04 0.00 0.00 34.50 32.64 2j6i s PRO 188 CO 0.81 -2.32 1.76 -0.22 0.04 0.00 0.00 177.00 177.07 2j6i h LYS 189 N -1.64 0.20 -2.10 4.56 3.64 -0.96 -3.42 116.57 116.86 2j6i h LYS 189 Ca -0.45 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 58.86 2j6i h LYS 189 Cb 1.26 -0.05 -0.20 0.00 -0.41 0.00 0.00 32.23 32.84 2j6i h LYS 189 CO 0.46 0.13 0.12 -2.00 -2.27 0.00 0.00 179.45 175.90 2j6i s GLU 190 N -6.18 0.95 -0.18 1.90 2.12 -1.23 -4.99 118.70 111.09 2j6i s GLU 190 Ca -0.13 0.45 -0.09 0.00 0.36 0.00 0.00 54.97 55.56 2j6i s GLU 190 Cb 0.09 0.45 -0.05 0.00 0.26 0.00 0.00 34.13 34.88 2j6i s GLU 190 CO 0.69 -0.24 0.11 -0.51 -0.54 0.00 0.00 175.26 174.77 2j6i s LEU 191 N -0.70 4.14 0.08 2.70 1.43 -1.26 -1.04 118.68 124.04 2j6i s LEU 191 Ca -0.08 0.25 0.05 0.00 -1.03 0.00 0.00 54.13 53.32 2j6i s LEU 191 Cb -0.02 -2.05 -0.03 0.00 0.03 0.00 0.00 46.19 44.12 2j6i s LEU 191 CO 0.07 0.23 -0.13 -0.76 0.23 0.00 0.00 176.35 175.99 2j6i s LEU 192 N 0.03 2.31 -0.01 1.79 1.43 0.01 -1.28 118.68 122.96 2j6i s LEU 192 Ca 0.09 -0.67 -0.05 0.00 -1.03 0.00 0.00 54.13 52.47 2j6i s LEU 192 Cb -0.11 -0.46 0.00 0.00 0.03 0.00 0.00 46.19 45.64 2j6i s LEU 192 CO -0.00 -0.12 0.10 -0.72 0.23 0.00 0.00 176.35 175.83 2j6i s TYR 193 N -1.59 0.02 -0.10 0.29 -0.85 -0.67 -1.04 117.35 113.42 2j6i s TYR 193 Ca 0.00 -0.05 0.01 0.00 -0.52 0.00 0.00 57.07 56.50 2j6i s TYR 193 Cb -0.08 -0.04 -0.02 0.00 0.38 0.00 0.00 41.96 42.19 2j6i s TYR 193 CO 0.02 -0.19 -0.12 -0.47 -1.52 0.00 0.00 175.55 173.27 2j6i s TYR 194 N -0.90 2.82 0.11 -3.49 5.04 -0.50 -1.39 117.35 119.04 2j6i s TYR 194 Ca -0.10 -0.39 -0.20 0.00 -2.44 0.00 0.00 57.07 53.94 2j6i s TYR 194 Cb -0.06 -1.78 0.05 0.00 0.35 0.00 0.00 41.96 40.52 2j6i s TYR 194 CO 0.01 -0.02 0.49 0.34 -1.34 0.00 0.00 175.55 175.02 2j6i s ASP 195 N -0.07 -0.38 0.54 4.32 -1.08 -1.26 -0.31 116.67 118.43 2j6i s ASP 195 Ca -0.01 -0.08 0.28 0.00 -0.52 0.00 0.00 52.55 52.22 2j6i s ASP 195 Cb -0.14 0.51 1.56 0.00 -1.46 0.00 0.00 42.92 43.39 2j6i s ASP 195 CO 0.03 -0.83 2.12 1.88 0.52 0.00 0.00 175.17 178.90 2j6i h TYR 196 N 2.43 0.00 -3.65 -5.34 -1.99 -1.99 -3.42 116.97 103.02 2j6i h TYR 196 Ca -0.33 0.00 -0.28 0.00 2.00 0.00 0.00 58.73 60.12 2j6i h TYR 196 Cb 1.25 0.00 -0.16 0.00 2.00 0.00 0.00 36.73 39.83 2j6i h TYR 196 CO 0.32 0.09 -0.71 -0.65 -0.00 0.00 0.00 178.16 177.20 2j6i s GLN 197 N -4.30 0.91 0.42 4.88 -1.52 -1.26 -5.15 119.66 113.64 2j6i s GLN 197 Ca -0.03 -1.32 -0.24 0.00 -1.95 0.00 0.00 55.36 51.81 2j6i s GLN 197 Cb 0.14 -0.42 -0.08 0.00 -0.22 0.00 0.00 33.01 32.42 2j6i s GLN 197 CO 0.57 0.04 1.13 0.00 -0.25 0.00 0.00 175.29 176.77 2j6i s ALA 198 N -3.21 3.05 0.46 6.09 0.00 -1.26 -4.99 121.76 121.89 2j6i s ALA 198 Ca 0.12 0.86 -0.24 0.00 0.00 0.00 0.00 51.96 52.70 2j6i s ALA 198 Cb 0.02 -3.34 -0.07 0.00 0.00 0.00 0.00 23.12 19.73 2j6i s ALA 198 CO -0.02 -0.47 1.26 -0.51 0.00 0.00 0.00 175.76 176.02 2j6i s LEU 199 N -2.77 4.05 0.64 0.00 1.43 -1.26 -5.00 118.68 115.78 2j6i s LEU 199 Ca 0.60 2.53 -0.18 0.00 -1.03 0.00 0.00 54.13 56.05 2j6i s LEU 199 Cb -0.27 -4.12 -0.02 0.00 0.03 0.00 0.00 46.19 41.81 2j6i s LEU 199 CO 0.33 -1.03 1.12 -2.65 0.23 0.00 0.00 176.35 174.35 2j6i n PRO 200 N -0.37 0.93 -0.35 1.29 -0.02 -1.26 -4.67 135.00 130.55 2j6i n PRO 200 Ca 0.07 0.37 0.11 0.00 -2.02 0.00 0.00 63.50 62.03 2j6i n PRO 200 Cb 0.46 -2.35 0.30 0.00 -0.02 0.00 0.00 33.50 31.89 2j6i n PRO 200 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2j6i h LYS 201 N 0.38 0.80 -0.30 -0.52 3.64 -1.99 0.58 116.57 119.16 2j6i h LYS 201 Ca -0.50 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 58.74 2j6i h LYS 201 Cb 1.35 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.98 2j6i h LYS 201 CO 0.51 0.53 -0.21 -0.44 -2.27 0.00 0.00 179.45 177.57 2j6i h ASP 202 N 0.82 0.56 -0.05 4.20 3.32 -1.99 -1.43 116.42 121.86 2j6i h ASP 202 Ca 0.55 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 57.40 2j6i h ASP 202 Cb 0.79 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.19 2j6i h ASP 202 CO -0.34 0.78 -0.06 0.00 -1.72 0.00 0.00 179.24 177.90 2j6i h ALA 203 N 1.27 0.08 -0.56 3.45 0.00 -1.31 -1.56 119.26 120.61 2j6i h ALA 203 Ca 0.08 -0.29 0.11 0.00 0.00 0.00 0.00 54.91 54.81 2j6i h ALA 203 Cb 0.65 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.31 2j6i h ALA 203 CO 0.05 -0.11 -0.18 0.93 0.00 0.00 0.00 179.25 179.93 2j6i h GLU 204 N -0.33 -0.04 -0.26 0.00 5.08 -1.03 -2.60 114.58 115.40 2j6i h GLU 204 Ca 0.01 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 2j6i h GLU 204 Cb 0.59 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2j6i h GLU 204 CO 0.01 -0.03 -0.29 0.93 -1.00 0.00 0.00 179.01 178.64 2j6i h GLU 205 N -0.04 0.53 -0.34 2.33 5.08 -1.23 0.41 114.58 121.31 2j6i h GLU 205 Ca 0.27 -0.22 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 2j6i h GLU 205 Cb 0.45 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 2j6i h GLU 205 CO -0.60 0.77 0.23 -0.22 -1.00 0.00 0.00 179.01 178.19 2j6i h LYS 206 N 0.46 0.22 -0.20 2.33 3.64 -0.87 -2.37 116.57 119.77 2j6i h LYS 206 Ca 0.06 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2j6i h LYS 206 Cb 0.74 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 2j6i h LYS 206 CO 0.06 0.15 0.00 1.33 -2.27 0.00 0.00 179.45 178.71 2j6i n VAL 207 N -4.48 0.58 -2.73 2.00 0.24 -1.12 -4.99 118.33 107.83 2j6i n VAL 207 Ca 0.04 -0.79 -0.19 0.00 -2.04 0.00 0.00 64.34 61.36 2j6i n VAL 207 Cb 0.25 0.80 0.02 0.00 -1.47 0.00 0.00 33.84 33.44 2j6i n VAL 207 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2j6i n GLY 208 N 0.55 -0.35 3.81 7.63 0.00 -0.49 -4.75 105.19 111.59 2j6i n GLY 208 Ca 0.09 -0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 