#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1e9h h GLU 2 N 0.00 0.27 -0.56 2.12 4.22 -2.07 -3.21 114.58 115.35 1e9h h GLU 2 Ca 0.00 -0.11 0.00 0.00 0.08 0.00 0.00 59.36 59.33 1e9h h GLU 2 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1e9h h GLU 2 CO 0.00 0.59 0.00 0.09 -2.18 0.00 0.00 179.01 177.51 1e9h n ASN 3 N -4.69 0.56 -4.61 1.04 3.02 -1.26 -4.79 115.26 104.53 1e9h n ASN 3 Ca -0.06 -1.38 -0.32 0.00 -0.03 0.00 0.00 54.58 52.78 1e9h n ASN 3 Cb 0.28 -0.28 -0.10 0.00 -0.61 0.00 0.00 39.78 39.07 1e9h n ASN 3 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1e9h s PHE 4 N -1.19 2.93 -0.33 3.10 0.08 -1.21 0.63 117.98 121.99 1e9h s PHE 4 Ca 0.00 -0.01 0.02 0.00 0.12 0.00 0.00 56.93 57.06 1e9h s PHE 4 Cb 0.00 -1.62 0.10 0.00 -0.57 0.00 0.00 43.02 40.93 1e9h s PHE 4 CO 0.00 0.39 0.07 -1.14 -0.10 0.00 0.00 175.22 174.44 1e9h s GLN 5 N -1.44 1.20 0.33 0.44 2.00 -0.84 -4.88 119.66 116.48 1e9h s GLN 5 Ca 0.17 -1.57 -0.29 0.00 -2.00 0.00 0.00 55.36 51.68 1e9h s GLN 5 Cb -0.11 -2.75 -0.11 0.00 0.80 0.00 0.00 33.01 30.84 1e9h s GLN 5 CO 0.08 -0.95 1.56 1.63 -0.50 0.00 0.00 175.29 177.11 1e9h n LYS 6 N 4.48 2.72 -0.12 1.67 5.02 -1.26 -1.35 118.16 129.32 1e9h n LYS 6 Ca 0.01 0.96 -0.22 0.00 -2.02 0.00 0.00 58.31 57.05 1e9h n LYS 6 Cb 0.42 -2.73 -0.09 0.00 -0.02 0.00 0.00 35.03 32.61 1e9h n LYS 6 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1e9h n VAL 7 N 1.49 1.30 -3.64 -0.18 0.31 0.30 -4.89 118.33 113.02 1e9h n VAL 7 Ca 0.06 -0.40 -0.04 0.00 -0.01 0.00 0.00 64.34 63.95 1e9h n VAL 7 Cb 0.38 -1.61 -0.06 0.00 -0.91 0.00 0.00 33.84 31.64 1e9h n VAL 7 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1e9h s GLU 8 N -2.44 0.14 0.68 5.55 -1.05 -1.08 -4.97 118.70 115.53 1e9h s GLU 8 Ca -0.32 0.12 -0.17 0.00 -0.15 0.00 0.00 54.97 54.45 1e9h s GLU 8 Cb 0.11 0.07 -0.01 0.00 -0.44 0.00 0.00 34.13 33.86 1e9h s GLU 8 CO 0.46 -0.03 1.08 1.17 0.95 0.00 0.00 175.26 178.89 1e9h n LYS 9 N 1.30 0.76 0.00 -4.83 4.81 -1.26 -1.20 118.16 117.74 1e9h n LYS 9 Ca -0.08 0.31 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 1e9h n LYS 9 Cb 0.57 -2.31 0.00 0.00 0.02 0.00 0.00 35.03 33.31 1e9h n LYS 9 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1e9h n ILE 10 N -2.20 0.00 -2.35 3.15 5.41 0.56 -4.77 119.36 119.15 1e9h n ILE 10 Ca 0.14 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.89 1e9h n ILE 10 Cb 0.49 -0.25 0.00 0.00 -0.71 0.00 0.00 39.64 39.16 1e9h n ILE 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1e9h n GLY 11 N 2.10 3.23 2.70 7.39 0.00 -1.12 -4.99 105.19 114.51 1e9h n GLY 11 Ca 0.00 -0.92 -0.19 0.00 0.00 0.00 0.00 46.02 44.90 1e9h n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1e9h s GLU 12 N 0.48 -0.06 0.71 1.61 2.02 -1.26 -3.12 118.70 119.08 1e9h s GLU 12 Ca 0.00 0.39 -0.10 0.00 0.02 0.00 0.00 54.97 55.28 1e9h s GLU 12 Cb 0.00 -0.46 0.16 0.00 0.10 0.00 0.00 34.13 33.93 1e9h s GLU 12 CO 0.00 -0.32 0.97 0.41 0.02 0.00 0.00 175.26 176.34 1e9h n GLY 13 N 5.24 -0.99 0.06 -1.39 0.00 -1.12 -4.89 105.19 102.10 1e9h n GLY 13 Ca -0.05 -1.77 0.10 0.00 0.00 0.00 0.00 46.02 44.31 1e9h n GLY 13 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1e9h n THR 14 N -3.22 0.00 -1.27 2.61 -1.04 -1.26 -3.99 114.28 106.11 1e9h n THR 14 Ca 0.13 -0.03 0.04 0.00 -2.04 0.00 0.00 64.05 62.15 1e9h n THR 14 Cb 0.44 1.01 0.06 0.00 -1.82 0.00 0.00 70.33 70.02 1e9h n THR 14 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1e9h n TYR 15 N -1.34 0.00 0.00 -1.42 4.02 -1.26 -5.05 117.16 112.11 1e9h n TYR 15 Ca 0.05 -0.47 0.00 0.00 -0.01 0.00 0.00 57.90 57.46 1e9h n TYR 15 Cb 0.35 -0.09 0.00 0.00 -0.02 0.00 0.00 39.34 39.58 1e9h n TYR 15 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1e9h n GLY 16 N -0.65 1.04 1.25 2.72 0.00 -1.17 -0.37 105.19 108.01 1e9h n GLY 16 Ca 0.07 0.18 -0.03 0.00 0.00 0.00 0.00 46.02 46.23 1e9h n GLY 16 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1e9h n VAL 17 N 0.00 0.00 -3.89 1.61 0.31 -1.24 -2.79 118.33 112.33 1e9h n VAL 17 Ca 0.00 -0.38 -0.21 0.00 -0.01 0.00 0.00 64.34 63.74 1e9h n VAL 17 Cb 0.00 0.34 -0.17 0.00 -0.91 0.00 0.00 33.84 33.10 1e9h n VAL 17 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1e9h s VAL 18 N -2.67 0.37 0.04 2.52 1.01 -1.18 -2.73 120.40 117.74 1e9h s VAL 18 Ca 0.06 0.07 0.08 0.00 0.00 0.00 0.00 61.98 62.18 1e9h s VAL 18 Cb -0.01 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 1e9h s VAL 18 CO 0.05 0.23 -0.21 -0.31 0.00 0.00 0.00 175.10 174.86 1e9h s TYR 19 N 1.55 2.49 0.04 5.22 1.51 0.15 -0.33 117.35 127.99 1e9h s TYR 19 Ca -0.02 -0.30 -0.26 0.00 -1.01 0.00 0.00 57.07 55.48 1e9h s TYR 19 Cb -0.13 -1.45 -0.05 0.00 -0.11 0.00 0.00 41.96 40.22 1e9h s TYR 19 CO -0.03 0.21 0.80 0.21 -1.11 0.00 0.00 175.55 175.62 1e9h s LYS 20 N -1.34 4.52 0.15 -0.62 2.20 -0.34 -0.31 119.74 124.00 1e9h s LYS 20 Ca 0.13 1.12 -0.08 0.00 -0.36 0.00 0.00 55.97 56.79 1e9h s LYS 20 Cb -0.10 -3.38 -0.01 0.00 -1.51 0.00 0.00 37.83 32.83 1e9h s LYS 20 CO 0.04 0.24 0.24 0.00 -0.36 0.00 0.00 175.35 175.51 1e9h s ALA 21 N 0.07 0.10 -0.08 3.13 0.00 0.58 0.11 121.76 125.67 1e9h s ALA 21 Ca 0.40 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 51.42 1e9h s ALA 21 Cb -0.21 0.81 0.03 0.00 0.00 0.00 0.00 23.12 23.74 1e9h s ALA 21 CO 0.24 -0.60 -0.04 -0.98 0.00 0.00 0.00 175.76 174.38 1e9h s ARG 22 N -3.96 1.03 -0.18 0.00 1.70 -0.46 0.13 118.95 117.20 1e9h s ARG 22 Ca 0.16 -0.07 -0.31 0.00 -0.47 0.00 0.00 55.73 55.04 1e9h s ARG 22 Cb 0.04 -1.21 -0.08 0.00 -0.57 0.00 0.00 34.95 33.13 1e9h s ARG 22 CO -0.01 -0.25 2.11 -1.71 -1.08 0.00 0.00 175.30 174.36 1e9h n ASN 23 N 4.89 3.22 -0.33 -2.89 2.85 0.23 -1.98 115.26 121.25 1e9h n ASN 23 Ca -0.12 0.51 0.05 0.00 -0.11 0.00 0.00 54.58 54.92 1e9h n ASN 23 Cb 0.50 -1.46 0.24 0.00 1.24 0.00 0.00 39.78 40.30 1e9h n ASN 23 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 1e9h h LYS 24 N 12.66 0.99 0.14 1.20 1.57 -0.12 0.97 116.57 133.99 1e9h h LYS 24 Ca -0.41 -0.06 -0.29 0.00 -1.87 0.00 0.00 60.65 58.02 1e9h h LYS 24 Cb 1.26 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.35 1e9h h LYS 24 CO 0.97 0.66 -1.44 -0.07 -0.57 0.00 0.00 179.45 178.99 1e9h h LEU 25 N 1.02 0.47 0.00 2.94 3.38 -1.89 -3.38 115.31 117.85 1e9h h LEU 25 Ca 0.44 -0.89 -0.00 0.00 0.09 0.00 0.00 57.88 57.52 1e9h h LEU 25 Cb 0.33 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1e9h h LEU 25 CO -0.19 1.64 -0.89 0.71 0.09 0.00 0.00 178.44 179.80 1e9h h THR 26 N -0.19 0.01 0.00 0.22 1.35 -1.93 -3.48 112.91 108.89 1e9h h THR 26 Ca -0.30 -1.02 0.00 0.00 -0.55 0.00 0.00 66.41 64.55 1e9h h THR 26 Cb 1.85 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 69.84 1e9h h THR 26 CO 0.11 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 175.99 1e9h n GLY 27 N 1.17 1.49 3.74 5.82 0.00 0.33 -5.02 105.19 112.72 1e9h n GLY 27 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1e9h n GLY 27 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1e9h s GLU 28 N -0.33 4.24 -0.08 1.61 2.12 -1.24 -4.67 118.70 120.35 1e9h s GLU 28 Ca 0.00 2.34 -0.19 0.00 0.36 0.00 0.00 54.97 57.47 1e9h s GLU 28 Cb 0.00 -3.12 -0.04 0.00 0.26 0.00 0.00 34.13 31.22 1e9h s GLU 28 CO 0.00 -0.50 0.53 0.08 -0.54 0.00 0.00 175.26 174.83 1e9h s VAL 29 N 0.41 5.11 0.34 3.70 1.01 -1.26 0.76 120.40 130.48 1e9h s VAL 29 Ca 0.63 1.08 0.03 0.00 0.00 0.00 0.00 61.98 63.73 1e9h s VAL 29 Cb -0.43 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.04 1e9h s VAL 29 CO 0.39 0.34 0.11 0.68 0.00 0.00 0.00 175.10 176.63 1e9h s VAL 30 N 0.42 0.71 -0.17 2.92 -7.23 0.34 -3.90 120.40 113.48 1e9h s VAL 30 Ca 0.29 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.47 1e9h s VAL 30 Cb -0.16 -2.55 0.02 0.00 0.56 0.00 0.00 36.38 34.25 1e9h s VAL 30 CO 0.13 0.00 -0.20 0.00 -0.31 0.00 0.00 175.10 174.72 1e9h s ALA 31 N -3.38 2.33 -0.20 1.32 0.00 0.02 -0.30 121.76 121.55 1e9h s ALA 31 Ca 0.32 -1.20 -0.06 0.00 0.00 0.00 0.00 51.96 51.01 1e9h s ALA 31 Cb 0.05 -1.16 -0.03 0.00 0.00 0.00 0.00 23.12 21.98 1e9h s ALA 31 CO 0.15 -0.30 0.03 -0.51 0.00 0.00 0.00 175.76 175.13 1e9h s LEU 32 N 1.22 3.51 -0.35 0.00 1.43 0.57 -0.20 118.68 124.87 1e9h s LEU 32 Ca 0.03 -0.08 -0.00 0.00 -1.03 0.00 0.00 54.13 53.05 1e9h s LEU 32 Cb -0.13 -1.89 0.09 0.00 0.03 0.00 0.00 46.19 44.28 1e9h s LEU 32 CO -0.11 0.11 0.08 -0.75 0.23 0.00 0.00 176.35 175.90 1e9h s LYS 33 N 0.77 2.00 0.02 1.70 2.20 -0.18 0.34 119.74 126.58 1e9h s LYS 33 Ca 0.02 -1.64 -0.25 0.00 -0.36 0.00 0.00 55.97 53.73 1e9h s LYS 33 Cb -0.14 -3.31 -0.05 0.00 -1.51 0.00 0.00 37.83 32.83 1e9h s LYS 33 CO 0.02 -0.87 0.78 -1.59 -0.36 0.00 0.00 175.35 173.33 1e9h s LYS 34 N 1.10 4.50 -0.19 4.03 -2.85 -1.11 -1.17 119.74 124.05 1e9h s LYS 34 Ca 0.04 1.07 -0.02 0.00 -1.00 0.00 0.00 55.97 56.05 1e9h s LYS 34 Cb -0.21 -3.39 -0.01 0.00 -2.06 0.00 0.00 37.83 32.16 1e9h s LYS 34 CO -0.04 0.20 -0.08 0.42 0.10 0.00 0.00 175.35 175.94 1e9h s ILE 35 N 0.24 3.17 0.01 3.79 1.09 0.26 -3.04 121.20 126.72 1e9h s ILE 35 Ca 0.40 -0.58 -0.30 0.00 -1.10 0.00 0.00 60.65 59.07 1e9h s ILE 35 Cb -0.20 -2.41 -0.04 0.00 -1.06 0.00 0.00 42.46 38.75 1e9h s ILE 35 CO 0.23 0.46 1.12 -0.13 -0.10 0.00 0.00 174.94 176.52 1e9h s ARG 36 N 1.14 4.45 0.00 2.79 0.52 0.50 -0.37 118.95 127.99 1e9h s ARG 36 Ca 0.01 1.62 0.00 0.00 -0.52 0.00 0.00 55.73 56.84 1e9h s ARG 36 Cb -0.14 -3.44 0.00 0.00 0.52 0.00 0.00 34.95 31.89 1e9h s ARG 36 CO -0.02 -0.24 0.00 1.28 0.02 0.00 0.00 175.30 176.34 1e9h n LEU 37 N 4.25 0.00 0.00 2.53 4.77 -1.03 -4.92 117.00 122.60 1e9h n LEU 37 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1e9h n LEU 37 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1e9h n LEU 37 CO 0.54 0.00 0.00 0.47 -1.33 0.00 0.00 177.39 177.07 1e9h n ASP 38 N 0.00 -1.67 -0.34 -1.43 8.00 -1.03 -4.96 116.55 115.11 1e9h n ASP 38 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1e9h n ASP 38 Cb 0.00 -0.29 0.00 0.00 -0.02 0.00 0.00 41.12 40.81 1e9h n ASP 38 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1e9h n THR 39 N -2.59 0.00 -2.23 -3.53 -1.04 -1.26 -4.73 