2j6i n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j6i s ALA 209 N -3.03 3.42 -0.11 4.61 0.00 0.13 -4.16 121.76 122.62 2j6i s ALA 209 Ca 0.18 0.19 0.04 0.00 0.00 0.00 0.00 51.96 52.36 2j6i s ALA 209 Cb -0.08 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.20 2j6i s ALA 209 CO 0.22 0.32 -0.23 0.50 0.00 0.00 0.00 175.76 176.57 2j6i s ARG 210 N -1.87 3.07 -0.07 0.00 3.52 -0.40 -4.67 118.95 118.53 2j6i s ARG 210 Ca 0.42 -0.86 -0.29 0.00 -0.13 0.00 0.00 55.73 54.87 2j6i s ARG 210 Cb -0.17 -2.34 -0.02 0.00 -1.56 0.00 0.00 34.95 30.86 2j6i s ARG 210 CO 0.21 0.16 0.97 0.50 -0.81 0.00 0.00 175.30 176.33 2j6i s ARG 211 N 0.39 4.47 -0.14 5.12 3.52 -1.26 -1.66 118.95 129.39 2j6i s ARG 211 Ca -0.17 1.35 -0.03 0.00 -0.13 0.00 0.00 55.73 56.74 2j6i s ARG 211 Cb -0.18 -3.51 -0.03 0.00 -1.56 0.00 0.00 34.95 29.68 2j6i s ARG 211 CO 0.08 -0.20 -0.02 0.08 -0.81 0.00 0.00 175.30 174.43 2j6i s VAL 212 N 1.58 4.06 0.27 7.11 1.01 -0.49 -4.95 120.40 128.99 2j6i s VAL 212 Ca 0.48 -0.31 -0.01 0.00 0.00 0.00 0.00 61.98 62.14 2j6i s VAL 212 Cb -0.19 -2.76 0.13 0.00 0.00 0.00 0.00 36.38 33.56 2j6i s VAL 212 CO 0.21 0.52 1.79 -0.08 0.00 0.00 0.00 175.10 177.54 2j6i h GLU 213 N 6.25 0.77 -4.49 2.72 4.22 -1.96 -3.40 114.58 118.68 2j6i h GLU 213 Ca -0.37 -0.19 -0.22 0.00 0.08 0.00 0.00 59.36 58.65 2j6i h GLU 213 Cb 1.19 -0.10 -0.18 0.00 0.50 0.00 0.00 28.75 30.16 2j6i h GLU 213 CO 0.61 0.76 -0.71 0.54 -2.18 0.00 0.00 179.01 178.03 2j6i s ASN 214 N -6.64 0.85 0.25 1.04 2.20 -1.26 -4.94 114.94 106.43 2j6i s ASN 214 Ca -0.09 -0.77 -0.05 0.00 -0.94 0.00 0.00 52.86 51.01 2j6i s ASN 214 Cb 0.15 0.09 0.28 0.00 -2.00 0.00 0.00 41.25 39.76 2j6i s ASN 214 CO 0.80 -0.36 1.82 0.40 -2.94 0.00 0.00 177.10 176.82 2j6i h ILE 215 N 3.79 1.24 -0.69 0.54 2.04 -1.99 -0.67 117.51 121.78 2j6i h ILE 215 Ca -0.35 -0.78 0.03 0.00 1.00 0.00 0.00 64.86 64.77 2j6i h ILE 215 Cb 1.18 0.41 -0.04 0.00 -0.74 0.00 0.00 36.82 37.62 2j6i h ILE 215 CO 0.53 0.31 0.43 -0.33 0.00 0.00 0.00 178.15 179.09 2j6i h GLU 216 N 1.03 0.81 0.00 2.37 3.07 -1.97 0.14 114.58 120.03 2j6i h GLU 216 Ca 0.24 -0.05 -0.11 0.00 -0.50 0.00 0.00 59.36 58.94 2j6i h GLU 216 Cb 0.21 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 27.92 2j6i h GLU 216 CO -0.02 0.53 -0.53 1.49 -1.40 0.00 0.00 179.01 179.09 2j6i h GLU 217 N 0.83 0.00 0.29 2.33 4.81 -1.86 -2.37 114.58 118.60 2j6i h GLU 217 Ca 0.28 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.50 2j6i h GLU 217 Cb 0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.42 2j6i h GLU 217 CO -0.11 0.53 -0.14 1.25 -0.73 0.00 0.00 179.01 179.81 2j6i h LEU 218 N 0.00 -0.32 -1.09 1.64 5.85 -0.37 -3.28 115.31 117.74 2j6i h LEU 218 Ca -0.01 -0.20 -0.07 0.00 0.84 0.00 0.00 57.88 58.44 2j6i h LEU 218 Cb 1.15 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 2j6i h LEU 218 CO 0.07 0.07 -0.35 -0.37 -0.34 0.00 0.00 178.44 177.52 2j6i h VAL 219 N -0.78 0.90 -0.09 1.05 -1.51 -1.03 -3.12 116.25 111.66 2j6i h VAL 219 Ca -0.04 -1.39 -0.01 0.00 -1.23 0.00 0.00 66.70 64.04 2j6i h VAL 219 Cb 0.51 1.83 -0.01 0.00 -2.13 0.00 0.00 31.29 31.50 2j6i h VAL 219 CO 0.06 0.34 0.01 0.00 -1.23 0.00 0.00 177.57 176.76 2j6i h ALA 220 N 1.65 1.85 -0.28 5.19 0.00 -1.48 -2.83 119.26 123.35 2j6i h ALA 220 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2j6i h ALA 220 Cb 0.81 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2j6i h ALA 220 CO 0.05 0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.42 2j6i n GLN 221 N -4.47 2.17 -3.64 0.00 10.64 -1.18 -4.26 117.38 116.64 2j6i n GLN 221 Ca -0.02 -1.87 -0.36 0.00 -1.83 0.00 0.00 57.00 52.92 2j6i n GLN 221 Cb 0.13 -1.31 -0.08 0.00 -0.86 0.00 0.00 30.24 28.12 2j6i n GLN 221 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2j6i s ALA 222 N -1.05 3.64 0.16 2.61 0.00 -1.07 -4.76 121.76 121.29 2j6i s ALA 222 Ca 0.24 -0.59 -0.05 0.00 0.00 0.00 0.00 51.96 51.56 2j6i s ALA 222 Cb 0.14 -2.28 0.00 0.00 0.00 0.00 0.00 23.12 20.98 2j6i s ALA 222 CO 0.19 0.11 1.40 -0.44 0.00 0.00 0.00 175.76 177.02 2j6i h ASP 223 N 6.72 0.62 -3.53 0.00 3.32 -0.78 -3.39 116.42 119.39 2j6i h ASP 223 Ca -0.41 -0.40 -0.48 0.00 0.02 0.00 0.00 57.03 55.76 2j6i h ASP 223 Cb 1.16 -0.18 -0.33 0.00 0.22 0.00 0.00 39.33 40.19 2j6i h ASP 223 CO 0.76 1.16 -0.80 -0.63 -1.72 0.00 0.00 179.24 178.00 2j6i s ILE 224 N -3.68 0.96 -0.05 0.35 1.01 -0.72 -1.34 121.20 117.74 2j6i s ILE 224 Ca -0.07 -0.40 0.05 0.00 0.00 0.00 0.00 60.65 60.23 2j6i s ILE 224 Cb 0.10 -0.89 -0.01 0.00 0.01 0.00 0.00 42.46 41.68 2j6i s ILE 224 CO 0.86 0.31 -0.20 -0.69 0.00 0.00 0.00 174.94 175.22 2j6i s VAL 225 N 0.59 1.63 -0.06 2.92 1.01 -0.34 0.10 120.40 126.25 2j6i s VAL 225 Ca -0.11 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.07 2j6i s VAL 225 Cb -0.14 -1.40 0.00 0.00 0.00 0.00 0.00 36.38 34.84 2j6i s VAL 225 CO 0.02 0.46 -0.17 0.28 0.00 0.00 0.00 175.10 175.69 2j6i s THR 226 N -0.01 1.49 -0.31 3.92 -1.32 0.44 -0.15 115.64 119.70 2j6i s THR 226 Ca -0.04 -0.72 -0.19 0.00 -1.21 0.00 0.00 61.69 59.53 2j6i s THR 226 Cb -0.12 -1.30 -0.01 0.00 -1.51 0.00 0.00 72.50 69.55 2j6i s THR 226 CO 0.03 0.43 0.55 -0.69 -2.21 0.00 0.00 174.62 172.73 2j6i s VAL 227 N 0.26 5.00 -0.41 5.08 1.01 -0.03 -0.43 120.40 130.87 2j6i s VAL 227 Ca -0.10 0.64 0.11 0.00 0.00 0.00 0.00 61.98 62.63 2j6i s VAL 227 Cb -0.14 -3.94 0.35 0.00 0.00 0.00 0.00 36.38 32.65 2j6i s VAL 227 CO 0.04 -0.12 0.78 0.59 0.00 0.00 0.00 175.10 176.38 2j6i n ASN 228 N 5.75 1.57 -4.08 3.32 3.02 0.42 -3.87 115.26 121.38 2j6i n ASN 228 Ca -0.03 -3.14 -0.11 0.00 -0.03 0.00 0.00 54.58 51.27 2j6i n ASN 228 Cb 0.49 -0.61 -0.11 0.00 -0.61 0.00 0.00 39.78 38.95 2j6i n ASN 228 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2j6i s ALA 229 N -2.65 0.61 0.78 5.41 0.00 -1.18 -4.27 121.76 120.46 2j6i s ALA 229 Ca 0.42 -0.97 -0.11 0.00 0.00 0.00 0.00 51.96 51.30 2j6i s ALA 229 Cb 0.34 0.12 0.06 0.00 0.00 0.00 0.00 23.12 23.64 2j6i s ALA 229 CO -0.09 -0.15 1.10 -1.25 0.00 0.00 0.00 175.76 175.37 2j6i s PRO 230 N -2.52 2.17 -0.23 0.00 0.04 -1.26 -4.51 135.00 128.69 2j6i s PRO 230 Ca -0.02 1.25 -0.27 0.00 0.04 0.00 0.00 61.00 61.99 2j6i s PRO 230 Cb -0.03 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2j6i s PRO 230 CO -0.03 -1.72 0.95 -1.17 0.04 0.00 0.00 177.00 175.08 2j6i s LEU 231 N -5.87 4.10 0.00 -3.56 2.96 -1.26 -4.73 118.68 110.32 2j6i s LEU 231 Ca 0.63 1.25 -0.03 0.00 -0.22 0.00 0.00 54.13 55.75 2j6i s LEU 231 Cb -0.18 -3.40 0.01 0.00 0.50 0.00 0.00 46.19 43.12 2j6i s LEU 231 CO 0.54 -0.60 0.24 0.00 -1.32 0.00 0.00 176.35 175.21 2j6i n HIS 232 N 6.14 -1.22 0.25 5.38 1.44 -1.26 -4.97 115.22 120.98 2j6i n HIS 232 Ca 0.09 -0.73 0.12 0.00 -2.01 0.00 0.00 57.72 55.19 2j6i n HIS 232 Cb 0.47 0.28 0.75 0.00 0.12 0.00 0.00 29.99 31.60 2j6i n HIS 232 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2j6i h ALA 233 N 1.86 1.86 0.00 1.59 0.00 -1.94 0.19 119.26 122.82 2j6i h ALA 233 Ca -0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2j6i h ALA 233 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2j6i h ALA 233 CO 0.14 -0.06 0.00 0.78 0.00 0.00 0.00 179.25 180.11 2j6i h GLY 234 N 0.00 0.00 0.00 0.00 0.00 -1.96 -3.38 103.07 97.74 2j6i h GLY 234 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2j6i h GLY 234 CO -0.00 0.00 -0.63 -1.30 0.00 0.00 0.00 176.54 174.61 2j6i n THR 235 N -2.65 0.00 -1.70 4.70 -2.24 -0.27 -4.84 114.28 107.28 2j6i n THR 235 Ca 0.04 -0.12 -0.43 0.00 -2.27 0.00 0.00 64.05 61.27 2j6i n THR 235 Cb 0.44 0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 69.23 2j6i n THR 235 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2j6i n LYS 236 N -1.19 2.69 -1.45 -0.78 4.81 0.50 -1.65 118.16 121.10 2j6i n LYS 236 Ca 0.00 0.98 -0.15 0.00 -0.87 0.00 0.00 58.31 58.26 2j6i n LYS 236 Cb 0.00 -2.84 -0.07 0.00 0.02 0.00 0.00 35.03 32.15 2j6i n LYS 236 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2j6i n GLY 237 N 4.04 1.47 0.15 3.14 0.00 -0.39 -4.89 105.19 108.71 2j6i n GLY 237 Ca 0.17 -0.01 -0.06 0.00 0.00 0.00 0.00 46.02 46.12 2j6i n GLY 237 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2j6i h LEU 238 N 0.00 -0.32 -7.89 0.99 5.85 0.08 -3.28 115.31 110.73 2j6i h LEU 238 Ca -0.32 0.10 -0.68 0.00 0.84 0.00 0.00 57.88 57.82 2j6i h LEU 238 Cb 1.26 0.21 -0.14 0.00 0.37 0.00 0.00 40.66 42.37 2j6i h LEU 238 CO 0.46 -0.12 1.49 -0.63 -0.34 0.00 0.00 178.44 179.31 2j6i s ILE 239 N -6.21 4.50 0.51 4.05 -1.09 -0.21 -4.69 121.20 118.06 2j6i s ILE 239 Ca -0.14 -1.83 0.04 0.00 -2.23 0.00 0.00 60.65 56.49 2j6i s ILE 239 Cb 0.13 -4.99 0.00 0.00 -1.58 0.00 0.00 42.46 36.02 2j6i s ILE 239 CO 0.70 -1.77 0.20 0.54 -1.23 0.00 0.00 174.94 173.38 2j6i s ASN 240 N 3.81 4.38 0.26 3.58 2.20 -1.24 -1.00 114.94 126.93 2j6i s ASN 240 Ca 0.44 -1.39 -0.02 0.00 -0.94 0.00 0.00 52.86 50.95 2j6i s ASN 240 Cb -0.01 0.30 0.54 0.00 -2.00 0.00 0.00 41.25 40.07 2j6i s ASN 240 CO -0.02 -0.90 1.70 0.50 -2.94 0.00 0.00 177.10 175.44 2j6i h LYS 241 N 1.12 0.35 0.46 3.55 3.64 -1.91 0.78 116.57 124.56 2j6i h LYS 241 Ca -0.41 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 58.93 2j6i h LYS 241 Cb 1.30 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 2j6i h LYS 241 CO 0.67 0.23 -0.22 1.49 -2.27 0.00 0.00 179.45 179.35 2j6i h GLU 242 N 0.36 -0.60 -0.56 1.90 4.57 -1.96 -2.51 114.58 115.79 2j6i h GLU 242 Ca 0.46 0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.63 2j6i h GLU 242 Cb 0.78 0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 29.48 2j6i h GLU 242 CO -0.49 -0.32 0.16 1.25 -1.18 0.00 0.00 179.01 178.43 2j6i h LEU 243 N -0.80 0.78 -1.53 1.64 5.85 -1.74 -2.52 115.31 116.99 2j6i h LEU 243 Ca -0.06 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.53 2j6i h LEU 243 Cb 0.55 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 2j6i h LEU 243 CO 0.10 0.75 0.28 -0.07 -0.34 0.00 0.00 178.44 179.16 2j6i h LEU 244 N 0.81 0.52 -2.27 2.25 3.38 -0.83 -0.02 115.31 119.16 2j6i h LEU 244 Ca 0.18 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2j6i h LEU 244 Cb 0.26 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2j6i h LEU 244 CO -0.01 0.39 0.00 0.77 0.09 0.00 0.00 178.44 179.69 2j6i h SER 245 N 0.61 0.00 0.86 -0.43 4.64 -0.98 -1.85 113.55 116.40 2j6i h SER 245 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2j6i h SER 245 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 2j6i h SER 245 CO -0.03 0.00 -0.55 0.29 -0.87 0.00 0.00 176.83 175.66 2j6i n LYS 246 N -3.01 0.24 -1.26 4.77 4.01 -0.03 -4.93 118.16 117.96 2j6i n LYS 246 Ca -0.01 0.08 -0.34 0.00 -0.51 0.00 0.00 58.31 57.52 2j6i n LYS 246 Cb 0.16 -1.66 0.11 0.00 -0.51 0.00 0.00 35.03 33.13 2j6i n LYS 246 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2j6i s PHE 247 N -3.14 1.86 0.37 2.13 0.40 -0.70 -3.66 117.98 115.25 2j6i s PHE 247 Ca 0.07 1.63 -0.27 0.00 -0.60 0.00 0.00 56.93 57.76 2j6i s PHE 247 Cb 0.14 -3.54 -0.11 0.00 0.51 0.00 0.00 43.02 40.02 2j6i s PHE 247 CO 0.70 -2.88 1.29 1.63 0.70 0.00 0.00 175.22 176.67 2j6i n LYS 248 N -2.98 2.09 -2.08 0.44 5.02 -1.21 -4.91 118.16 114.53 2j6i n LYS 248 Ca 0.14 0.74 -0.42 0.00 -2.02 0.00 0.00 58.31 56.74 2j6i n LYS 248 Cb 0.50 -2.37 -0.03 0.00 -0.02 0.00 0.00 35.03 33.12 2j6i n LYS 248 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2j6i s LYS 249 N -2.01 4.24 -0.54 1.97 3.01 -1.26 -2.08 119.74 123.07 2j6i s LYS 249 Ca 0.57 2.15 0.00 0.00 -1.01 0.00 