114.28 98.89 1e9h n THR 39 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1e9h n THR 39 Cb 0.02 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.53 1e9h n THR 39 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1e9h n GLU 40 N -0.68 -0.47 0.00 -2.82 4.07 -1.26 -4.60 120.64 114.87 1e9h n GLU 40 Ca 0.00 -0.23 0.00 0.00 -0.06 0.00 0.00 57.16 56.87 1e9h n GLU 40 Cb 0.00 0.42 0.00 0.00 -0.06 0.00 0.00 31.44 31.80 1e9h n GLU 40 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 1e9h n THR 41 N -0.53 0.00 -0.79 6.31 5.66 -1.26 -5.03 114.28 118.63 1e9h n THR 41 Ca 0.00 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.04 1e9h n THR 41 Cb 0.00 0.00 0.05 0.00 -1.55 0.00 0.00 70.33 68.83 1e9h n THR 41 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1e9h n GLU 42 N 0.00 1.55 0.00 1.09 -0.58 -1.26 -5.12 120.64 116.32 1e9h n GLU 42 Ca 0.00 -1.67 0.00 0.00 -0.42 0.00 0.00 57.16 55.07 1e9h n GLU 42 Cb 0.00 -1.04 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 1e9h n GLU 42 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1e9h n GLY 43 N -0.69 -0.77 3.69 0.62 0.00 -1.26 -4.78 105.19 101.99 1e9h n GLY 43 Ca 0.06 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 1e9h n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1e9h s VAL 44 N 0.00 3.94 0.17 1.61 1.01 -1.26 -4.95 120.40 120.93 1e9h s VAL 44 Ca 0.00 1.32 -0.33 0.00 0.00 0.00 0.00 61.98 62.96 1e9h s VAL 44 Cb 0.00 -3.85 -0.15 0.00 0.00 0.00 0.00 36.38 32.39 1e9h s VAL 44 CO 0.00 0.01 1.36 -2.65 0.00 0.00 0.00 175.10 173.83 1e9h n PRO 45 N 5.07 1.65 0.28 2.72 -0.02 -1.26 -4.82 135.00 138.62 1e9h n PRO 45 Ca 0.12 0.59 0.13 0.00 -2.02 0.00 0.00 63.50 62.32 1e9h n PRO 45 Cb 0.45 -2.23 0.81 0.00 -0.02 0.00 0.00 33.50 32.51 1e9h n PRO 45 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1e9h h SER 46 N 4.41 0.00 0.58 2.55 4.64 -1.95 0.13 113.55 123.91 1e9h h SER 46 Ca -0.45 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.80 1e9h h SER 46 Cb 1.30 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.38 1e9h h SER 46 CO 0.77 0.06 -0.34 0.71 -0.87 0.00 0.00 176.83 177.16 1e9h h THR 47 N 0.00 0.98 0.20 2.95 1.35 -1.89 -1.36 112.91 115.15 1e9h h THR 47 Ca -0.00 -1.28 -0.33 0.00 -0.55 0.00 0.00 66.41 64.25 1e9h h THR 47 Cb 0.16 1.75 0.02 0.00 -1.73 0.00 0.00 68.15 68.34 1e9h h THR 47 CO 0.01 0.33 -1.53 0.00 -0.25 0.00 0.00 175.52 174.08 1e9h h ALA 48 N 1.66 0.01 -0.40 6.62 0.00 -1.34 -1.80 119.26 124.01 1e9h h ALA 48 Ca -0.00 -0.97 0.07 0.00 0.00 0.00 0.00 54.91 54.00 1e9h h ALA 48 Cb 0.72 0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 1e9h h ALA 48 CO 0.04 0.88 0.05 0.82 0.00 0.00 0.00 179.25 181.04 1e9h h ILE 49 N 0.12 0.76 -0.12 0.00 1.08 -1.03 0.87 117.51 119.19 1e9h h ILE 49 Ca -0.26 -0.06 -0.05 0.00 -0.39 0.00 0.00 64.86 64.11 1e9h h ILE 49 Cb 2.11 0.58 -0.00 0.00 -3.07 0.00 0.00 36.82 36.43 1e9h h ILE 49 CO 0.23 0.03 -0.11 0.03 -0.69 0.00 0.00 178.15 177.64 1e9h h ARG 50 N 0.17 0.28 -0.51 2.37 3.08 -1.33 -2.38 114.38 116.05 1e9h h ARG 50 Ca 0.19 -0.14 0.08 0.00 0.07 0.00 0.00 59.98 60.18 1e9h h ARG 50 Cb 0.25 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.24 1e9h h ARG 50 CO -0.28 0.68 0.14 1.49 -1.07 0.00 0.00 179.97 180.92 1e9h h GLU 51 N -0.10 0.28 0.01 0.04 4.81 -0.93 -0.48 114.58 118.20 1e9h h GLU 51 Ca 0.02 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1e9h h GLU 51 Cb 0.62 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1e9h h GLU 51 CO 0.03 0.19 -0.01 0.82 -0.73 0.00 0.00 179.01 179.31 1e9h h ILE 52 N 0.29 1.43 -0.38 2.32 2.04 -0.87 -1.77 117.51 120.58 1e9h h ILE 52 Ca 0.25 -1.37 -0.02 0.00 1.00 0.00 0.00 64.86 64.73 1e9h h ILE 52 Cb 0.32 2.34 -0.02 0.00 -0.74 0.00 0.00 36.82 38.72 1e9h h ILE 52 CO -0.30 0.35 0.16 0.77 0.00 0.00 0.00 178.15 179.13 1e9h h SER 53 N -0.61 0.52 -0.40 1.72 4.64 -1.37 -1.46 113.55 116.59 1e9h h SER 53 Ca -0.00 -0.16 -0.07 0.00 -0.47 0.00 0.00 61.79 61.08 1e9h h SER 53 Cb 0.59 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 1e9h h SER 53 CO 0.00 0.54 -0.03 -0.07 -0.87 0.00 0.00 176.83 176.40 1e9h h LEU 54 N 0.47 0.71 -0.88 5.97 3.38 -1.18 -3.06 115.31 120.72 1e9h h LEU 54 Ca 0.13 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.71 1e9h h LEU 54 Cb 0.18 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1e9h h LEU 54 CO -0.01 0.87 0.15 0.25 0.09 0.00 0.00 178.44 179.79 1e9h h LEU 55 N 0.54 0.93 -2.38 1.67 5.85 -1.25 -0.40 115.31 120.28 1e9h h LEU 55 Ca 0.11 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1e9h h LEU 55 Cb 0.52 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 1e9h h LEU 55 CO 0.03 0.90 0.01 0.11 -0.34 0.00 0.00 178.44 179.14 1e9h h LYS 56 N 0.94 0.00 -0.09 1.25 1.57 -1.21 0.47 116.57 119.50 1e9h h LYS 56 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1e9h h LYS 56 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1e9h h LYS 56 CO -0.00 0.00 0.00 -1.91 -0.57 0.00 0.00 179.45 176.97 1e9h n GLU 57 N -3.97 1.55 -3.81 3.15 2.13 -0.18 -4.63 120.64 114.89 1e9h n GLU 57 Ca -0.03 -0.82 -0.29 0.00 0.66 0.00 0.00 57.16 56.68 1e9h n GLU 57 Cb 0.09 -1.41 -0.13 0.00 0.27 0.00 0.00 31.44 30.27 1e9h n GLU 57 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1e9h s LEU 58 N -1.71 3.77 -0.36 4.31 1.43 0.15 -5.05 118.68 121.22 1e9h s LEU 58 Ca 0.34 -3.24 -0.13 0.00 -1.03 0.00 0.00 54.13 50.07 1e9h s LEU 58 Cb 0.18 -1.35 -0.00 0.00 0.03 0.00 0.00 46.19 45.05 1e9h s LEU 58 CO 0.28 -0.18 0.25 0.21 0.23 0.00 0.00 176.35 177.15 1e9h s ASN 59 N -0.53 6.03 -0.22 2.29 3.04 -1.26 -4.92 114.94 119.37 1e9h s ASN 59 Ca 0.22 -0.61 -0.27 0.00 0.04 0.00 0.00 52.86 52.24 1e9h s ASN 59 Cb -0.14 -2.13 0.11 0.00 -1.54 0.00 0.00 41.25 37.55 1e9h s ASN 59 CO -0.09 -0.31 0.92 -2.28 -3.04 0.00 0.00 177.10 172.31 1e9h s HIS 60 N 1.69 -0.53 0.63 0.43 2.46 -1.26 -5.04 115.29 113.67 1e9h s HIS 60 Ca 0.05 1.17 0.40 0.00 0.47 0.00 0.00 55.06 57.15 1e9h s HIS 60 Cb -0.18 0.37 2.15 0.00 -0.13 0.00 0.00 32.58 34.80 1e9h s HIS 60 CO 0.10 -0.33 2.21 -1.35 -2.47 0.00 0.00 174.74 172.90 1e9h h PRO 61 N 3.80 0.00 -0.45 2.88 0.11 -1.99 -1.78 132.00 134.56 1e9h h PRO 61 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1e9h h PRO 61 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1e9h h PRO 61 CO 0.18 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.06 1e9h n ASN 62 N -2.98 3.49 -4.04 -2.05 5.03 -1.26 -4.86 115.26 108.58 1e9h n ASN 62 Ca -0.03 -2.18 -0.29 0.00 0.87 0.00 0.00 54.58 52.95 1e9h n ASN 62 Cb 0.16 -0.37 -0.17 0.00 -1.02 0.00 0.00 39.78 38.39 1e9h n ASN 62 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1e9h s ILE 63 N -1.33 1.56 0.34 2.41 1.01 -0.67 -0.99 121.20 123.52 1e9h s ILE 63 Ca 0.34 -0.65 -0.25 0.00 0.00 0.00 0.00 60.65 60.09 1e9h s ILE 63 Cb 0.20 -1.44 -0.15 0.00 0.01 0.00 0.00 42.46 41.08 1e9h s ILE 63 CO 0.20 0.46 0.53 1.33 0.00 0.00 0.00 174.94 177.45 1e9h n VAL 64 N 4.46 1.67 -3.54 2.92 0.24 -0.57 -4.53 118.33 118.97 1e9h n VAL 64 Ca -0.18 -0.50 -0.37 0.00 -2.04 0.00 0.00 64.34 61.25 1e9h n VAL 64 Cb 0.51 -0.38 -0.08 0.00 -1.47 0.00 0.00 33.84 32.42 1e9h n VAL 64 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1e9h s LYS 65 N -1.32 4.20 -0.38 7.34 2.36 -1.26 -4.95 119.74 125.72 1e9h s LYS 65 Ca 0.62 0.02 -0.22 0.00 -2.55 0.00 0.00 55.97 53.84 1e9h s LYS 65 Cb -0.71 -3.47 0.01 0.00 -1.05 0.00 0.00 37.83 32.61 1e9h s LYS 65 CO 0.59 0.14 0.72 -1.17 1.55 0.00 0.00 175.35 177.19 1e9h s LEU 66 N 0.77 4.21 0.00 5.43 2.96 -1.26 -0.89 118.68 129.90 1e9h s LEU 66 Ca 0.15 0.17 0.06 0.00 -0.22 0.00 0.00 54.13 54.28 1e9h s LEU 66 Cb -0.13 -2.91 -0.24 0.00 0.50 0.00 0.00 46.19 43.40 1e9h s LEU 66 CO 0.04 -0.72 0.84 -0.07 -1.32 0.00 0.00 176.35 175.12 1e9h h LEU 67 N 9.67 0.14 -7.10 -0.68 3.38 0.36 -3.49 115.31 117.59 1e9h h LEU 67 Ca -0.25 -0.22 0.16 0.00 0.09 0.00 0.00 57.88 57.66 1e9h h LEU 67 Cb 1.10 -0.04 -0.15 0.00 0.09 0.00 0.00 40.66 41.66 1e9h h LEU 67 CO 0.89 1.19 0.57 -0.62 0.09 0.00 0.00 178.44 180.56 1e9h s ASP 68 N -6.55 -0.28 -0.30 -0.43 2.15 -0.83 -4.99 116.67 105.45 1e9h s ASP 68 Ca -0.06 -0.06 0.01 0.00 0.43 0.00 0.00 52.55 52.87 1e9h s ASP 68 Cb 0.08 0.34 0.09 0.00 -0.30 0.00 0.00 42.92 43.13 1e9h s ASP 68 CO 0.83 -0.57 0.04 -0.69 -0.17 0.00 0.00 175.17 174.61 1e9h s VAL 69 N -2.97 1.49 -0.59 1.11 1.01 -1.26 0.75 120.40 119.94 1e9h s VAL 69 Ca 0.07 -1.65 -0.23 0.00 0.00 0.00 0.00 61.98 60.18 1e9h s VAL 69 Cb -0.01 -2.02 0.06 0.00 0.00 0.00 0.00 36.38 34.41 1e9h s VAL 69 CO -0.06 -0.50 0.90 -0.63 0.00 0.00 0.00 175.10 174.80 1e9h s ILE 70 N 1.33 4.45 -0.37 2.22 1.01 0.25 -4.93 121.20 125.17 1e9h s ILE 70 Ca 0.06 -0.11 -0.19 0.00 0.00 0.00 0.00 60.65 60.41 1e9h s ILE 70 Cb -0.18 -4.56 0.00 0.00 0.01 0.00 0.00 42.46 37.73 1e9h s ILE 70 CO -0.15 -1.20 0.55 -2.28 0.00 0.00 0.00 174.94 171.87 1e9h s HIS 71 N 3.76 3.16 0.17 3.97 2.46 -1.26 0.04 115.29 127.58 1e9h s HIS 71 Ca 0.24 0.16 0.07 0.00 0.47 0.00 0.00 55.06 56.00 1e9h s HIS 71 Cb -0.15 -3.02 -0.04 0.00 -0.13 0.00 0.00 32.58 29.23 1e9h s HIS 71 CO 0.14 -0.61 -0.14 0.99 -2.47 0.00 0.00 174.74 172.66 1e9h s THR 72 N 2.50 1.55 0.28 0.89 2.01 -0.53 -5.04 115.64 117.31 1e9h s THR 72 Ca 0.20 -2.02 -0.03 0.00 0.31 0.00 0.00 61.69 60.14 1e9h s THR 72 Cb -0.15 -1.86 0.26 0.00 0.01 0.00 0.00 72.50 70.77 1e9h s THR 72 CO 0.14 -0.54 1.94 -0.08 -0.69 0.00 0.00 174.62 175.39 1e9h h GLU 73 N 2.93 1.17 0.08 4.92 4.81 -2.03 -3.18 114.58 123.27 1e9h h GLU 73 Ca -0.39 -0.07 -0.17 0.00 -0.13 0.00 0.00 59.36 58.60 1e9h h GLU 73 Cb 1.21 -0.26 0.02 0.00 0.63 0.00 0.00 28.75 30.34 1e9h h GLU 73 CO 0.58 0.77 -0.71 -0.91 -0.73 0.00 0.00 179.01 178.02 1e9h h ASN 74 N 1.20 0.48 -5.35 1.04 4.21 -1.98 -3.37 115.58 111.81 1e9h h ASN 74 Ca 0.35 -0.88 -0.12 0.00 1.21 0.00 0.00 56.30 56.86 1e9h h ASN 74 Cb -0.08 -0.15 -0.12 0.00 -1.12 0.00 0.00 38.32 36.86 1e9h h ASN 74 CO -0.09 1.31 -0.31 -1.59 -1.29 0.00 0.00 177.43 175.46 1e9h s LYS 75 N -2.75 1.36 -0.13 0.81 -2.85 -1.20 -2.48 119.74 112.50 1e9h s LYS 75 Ca -0.14 -1.34 -0.00 0.00 -1.00 0.00 0.00 55.97 53.49 1e9h s LYS 75 Cb 0.02 0.39 0.02 0.00 -2.06 0.00 0.00 37.83 36.20 1e9h s LYS 75 CO 0.82 -0.52 -0.11 -1.17 0.10 0.00 0.00 175.35 174.48 1e9h s LEU 76 N -3.05 1.40 -0.23 2.77 0.20 0.50 -1.45 118.68 118.83 1e9h s LEU 76 Ca 0.26 -0.38 -0.09 0.00 0.69 0.00 0.00 54.13 54.61 1e9h s LEU 76 Cb 0.02 -0.99 -0.04 0.00 -0.43 0.00 0.00 46.19 44.75 1e9h s LEU 76 CO 0.08 -0.09 0.12 -0.31 -0.29 0.00 0.00 176.35 175.86 1e9h s TYR 77 N 1.60 3.25 -0.24 5.38 2.02 0.11 0.91 117.35 130.37 1e9h s TYR 77 Ca 0.05 0.07 -0.09 0.00 -0.37 0.00 0.00 57.07 56.73 1e9h s TYR 77 Cb -0.13 -2.22 -0.04 0.00 -0.40 0.00 0.00 41.96 39.17 1e9h s TYR 77 CO -0.09 -0.00 0.13 -0.51 -1.57 0.00 0.00 175.55 173.51 1e9h s LEU 78 N 1.03 3.87 -0.29 -1.29 1.43 -0.31 0.85 118.68 123.96 1e9h s LEU 78 Ca 0.06 -0.00 -0.11 0.00 -1.03 0.00 0.00 54.13 53.05 1e9h s LEU 78 Cb -0.14 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.00 1e9h s LEU 78 CO 0.04 0.03 0.19 -0.69 0.23 0.00 0.00 176.35 176.16 1e9h s VAL 79 N 1.23 5.26 0.32 -1.59 1.01 0.23 -1.01 120.40 125.85 1e9h s VAL 79 Ca 0.06 0.07 0.10 0.00 0.00 0.00 0.00 61.98 62.21 1e9h s VAL 79 Cb -0.14 -3.54 -0.06 0.00 0.00 0.00 0.00 36.38 32.64 1e9h s VAL 79 CO 0.05 0.20 -0.10 -0.36 0.00 0.00 0.00 175.10 174.89 1e9h s PHE 80 N 1.74 2.42 0.60 5.22 0.40 0.72 0.10 117.98 129.19 1e9h s PHE 80 Ca 0.07 -0.42 -0.17 0.00 -0.60 0.00 0.00 56.93 55.81 1e9h s PHE 80 Cb -0.16 -1.28 -0.03 0.00 0.51 0.00 0.00 43.02 42.06 1e9h s PHE 80 CO 0.11 0.60 1.13 -1.83 0.70 0.00 0.00 175.22 175.93 1e9h s GLU 81 N -3.61 3.05 -0.03 0.44 -1.05 -0.07 -0.80 118.70 116.63 1e9h s GLU 81 Ca 0.32 1.56 -0.09 0.00 -0.15 0.00 0.00 54.97 56.61 1e9h s GLU 81 Cb -0.01 -1.97 -0.05 0.00 -0.44 0.00 0.00 34.13 31.66 1e9h s GLU 81 CO 0.17 -1.08 0.27 0.12 0.95 0.00 0.00 175.26 175.69 1e9h s PHE 82 N -1.98 3.62 -0.00 4.83 5.36 -1.25 -4.32 117.98 124.23 1e9h s PHE 82 Ca 0.71 0.66 0.02 0.00 -0.96 0.00 0.00 56.93 57.37 1e9h s PHE 82 Cb -0.24 -2.05 -0.01 0.00 -0.34 0.00 0.00 43.02 40.39 1e9h s PHE 82 CO 0.34 0.65 -0.08 -0.51 -1.46 0.00 0.00 175.22 174.16 1e9h s LEU 83 N -1.41 2.02 0.50 6.12 1.02 -1.26 -5.01 118.68 120.65 1e9h s LEU 83 Ca 0.23 -0.15 0.18 0.00 0.02 0.00 0.00 54.13 54.42 1e9h s LEU 83 Cb -0.14 -0.38 1.23 0.00 0.02 0.00 0.00 46.19 46.92 1e9h s LEU 83 CO 0.12 0.09 2.06 0.45 0.02 0.00 0.00 176.35 179.08 1e9h h HIS 84 N 5.92 0.13 -2.70 0.29 3.86 -1.92 -3.47 115.15 117.25 1e9h h HIS 84 Ca -0.30 0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.01 1e9h h HIS 84 Cb 1.18 -0.04 -0.03 0.00 1.06 0.00 0.00 27.41 29.58 1e9h h HIS 84 CO 0.41 0.07 0.43 -1.14 0.86 0.00 0.00 177.93 178.55 1e9h s GLN 85 N -5.15 1.65 0.26 2.45 2.00 -0.90 -5.03 119.66 114.95 1e9h s GLN 85 Ca -0.06 -1.03 0.12 0.00 -2.00 0.00 0.00 55.36 52.39 1e9h s GLN 85 Cb 0.18 0.49 -0.05 0.00 0.80 0.00 0.00 33.01 34.43 1e9h s GLN 85 CO 0.71 -0.77 -0.19 0.16 -0.50 0.00 0.00 175.29 174.70 1e9h s ASP 86 N -3.16 3.63 0.37 6.67 1.47 -1.26 -0.45 116.67 123.94 1e9h s ASP 86 Ca 0.17 -0.96 0.09 0.00 1.18 0.00 0.00 52.55 53.02 1e9h s ASP 86 Cb -0.04 -0.33 0.83 0.00 -0.34 0.00 0.00 42.92 43.04 1e9h s ASP 86 CO 0.07 0.06 1.93 0.25 0.68 0.00 0.00 175.17 178.16 1e9h h LEU 87 N 2.45 0.60 0.69 2.11 5.85 -0.66 -2.19 115.31 124.16 1e9h h LEU 87 Ca -0.42 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.29 1e9h h LEU 87 Cb 1.25 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 42.18 1e9h h LEU 87 CO 0.57 0.36 -0.33 0.50 -0.34 0.00 0.00 178.44 179.20 1e9h h LYS 88 N 0.67 -0.90 -0.30 1.25 3.64 -1.74 0.78 116.57 119.98 1e9h h LYS 88 Ca 0.36 0.06 0.06 0.00 -1.27 0.00 0.00 60.65 59.85 1e9h h LYS 88 Cb 0.49 0.20 -0.08 0.00 -0.41 0.00 0.00 32.23 32.43 1e9h h LYS 88 CO -0.13 -0.57 -0.44 0.87 -2.27 0.00 0.00 179.45 176.92 1e9h h LYS 89 N -1.08 -0.38 -0.93 1.90 1.57 -1.86 0.85 116.57 116.64 1e9h h LYS 89 Ca -0.09 0.03 0.11 0.00 -1.87 0.00 0.00 60.65 58.82 1e9h h LYS 89 Cb 0.74 0.09 -0.07 0.00 0.08 0.00 0.00 32.23 33.07 1e9h h LYS 89 CO 0.16 -0.25 0.60 0.35 -0.57 0.00 0.00 179.45 179.73 1e9h h PHE 90 N -0.40 1.00 -0.76 -1.35 3.57 -1.34 0.09 116.94 117.76 1e9h h PHE 90 Ca 0.11 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 1e9h h PHE 90 Cb 0.60 -0.32 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 1e9h h PHE 90 CO -0.58 0.43 0.30 0.52 -2.23 0.00 0.00 178.31 176.76 1e9h h MET 91 N 0.90 1.13 -0.19 1.11 2.86 0.85 -2.73 114.93 118.87 1e9h h MET 91 Ca 0.44 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.87 1e9h h MET 91 Cb 0.47 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 1e9h h MET 91 CO -0.21 0.92 0.07 -0.44 1.06 0.00 0.00 176.91 178.31 1e9h h ASP 92 N 1.09 0.27 0.00 1.22 3.32 0.97 0.40 116.42 123.69 1e9h h ASP 92 Ca 0.25 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1e9h h ASP 92 Cb 0.21 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1e9h h ASP 92 CO -0.02 0.38 0.01 0.00 -1.72 0.00 0.00 179.24 177.90 1e9h n ALA 93 N -2.25 0.99 0.36 3.45 0.00 -0.45 -0.32 120.51 122.30 1e9h n ALA 93 Ca -0.04 0.07 0.05 0.00 0.00 0.00 0.00 53.44 53.52 1e9h n ALA 93 Cb 0.14 -1.09 -0.06 0.00 0.00 0.00 0.00 19.45 18.44 1e9h n ALA 93 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1e9h n SER 94 N -1.76 0.88 -0.44 0.00 7.64 -0.80 -4.73 113.62 114.42 1e9h n SER 94 Ca -0.01 -0.59 0.34 0.00 1.01 0.00 0.00 58.87 59.63 1e9h n SER 94 Cb 0.02 1.08 0.54 0.00 -1.01 0.00 0.00 64.21 64.85 1e9h n SER 94 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1e9h n ALA 95 N -1.34 1.19 -0.05 -0.43 0.00 0.56 0.73 120.51 121.18 1e9h n ALA 95 Ca 0.01 0.53 -0.11 0.00 0.00 0.00 0.00 53.44 53.87 1e9h n ALA 95 Cb 0.17 -0.79 -0.14 0.00 0.00 0.00 0.00 19.45 18.68 1e9h n ALA 95 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1e9h n LEU 96 N -3.69 1.00 -0.05 0.00 7.99 -1.26 -4.59 117.00 116.41 1e9h n LEU 96 Ca 0.31 0.23 0.01 0.00 -0.01 0.00 0.00 56.01 56.54 1e9h n LEU 96 Cb 1.31 0.02 -0.16 0.00 -0.11 0.00 0.00 43.42 44.47 1e9h n LEU 96 CO 0.24 0.52 -0.93 0.41 -1.51 0.00 0.00 177.39 176.12 1e9h n THR 97 N -3.03 0.67 0.00 -5.08 -1.04 0.22 -5.11 114.28 100.91 1e9h n THR 97 Ca -0.26 -0.67 0.00 0.00 -2.04 0.00 0.00 64.05 61.08 1e9h n THR 97 Cb 1.08 -0.23 0.00 0.00 -1.82 0.00 0.00 70.33 69.36 1e9h n THR 97 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1e9h n GLY 98 N 1.49 0.19 3.61 3.41 0.00 0.12 -4.94 105.19 109.06 1e9h n GLY 98 Ca -0.17 -1.69 -0.38 0.00 0.00 0.00 0.00 46.02 43.78 1e9h n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1e9h s ILE 99 N -2.98 5.30 0.27 -0.61 1.01 -1.26 -4.95 121.20 117.98 1e9h s ILE 99 Ca 0.00 0.23 -0.30 0.00 0.00 0.00 0.00 60.65 60.57 1e9h s ILE 99 Cb 0.00 -3.55 -0.12 0.00 0.01 0.00 0.00 42.46 38.81 1e9h s ILE 99 CO 0.00 0.26 1.63 -2.84 0.00 0.00 0.00 174.94 173.99 1e9h s PRO 100 N 1.66 4.12 0.35 2.79 0.02 -1.26 -4.74 135.00 137.94 1e9h s PRO 100 Ca 0.08 2.59 0.14 0.00 0.02 0.00 0.00 61.00 63.84 1e9h s PRO 100 Cb -0.16 -3.03 1.03 0.00 0.02 0.00 0.00 34.50 32.36 1e9h s PRO 100 CO 0.10 -0.67 1.71 -0.07 -0.33 0.00 0.00 177.00 177.74 1e9h h LEU 101 N 5.37 0.55 -0.23 -5.54 4.07 -1.98 0.19 115.31 117.74 1e9h h LEU 101 Ca -0.46 0.14 0.06 0.00 0.08 0.00 0.00 57.88 57.70 1e9h h LEU 101 Cb 1.21 0.06 -0.06 0.00 1.08 0.00 0.00 40.66 42.95 1e9h h LEU 101 CO 0.84 0.02 -0.20 -0.65 -1.08 0.00 0.00 178.44 177.37 1e9h h PRO 102 N 0.44 -0.19 -0.18 1.13 0.11 -1.98 0.61 132.00 131.93 1e9h h PRO 102 Ca 0.67 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.78 1e9h h PRO 102 Cb 1.51 0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.65 1e9h h PRO 102 CO -0.46 -0.13 0.07 1.25 -0.21 0.00 0.00 178.00 178.52 1e9h h LEU 103 N -0.20 0.25 -0.69 2.35 5.85 -1.04 0.11 115.31 121.93 1e9h h LEU 103 Ca 0.13 -0.17 0.10 0.00 0.84 0.00 0.00 57.88 58.78 1e9h h LEU 103 Cb 0.40 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 41.29 1e9h h LEU 103 CO -0.35 0.36 0.31 0.40 -0.34 0.00 0.00 178.44 178.82 1e9h h ILE 104 N 0.13 0.79 -0.01 4.05 2.04 -0.68 0.17 117.51 124.00 1e9h h ILE 104 Ca 0.06 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 1e9h h ILE 104 Cb 0.19 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1e9h h ILE 104 CO -0.00 0.10 0.00 0.50 0.00 0.00 0.00 178.15 178.74 1e9h h LYS 105 N 0.53 0.02 -0.28 2.37 3.64 0.58 -1.77 116.57 121.65 1e9h h LYS 105 Ca 0.35 -0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.76 1e9h h LYS 105 Cb 0.42 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.21 1e9h h LYS 105 CO -0.30 0.29 0.10 1.03 -2.27 0.00 0.00 179.45 178.29 1e9h h SER 106 N -0.26 0.11 -0.18 4.20 0.87 -0.27 0.36 113.55 118.38 1e9h h SER 106 Ca 0.00 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1e9h h SER 106 Cb 0.28 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 1e9h h SER 106 CO 0.00 0.10 0.11 1.88 -0.53 0.00 0.00 176.83 178.39 1e9h h TYR 107 N 0.23 0.24 -0.41 2.24 0.05 -0.65 -0.89 116.97 117.78 1e9h h TYR 107 Ca 0.12 -0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.91 1e9h h TYR 107 Cb 0.09 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.73 1e9h h TYR 107 CO -0.13 0.20 0.26 1.25 -1.05 0.00 0.00 178.16 178.69 1e9h h LEU 108 N 0.21 0.45 0.02 3.88 5.85 -1.13 0.92 115.31 125.50 1e9h h LEU 108 Ca 0.06 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1e9h h LEU 108 Cb 0.03 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 40.91 1e9h h LEU 108 CO -0.01 0.32 -0.31 0.15 -0.34 0.00 0.00 178.44 178.26 1e9h h PHE 109 N 0.54 -0.83 0.01 1.25 3.57 -0.62 0.12 116.94 120.97 1e9h h PHE 109 Ca 0.15 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.70 1e9h h PHE 109 Cb -0.04 0.37 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 1e9h h PHE 109 CO -0.05 -0.40 -0.11 1.96 -2.23 0.00 0.00 178.31 177.48 1e9h h GLN 110 N -0.47 -0.18 -0.72 1.11 4.20 -0.94 -2.19 115.11 115.92 1e9h h GLN 110 Ca 0.06 0.01 0.12 0.00 0.06 0.00 0.00 58.65 58.90 1e9h h GLN 110 Cb 0.54 0.04 -0.08 0.00 0.30 0.00 0.00 27.48 28.28 1e9h h GLN 110 CO -0.24 -0.12 0.31 -0.07 -0.67 0.00 0.00 178.83 178.03 1e9h h LEU 111 N -0.19 0.34 -2.05 1.46 3.38 -0.48 0.43 115.31 118.20 1e9h