0.00 55.97 57.68 2j6i s LYS 249 Cb -0.54 -3.55 0.00 0.00 -1.01 0.00 0.00 37.83 32.73 2j6i s LYS 249 CO 0.61 -0.64 0.00 0.41 0.51 0.00 0.00 175.35 176.24 2j6i n GLY 250 N 3.79 0.24 3.77 -3.33 0.00 -0.40 -4.97 105.19 104.30 2j6i n GLY 250 Ca 0.14 -0.66 -0.31 0.00 0.00 0.00 0.00 46.02 45.20 2j6i n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j6i s ALA 251 N -2.29 2.19 -0.07 4.61 0.00 -0.88 -3.93 121.76 121.38 2j6i s ALA 251 Ca 0.00 0.13 0.02 0.00 0.00 0.00 0.00 51.96 52.11 2j6i s ALA 251 Cb 0.00 -3.23 -0.03 0.00 0.00 0.00 0.00 23.12 19.87 2j6i s ALA 251 CO 0.00 -1.79 -0.10 -1.58 0.00 0.00 0.00 175.76 172.29 2j6i s TRP 252 N -2.95 2.85 -0.10 0.00 0.51 -0.45 -0.66 118.94 118.13 2j6i s TRP 252 Ca 0.61 -0.11 0.02 0.00 -2.12 0.00 0.00 56.10 54.50 2j6i s TRP 252 Cb -0.17 -1.70 0.01 0.00 -0.81 0.00 0.00 33.47 30.80 2j6i s TRP 252 CO 0.56 0.22 -0.16 -1.17 -0.51 0.00 0.00 176.95 175.89 2j6i s LEU 253 N -0.63 1.76 -0.04 2.99 2.96 -0.52 -1.20 118.68 124.01 2j6i s LEU 253 Ca 0.09 -0.42 0.07 0.00 -0.22 0.00 0.00 54.13 53.65 2j6i s LEU 253 Cb -0.11 -1.08 -0.02 0.00 0.50 0.00 0.00 46.19 45.48 2j6i s LEU 253 CO 0.01 0.04 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.15 2j6i s VAL 254 N 0.82 2.17 -0.22 1.68 1.01 0.78 -1.77 120.40 124.87 2j6i s VAL 254 Ca -0.10 -1.05 -0.04 0.00 0.00 0.00 0.00 61.98 60.79 2j6i s VAL 254 Cb -0.16 -1.77 0.08 0.00 0.00 0.00 0.00 36.38 34.54 2j6i s VAL 254 CO 0.01 0.58 0.14 0.21 0.00 0.00 0.00 175.10 176.04 2j6i s ASN 255 N -0.48 2.52 -0.18 3.32 2.47 -0.51 -0.85 114.94 121.23 2j6i s ASN 255 Ca 0.06 -0.78 0.15 0.00 0.42 0.00 0.00 52.86 52.71 2j6i s ASN 255 Cb -0.11 -0.12 0.39 0.00 -1.45 0.00 0.00 41.25 39.96 2j6i s ASN 255 CO 0.01 -0.38 1.25 0.35 -3.72 0.00 0.00 177.10 174.61 2j6i n THR 256 N 5.28 2.13 0.00 -5.21 -2.24 -1.25 -3.27 114.28 109.71 2j6i n THR 256 Ca -0.06 -2.54 0.00 0.00 -2.27 0.00 0.00 64.05 59.18 2j6i n THR 256 Cb 0.47 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 2j6i n THR 256 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j6i n ALA 257 N -1.17 0.00 -3.07 6.98 0.00 -1.25 -4.89 120.51 117.11 2j6i n ALA 257 Ca 0.20 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.51 2j6i n ALA 257 Cb 0.74 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 20.06 2j6i n ALA 257 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2j6i s ARG 258 N 0.00 0.07 0.21 0.00 1.81 -1.26 -4.95 118.95 114.83 2j6i s ARG 258 Ca 0.00 0.12 -0.09 0.00 -1.72 0.00 0.00 55.73 54.04 2j6i s ARG 258 Cb 0.00 -0.00 0.25 0.00 -0.45 0.00 0.00 34.95 34.75 2j6i s ARG 258 CO 0.00 -0.03 1.80 0.78 -0.68 0.00 0.00 175.30 177.17 2j6i h GLY 259 N 6.24 0.98 2.00 -3.53 0.00 -1.78 -2.61 103.07 104.37 2j6i h GLY 259 Ca -0.28 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.81 2j6i h GLY 259 CO 0.47 0.14 0.00 0.00 0.00 0.00 0.00 176.54 177.14 2j6i h ALA 260 N 1.36 1.00 0.00 3.60 0.00 -1.93 -1.92 119.26 121.38 2j6i h ALA 260 Ca 0.30 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 2j6i h ALA 260 Cb 0.21 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2j6i h ALA 260 CO -0.20 0.00 -0.10 0.82 0.00 0.00 0.00 179.25 179.77 2j6i h ILE 261 N 0.00 1.06 -3.19 0.00 2.04 -1.65 -1.03 117.51 114.75 2j6i h ILE 261 Ca 0.00 -0.36 -0.56 0.00 1.00 0.00 0.00 64.86 64.95 2j6i h ILE 261 Cb 0.19 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 2j6i h ILE 261 CO 0.00 0.10 -0.25 0.00 0.00 0.00 0.00 178.15 178.00 2j6i s VAL 263 N -1.77 4.96 0.08 0.00 1.01 -0.17 -4.61 120.40 119.89 2j6i s VAL 263 Ca 0.42 0.72 -0.21 0.00 0.00 0.00 0.00 61.98 62.92 2j6i s VAL 263 Cb -0.12 -3.99 -0.11 0.00 0.00 0.00 0.00 36.38 32.17 2j6i s VAL 263 CO 0.25 -0.16 1.58 0.00 0.00 0.00 0.00 175.10 176.78 2j6i h ALA 264 N 8.26 0.21 0.00 5.51 0.00 -1.89 -2.05 119.26 129.30 2j6i h ALA 264 Ca -0.27 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 2j6i h ALA 264 Cb 1.12 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2j6i h ALA 264 CO 0.79 -0.17 -0.24 0.93 0.00 0.00 0.00 179.25 180.56 2j6i h GLU 265 N 0.07 0.00 -0.43 0.00 4.39 -1.97 -1.90 114.58 114.74 2j6i h GLU 265 Ca 0.05 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.69 2j6i h GLU 265 Cb 0.23 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 2j6i h GLU 265 CO -0.00 0.24 0.04 -0.44 -1.16 0.00 0.00 179.01 177.68 2j6i h ASP 266 N 0.00 0.72 -0.28 1.42 3.32 -1.75 -0.78 116.42 119.07 2j6i h ASP 266 Ca -0.00 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 56.76 2j6i h ASP 266 Cb 0.46 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 2j6i h ASP 266 CO 0.03 0.83 0.15 0.58 -1.72 0.00 0.00 179.24 179.11 2j6i h VAL 267 N 0.59 1.12 -0.41 -1.35 2.07 -1.03 -1.58 116.25 115.66 2j6i h VAL 267 Ca 0.13 -0.33 0.02 0.00 0.82 0.00 0.00 66.70 67.34 2j6i h VAL 267 Cb 0.44 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 2j6i h VAL 267 CO 0.02 0.12 0.23 0.00 0.02 0.00 0.00 177.57 177.96 2j6i h ALA 268 N 1.03 0.52 -0.31 1.67 0.00 -1.20 -0.41 119.26 120.56 2j6i h ALA 268 Ca 0.10 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.05 2j6i h ALA 268 Cb 0.06 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2j6i h ALA 268 CO -0.02 -0.10 0.05 0.00 0.00 0.00 0.00 179.25 179.19 2j6i h ALA 269 N 1.19 0.32 -0.49 0.00 0.00 -1.06 -1.53 119.26 117.70 2j6i h ALA 269 Ca 0.16 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 2j6i h ALA 269 Cb 0.02 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2j6i h ALA 269 CO -0.08 -0.35 0.05 0.00 0.00 0.00 0.00 179.25 178.87 2j6i h ALA 270 N 1.24 1.18 -0.15 0.00 0.00 -0.74 0.06 119.26 120.84 2j6i h ALA 270 Ca 0.15 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2j6i h ALA 270 Cb 0.16 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 