h LEU 111 Ca 0.04 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1e9h h LEU 111 Cb 0.23 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 1e9h h LEU 111 CO -0.10 0.16 -0.07 -0.07 0.09 0.00 0.00 178.44 178.45 1e9h h LEU 112 N 0.49 0.00 -0.06 1.67 3.38 -0.26 -2.04 115.31 118.49 1e9h h LEU 112 Ca 0.38 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.27 1e9h h LEU 112 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1e9h h LEU 112 CO -0.34 0.07 -0.27 1.56 0.09 0.00 0.00 178.44 179.55 1e9h h GLN 113 N 0.00 0.29 -0.87 1.13 4.20 0.39 -1.81 115.11 118.43 1e9h h GLN 113 Ca -0.00 -0.23 0.03 0.00 0.06 0.00 0.00 58.65 58.50 1e9h h GLN 113 Cb 0.16 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.94 1e9h h GLN 113 CO 0.01 0.88 0.57 0.78 -0.67 0.00 0.00 178.83 180.40 1e9h h GLY 114 N -0.24 1.24 0.80 3.46 0.00 -0.76 -1.82 103.07 105.74 1e9h h GLY 114 Ca -0.02 -0.44 -0.10 0.00 0.00 0.00 0.00 47.33 46.77 1e9h h GLY 114 CO 0.06 0.40 -0.32 -2.00 0.00 0.00 0.00 176.54 174.67 1e9h h LEU 115 N 1.12 0.51 -1.22 3.11 5.85 -1.41 -1.89 115.31 121.39 1e9h h LEU 115 Ca 0.34 -0.58 0.08 0.00 0.84 0.00 0.00 57.88 58.56 1e9h h LEU 115 Cb -0.03 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 40.79 1e9h h LEU 115 CO -0.09 1.00 0.56 0.00 -0.34 0.00 0.00 178.44 179.57 1e9h h ALA 116 N 0.53 1.62 0.07 1.25 0.00 -1.11 0.13 119.26 121.75 1e9h h ALA 116 Ca -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1e9h h ALA 116 Cb 0.93 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1e9h h ALA 116 CO 0.07 0.22 -0.03 0.35 0.00 0.00 0.00 179.25 179.86 1e9h h PHE 117 N 0.90 -0.08 -0.50 0.00 3.57 -1.15 0.14 116.94 119.82 1e9h h PHE 117 Ca 0.39 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.97 1e9h h PHE 117 Cb 0.34 0.03 -0.07 0.00 2.79 0.00 0.00 35.95 39.04 1e9h h PHE 117 CO -0.00 0.15 0.13 0.00 -2.23 0.00 0.00 178.31 176.36 1e9h h HIS 119 N 0.28 0.23 0.00 0.00 3.86 -0.68 0.16 115.15 118.99 1e9h h HIS 119 Ca 0.25 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.40 1e9h h HIS 119 Cb 0.32 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.74 1e9h h HIS 119 CO -0.20 0.60 0.00 0.77 0.86 0.00 0.00 177.93 179.96 1e9h h SER 120 N 0.16 0.00 -0.24 2.45 0.02 0.36 -2.55 113.55 113.74 1e9h h SER 120 Ca 0.01 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.83 1e9h h SER 120 Cb 0.84 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.31 1e9h h SER 120 CO 0.07 0.00 -0.22 1.41 -1.14 0.00 0.00 176.83 176.94 1e9h n HIS 121 N -2.66 0.75 -3.92 3.45 8.25 -0.70 -4.97 115.22 115.42 1e9h n HIS 121 Ca 0.01 -1.59 -0.27 0.00 -0.26 0.00 0.00 57.72 55.61 1e9h n HIS 121 Cb 0.24 -0.42 -0.01 0.00 1.12 0.00 0.00 29.99 30.92 1e9h n HIS 121 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1e9h n ARG 122 N -1.13 -2.91 -4.24 -0.41 -4.01 -0.96 -4.93 116.66 98.08 1e9h n ARG 122 Ca 0.29 0.40 -0.26 0.00 -1.04 0.00 0.00 57.85 57.25 1e9h n ARG 122 Cb 0.93 -4.41 -0.17 0.00 -3.04 0.00 0.00 32.46 25.77 1e9h n ARG 122 CO 0.00 0.00 0.00 0.08 -3.04 0.00 0.00 177.63 174.67 1e9h s VAL 123 N -3.88 1.06 -0.23 8.89 1.01 0.50 -1.75 120.40 126.00 1e9h s VAL 123 Ca 0.08 -0.38 -0.10 0.00 0.00 0.00 0.00 61.98 61.59 1e9h s VAL 123 Cb -0.03 -1.03 -0.05 0.00 0.00 0.00 0.00 36.38 35.27 1e9h s VAL 123 CO 0.89 0.36 0.15 -0.76 0.00 0.00 0.00 175.10 175.73 1e9h s LEU 124 N 1.18 4.09 -0.05 3.92 1.43 -0.80 -3.73 118.68 124.71 1e9h s LEU 124 Ca -0.05 0.11 -0.25 0.00 -1.03 0.00 0.00 54.13 52.91 1e9h s LEU 124 Cb -0.14 -2.09 -0.22 0.00 0.03 0.00 0.00 46.19 43.76 1e9h s LEU 124 CO -0.02 0.08 1.07 -0.74 0.23 0.00 0.00 176.35 176.96 1e9h h HIS 125 N 7.43 0.18 -0.93 0.29 -0.00 -1.91 -2.18 115.15 118.04 1e9h h HIS 125 Ca -0.38 -0.09 -0.40 0.00 -0.00 0.00 0.00 60.37 59.50 1e9h h HIS 125 Cb 1.17 -0.02 -0.16 0.00 -0.00 0.00 0.00 27.41 28.40 1e9h h HIS 125 CO 0.66 0.84 -0.36 0.54 -0.00 0.00 0.00 177.93 179.60 1e9h n ARG 126 N -4.60 -1.38 -2.41 5.26 1.74 -1.26 -2.81 116.66 111.20 1e9h n ARG 126 Ca -0.09 1.19 -0.03 0.00 -0.77 0.00 0.00 57.85 58.15 1e9h n ARG 126 Cb 0.43 -5.52 0.10 0.00 -1.02 0.00 0.00 32.46 26.45 1e9h n ARG 126 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1e9h n ASP 127 N -1.18 -1.36 -4.66 0.55 2.03 -1.26 -2.80 116.55 107.87 1e9h n ASP 127 Ca -0.19 -2.15 -0.43 0.00 0.52 0.00 0.00 54.79 52.54 1e9h n ASP 127 Cb 0.65 0.62 -0.02 0.00 -0.72 0.00 0.00 41.12 41.64 1e9h n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1e9h s LEU 128 N -3.45 4.18 0.08 -2.67 1.43 -1.26 -4.84 118.68 112.15 1e9h s LEU 128 Ca 0.08 1.79 -0.19 0.00 -1.03 0.00 0.00 54.13 54.78 1e9h s LEU 128 Cb 0.38 -3.54 0.04 0.00 0.03 0.00 0.00 46.19 43.10 1e9h s LEU 128 CO -0.11 -0.85 0.44 -1.59 0.23 0.00 0.00 176.35 174.47 1e9h s LYS 129 N 3.73 1.01 0.63 1.70 -2.85 -1.26 -4.85 119.74 117.85 1e9h s LYS 129 Ca 0.60 -0.45 0.29 0.00 -1.00 0.00 0.00 55.97 55.41 1e9h s LYS 129 Cb -0.24 0.45 1.53 0.00 -2.06 0.00 0.00 37.83 37.51 1e9h s LYS 129 CO 0.19 -0.37 1.90 -1.35 0.10 0.00 0.00 175.35 175.82 1e9h h PRO 130 N 2.71 0.00 0.00 1.78 0.11 -1.94 0.14 132.00 134.79 1e9h h PRO 130 Ca -0.32 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.70 1e9h h PRO 130 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1e9h h PRO 130 CO 0.44 0.00 -0.45 -0.56 -0.21 0.00 0.00 178.00 177.21 1e9h h GLN 131 N 0.00 0.00 -0.56 1.05 -0.00 -1.95 -2.41 115.11 111.23 1e9h h GLN 131 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.74 1e9h h GLN 131 Cb 0.89 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.37 1e9h h GLN 131 CO -0.00 0.43 0.00 0.09 -0.00 0.00 0.00 178.83 179.35 1e9h n ASN 132 N -3.20 3.05 -4.34 0.06 3.02 0.47 -4.77 115.26 109.54 1e9h n ASN 132 Ca 0.02 -2.21 -0.33 0.00 -0.03 0.00 0.00 54.58 52.04 1e9h n ASN 132 Cb 0.71 -0.42 -0.15 0.00 -0.61 0.00 0.00 39.78 39.31 1e9h n ASN 132 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1e9h s LEU 133 N -1.26 2.59 0.00 3.41 1.43 -1.20 -0.79 118.68 122.86 1e9h s LEU 133 Ca 0.33 -0.37 0.02 0.00 -1.03 0.00 0.00 54.13 53.08 1e9h s LEU 133 Cb 0.20 -1.57 -0.03 0.00 0.03 0.00 0.00 46.19 44.81 1e9h s LEU 133 CO 0.18 0.17 -0.04 -0.76 0.23 0.00 0.00 176.35 176.12 1e9h s LEU 134 N 0.32 3.31 0.00 1.79 1.43 -0.27 -0.85 118.68 124.42 1e9h s LEU 134 Ca -0.12 -0.09 0.04 0.00 -1.03 0.00 0.00 54.13 52.93 1e9h s LEU 134 Cb -0.16 -1.89 -0.01 0.00 0.03 0.00 0.00 46.19 44.15 1e9h s LEU 134 CO 0.06 0.28 -0.12 0.27 0.23 0.00 0.00 176.35 177.07 1e9h s ILE 135 N -1.03 0.96 0.54 -0.59 -4.36 0.40 0.00 121.20 117.11 1e9h s ILE 135 Ca 0.18 -0.61 0.06 0.00 -0.26 0.00 0.00 60.65 60.02 1e9h s ILE 135 Cb -0.11 -0.82 0.04 0.00 1.25 0.00 0.00 42.46 42.81 1e9h s ILE 135 CO 0.08 0.20 0.41 0.54 0.24 0.00 0.00 174.94 176.42 1e9h s ASN 136 N -0.46 4.67 0.00 4.36 2.20 -0.88 -2.12 114.94 122.70 1e9h s ASN 136 Ca 0.04 -1.20 0.17 0.00 -0.94 0.00 0.00 52.86 50.93 1e9h s ASN 136 Cb -0.05 0.34 0.98 0.00 -2.00 0.00 0.00 41.25 40.51 1e9h s ASN 136 CO -0.00 -1.08 1.44 0.35 -2.94 0.00 0.00 177.10 174.87 1e9h n THR 137 N -1.76 0.12 1.05 0.54 -2.24 -1.26 -3.20 114.28 107.52 1e9h n THR 137 Ca -0.01 0.03 0.12 0.00 -2.27 0.00 0.00 64.05 61.93 1e9h n THR 137 Cb 0.64 -0.76 0.12 0.00 -2.10 0.00 0.00 70.33 68.23 1e9h n THR 137 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1e9h n GLU 138 N -1.07 2.07 -0.03 -0.78 4.07 -1.26 -4.55 120.64 119.09 1e9h n GLU 138 Ca 0.12 -1.68 0.00 0.00 -0.06 0.00 0.00 57.16 55.54 1e9h n GLU 138 Cb 0.08 -1.47 0.00 0.00 -0.06 0.00 0.00 31.44 29.99 1e9h n GLU 138 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1e9h n GLY 139 N 1.35 0.65 3.84 8.31 0.00 -1.20 -4.73 105.19 113.41 1e9h n GLY 139 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1e9h n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1e9h s ALA 140 N -2.04 3.34 -0.04 4.61 0.00 -1.26 -4.85 121.76 121.51 1e9h s ALA 140 Ca 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 51.96 52.00 1e9h s ALA 140 Cb 0.00 -2.78 0.02 0.00 0.00 0.00 0.00 23.12 20.36 1e9h s ALA 140 CO 0.00 0.33 0.11 -1.50 0.00 0.00 0.00 175.76 174.70 1e9h s ILE 141 N -1.88 -0.02 0.02 0.00 2.07 -1.26 -2.07 121.20 118.08 1e9h s ILE 141 Ca 0.52 0.06 -0.03 0.00 -1.41 0.00 0.00 60.65 59.79 1e9h s ILE 141 Cb -0.12 -0.16 -0.02 0.00 0.13 0.00 0.00 42.46 42.29 1e9h s ILE 141 CO 0.18 0.02 0.04 -0.54 -1.91 0.00 0.00 174.94 172.73 1e9h s LYS 142 N 0.41 0.46 0.16 3.50 1.02 0.10 -4.68 119.74 120.70 1e9h s LYS 142 Ca -0.03 -0.68 -0.30 0.00 0.02 0.00 0.00 55.97 54.98 1e9h s LYS 142 Cb -0.04 0.17 -0.08 0.00 -0.52 0.00 0.00 37.83 37.36 1e9h s LYS 142 CO -0.02 -0.10 1.22 -0.51 -0.92 0.00 0.00 175.35 175.03 1e9h s LEU 143 N -1.80 4.43 0.00 3.17 1.43 -0.16 -1.11 118.68 124.63 1e9h s LEU 143 Ca -0.10 2.22 0.05 0.00 -1.03 0.00 0.00 54.13 55.26 1e9h s LEU 143 Cb -0.05 -3.60 -0.02 0.00 0.03 0.00 0.00 46.19 42.55 1e9h s LEU 143 CO -0.03 -0.42 0.17 0.00 0.23 0.00 0.00 176.35 176.30 1e9h n ALA 144 N 2.86 0.59 -3.15 4.21 0.00 0.03 -1.51 120.51 123.54 1e9h n ALA 144 Ca 0.06 -2.03 -0.20 0.00 0.00 0.00 0.00 53.44 51.27 1e9h n ALA 144 Cb 0.45 1.41 0.02 0.00 0.00 0.00 0.00 19.45 21.32 1e9h n ALA 144 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1e9h n ASP 145 N -1.56 -6.89 -2.08 0.00 -0.08 -1.26 -4.84 116.55 99.83 1e9h n ASP 145 Ca -0.04 0.19 -0.25 0.00 -1.51 0.00 0.00 54.79 53.18 1e9h n ASP 145 Cb 0.60 -3.82 0.07 0.00 2.34 0.00 0.00 41.12 40.32 1e9h n ASP 145 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1e9h n PHE 146 N -0.41 2.41 0.24 -0.67 3.01 -1.26 -4.47 117.46 116.31 1e9h n PHE 146 Ca 0.02 -2.33 0.14 0.00 1.01 0.00 0.00 57.45 56.28 1e9h n PHE 146 Cb 0.56 -1.13 0.37 0.00 -0.01 0.00 0.00 39.48 39.26 1e9h n PHE 146 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1e9h h GLY 147 N 2.15 0.00 -1.10 1.37 0.00 -1.90 -3.20 103.07 100.39 1e9h h GLY 147 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.79 1e9h h GLY 147 CO 1.13 0.00 0.00 1.04 0.00 0.00 0.00 176.54 178.71 1e9h n LEU 148 N -3.11 2.25 -4.74 3.11 7.99 -1.26 -4.77 117.00 116.47 1e9h n LEU 148 Ca 0.03 -1.19 -0.32 0.00 -0.01 0.00 0.00 56.01 54.52 1e9h n LEU 148 Cb 0.45 -0.05 0.11 0.00 -0.11 0.00 0.00 43.42 43.81 1e9h n LEU 148 CO 0.32 0.45 0.71 0.00 -1.51 0.00 0.00 177.39 177.36 1e9h s ALA 149 N -1.05 2.06 -0.10 -1.18 0.00 -1.13 -4.70 121.76 115.66 1e9h s ALA 149 Ca 0.17 0.45 -0.24 0.00 0.00 0.00 0.00 51.96 52.34 1e9h s ALA 149 Cb 0.11 -3.35 0.05 0.00 0.00 0.00 0.00 23.12 19.94 1e9h s ALA 149 CO 0.16 -1.99 0.56 -0.98 0.00 0.00 0.00 175.76 173.52 1e9h s ARG 150 N -4.64 0.84 0.29 0.00 1.04 -0.82 -4.86 118.95 110.80 1e9h s ARG 150 Ca 0.65 0.35 -0.28 0.00 -1.04 0.00 0.00 55.73 55.40 1e9h s ARG 150 Cb -0.20 0.40 -0.09 0.00 -2.04 0.00 0.00 34.95 33.01 1e9h s ARG 150 CO 0.54 -0.21 1.03 0.00 -0.04 0.00 0.00 175.30 176.61 1e9h s ALA 151 N -0.71 3.32 0.33 7.88 0.00 -1.26 -1.91 121.76 129.41 1e9h s ALA 151 Ca -0.08 0.74 0.08 0.00 0.00 0.00 0.00 51.96 52.70 1e9h s ALA 151 Cb -0.03 -3.27 -0.06 0.00 0.00 0.00 0.00 23.12 19.76 1e9h s ALA 151 CO 0.06 -0.02 -0.06 -0.59 0.00 0.00 0.00 175.76 175.15 1e9h s PHE 152 N -1.29 2.22 0.46 0.00 -0.71 -0.72 -4.95 117.98 112.99 1e9h s PHE 152 Ca 0.46 -0.63 0.07 0.00 -1.04 0.00 0.00 56.93 55.78 1e9h s PHE 152 Cb -0.27 -1.33 -0.01 0.00 -1.21 0.00 0.00 43.02 40.20 1e9h s PHE 152 CO 0.34 0.41 0.30 0.20 -1.34 0.00 0.00 175.22 175.13 1e9h s GLY 153 N -3.55 2.31 -0.26 1.99 0.00 -1.26 -4.87 107.32 101.68 1e9h s GLY 153 Ca 0.32 -1.73 0.02 0.00 0.00 0.00 0.00 44.72 43.34 1e9h s GLY 153 CO 0.15 -1.87 -0.08 0.14 0.00 0.00 0.00 173.10 171.44 1e9h s VAL 154 N -2.63 1.98 1.00 1.40 1.01 -1.26 -2.46 120.40 119.44 1e9h s VAL 154 Ca 0.40 -1.58 -0.16 0.00 0.00 0.00 0.00 61.98 60.64 1e9h s VAL 154 Cb -0.00 -2.17 0.20 0.00 0.00 0.00 0.00 36.38 34.41 1e9h s VAL 154 CO 0.23 -0.11 1.22 -2.16 0.00 0.00 0.00 175.10 174.29 1e9h s PRO 155 N 1.17 0.42 0.55 2.72 0.04 -1.26 -5.13 135.00 133.51 1e9h s PRO 155 Ca -0.06 -0.14 -0.13 0.00 0.04 0.00 0.00 61.00 60.71 1e9h s PRO 155 Cb -0.20 -1.79 -0.06 0.00 0.04 0.00 0.00 34.50 32.49 1e9h s PRO 155 CO -0.06 -2.61 0.98 0.14 0.04 0.00 0.00 177.00 175.49 1e9h s VAL 156 N -3.52 4.66 0.48 -0.36 -7.23 -1.03 -5.09 120.40 108.31 1e9h s VAL 156 Ca 0.70 0.95 0.03 0.00 -1.81 0.00 0.00 61.98 61.85 1e9h s VAL 156 Cb -0.08 -3.80 -0.03 0.00 0.56 0.00 0.00 36.38 33.03 1e9h s VAL 156 CO 0.53 -0.90 0.01 0.00 -0.31 0.00 0.00 175.10 174.44 1e9h s ARG 157 N -4.60 2.12 0.09 4.82 1.70 -1.26 -5.02 118.95 116.79 1e9h s ARG 157 Ca 0.56 -2.31 -0.31 0.00 -0.47 0.00 0.00 55.73 53.20 1e9h s ARG 157 Cb -0.10 -1.49 -0.09 0.00 -0.57 0.00 0.00 34.95 32.69 1e9h s ARG 157 CO 0.43 -0.29 1.73 0.99 -1.08 0.00 0.00 175.30 177.08 1e9h s THR 158 N -2.86 2.83 0.00 4.99 2.01 -1.26 -4.77 115.64 116.57 1e9h s THR 158 Ca 0.14 0.29 0.00 0.00 0.31 0.00 0.00 61.69 62.43 1e9h s THR 158 Cb 0.04 -3.19 0.00 0.00 0.01 0.00 0.00 72.50 69.36 1e9h s THR 158 CO 0.07 -0.00 0.00 -1.22 -0.69 0.00 0.00 174.62 172.78 1e9h n TYR 159 N 5.68 0.00 0.00 4.92 4.01 -1.26 -5.11 117.16 125.40 1e9h n TYR 159 Ca 0.17 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 1e9h n TYR 159 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 1e9h n TYR 159 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1e9h n HIS 161 N -0.85 0.00 -0.96 -0.72 -0.00 -1.26 -5.06 115.22 106.37 1e9h n HIS 161 Ca 0.00 0.00 -0.43 0.00 0.46 0.00 0.00 57.72 57.75 1e9h n HIS 161 Cb 0.00 0.00 -0.07 0.00 -0.12 0.00 0.00 29.99 29.80 1e9h n HIS 161 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 1e9h n GLU 162 N -1.39 1.12 -4.06 1.57 4.71 -1.26 -4.83 120.64 116.51 1e9h n GLU 162 Ca 0.00 -1.60 -0.14 0.00 -0.01 0.00 0.00 57.16 55.41 1e9h n GLU 162 Cb 0.06 -2.79 -0.13 0.00 -1.01 0.00 0.00 31.44 27.58 1e9h n GLU 162 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1e9h s VAL 163 N 5.46 0.34 0.11 2.62 0.11 -1.26 -5.08 120.40 122.71 1e9h s VAL 163 Ca 0.59 -0.51 0.00 0.00 -2.93 0.00 0.00 61.98 59.13 1e9h s VAL 163 Cb 0.14 -0.35 0.00 0.00 -1.53 0.00 0.00 36.38 34.64 1e9h s VAL 163 CO 0.17 -0.12 0.00 0.52 -3.33 0.00 0.00 175.10 172.34 1e9h n VAL 164 N 2.39 -2.34 -1.68 2.04 0.31 -1.12 -4.89 118.33 113.04 1e9h n VAL 164 Ca -0.17 0.74 -0.45 0.00 -0.01 0.00 0.00 64.34 64.46 1e9h n VAL 164 Cb 0.57 -1.62 -0.03 0.00 -0.91 0.00 0.00 33.84 31.85 1e9h n VAL 164 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1e9h n THR 165 N -0.29 0.36 -0.35 2.52 -1.04 -1.26 -4.67 114.28 109.54 1e9h n THR 165 Ca 0.00 -0.09 0.06 0.00 -2.04 0.00 0.00 64.05 61.98 1e9h n THR 165 Cb 0.00 -1.59 0.15 0.00 -1.82 0.00 0.00 70.33 67.06 1e9h n THR 165 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1e9h n LEU 166 N 3.00 -0.33 0.29 -4.42 7.94 -1.26 -0.73 117.00 121.49 1e9h n LEU 166 Ca 0.15 1.66 0.17 0.00 -1.11 0.00 0.00 56.01 56.88 1e9h n LEU 166 Cb 0.31 -0.51 0.90 0.00 0.53 0.00 0.00 43.42 44.65 1e9h n LEU 166 CO 0.63 -1.60 1.07 -0.50 -1.11 0.00 0.00 177.39 175.88 1e9h h TRP 167 N 0.00 0.00 -0.09 1.96 4.06 -1.89 -2.49 115.95 117.50 1e9h h TRP 167 Ca 0.47 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.42 1e9h h TRP 167 Cb 0.74 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.90 1e9h h TRP 167 CO -0.73 0.05 0.00 0.66 -3.56 0.00 0.00 178.44 174.86 1e9h n TYR 168 N -3.44 0.24 -3.03 0.49 4.01 0.09 -4.57 117.16 110.95 1e9h n TYR 168 Ca -0.02 -0.81 -0.40 0.00 -0.16 0.00 0.00 57.90 56.51 1e9h n TYR 168 Cb 0.17 -0.15 -0.05 0.00 -0.31 0.00 0.00 39.34 39.00 1e9h n TYR 168 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1e9h s ARG 169 N -2.25 4.44 0.51 -0.72 3.52 -0.58 -3.88 118.95 119.99 1e9h s ARG 169 Ca 0.26 0.91 -0.20 0.00 -0.13 0.00 0.00 55.73 56.57 1e9h s ARG 169 Cb 0.21 -3.44 -0.07 0.00 -1.56 0.00 0.00 34.95 30.09 1e9h s ARG 169 CO 0.05 0.08 1.10 0.00 -0.81 0.00 0.00 175.30 175.72 1e9h s ALA 170 N 0.72 2.80 0.40 6.12 0.00 -1.26 -4.88 121.76 125.67 1e9h s ALA 170 Ca 0.38 0.75 0.13 0.00 0.00 0.00 0.00 51.96 53.23 1e9h s ALA 170 Cb -0.18 -3.32 0.97 0.00 0.00 0.00 0.00 23.12 20.58 1e9h s ALA 170 CO 0.19 -0.57 1.89 -1.00 0.00 0.00 0.00 175.76 176.27 1e9h h PRO 171 N 1.47 0.51 0.00 0.00 0.13 -1.97 0.01 132.00 132.14 1e9h h PRO 171 Ca -0.50 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.59 1e9h h PRO 171 Cb 1.24 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 1e9h h PRO 171 CO 0.58 0.33 -0.06 1.05 -0.23 0.00 0.00 178.00 179.67 1e9h h GLU 172 N 0.52 0.00 0.07 0.86 9.09 -1.93 0.30 114.58 123.49 1e9h h GLU 172 Ca 0.41 0.00 -0.20 0.00 0.05 0.00 0.00 59.36 59.62 1e9h h GLU 172 Cb 0.84 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.93 1e9h h GLU 172 CO -0.16 0.06 -1.05 0.82 0.05 0.00 0.00 179.01 178.73 1e9h h ILE 173 N 0.00 1.20 -0.41 -1.06 2.04 -1.36 -1.11 117.51 116.80 1e9h h ILE 173 Ca -0.00 -2.35 0.06 0.00 1.00 0.00 0.00 64.86 63.57 1e9h h ILE 173 Cb 0.41 2.78 -0.02 0.00 -0.74 0.00 0.00 36.82 39.25 1e9h h ILE 173 CO 0.01 0.60 0.28 -0.07 0.00 0.00 0.00 178.15 178.97 1e9h h LEU 174 N -0.60 0.27 -0.84 1.44 3.38 -1.02 -0.67 115.31 117.28 1e9h h LEU 174 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1e9h h LEU 174 Cb 1.50 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.19 1e9h h LEU 174 CO -0.01 0.18 -0.01 0.18 0.09 0.00 0.00 178.44 178.87 1e9h n LEU 175 N -4.48 1.31 -0.32 1.67 4.77 0.10 -4.86 117.00 115.20 1e9h n LEU 175 Ca 0.05 -0.43 -0.03 0.00 -0.03 0.00 0.00 56.01 55.57 1e9h n LEU 175 Cb 0.25 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.33 1e9h n LEU 175 CO 0.35 0.22 -0.04 0.61 -1.33 0.00 0.00 177.39 177.20 1e9h n GLY 176 N 1.16 0.44 3.70 -0.72 0.00 -0.26 -0.21 105.19 109.32 1e9h n GLY 176 Ca 0.19 -0.84 -0.44 0.00 0.00 0.00 0.00 46.02 44.94 1e9h n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1e9h n LYS 178 N 2.35 0.01 -3.91 0.00 2.85 -1.26 -4.57 118.16 113.63 1e9h n LYS 178 Ca 0.11 0.20 -0.22 0.00 -1.05 0.00 0.00 58.31 57.35 1e9h n LYS 178 Cb 0.33 -1.52 -0.17 0.00 -0.65 0.00 0.00 35.03 33.02 1e9h n LYS 178 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1e9h s TYR 179 N -3.01 0.80 0.06 5.58 2.02 -1.26 -4.06 117.35 117.48 1e9h s TYR 179 Ca 0.09 -0.26 0.03 0.00 -0.37 0.00 0.00 57.07 56.56 1e9h s TYR 179 Cb 0.12 -0.82 -0.03 0.00 -0.40 0.00 0.00 41.96 40.83 1e9h s TYR 179 CO 0.34 -0.31 -0.09 1.52 -1.57 0.00 0.00 175.55 175.43 1e9h s TYR 180 N 1.60 0.84 0.00 2.71 -0.85 -1.26 -5.05 117.35 115.34 1e9h s TYR 180 Ca -0.00 -0.55 0.00 0.00 -0.52 0.00 0.00 57.07 56.00 1e9h s TYR 180 Cb -0.13 -0.49 0.00 0.00 0.38 0.00 0.00 41.96 41.72 1e9h s TYR 180 CO -0.04 -0.05 0.00 0.45 -1.52 0.00 0.00 175.55 174.39 1e9h n SER 181 N 1.18 0.00 0.10 -0.18 2.88 -1.26 -4.93 113.62 111.41 1e9h n SER 181 Ca -0.21 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 57.52 1e9h n SER 181 Cb 0.55 0.00 0.75 0.00 -0.75 0.00 0.00 64.21 64.76 1e9h n SER 181 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1e9h h THR 182 N 0.00 0.58 0.00 2.46 1.35 -1.98 -2.04 112.91 113.27 1e9h h THR 182 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1e9h h THR 182 Cb 0.00 0.76 -0.00 0.00 -1.73 0.00 0.00 68.15 67.18 1e9h h THR 182 CO 0.00 0.00 -0.01 0.00 -0.25 0.00 0.00 175.52 175.26 1e9h h ALA 183 N 1.70 1.42 0.00 6.62 0.00 -1.93 -1.62 119.26 125.45 1e9h h ALA 183 Ca 0.17 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1e9h h ALA 183 Cb 0.81 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1e9h h ALA 183 CO -0.00 0.02 -0.37 -0.39 0.00 0.00 0.00 179.25 178.51 1e9h h VAL 184 N 0.00 1.11 0.00 0.00 -1.51 -1.78 -1.40 116.25 112.68 1e9h h VAL 184 Ca -0.00 -1.33 -0.13 0.00 -1.23 0.00 0.00 66.70 64.01 1e9h h VAL 184 Cb 0.04 1.75 -0.02 0.00 -2.13 0.00 0.00 31.29 30.93 1e9h h VAL 184 CO 0.00 0.36 -0.62 0.44 -1.23 0.00 0.00 177.57 176.52 1e9h h ASP 185 N 0.00 0.00 -0.26 4.19 3.32 -1.49 -2.86 116.42 119.32 1e9h h ASP 185 Ca -0.00 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.88 1e9h h ASP 185 Cb 0.72 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.27 1e9h h ASP 185 CO 0.05 0.62 -0.47 0.40 -1.72 0.00 0.00 179.24 178.12 1e9h h ILE 186 N 0.00 1.29 -0.28 0.35 1.08 -1.33 -2.18 117.51 116.45 1e9h h ILE 186 Ca -0.01 -1.67 0.05 0.00 -0.39 0.00 0.00 64.86 62.85 1e9h h ILE 186 Cb 1.27 1.70 -0.05 0.00 -3.07 0.00 0.00 36.82 36.67 1e9h h ILE 186 CO 0.08 0.53 -0.05 -0.25 -0.69 0.00 0.00 178.15 177.77 1e9h h TRP 187 N 0.52 -0.12 -0.49 1.37 2.91 -1.22 0.65 115.95 119.58 1e9h h TRP 187 Ca 0.01 0.02 0.07 0.00 1.13 0.00 0.00 58.89 60.13 1e9h h TRP 187 Cb 1.07 0.09 -0.06 0.00 -0.51 0.00 0.00 29.16 29.76 1e9h h TRP 187 CO 0.08 -0.10 0.14 0.77 -1.03 0.00 0.00 178.44 178.30 1e9h h SER 188 N 0.02 0.10 -0.19 2.65 0.02 -1.38 -1.49 113.55 113.28 1e9h h SER 188 Ca 0.13 0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 61.11 1e9h h SER 188 Cb 0.20 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 1e9h h SER 188 CO -0.27 0.09 0.01 -0.07 -1.14 0.00 0.00 176.83 175.45 1e9h h LEU 189 N 0.30 0.41 -0.66 5.07 3.38 -0.59 -0.93 115.31 122.29 1e9h h LEU 189 Ca 0.24 -0.06 -0.11 0.00 0.09 0.00 0.00 57.88 58.03 1e9h h LEU 189 Cb 0.28 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1e9h h LEU 189 CO -0.27 0.46 -0.16 1.23 0.09 0.00 0.00 178.44 179.79 1e9h h GLY 190 N 0.74 0.95 1.44 0.83 0.00 0.03 0.63 103.07 107.69 1e9h h GLY 190 Ca 0.10 -0.78 -0.10 0.00 0.00 0.00 0.00 47.33 46.56 1e9h h GLY 190 CO 0.01 0.71 -0.18 0.00 0.00 0.00 0.00 176.54 177.08 1e9h h ILE 192 N 0.59 1.37 0.24 0.00 2.04 -0.92 0.86 117.51 121.68 1e9h h ILE 192 Ca 0.09 -2.14 -0.01 0.00 1.00 0.00 0.00 64.86 63.80 1e9h h ILE 192 Cb 0.63 2.