2j6i h ALA 270 CO -0.20 0.54 -0.03 1.25 0.00 0.00 0.00 179.25 180.81 2j6i h LEU 271 N 0.73 0.29 -1.59 0.00 5.85 -0.92 0.53 115.31 120.21 2j6i h LEU 271 Ca 0.15 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 58.47 2j6i h LEU 271 Cb 0.37 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2j6i h LEU 271 CO 0.01 0.58 -0.19 -0.33 -0.34 0.00 0.00 178.44 178.17 2j6i h GLU 272 N -0.00 0.00 0.00 1.25 4.39 -0.92 -2.90 114.58 116.40 2j6i h GLU 272 Ca 0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.74 2j6i h GLU 272 Cb 0.45 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2j6i h GLU 272 CO 0.01 0.19 -0.78 0.66 -1.16 0.00 0.00 179.01 177.93 2j6i h SER 273 N 0.00 0.00 0.00 1.42 4.64 -0.93 -3.41 113.55 115.28 2j6i h SER 273 Ca -0.00 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 2j6i h SER 273 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2j6i h SER 273 CO 0.02 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.64 2j6i n GLY 274 N 1.24 0.68 0.29 -0.77 0.00 -1.02 -4.94 105.19 100.67 2j6i n GLY 274 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 2j6i n GLY 274 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2j6i h GLN 275 N 4.22 0.98 -5.71 1.61 5.75 -1.43 -2.23 115.11 118.30 2j6i h GLN 275 Ca 0.00 -0.07 -0.66 0.00 -0.15 0.00 0.00 58.65 57.77 2j6i h GLN 275 Cb 0.00 -0.21 -0.14 0.00 1.07 0.00 0.00 27.48 28.19 2j6i h GLN 275 CO 0.00 0.67 -0.59 -0.51 -2.65 0.00 0.00 178.83 175.75 2j6i s LEU 276 N -10.09 3.75 0.11 -2.39 1.43 0.03 -1.27 118.68 110.25 2j6i s LEU 276 Ca -0.13 0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.16 2j6i s LEU 276 Cb 0.15 -1.89 -0.22 0.00 0.03 0.00 0.00 46.19 44.26 2j6i s LEU 276 CO 0.78 0.32 1.24 -0.09 0.23 0.00 0.00 176.35 178.83 2j6i h ARG 277 N 5.57 0.12 -2.22 1.70 2.43 -1.01 -3.39 114.38 117.59 2j6i h ARG 277 Ca -0.47 -0.20 -0.05 0.00 -0.81 0.00 0.00 59.98 58.46 2j6i h ARG 277 Cb 1.19 0.07 -0.17 0.00 -0.42 0.00 0.00 29.97 30.64 2j6i h ARG 277 CO 0.59 1.08 0.20 0.20 -1.51 0.00 0.00 179.97 180.54 2j6i s GLY 278 N -4.67 -0.58 0.00 2.80 0.00 -1.23 -4.28 107.32 99.36 2j6i s GLY 278 Ca -0.01 1.15 0.01 0.00 0.00 0.00 0.00 44.72 45.87 2j6i s GLY 278 CO 0.85 0.78 -0.04 -0.47 0.00 0.00 0.00 173.10 174.21 2j6i s TYR 279 N -1.78 0.36 0.28 1.90 5.04 0.73 -1.44 117.35 122.43 2j6i s TYR 279 Ca -0.08 -0.12 -0.18 0.00 -2.44 0.00 0.00 57.07 54.25 2j6i s TYR 279 Cb -0.00 -0.23 0.01 0.00 0.35 0.00 0.00 41.96 42.09 2j6i s TYR 279 CO 0.04 -0.02 0.64 0.20 -1.34 0.00 0.00 175.55 175.08 2j6i s GLY 280 N -0.27 0.15 0.00 8.97 0.00 -0.73 -1.07 107.32 114.38 2j6i s GLY 280 Ca -0.00 -0.53 0.00 0.00 0.00 0.00 0.00 44.72 44.19 2j6i s GLY 280 CO -0.00 -0.28 0.00 0.61 0.00 0.00 0.00 173.10 173.43 2j6i n GLY 281 N -0.44 0.67 0.01 0.20 0.00 -1.15 -1.42 105.19 103.07 2j6i n GLY 281 Ca -0.03 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.13 2j6i n GLY 281 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2j6i n ASP 282 N 3.00 1.45 -4.53 1.61 5.75 -1.20 -1.42 116.55 121.20 2j6i n ASP 282 Ca 0.00 -1.78 -0.32 0.00 -0.01 0.00 0.00 54.79 52.68 2j6i n ASP 282 Cb 0.00 -0.02 -0.12 0.00 -1.03 0.00 0.00 41.12 39.95 2j6i n ASP 282 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 2j6i s VAL 283 N -0.79 3.27 0.06 2.12 -7.23 -1.25 -2.58 120.40 114.00 2j6i s VAL 283 Ca 0.01 -0.86 0.01 0.00 -1.81 0.00 0.00 61.98 59.33 2j6i s VAL 283 Cb 0.01 -2.37 -0.03 0.00 0.56 0.00 0.00 36.38 34.55 2j6i s VAL 283 CO 0.00 0.44 -0.05 0.26 -0.31 0.00 0.00 175.10 175.44 2j6i s TRP 284 N -0.90 0.64 -0.05 2.82 0.52 -1.26 -4.43 118.94 116.27 2j6i s TRP 284 Ca 0.15 -0.79 -0.01 0.00 0.02 0.00 0.00 56.10 55.46 2j6i s TRP 284 Cb -0.11 -0.40 0.03 0.00 -1.15 0.00 0.00 33.47 31.84 2j6i s TRP 284 CO 0.05 -0.20 0.03 0.12 0.02 0.00 0.00 176.95 176.97 2j6i s PHE 285 N -2.80 0.34 0.97 -1.98 5.36 -1.26 -3.92 117.98 114.69 2j6i s PHE 285 Ca 0.01 0.05 -0.11 0.00 -0.96 0.00 0.00 56.93 55.91 2j6i s PHE 285 Cb -0.00 -0.60 0.17 0.00 -0.34 0.00 0.00 43.02 42.25 2j6i s PHE 285 CO -0.04 -0.24 1.09 -1.25 -1.46 0.00 0.00 175.22 173.32 2j6i s PRO 286 N 1.92 0.63 -0.05 10.12 0.04 -1.26 -4.95 135.00 141.44 2j6i s PRO 286 Ca 0.03 1.08 -0.01 0.00 0.04 0.00 0.00 61.00 62.14 2j6i s PRO 286 Cb -0.12 -1.72 0.03 0.00 0.04 0.00 0.00 34.50 32.73 2j6i s PRO 286 CO -0.04 -2.75 0.00 -1.14 0.04 0.00 0.00 177.00 173.12 2j6i s GLN 287 N -4.71 0.46 0.43 4.56 0.74 -1.25 -3.07 119.66 116.81 2j6i s GLN 287 Ca 0.66 0.11 -0.25 0.00 0.05 0.00 0.00 55.36 55.92 2j6i s GLN 287 Cb -0.21 -0.75 -0.09 0.00 1.10 0.00 0.00 33.01 33.05 2j6i s GLN 287 CO 0.59 -0.23 1.31 -0.35 -0.55 0.00 0.00 175.29 176.07 2j6i n PRO 288 N 4.72 2.02 -1.93 1.67 -0.04 -1.26 -5.09 135.00 135.09 2j6i n PRO 288 Ca -0.15 0.72 -0.42 0.00 -0.04 0.00 0.00 63.50 63.61 2j6i n PRO 288 Cb 0.50 -2.45 -0.03 0.00 -0.04 0.00 0.00 33.50 31.49 2j6i n PRO 288 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2j6i s ALA 289 N -1.19 3.75 0.89 0.55 0.00 -1.17 -4.98 121.76 119.59 2j6i s ALA 289 Ca 0.61 1.32 -0.11 0.00 0.00 0.00 0.00 51.96 53.78 2j6i s ALA 289 Cb -0.49 -3.65 0.13 0.00 0.00 0.00 0.00 23.12 19.11 2j6i s ALA 289 CO 0.58 -0.89 1.17 -2.14 0.00 0.00 0.00 175.76 174.47 2j6i s PRO 290 N 1.66 1.16 0.65 0.00 0.02 -1.26 -4.87 135.00 132.37 2j6i s PRO 290 Ca 0.72 1.62 0.42 0.00 0.02 0.00 0.00 61.00 63.78 2j6i s PRO 290 Cb -0.43 -1.74 2.31 0.00 0.02 0.00 0.00 34.50 34.67 2j6i s PRO 290 CO 0.32 -2.54 2.34 1.57 -0.33 0.00 0.00 177.00 178.36 2j6i h LYS 291 N -1.62 0.00 -0.01 5.54 2.10 -2.02 -1.52 116.57 119.04 2j6i h LYS 291 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 2j6i h LYS 291 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 2j6i h