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.83 1e9h h ILE 192 CO 0.04 0.65 -0.11 0.15 0.00 0.00 0.00 178.15 178.88 1e9h h PHE 193 N 0.31 -0.30 -0.36 1.37 3.57 -0.67 0.42 116.94 121.28 1e9h h PHE 193 Ca -0.04 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.52 1e9h h PHE 193 Cb 1.34 0.10 -0.05 0.00 2.79 0.00 0.00 35.95 40.12 1e9h h PHE 193 CO 0.05 -0.08 0.03 0.00 -2.23 0.00 0.00 178.31 176.08 1e9h h ALA 194 N 0.27 0.36 -0.61 2.41 0.00 -1.07 -1.88 119.26 118.73 1e9h h ALA 194 Ca -0.03 0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1e9h h ALA 194 Cb 0.35 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1e9h h ALA 194 CO 0.05 -0.37 0.41 1.49 0.00 0.00 0.00 179.25 180.83 1e9h h GLU 195 N 0.14 0.76 -0.02 0.00 4.81 -0.50 -2.11 114.58 117.66 1e9h h GLU 195 Ca 0.18 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.27 1e9h h GLU 195 Cb 0.23 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1e9h h GLU 195 CO -0.27 0.50 -0.42 0.52 -0.73 0.00 0.00 179.01 178.61 1e9h h MET 196 N 0.78 0.03 0.24 1.92 2.86 -0.08 -0.40 114.93 120.29 1e9h h MET 196 Ca 0.24 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.85 1e9h h MET 196 Cb -0.01 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.65 1e9h h MET 196 CO -0.06 0.45 -0.12 0.28 1.06 0.00 0.00 176.91 178.53 1e9h h VAL 197 N 0.03 0.00 0.00 -2.22 2.07 -1.15 -3.37 116.25 111.60 1e9h h VAL 197 Ca -0.00 -0.40 -0.09 0.00 0.82 0.00 0.00 66.70 67.03 1e9h h VAL 197 Cb 0.76 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1e9h h VAL 197 CO 0.06 0.00 -0.43 0.71 0.02 0.00 0.00 177.57 177.93 1e9h h THR 198 N -0.73 0.83 0.00 2.57 1.35 -1.61 -3.46 112.91 111.87 1e9h h THR 198 Ca -0.03 -1.84 0.00 0.00 -0.55 0.00 0.00 66.41 63.99 1e9h h THR 198 Cb 0.25 2.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.84 1e9h h THR 198 CO 0.05 0.42 0.00 0.54 -0.25 0.00 0.00 175.52 176.28 1e9h n ARG 199 N -3.35 0.00 -3.65 4.72 1.74 -0.16 -5.04 116.66 110.92 1e9h n ARG 199 Ca 0.01 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.96 1e9h n ARG 199 Cb 0.62 -1.93 -0.13 0.00 -1.02 0.00 0.00 32.46 30.00 1e9h n ARG 199 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1e9h s ARG 200 N -0.33 0.16 0.00 5.56 1.70 -1.24 -5.01 118.95 119.79 1e9h s ARG 200 Ca 0.00 0.74 0.00 0.00 -0.47 0.00 0.00 55.73 56.00 1e9h s ARG 200 Cb 0.00 -0.06 0.00 0.00 -0.57 0.00 0.00 34.95 34.32 1e9h s ARG 200 CO 0.00 -0.30 0.00 0.00 -1.08 0.00 0.00 175.30 173.92 1e9h n ALA 201 N 5.35 -0.24 0.13 7.88 0.00 -1.26 -4.78 120.51 127.59 1e9h n ALA 201 Ca -0.06 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.24 1e9h n ALA 201 Cb 0.50 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.88 1e9h n ALA 201 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1e9h h LEU 202 N 0.00 -0.30 -7.00 0.00 5.85 -1.91 -3.37 115.31 108.57 1e9h h LEU 202 Ca 0.00 0.02 -0.62 0.00 0.84 0.00 0.00 57.88 58.12 1e9h h LEU 202 Cb 0.00 0.09 -0.41 0.00 0.37 0.00 0.00 40.66 40.72 1e9h h LEU 202 CO 0.00 -0.19 -0.70 -0.36 -0.34 0.00 0.00 178.44 176.85 1e9h s PHE 203 N -6.14 2.63 -1.07 1.25 0.08 -1.26 -5.02 117.98 108.45 1e9h s PHE 203 Ca -0.15 -2.87 -0.05 0.00 0.12 0.00 0.00 56.93 53.98 1e9h s PHE 203 Cb 0.06 -2.20 0.12 0.00 -0.57 0.00 0.00 43.02 40.43 1e9h s PHE 203 CO 0.65 -0.70 2.45 -0.35 -0.10 0.00 0.00 175.22 177.17 1e9h n PRO 204 N 2.80 4.05 -0.74 0.24 -0.04 -1.26 -4.59 135.00 135.45 1e9h n PRO 204 Ca 0.15 -3.24 -0.30 0.00 -0.04 0.00 0.00 63.50 60.07 1e9h n PRO 204 Cb 0.36 -2.49 0.25 0.00 -0.04 0.00 0.00 33.50 31.59 1e9h n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1e9h s GLY 205 N 0.24 1.51 -0.00 0.55 0.00 -1.26 -4.98 107.32 103.38 1e9h s GLY 205 Ca 0.54 -0.69 0.00 0.00 0.00 0.00 0.00 44.72 44.58 1e9h s GLY 205 CO -0.14 0.18 0.75 2.09 0.00 0.00 0.00 173.10 175.98 1e9h n ASP 206 N -5.04 0.96 -3.51 1.64 5.68 -1.26 -4.86 116.55 110.16 1e9h n ASP 206 Ca 0.10 -1.50 -0.14 0.00 -0.50 0.00 0.00 54.79 52.76 1e9h n ASP 206 Cb 0.58 -0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.52 1e9h n ASP 206 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1e9h s SER 207 N -0.50 -0.51 0.16 -1.12 1.04 -1.26 -5.02 113.70 106.50 1e9h s SER 207 Ca 0.00 0.15 -0.15 0.00 0.48 0.00 0.00 55.95 56.43 1e9h s SER 207 Cb 0.00 0.54 0.08 0.00 0.10 0.00 0.00 66.02 66.74 1e9h s SER 207 CO 0.00 -0.81 1.76 -0.33 0.98 0.00 0.00 173.24 174.84 1e9h h GLU 208 N 2.49 0.32 -0.21 4.02 5.08 -1.98 0.32 114.58 124.62 1e9h h GLU 208 Ca -0.32 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 57.96 1e9h h GLU 208 Cb 1.24 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 1e9h h GLU 208 CO 0.40 0.21 -0.17 0.97 -1.00 0.00 0.00 179.01 179.43 1e9h h ILE 209 N 0.33 1.22 -0.01 3.13 6.09 -1.97 -0.77 117.51 125.53 1e9h h ILE 209 Ca 0.18 -1.00 -0.15 0.00 -1.37 0.00 0.00 64.86 62.51 1e9h h ILE 209 Cb 0.14 1.25 -0.02 0.00 0.47 0.00 0.00 36.82 38.66 1e9h h ILE 209 CO -0.16 0.32 -0.70 -0.78 -3.07 0.00 0.00 178.15 173.75 1e9h h ASP 210 N 0.33 0.09 -0.35 2.19 3.58 -1.71 -2.28 116.42 118.27 1e9h h ASP 210 Ca 0.06 -0.06 -0.16 0.00 0.42 0.00 0.00 57.03 57.28 1e9h h ASP 210 Cb 0.49 -0.03 -0.00 0.00 1.72 0.00 0.00 39.33 41.51 1e9h h ASP 210 CO 0.03 0.76 -0.42 -0.61 -2.88 0.00 0.00 179.24 176.12 1e9h h GLN 211 N 0.05 0.91 0.19 0.28 5.75 0.17 -1.91 115.11 120.55 1e9h h GLN 211 Ca -0.01 -0.51 -0.01 0.00 -0.15 0.00 0.00 58.65 57.97 1e9h h GLN 211 Cb 1.24 0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.82 1e9h h GLN 211 CO 0.10 1.15 -0.09 -0.07 -2.65 0.00 0.00 178.83 177.27 1e9h h LEU 212 N 0.71 -0.22 -1.29 -2.39 3.38 -1.07 -2.17 115.31 112.27 1e9h h LEU 212 Ca 0.05 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.90 1e9h h LEU 212 Cb 1.02 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.79 1e9h h LEU 212 CO 0.10 0.03 0.50 -0.26 0.09 0.00 0.00 178.44 178.90 1e9h h PHE 213 N -0.47 0.90 0.00 1.13 -1.00 -1.45 0.59 116.94 116.63 1e9h h PHE 213 Ca -0.03 0.02 -0.05 0.00 2.81 0.00 0.00 57.97 60.72 1e9h h PHE 213 Cb 0.36 -0.30 -0.01 0.00 3.61 0.00 0.00 35.95 39.61 1e9h h PHE 213 CO -0.00 0.52 -0.26 0.00 -1.61 0.00 0.00 178.31 176.96 1e9h h ARG 214 N 0.93 0.00 0.03 1.51 3.08 -1.23 0.25 114.38 118.95 1e9h h ARG 214 Ca 0.30 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.30 1e9h h ARG 214 Cb 0.05 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.10 1e9h h ARG 214 CO -0.09 0.26 -0.24 0.82 -1.07 0.00 0.00 179.97 179.65 1e9h h ILE 215 N 0.00 1.67 -0.35 2.04 2.04 -0.13 -3.30 117.51 119.48 1e9h h ILE 215 Ca -0.00 -2.27 0.03 0.00 1.00 0.00 0.00 64.86 63.61 1e9h h ILE 215 Cb 0.59 3.19 -0.02 0.00 -0.74 0.00 0.00 36.82 39.83 1e9h h ILE 215 CO 0.03 0.61 0.24 -0.26 0.00 0.00 0.00 178.15 178.77 1e9h h PHE 216 N -0.74 0.36 0.00 1.37 0.04 0.31 -1.00 116.94 117.29 1e9h h PHE 216 Ca -0.04 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1e9h h PHE 216 Cb 1.13 -0.12 0.00 0.00 2.20 0.00 0.00 35.95 39.16 1e9h h PHE 216 CO 0.23 0.22 0.00 0.54 -0.60 0.00 0.00 178.31 178.70 1e9h n ARG 217 N -4.49 0.19 -0.10 1.51 1.74 0.05 0.02 116.66 115.59 1e9h n ARG 217 Ca 0.03 0.07 -0.18 0.00 -0.77 0.00 0.00 57.85 57.00 1e9h n ARG 217 Cb 0.14 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.00 1e9h n ARG 217 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1e9h n THR 218 N -1.38 1.10 0.78 0.55 -1.04 -0.48 -4.64 114.28 109.17 1e9h n THR 218 Ca 0.09 -0.34 0.11 0.00 -2.04 0.00 0.00 64.05 61.87 1e9h n THR 218 Cb 0.23 -1.53 0.11 0.00 -1.82 0.00 0.00 70.33 67.31 1e9h n THR 218 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1e9h n LEU 219 N -3.57 2.86 0.00 -4.42 4.77 -0.63 -1.98 117.00 114.03 1e9h n LEU 219 Ca -0.37 -1.08 0.00 0.00 -0.03 0.00 0.00 56.01 54.52 1e9h n LEU 219 Cb 0.81 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.87 1e9h n LEU 219 CO 0.09 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 1e9h n GLY 220 N 1.22 -1.32 3.70 -0.72 0.00 0.10 -4.53 105.19 103.65 1e9h n GLY 220 Ca 0.13 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.26 1e9h n GLY 220 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1e9h s THR 221 N -3.31 3.94 0.51 2.61 2.01 -0.67 -4.56 115.64 116.17 1e9h s THR 221 Ca 0.00 1.36 -0.21 0.00 0.31 0.00 0.00 61.69 63.15 1e9h s THR 221 Cb 0.00 -3.87 -0.06 0.00 0.01 0.00 0.00 72.50 68.58 1e9h s THR 221 CO 0.00 0.06 1.15 -2.16 -0.69 0.00 0.00 174.62 172.98 1e9h s PRO 222 N 1.58 3.52 0.23 4.92 0.04 -1.26 -4.82 135.00 139.21 1e9h s PRO 222 Ca 0.60 1.70 0.00 0.00 0.04 0.00 0.00 61.00 63.34 1e9h s PRO 222 Cb -0.30 -2.19 -0.04 0.00 0.04 0.00 0.00 34.50 32.01 1e9h s PRO 222 CO 0.27 -0.73 0.12 0.16 0.04 0.00 0.00 177.00 176.86 1e9h s ASP 223 N -1.57 0.63 0.63 6.66 1.47 -1.26 -4.92 116.67 118.31 1e9h s ASP 223 Ca 0.69 -1.39 0.31 0.00 1.18 0.00 0.00 52.55 53.33 1e9h s ASP 223 Cb -0.26 0.28 1.67 0.00 -0.34 0.00 0.00 42.92 44.27 1e9h s ASP 223 CO 0.31 -0.79 2.00 -0.33 0.68 0.00 0.00 175.17 177.03 1e9h h GLU 224 N 2.51 0.00 0.37 2.11 4.39 -1.97 0.62 114.58 122.61 1e9h h GLU 224 Ca -0.37 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.31 1e9h h GLU 224 Cb 1.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 1e9h h GLU 224 CO 0.56 0.00 -0.18 0.28 -1.16 0.00 0.00 179.01 178.51 1e9h h VAL 225 N 0.00 0.00 -0.38 3.13 2.07 -1.99 -3.18 116.25 115.91 1e9h h VAL 225 Ca 0.07 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 67.03 1e9h h VAL 225 Cb 0.69 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1e9h h VAL 225 CO -0.00 0.00 -0.06 1.62 0.02 0.00 0.00 177.57 179.15 1e9h h VAL 226 N -0.99 1.23 -2.53 2.57 3.04 -1.77 -3.39 116.25 114.41 1e9h h VAL 226 Ca -0.05 -0.99 -0.55 0.00 -1.01 0.00 0.00 66.70 64.10 1e9h h VAL 226 Cb 0.38 1.01 -0.38 0.00 -2.01 0.00 0.00 31.29 30.30 1e9h h VAL 226 CO 0.08 0.34 -0.82 0.86 -1.01 0.00 0.00 177.57 177.02 1e9h s TRP 227 N -4.86 0.55 0.08 3.17 -0.11 0.14 -4.50 118.94 113.40 1e9h s TRP 227 Ca -0.08 -1.45 -0.33 0.00 1.22 0.00 0.00 56.10 55.46 1e9h s TRP 227 Cb 0.15 -0.84 -0.12 0.00 -1.50 0.00 0.00 33.47 31.15 1e9h s TRP 227 CO 0.79 -0.85 1.74 -2.30 -4.62 0.00 0.00 176.95 171.71 1e9h n PRO 228 N 4.18 2.32 0.00 5.86 -0.02 -1.20 -3.08 135.00 143.07 1e9h n PRO 228 Ca 0.10 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 1e9h n PRO 228 Cb 0.38 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 1e9h n PRO 228 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1e9h n GLY 229 N 3.92 1.89 0.35 -1.23 0.00 -1.26 -5.04 105.19 103.82 1e9h n GLY 229 Ca 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 1e9h n GLY 229 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1e9h h VAL 230 N 0.00 0.00 0.00 1.61 -1.51 -1.87 -2.06 116.25 112.42 1e9h h VAL 230 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 1e9h h VAL 230 Cb 0.00 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 29.16 1e9h h VAL 230 CO 0.00 0.00 0.32 0.35 -1.23 0.00 0.00 177.57 177.01 1e9h n THR 231 N -4.58 0.75 0.50 7.19 -2.24 -1.26 0.72 114.28 115.36 1e9h n THR 231 Ca -0.07 0.51 0.07 0.00 -2.27 0.00 0.00 64.05 62.30 1e9h n THR 231 Cb 0.30 -1.51 -0.10 0.00 -2.10 0.00 0.00 70.33 66.93 1e9h n THR 231 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1e9h n SER 232 N -1.22 0.92 -4.56 3.42 7.64 -0.78 -4.96 113.62 114.08 1e9h n SER 232 Ca -0.00 -0.60 -0.34 0.00 1.01 0.00 0.00 58.87 58.94 1e9h n SER 232 Cb 0.32 1.22 0.11 0.00 -1.01 0.00 0.00 64.21 64.84 1e9h n SER 232 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 1e9h n MET 233 N -1.57 0.10 -0.21 1.43 2.81 0.22 -4.91 117.12 115.00 1e9h n MET 233 Ca 0.01 0.10 -0.01 0.00 -1.81 0.00 0.00 57.70 55.98 1e9h n MET 233 Cb 0.29 -2.12 0.09 0.00 -0.71 0.00 0.00 33.22 30.77 1e9h n MET 233 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1e9h h PRO 234 N -0.91 0.54 -0.54 0.03 0.11 -1.76 -3.04 132.00 126.44 1e9h h PRO 234 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1e9h h PRO 234 Cb 1.31 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1e9h h PRO 234 CO 0.42 0.36 0.00 -0.25 -0.21 0.00 0.00 178.00 178.32 1e9h n ASP 235 N -4.87 4.76 -4.80 -2.05 8.00 0.71 -4.96 116.55 113.34 1e9h n ASP 235 Ca 0.08 -2.65 -0.35 0.00 0.71 0.00 0.00 54.79 52.58 1e9h n ASP 235 Cb 0.20 -0.58 -0.07 0.00 -0.02 0.00 0.00 41.12 40.66 1e9h n ASP 235 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1e9h s TYR 236 N -2.22 3.50 -0.06 1.24 6.14 -1.15 -4.89 117.35 119.92 1e9h s TYR 236 Ca 0.49 1.69 -0.00 0.00 0.64 0.00 0.00 57.07 59.88 1e9h s TYR 236 Cb 0.34 -2.88 0.03 0.00 0.42 0.00 0.00 41.96 39.87 1e9h s TYR 236 CO 0.19 0.06 -0.02 0.15 0.64 0.00 0.00 175.55 176.56 1e9h s LYS 237 N -2.60 0.75 0.39 4.97 -0.14 -1.26 -4.95 119.74 116.89 1e9h s LYS 237 Ca 0.56 0.00 0.26 0.00 -1.36 0.00 0.00 55.97 55.44 1e9h s LYS 237 Cb -0.14 -0.96 1.42 0.00 -1.68 0.00 0.00 37.83 36.47 1e9h s LYS 237 CO 0.18 -0.22 1.80 -1.00 -0.76 0.00 0.00 175.35 175.36 1e9h h PRO 238 N 7.88 0.00 0.00 -1.68 0.13 -1.97 0.60 132.00 136.96 1e9h h PRO 238 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1e9h h PRO 238 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1e9h h PRO 238 CO 0.35 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.99 1e9h n SER 239 N -2.42 0.30 -4.57 1.44 3.41 -1.26 -4.87 113.62 105.64 1e9h n SER 239 Ca -0.02 0.54 -0.50 0.00 -0.26 0.00 0.00 58.87 58.63 1e9h n SER 239 Cb 0.05 -0.62 -0.05 0.00 -0.26 0.00 0.00 64.21 63.33 1e9h n SER 239 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1e9h n PHE 240 N -1.80 1.29 -2.00 7.33 3.72 0.20 -4.87 117.46 121.33 1e9h n PHE 240 Ca 0.05 0.69 -0.41 0.00 -0.05 0.00 0.00 57.45 57.73 1e9h n PHE 240 Cb 0.30 -2.28 -0.02 0.00 -0.94 0.00 0.00 39.48 36.55 1e9h n PHE 240 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 1e9h s PRO 241 N -0.08 4.26 -0.65 -1.08 0.02 -1.26 -4.93 135.00 131.27 1e9h s PRO 241 Ca 0.78 2.34 -0.19 0.00 0.02 0.00 0.00 61.00 63.95 1e9h s PRO 241 Cb -0.91 -3.06 0.11 0.00 0.02 0.00 0.00 34.50 30.66 1e9h s PRO 241 CO 0.51 -0.36 0.77 0.15 -0.33 0.00 0.00 177.00 177.74 1e9h s LYS 242 N -1.26 3.15 0.20 5.54 1.02 -1.26 -4.77 119.74 122.36 1e9h s LYS 242 Ca 0.54 -1.42 -0.09 0.00 0.02 0.00 0.00 55.97 55.02 1e9h s LYS 242 Cb -0.42 -4.34 -0.07 0.00 -0.52 0.00 0.00 37.83 32.48 1e9h s LYS 242 CO 0.51 -1.57 0.51 -1.58 -0.92 0.00 0.00 175.35 172.30 1e9h s TRP 243 N 2.60 3.45 0.34 3.18 0.51 -1.26 -4.91 118.94 122.85 1e9h s TRP 243 Ca 0.15 0.82 -0.14 0.00 -2.12 0.00 0.00 56.10 54.81 1e9h s TRP 243 Cb -0.21 -2.21 -0.08 0.00 -0.81 0.00 0.00 33.47 30.16 1e9h s TRP 243 CO 0.04 0.32 0.74 0.00 -0.51 0.00 0.00 176.95 177.54 1e9h s ALA 244 N -1.75 3.33 0.14 0.98 0.00 -1.26 -1.67 121.76 121.52 1e9h s ALA 244 Ca 0.45 -0.02 -0.31 0.00 0.00 0.00 0.00 51.96 52.08 1e9h s ALA 244 Cb -0.12 -2.75 -0.09 0.00 0.00 0.00 0.00 23.12 20.17 1e9h s ALA 244 CO 0.22 0.25 1.44 0.50 0.00 0.00 0.00 175.76 178.16 1e9h s ARG 245 N -3.20 4.29 -0.18 0.00 3.52 -1.26 -4.12 118.95 117.99 1e9h s ARG 245 Ca 0.53 2.17 -0.23 0.00 -0.13 0.00 0.00 55.73 58.07 1e9h s ARG 245 Cb -0.10 -3.21 -0.02 0.00 -1.56 0.00 0.00 34.95 30.06 1e9h s ARG 245 CO 0.21 -0.48 0.72 -1.14 -0.81 0.00 0.00 175.30 173.80 1e9h s GLN 246 N 1.00 4.25 0.05 5.12 0.74 -0.84 -4.91 119.66 125.07 1e9h s GLN 246 Ca 0.66 0.80 -0.36 0.00 0.05 0.00 0.00 55.36 56.50 1e9h s GLN 246 Cb -0.39 -3.58 -0.16 0.00 1.10 0.00 0.00 33.01 29.99 1e9h s GLN 246 CO 0.31 -0.28 1.47 -3.47 -0.55 0.00 0.00 175.29 172.77 1e9h n ASP 247 N 5.13 2.17 0.05 6.67 4.64 -1.26 -4.82 116.55 129.13 1e9h n ASP 247 Ca 0.01 1.10 0.21 0.00 -1.38 0.00 0.00 54.79 54.73 1e9h n ASP 247 Cb 0.49 -1.25 0.73 0.00 -1.04 0.00 0.00 41.12 40.06 1e9h n ASP 247 CO 0.00 0.00 0.00 -0.26 -0.82 0.00 0.00 177.20 176.12 1e9h h PHE 248 N 5.42 0.00 0.00 -0.67 -1.00 -1.94 -1.98 116.94 116.77 1e9h h PHE 248 Ca -0.47 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.31 1e9h h PHE 248 Cb 1.31 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.87 1e9h h PHE 248 CO 0.64 0.00 0.00 -1.13 -1.61 0.00 0.00 178.31 176.21 1e9h n SER 249 N -3.84 0.61 0.06 2.17 3.41 -1.26 -2.14 113.62 112.63 1e9h n SER 249 Ca 0.09 0.66 0.12 0.00 -0.26 0.00 0.00 58.87 59.48 1e9h n SER 249 Cb 0.67 -0.79 0.04 0.00 -0.26 0.00 0.00 64.21 63.87 1e9h n SER 249 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1e9h n LYS 250 N -2.19 0.43 -0.07 4.33 4.01 -0.74 -2.63 118.16 121.30 1e9h n LYS 250 Ca 0.02 0.05 -0.15 0.00 -0.51 0.00 0.00 58.31 57.72 1e9h n LYS 250 Cb 0.20 -1.70 -0.05 0.00 -0.51 0.00 0.00 35.03 32.97 1e9h n LYS 250 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1e9h h VAL 251 N 0.00 1.29 -1.74 -0.18 2.07 -1.56 -3.37 116.25 112.76 1e9h h VAL 251 Ca 0.00 -1.71 -0.51 0.00 0.82 0.00 0.00 66.70 65.30 1e9h h VAL 251 Cb 0.85 1.73 -0.35 0.00 -1.52 0.00 0.00 31.29 32.00 1e9h h VAL 251 CO 0.00 0.55 -1.01 0.52 0.02 0.00 0.00 177.57 177.64 1e9h n VAL 252 N -4.08 -0.63 -0.34 2.57 0.31 -1.24 -5.03 118.33 109.89 1e9h n VAL 252 Ca -0.05 -3.62 0.26 0.00 -0.01 0.00 0.00 64.34 60.93 1e9h n VAL 252 Cb 0.61 -1.45 0.51 0.00 -0.91 0.00 0.00 33.84 32.60 1e9h n VAL 252 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1e9h h PRO 253 N 4.09 0.25 0.00 5.55 0.13 -1.68 -1.24 132.00 139.09 1e9h h PRO 253 Ca 0.05 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 1e9h h PRO 253 Cb 0.90 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1e9h h PRO 253 CO 0.43 0.17 0.00 -2.30 -0.23 0.00 0.00 178.00 176.07 1e9h n PRO 254 N -5.01 0.28 -2.93 1.56 -0.02 -1.26 -4.78 135.00 122.84 1e9h n PRO 254 Ca 0.33 0.09 -0.40 0.00 -2.02 0.00 0.00 63.50 61.50 1e9h n PRO 254 Cb 1.07 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 33.00 1e9h n PRO 254 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1e9h s LEU 255 N -2.32 4.40 1.26 2.45 2.96 -0.47 -5.07 118.68 121.90 1e9h s LEU 255 Ca 0.15 1.44 -0.20 0.00 -0.22 0.00 0.00 54.13 55.30 1e9h s LEU 255 Cb 0.09 -3.28 0.31 0.00 0.50 0.00 0.00 46.19 43.80 1e9h s LEU 255 CO 0.17 -0.08 1.07 1.51 -1.32 0.00 0.00 176.35 177.70 1e9h s ASP 256 N 0.41 0.39 0.47 3.68 3.84 -1.26 -4.71 116.67 119.49 1e9h s ASP 256 Ca 0.42 0.64 0.20 0.00 -0.00 0.00 0.00 52.55 53.80 1e9h s ASP 256 Cb -0.20 -0.88 1.16 0.00 -1.38 0.00 0.00 42.92 41.63 1e9h s ASP 256 CO 0.23 -4.45 2.01 -0.08 -0.00 0.00 0.00 175.17 172.88 1e9h h GLU 257 N -2.80 0.00 -0.03 2.11 4.81 -1.99 -2.25 114.58 114.43 1e9h h GLU 257 Ca -0.44 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 58.69 1e9h h GLU 257 Cb 1.30 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.69 1e9h h GLU 257 CO 0.31 0.18 -0.38 -0.44 -0.73 0.00 0.00 179.01 177.95 1e9h h ASP 258 N 0.00 0.38 -0.49 1.04 3.32 -1.97 -2.67 116.42 116.03 1e9h h ASP 258 Ca -0.00 -0.72 0.08 0.00 0.02 0.00 0.00 57.03 56.41 1e9h h ASP 258 Cb 0.36 -0.11 -0.07 0.00 0.22 0.00 0.00 39.33 39.73 1e9h h ASP 258 CO 0.02 1.04 0.10 1.23 -1.72 0.00 0.00 179.24 179.92 1e9h h GLY 259 