LYS 291 CO 0.43 0.00 -0.48 -0.40 -2.00 0.00 0.00 179.45 176.99 2j6i n ASP 292 N -3.18 1.76 -4.58 7.07 5.75 -1.26 -5.00 116.55 117.12 2j6i n ASP 292 Ca -0.03 -1.35 -0.53 0.00 -0.01 0.00 0.00 54.79 52.87 2j6i n ASP 292 Cb 0.09 0.46 -0.06 0.00 -1.03 0.00 0.00 41.12 40.57 2j6i n ASP 292 CO 0.00 0.00 0.00 1.57 -0.11 0.00 0.00 177.20 178.66 2j6i n HIS 293 N -0.26 1.37 0.28 2.11 -0.00 -0.58 -4.82 115.22 113.32 2j6i n HIS 293 Ca 0.09 0.70 0.13 0.00 0.46 0.00 0.00 57.72 59.11 2j6i n HIS 293 Cb 0.44 -2.29 0.84 0.00 -0.12 0.00 0.00 29.99 28.85 2j6i n HIS 293 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2j6i h PRO 294 N 4.28 0.00 0.00 1.57 0.13 -1.94 -2.13 132.00 133.91 2j6i h PRO 294 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2j6i h PRO 294 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2j6i h PRO 294 CO 0.76 0.03 0.00 -1.49 -0.23 0.00 0.00 178.00 177.06 2j6i h TRP 295 N 0.00 0.00 0.22 1.56 4.06 -1.89 -2.31 115.95 117.59 2j6i h TRP 295 Ca -0.00 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 2j6i h TRP 295 Cb 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.23 2j6i h TRP 295 CO 0.00 0.00 -0.11 0.00 -3.56 0.00 0.00 178.44 174.77 2j6i h ARG 296 N 0.00 -0.29 0.00 0.49 3.08 -1.73 -3.36 114.38 112.57 2j6i h ARG 296 Ca 0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2j6i h ARG 296 Cb 0.33 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.44 2j6i h ARG 296 CO 0.00 0.08 -0.87 -0.25 -1.07 0.00 0.00 179.97 177.85 2j6i n ASP 297 N -5.04 0.63 -4.73 7.04 8.00 -1.19 -4.95 116.55 116.31 2j6i n ASP 297 Ca -0.09 -0.23 -0.42 0.00 0.71 0.00 0.00 54.79 54.76 2j6i n ASP 297 Cb 0.26 0.62 -0.01 0.00 -0.02 0.00 0.00 41.12 41.96 2j6i n ASP 297 CO 0.00 0.00 0.00 1.15 -0.39 0.00 0.00 177.20 177.96 2j6i n MET 298 N -1.87 2.53 -4.12 -1.24 0.00 -0.88 -5.01 117.12 106.54 2j6i n MET 298 Ca 0.03 0.90 -0.09 0.00 0.00 0.00 0.00 57.70 58.54 2j6i n MET 298 Cb 0.41 -2.63 -0.10 0.00 0.00 0.00 0.00 33.22 30.90 2j6i n MET 298 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 2j6i s ARG 299 N -0.88 0.82 0.72 3.17 1.81 -1.26 -4.68 118.95 118.64 2j6i s ARG 299 Ca 0.62 -1.35 -0.12 0.00 -1.72 0.00 0.00 55.73 53.16 2j6i s ARG 299 Cb -0.53 0.23 0.16 0.00 -0.45 0.00 0.00 34.95 34.37 2j6i s ARG 299 CO 0.52 -0.21 0.97 0.27 -0.68 0.00 0.00 175.30 176.18 2j6i n ASN 300 N -0.02 0.11 0.27 0.23 0.23 0.12 -3.60 115.26 112.58 2j6i n ASN 300 Ca -0.09 -1.37 0.18 0.00 -0.53 0.00 0.00 54.58 52.77 2j6i n ASN 300 Cb 0.63 -0.74 0.90 0.00 -2.08 0.00 0.00 39.78 38.49 2j6i n ASN 300 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 2j6i h LYS 301 N 0.00 0.00 -0.12 -3.83 2.10 -1.79 -0.66 116.57 112.27 2j6i h LYS 301 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 2j6i h LYS 301 Cb 0.88 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.21 2j6i h LYS 301 CO 0.23 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.34 2j6i n TYR 302 N -2.81 0.13 -0.74 0.07 0.53 -1.26 -4.93 117.16 108.14 2j6i n TYR 302 Ca -0.01 -0.06 0.00 0.00 -1.02 0.00 0.00 57.90 56.80 2j6i n TYR 302 Cb 0.12 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.43 2j6i n TYR 302 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2j6i n GLY 303 N 1.30 0.55 0.00 2.72 0.00 -0.25 -5.02 105.19 104.49 2j6i n GLY 303 Ca 0.17 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2j6i n GLY 303 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j6i n ALA 304 N 0.23 0.00 -1.22 4.61 0.00 -1.26 -4.82 120.51 118.06 2j6i n ALA 304 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 2j6i n ALA 304 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2j6i n ALA 304 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j6i n GLY 305 N 1.47 0.94 3.04 0.00 0.00 -1.26 0.11 105.19 109.49 2j6i n GLY 305 Ca 0.00 -0.59 -0.32 0.00 0.00 0.00 0.00 46.02 45.12 2j6i n GLY 305 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2j6i s ASN 306 N -2.81 4.20 -0.35 1.61 3.84 -1.26 -0.20 114.94 119.98 2j6i s ASN 306 Ca 0.00 -1.29 0.06 0.00 0.21 0.00 0.00 52.86 51.84 2j6i s ASN 306 Cb 0.00 -1.44 0.44 0.00 -0.55 0.00 0.00 41.25 39.70 2j6i s ASN 306 CO 0.00 -0.19 1.17 0.00 -2.79 0.00 0.00 177.10 175.29 2j6i n ALA 307 N 4.51 5.06 -1.78 1.71 0.00 -0.23 -4.95 120.51 124.82 2j6i n ALA 307 Ca -0.14 -3.98 -0.36 0.00 0.00 0.00 0.00 53.44 48.95 2j6i n ALA 307 Cb 0.43 -0.42 -0.05 0.00 0.00 0.00 0.00 19.45 19.41 2j6i n ALA 307 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2j6i s MET 308 N -3.58 4.26 0.18 0.00 -1.94 -1.26 -2.94 119.30 114.01 2j6i s MET 308 Ca 0.50 1.46 0.03 0.00 -1.71 0.00 0.00 55.69 55.96 2j6i s MET 308 Cb 0.41 -2.58 -0.05 0.00 2.01 0.00 0.00 34.83 34.62 2j6i s MET 308 CO -0.05 -0.04 -0.02 0.95 -0.01 0.00 0.00 175.02 175.85 2j6i s THR 309 N -1.67 0.84 1.07 2.05 -4.23 -0.51 -4.92 115.64 108.28 2j6i s THR 309 Ca 0.56 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.94 2j6i s THR 309 Cb -0.21 -2.10 0.23 0.00 1.34 0.00 0.00 72.50 71.76 2j6i s THR 309 CO 0.26 -0.51 1.06 -2.84 -0.54 0.00 0.00 174.62 172.06 2j6i s PRO 310 N -3.87 -0.19 -0.75 3.99 0.02 -1.26 -4.30 135.00 128.64 2j6i s PRO 310 Ca 0.23 0.69 -0.26 0.00 0.02 0.00 0.00 61.00 61.67 2j6i s PRO 310 Cb 0.05 -1.65 0.02 0.00 0.02 0.00 0.00 34.50 32.94 2j6i s PRO 310 CO 0.04 -3.19 1.41 -1.58 -0.33 0.00 0.00 177.00 173.35 2j6i s HIS 311 N -2.73 2.18 0.00 6.54 5.65 -1.06 -4.60 115.29 121.27 2j6i s HIS 311 Ca 0.67 0.04 0.00 0.00 0.25 0.00 0.00 55.06 56.02 2j6i s HIS 311 Cb -0.22 -4.53 0.00 0.00 -1.18 0.00 0.00 32.58 26.66 2j6i s HIS 311 CO 0.61 -2.10 0.00 2.48 -0.65 0.00 0.00 174.74 175.08 2j6i n TYR 312 N 10.04 0.00 -0.36 3.88 0.18 -1.26 -4.95 117.16 124.68 2j6i n TYR 312 Ca 0.10 0.00 0.01 0.00 1.88 0.00 0.00 57.90 59.89 2j6i n TYR 312 Cb 0.50 0.01 0.15 0.00 -0.38 0.00 0.00 39.34 39.62 2j6i n TYR 312 CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 2j6i h SER 313 N 0.00 1.04 -0.35 9.48 4.64 -1.92 -0.84 113.55 125.60 2j6i h SER 313 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2j6i h SER 313 Cb 0.37 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 2j6i h SER 313 CO 0.00 0.69 0.00 0.61 -0.87 0.00 0.00 176.83 177.26 2j6i n GLY 314 N -1.36 1.74 0.88 -0.77 0.00 -1.26 -3.95 105.19 100.46 2j6i n GLY 314 Ca 0.14 -0.48 0.05 0.00 0.00 0.00 0.00 46.02 45.74 2j6i n GLY 314 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2j6i n THR 315 N 0.49 1.31 -0.69 2.61 5.66 -0.32 -4.70 114.28 118.63 2j6i n THR 315 Ca 0.15 -2.25 -0.32 0.00 -3.05 0.00 0.00 64.05 58.58 2j6i n THR 315 Cb 0.60 0.23 0.16 0.00 -1.55 0.00 0.00 70.33 69.77 2j6i n THR 315 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2j6i n THR 316 N -0.52 0.00 0.16 1.09 -2.24 -1.23 -4.65 114.28 106.89 2j6i n THR 316 Ca 0.13 -0.20 0.04 0.00 -2.27 0.00 0.00 64.05 61.75 2j6i n THR 316 Cb 0.85 -0.77 0.47 0.00 -2.10 0.00 0.00 70.33 68.78 2j6i n THR 316 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2j6i h LEU 317 N -1.92 0.15 -0.39 3.22 3.38 -1.96 0.74 115.31 118.52 2j6i h LEU 317 Ca -0.48 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.34 2j6i h LEU 317 Cb 1.30 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 2j6i h LEU 317 CO 0.39 0.26 -0.24 0.44 0.09 0.00 0.00 178.44 179.38 2j6i h ASP 318 N 0.16 0.89 -0.43 -0.43 3.32 -1.93 -1.72 116.42 116.28 2j6i h ASP 318 Ca 0.04 -0.42 -0.07 0.00 0.02 0.00 0.00 57.03 56.59 2j6i h ASP 318 Cb 0.25 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 2j6i h ASP 318 CO 0.01 1.12 -0.01 0.00 -1.72 0.00 0.00 179.24 178.65 2j6i h ALA 319 N 0.80 0.58 -0.67 3.45 0.00 -1.62 -2.78 119.26 119.01 2j6i h ALA 319 Ca 0.08 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.73 2j6i h ALA 319 Cb 0.81 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 2j6i h ALA 319 CO 0.07 0.37 0.44 1.96 0.00 0.00 0.00 179.25 182.10 2j6i h GLN 320 N 0.60 0.87 -0.24 0.00 4.20 -0.71 0.55 115.11 120.38 2j6i h GLN 320 Ca 0.12 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.78 2j6i h GLN 320 Cb 0.50 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 2j6i h GLN 320 CO 0.02 0.58 0.15 1.15 -0.67 0.00 0.00 178.83 180.06 2j6i h THR 321 N 0.90 1.08 -0.75 -0.54 2.02 -1.17 -0.47 112.91 113.97 2j6i h THR 321 Ca 0.25 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.24 2j6i h THR 321 Cb -0.09 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.06 2j6i h THR 321 CO -0.06 0.08 0.44 0.03 0.37 0.00 0.00 175.52 176.38 2j6i h ARG 322 N 0.31 1.03 -0.50 6.66 3.08 -1.02 -0.45 114.38 123.48 2j6i h ARG 322 Ca 0.09 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 59.97 2j6i h ARG 322 Cb -0.00 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.82 2j6i h ARG 322 CO -0.02 0.73 0.05 1.88 -1.07 0.00 0.00 179.97 181.54 2j6i h TYR 323 N 1.04 0.91 -0.13 3.04 0.99 -0.69 -0.14 116.97 121.99 2j6i h TYR 323 Ca 0.27 -0.14 -0.03 0.00 2.00 0.00 0.00 58.73 60.83 2j6i h TYR 323 Cb -0.02 -0.24 -0.00 0.00 1.00 0.00 0.00 36.73 37.47 2j6i h TYR 323 CO 0.01 0.84 -0.02 0.00 -0.00 0.00 0.00 178.16 178.98 2j6i h ALA 324 N 0.95 0.18 -0.63 3.88 0.00 -0.55 0.02 119.26 123.12 2j6i h ALA 324 Ca 0.15 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2j6i h ALA 324 Cb 0.44 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 2j6i h ALA 324 CO 0.02 -0.09 0.39 0.37 0.00 0.00 0.00 179.25 179.94 2j6i h GLN 325 N -0.06 0.84 -0.29 0.00 5.75 -1.10 -1.30 115.11 118.95 2j6i h GLN 325 Ca 0.03 -0.07 -0.06 0.00 -0.15 0.00 0.00 58.65 58.41 2j6i h GLN 325 Cb 0.43 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 2j6i h GLN 325 CO 0.01 0.59 -0.08 0.78 -2.65 0.00 0.00 178.83 177.48 2j6i h GLY 326 N 0.85 0.51 0.81 2.39 0.00 -0.85 -0.42 103.07 106.36 2j6i h GLY 326 Ca 0.23 -0.32 -0.06 0.00 0.00 0.00 0.00 47.33 47.18 2j6i h GLY 326 CO -0.05 0.30 -0.09 -0.84 0.00 0.00 0.00 176.54 175.87 2j6i h THR 327 N 0.44 1.30 -0.47 4.70 2.02 -0.53 -1.42 112.91 118.96 2j6i h THR 327 Ca 0.09 -1.13 0.05 0.00 0.77 0.00 0.00 66.41 66.18 2j6i h THR 327 Cb 0.41 1.60 -0.04 0.00 -1.74 0.00 0.00 68.15 68.38 2j6i h THR 327 CO 0.02 0.34 0.22 0.58 0.37 0.00 0.00 175.52 177.06 2j6i h VAL 328 N 0.14 0.93 -0.23 3.16 2.07 -0.87 0.17 116.25 121.62 2j6i h VAL 328 Ca 0.05 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.44 2j6i h VAL 328 Cb 0.57 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2j6i h VAL 328 CO 0.03 0.08 0.09 0.78 0.02 0.00 0.00 177.57 178.57 2j6i h ASN 329 N 0.44 0.12 -0.31 0.57 2.35 -0.95 0.14 115.58 117.94 2j6i h ASN 329 Ca 0.21 0.02 0.04 0.00 -0.55 0.00 0.00 56.30 56.02 2j6i h ASN 329 Cb 0.14 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.48 2j6i h ASN 329 CO -0.16 0.10 0.09 0.40 -1.65 0.00 0.00 177.43 176.21 2j6i h ILE 330 N 0.21 0.90 -0.67 2.81 2.04 -1.01 -1.05 117.51 120.73 2j6i h ILE 330 Ca 0.10 -0.07 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 2j6i h ILE 330 Cb 0.06 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.76 2j6i h ILE 330 CO -0.09 0.04 0.30 -0.07 0.00 0.00 0.00 178.15 178.33 2j6i h LEU 331 N 0.22 0.89 -0.49 1.44 3.38 -0.33 -1.67 115.31 118.75 2j6i h LEU 331 Ca 0.14 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2j6i h LEU 331 Cb 0.12 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2j6i h LEU 331 CO -0.16 0.80 0.31 -0.08 0.09 0.00 0.00 178.44 179.40 2j6i h GLU 332 N 0.93 0.66 -1.00 1.13 4.57 -0.62 0.41 114.58 120.65 2j6i h GLU 332 Ca 0.23 -0.05 0.10 0.00 -1.18 0.00 0.00 59.36 58.46 2j6i h GLU 332 Cb 0.16 -0.14 -0.08 0.00 -0.16 0.00 0.00 28.75 28.52 2j6i h GLU 332 CO -0.02 0.46 0.64 0.77 -1.18 0.00 0.00 179.01 179.67 2j6i h SER 333 N 0.66 0.97 0.07 1.04 0.02 -0.74 -1.68 113.55 113.90 2j6i h SER 333 Ca 0.18 0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2j6i h SER 333 Cb -0.05 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.33 2j6i h SER 333 CO -0.04 0.56 -0.03 0.15 -1.14 0.00 0.00 176.83 176.33 2j6i h PHE 334 N 1.07 -0.09 -0.55 3.45 3.57 -0.66 0.12 116.94 123.85 2j6i h PHE 334 Ca 0.47 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.96 2j6i h PHE 334 Cb 0.36 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.10 2j6i h PHE 334 CO -0.00 0.48 0.30 0.74 -2.23 0.00 0.00 178.31 177.59 2j6i h PHE 335 N -0.79 0.73 0.00 0.41 0.05 -0.06 -1.44 116.94 115.83 2j6i h PHE 335 Ca -0.01 -0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.77 2j6i h PHE 335 Cb 0.61 -0.24 0.00 0.00 2.00 0.00 0.00 35.95 38.32 2j6i h PHE 335 CO 0.13 0.51 0.00 0.25 -0.18 0.00 0.00 178.31 179.02 2j6i n THR 336 N -4.40 0.63 -0.99 -1.55 -2.24 -0.64 -4.89 114.28 100.20 2j6i n THR 336 Ca 0.05 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2j6i n THR 336 Cb 0.10 -0.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.57 2j6i n THR 336 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j6i n GLY 337 N 0.92 0.33 0.23 3.38 0.00 -0.54 -4.88 105.19 104.62 2j6i n GLY 337 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 2j6i n GLY 337 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2j6i h LYS 338 N 0.70 0.68 -5.79 1.61 1.57 -1.78 -3.47 116.57 110.08 2j6i h LYS 338 Ca 0.00 -0.39 -0.40 0.00 -1.87 0.00 0.00 60.65 57.98 2j6i h LYS 338 Cb 0.36 0.03 -0.12 0.00 0.08 0.00 0.00 32.23 32.58 2j6i h LYS 338 CO 0.00 1.01 -0.60 1.19 -0.57 0.00 0.00 179.45 180.48 2j6i n PHE 339 N -4.00 -1.76 -1.40 -1.35 3.01 0.41 -4.83 117.46 107.53 2j6i n PHE 339 Ca -0.03 0.52 -0.26 0.00 1.01 0.00 0.00 57.45 58.70 2j6i n PHE 339 Cb 0.57 -2.78 -0.08 0.00 -0.01 0.00 0.00 39.48 37.19 2j6i n PHE 339 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 2j6i n ASP 340 N -2.33 6.63 -4.75 4.37 5.75 -1.26 -4.95 116.55 120.00 2j6i n ASP 340 Ca 0.01 -2.89 -0.37 0.00 -0.01 0.00 0.00 54.79 51.54 2j6i n ASP 340 Cb 0.52 -1.35 0.04 0.00 -1.03 0.00 0.00 41.12 39.30 2j6i n ASP 340 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 2j6i s TYR 341 N -0.29 2.29 0.16 2.11 4.12 -1.26 -4.95 117.35 119.53 2j6i s TYR 341 Ca 0.62 1.46 -0.32 0.00 0.02 0.00 0.00 57.07 58.86 2j6i s TYR 341 Cb 0.31 -3.64 -0.11 0.00 -1.52 0.00 0.00 41.96 36.99 2j6i s TYR 341 CO -0.11 -2.60 1.79 0.54 0.02 0.00 0.00 175.55 175.19 2j6i n ARG 342 N -1.45 2.76 -0.34 -0.62 1.74 -1.26 -4.89 116.66 112.60 2j6i n ARG 342 Ca 0.13 1.00 0.08 0.00 -0.77 0.00 0.00 57.85 58.29 2j6i n ARG 342 Cb 0.48 -2.87 0.24 0.00 -1.02 0.00 0.00 32.46 29.29 2j6i n ARG 342 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2j6i h PRO 343 N 7.77 0.84 0.00 5.56 0.11 -1.98 0.19 132.00 144.48 2j6i h PRO 343 Ca -0.45 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2j6i h PRO 343 Cb 1.22 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2j6i h PRO 343 CO 0.95 0.55 0.00 -0.56 -0.21 0.00 0.00 178.00 178.73 2j6i h GLN 344 N 0.86 0.00 0.00 1.05 -0.00 -1.98 -2.67 115.11 112.37 2j6i h GLN 344 Ca 0.49 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 59.11 2j6i h GLN 344 Cb 0.58 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.05 2j6i h GLN 344 CO -0.30 0.00 -0.17 -0.44 -0.00 0.00 0.00 178.83 177.92 2j6i h ASP 345 N 0.00 0.00 -3.03 0.06 3.32 -1.17 -3.42 116.42 112.18 2j6i h ASP 345 Ca 0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 2j6i h ASP 345 Cb 0.19 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.69 2j6i h ASP 345 CO 0.00 0.17 0.90 -0.63 -1.72 0.00 0.00 179.24 177.96 2j6i s ILE 346 N -3.13 4.33 -0.13 0.35 1.01 -1.01 -1.39 121.20 121.23 2j6i s ILE 346 Ca 0.06 1.58 -0.09 0.00 0.00 0.00 0.00 60.65 62.19 2j6i s ILE 346 Cb 0.06 -4.13 -0.03 0.00 0.01 0.00 0.00 42.46 38.37 2j6i s ILE 346 CO 0.69 -0.26 -0.18 -0.38 0.00 0.00 0.00 174.94 174.81 2j6i n ILE 347 N 5.63 1.29 -4.78 2.92 5.41 0.37 -4.95 119.36 125.24 2j6i n ILE 347 Ca 0.14 0.24 -0.28 0.00 1.00 0.00 0.00 62.75 63.85 2j6i n ILE 347 Cb 0.46 -2.30 -0.14 0.00 -0.71 0.00 0.00 39.64 36.94 2j6i n ILE 347 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2j6i s LEU 348 N -7.82 2.16 -0.28 1.39 1.43 -0.68 -4.52 118.68 110.36 2j6i s LEU 348 Ca -0.15 -0.55 -0.02 0.00 -1.03 0.00 0.00 54.13 52.39 2j6i s LEU 348 Cb 0.02 -1.12 0.04 0.00 0.03 0.00 0.00 46.19 45.16 2j6i s LEU 348 CO 0.22 0.21 -0.02 -0.22 0.23 0.00 0.00 176.35 176.77 2j6i s LEU 349 N -1.17 3.66 -1.56 1.79 2.96 0.14 -0.31 118.68 124.18 2j6i s LEU 349 Ca 0.09 -1.15 -0.07 0.00 -0.22 0.00 0.00 54.13 52.78 2j6i s LEU 349 Cb -0.09 -1.69 0.07 0.00 0.50 0.00 0.00 46.19 44.97 2j6i s LEU 349 CO 0.02 -0.22 0.45 0.59 -1.32 0.00 0.00 176.35 175.88 2j6i n ASN 350 N 4.63 -1.06 0.00 3.68 5.03 -1.22 -1.19 115.26 125.12 2j6i n ASN 350 Ca -0.14 -1.08 0.00 0.00 0.87 0.00 0.00 54.58 54.22 2j6i n ASN 350 Cb 0.44 -2.54 0.00 0.00 -1.02 0.00 0.00 39.78 36.66 2j6i n ASN 350 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2j6i n GLY 351 N -1.87 1.51 3.74 7.41 0.00 0.22 -4.34 105.19 111.87 2j6i n GLY 351 Ca -0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 2j6i n GLY 351 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j6i s GLU 352 N -0.33 2.96 0.00 1.61 2.02 -0.33 -4.04 118.70 120.59 2j6i s GLU 352 Ca 0.00 -0.53 0.23 0.00 0.02 0.00 0.00 54.97 54.69 2j6i s GLU 352 Cb 0.00 -2.79 1.37 0.00 0.10 0.00 0.00 34.13 32.81 2j6i s GLU 352 CO 0.00 0.64 1.74 0.66 0.02 0.00 0.00 175.26 178.32