N -0.25 0.60 0.68 2.75 0.00 -1.85 0.07 103.07 105.08 1e9h h GLY 259 Ca -0.04 -0.03 0.04 0.00 0.00 0.00 0.00 47.33 47.31 1e9h h GLY 259 CO 0.08 -0.06 0.14 3.21 0.00 0.00 0.00 176.54 179.90 1e9h h ARG 260 N 0.24 0.29 -0.12 4.80 3.08 -1.44 0.71 114.38 121.94 1e9h h ARG 260 Ca 0.25 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1e9h h ARG 260 Cb 0.32 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1e9h h ARG 260 CO -0.32 0.19 0.07 1.03 -1.07 0.00 0.00 179.97 179.87 1e9h h SER 261 N 0.30 0.12 0.31 7.04 0.87 -0.94 -0.16 113.55 121.08 1e9h h SER 261 Ca 0.17 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.72 1e9h h SER 261 Cb 0.14 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 1e9h h SER 261 CO -0.17 0.09 -0.15 0.25 -0.53 0.00 0.00 176.83 176.32 1e9h h LEU 262 N 0.15 -0.35 -0.56 2.23 5.85 -0.65 -2.22 115.31 119.76 1e9h h LEU 262 Ca 0.05 -0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.77 1e9h h LEU 262 Cb -0.01 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.06 1e9h h LEU 262 CO -0.02 -0.17 0.26 0.25 -0.34 0.00 0.00 178.44 178.42 1e9h h LEU 263 N -0.51 0.35 -1.52 2.25 5.85 -0.82 -0.87 115.31 120.03 1e9h h LEU 263 Ca -0.04 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.76 1e9h h LEU 263 Cb 0.38 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 1e9h h LEU 263 CO 0.07 0.23 0.37 0.77 -0.34 0.00 0.00 178.44 179.54 1e9h h SER 264 N 0.50 0.53 0.75 1.25 4.64 -0.93 -1.45 113.55 118.84 1e9h h SER 264 Ca 0.26 -0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.42 1e9h h SER 264 Cb 0.21 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 1e9h h SER 264 CO -0.20 0.37 -0.70 1.56 -0.87 0.00 0.00 176.83 176.98 1e9h h GLN 265 N 0.62 0.00 0.00 4.77 4.20 -0.55 -3.01 115.11 121.14 1e9h h GLN 265 Ca 0.22 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.93 1e9h h GLN 265 Cb 0.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1e9h h GLN 265 CO -0.06 0.70 0.00 0.52 -0.67 0.00 0.00 178.83 179.32 1e9h h MET 266 N 0.00 0.00 -0.45 1.46 2.86 -0.38 -2.65 114.93 115.77 1e9h h MET 266 Ca -0.01 0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.41 1e9h h MET 266 Cb 1.27 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 32.79 1e9h h MET 266 CO 0.09 0.00 0.04 1.28 1.06 0.00 0.00 176.91 179.38 1e9h n LEU 267 N -2.65 4.56 -4.76 1.22 4.77 -0.69 -4.02 117.00 115.42 1e9h n LEU 267 Ca 0.04 -3.72 -0.41 0.00 -0.03 0.00 0.00 56.01 51.89 1e9h n LEU 267 Cb 0.43 -0.67 -0.03 0.00 -2.33 0.00 0.00 43.42 40.83 1e9h n LEU 267 CO 0.30 1.21 0.94 -2.28 -1.33 0.00 0.00 177.39 176.22 1e9h s HIS 268 N -3.24 3.21 0.02 -1.77 2.46 -1.19 -4.95 115.29 109.82 1e9h s HIS 268 Ca 0.47 1.45 -0.16 0.00 0.47 0.00 0.00 55.06 57.28 1e9h s HIS 268 Cb 0.42 -3.58 -0.09 0.00 -0.13 0.00 0.00 32.58 29.20 1e9h s HIS 268 CO 0.02 -1.56 1.14 1.88 -2.47 0.00 0.00 174.74 173.75 1e9h h TYR 269 N 3.81 -0.55 -1.80 3.88 0.05 -1.92 -3.41 116.97 117.04 1e9h h TYR 269 Ca -0.48 -0.01 -0.58 0.00 0.05 0.00 0.00 58.73 57.71 1e9h h TYR 269 Cb 1.22 0.18 -0.00 0.00 1.01 0.00 0.00 36.73 39.14 1e9h h TYR 269 CO 0.57 -0.34 1.51 -3.47 -1.05 0.00 0.00 178.16 175.39 1e9h n ASP 270 N -3.72 2.97 0.18 3.88 -0.08 -1.26 -4.84 116.55 113.68 1e9h n ASP 270 Ca -0.07 0.12 0.09 0.00 -1.51 0.00 0.00 54.79 53.42 1e9h n ASP 270 Cb 0.23 -1.52 0.50 0.00 2.34 0.00 0.00 41.12 42.67 1e9h n ASP 270 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1e9h h PRO 271 N 15.40 0.00 0.00 -0.67 0.13 -1.96 0.80 132.00 145.71 1e9h h PRO 271 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1e9h h PRO 271 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1e9h h PRO 271 CO 1.00 0.00 -0.36 -0.91 -0.23 0.00 0.00 178.00 177.50 1e9h h ASN 272 N 0.00 0.00 0.00 1.44 2.35 -1.95 -3.30 115.58 114.12 1e9h h ASN 272 Ca 0.00 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1e9h h ASN 272 Cb 0.33 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.70 1e9h h ASN 272 CO 0.00 0.04 -1.04 0.29 -1.65 0.00 0.00 177.43 175.07 1e9h n LYS 273 N -2.38 1.45 -2.56 0.81 4.76 0.24 -4.94 118.16 115.55 1e9h n LYS 273 Ca 0.04 -0.05 -0.42 0.00 -2.87 0.00 0.00 58.31 55.01 1e9h n LYS 273 Cb 0.46 -1.28 -0.03 0.00 -1.84 0.00 0.00 35.03 32.35 1e9h n LYS 273 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 1e9h s ARG 274 N -2.66 4.36 0.22 1.97 1.70 -0.98 -4.93 118.95 118.63 1e9h s ARG 274 Ca 0.02 1.54 -0.27 0.00 -0.47 0.00 0.00 55.73 56.55 1e9h s ARG 274 Cb 0.11 -3.58 -0.17 0.00 -0.57 0.00 0.00 34.95 30.75 1e9h s ARG 274 CO 0.64 -0.43 0.47 1.51 -1.08 0.00 0.00 175.30 176.41 1e9h n ILE 275 N 4.71 1.86 -2.73 4.99 3.06 -1.00 -4.97 119.36 125.28 1e9h n ILE 275 Ca 0.10 -0.50 -0.27 0.00 -2.50 0.00 0.00 62.75 59.59 1e9h n ILE 275 Cb 0.47 0.00 -0.00 0.00 0.54 0.00 0.00 39.64 40.65 1e9h n ILE 275 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 1e9h s SER 276 N -0.99 6.27 0.34 9.51 1.04 -1.26 -4.85 113.70 123.76 1e9h s SER 276 Ca 0.63 0.87 0.03 0.00 0.48 0.00 0.00 55.95 57.96 1e9h s SER 276 Cb -0.90 -2.22 0.61 0.00 0.10 0.00 0.00 66.02 63.62 1e9h s SER 276 CO 0.56 -0.54 1.94 0.00 0.98 0.00 0.00 173.24 176.18 1e9h h ALA 277 N 0.29 1.45 0.73 5.32 0.00 -1.94 -1.68 119.26 123.44 1e9h h ALA 277 Ca -0.47 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 1e9h h ALA 277 Cb 1.21 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1e9h h ALA 277 CO 0.62 0.43 -0.44 0.87 0.00 0.00 0.00 179.25 180.73 1e9h h LYS 278 N 0.68 -1.05 -0.64 0.00 1.57 -1.93 -2.69 116.57 112.52 1e9h h LYS 278 Ca 0.17 0.07 0.10 0.00 -1.87 0.00 0.00 60.65 59.12 1e9h h LYS 278 Cb 0.13 0.24 -0.08 0.00 0.08 0.00 0.00 32.23 32.60 1e9h h LYS 278 CO -0.02 -0.70 0.24 0.00 -0.57 0.00 0.00 179.45 178.41 1e9h h ALA 279 N -1.29 0.83 -0.78 3.86 0.00 -1.94 -1.51 119.26 118.43 1e9h h ALA 279 Ca -0.10 0.09 0.17 0.00 0.00 0.00 0.00 54.91 55.07 1e9h h ALA 279 Cb 0.87 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.66 1e9h h ALA 279 CO 0.11 -0.19 0.53 0.00 0.00 0.00 0.00 179.25 179.70 1e9h h ALA 280 N 1.44 2.22 -0.02 0.00 0.00 -1.17 -0.69 119.26 121.04 1e9h h ALA 280 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1e9h h ALA 280 Cb 0.41 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1e9h h ALA 280 CO -0.32 -0.44 0.06 -0.07 0.00 0.00 0.00 179.25 178.48 1e9h h LEU 281 N 0.35 0.00 -0.28 0.00 3.38 -0.93 -1.61 115.31 116.22 1e9h h LEU 281 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 1e9h h LEU 281 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1e9h h LEU 281 CO -0.12 0.00 -0.69 0.00 0.09 0.00 0.00 178.44 177.72 1e9h n ALA 282 N -2.12 4.05 -1.67 1.53 0.00 -0.26 -4.92 120.51 117.12 1e9h n ALA 282 Ca -0.02 -0.53 -0.45 0.00 0.00 0.00 0.00 53.44 52.44 1e9h n ALA 282 Cb 0.13 -0.89 -0.02 0.00 0.00 0.00 0.00 19.45 18.67 1e9h n ALA 282 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1e9h n HIS 283 N -1.07 2.18 -0.46 0.00 -0.00 -0.61 -4.86 115.22 110.40 1e9h n HIS 283 Ca 0.06 0.44 0.42 0.00 -0.00 0.00 0.00 57.72 58.64 1e9h n HIS 283 Cb 0.36 -2.46 0.77 0.00 -0.00 0.00 0.00 29.99 28.67 1e9h n HIS 283 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1e9h h PRO 284 N 4.10 0.01 -0.55 1.57 0.11 -1.93 -1.42 132.00 133.88 1e9h h PRO 284 Ca -0.45 -0.00 0.16 0.00 0.11 0.00 0.00 66.00 65.82 1e9h h PRO 284 Cb 1.28 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 1e9h h PRO 284 CO 0.75 0.01 0.50 0.35 -0.21 0.00 0.00 178.00 179.39 1e9h h PHE 285 N 0.01 0.00 -0.02 0.65 3.57 -1.89 -2.01 116.94 117.25 1e9h h PHE 285 Ca 0.70 0.00 0.00 0.00 3.53 0.00 0.00 57.97 62.20 1e9h h PHE 285 Cb 2.80 0.00 0.00 0.00 2.79 0.00 0.00 35.95 41.54 1e9h h PHE 285 CO -0.00 0.00 -0.18 1.19 -2.23 0.00 0.00 178.31 177.09 1e9h n PHE 286 N -3.91 0.00 0.04 0.41 3.72 -0.53 -4.51 117.46 112.68 1e9h n PHE 286 Ca 0.11 0.00 0.22 0.00 -0.05 0.00 0.00 57.45 57.72 1e9h n PHE 286 Cb 0.72 -0.02 0.68 0.00 -0.94 0.00 0.00 39.48 39.91 1e9h n PHE 286 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1e9h h GLN 287 N 2.86 0.00 -0.28 -1.08 3.07 -1.54 0.11 115.11 118.25 1e9h h GLN 287 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1e9h h GLN 287 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.28 1e9h h GLN 287 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 178.83 178.52 1e9h n ASP 288 N -3.55 2.91 -4.71 0.06 5.68 -1.26 -5.05 116.55 110.64 1e9h n ASP 288 Ca 0.10 -2.15 -0.38 0.00 -0.50 0.00 0.00 54.79 51.86 1e9h n ASP 288 Cb 0.80 -0.24 0.05 0.00 -1.14 0.00 0.00 41.12 40.59 1e9h n ASP 288 CO 0.00 0.00 0.00 0.55 -1.33 0.00 0.00 177.20 176.42 1e9h n VAL 289 N 0.21 3.99 -4.11 2.12 3.14 0.39 -5.04 118.33 119.04 1e9h n VAL 289 Ca 0.11 -0.50 -0.11 0.00 -2.96 0.00 0.00 64.34 60.89 1e9h n VAL 289 Cb 0.47 -1.49 -0.08 0.00 -1.06 0.00 0.00 33.84 31.68 1e9h n VAL 289 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 1e9h s THR 290 N -1.35 0.00 -0.96 1.55 -4.23 -1.26 -5.07 115.64 104.31 1e9h s THR 290 Ca 0.75 -1.72 -0.02 0.00 -1.18 0.00 0.00 61.69 59.51 1e9h s THR 290 Cb -0.42 -2.36 0.27 0.00 1.34 0.00 0.00 72.50 71.33 1e9h s THR 290 CO 0.47 0.00 1.12 1.17 -0.54 0.00 0.00 174.62 176.84 1e9h n LYS 291 N -0.33 3.53 0.00 3.99 4.81 -1.26 -4.35 118.16 124.55 1e9h n LYS 291 Ca 0.00 -4.55 0.00 0.00 -0.87 0.00 0.00 58.31 52.89 1e9h n LYS 291 Cb 0.64 -2.44 0.00 0.00 0.02 0.00 0.00 35.03 33.25 1e9h n LYS 291 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1e9h n PRO 292 N 1.66 0.00 0.00 1.64 -0.02 -1.26 -4.88 135.00 132.14 1e9h n PRO 292 Ca 0.25 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1e9h n PRO 292 Cb 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.84 1e9h n PRO 292 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 1e9h n VAL 293 N 0.00 0.00 -0.96 -1.45 3.14 -1.26 -4.57 118.33 113.23 1e9h n VAL 293 Ca 0.00 0.00 -0.24 0.00 -2.96 0.00 0.00 64.34 61.14 1e9h n VAL 293 Cb 0.00 0.00 0.20 0.00 -1.06 0.00 0.00 33.84 32.98 1e9h n VAL 293 CO 0.00 0.00 0.00 -0.81 -6.46 0.00 0.00 176.83 169.56 1e9h n PRO 294 N -0.07 -2.67 -0.63 1.45 -0.04 -1.26 -4.90 135.00 126.88 1e9h n PRO 294 Ca 0.00 -1.40 0.02 0.00 -0.04 0.00 0.00 63.50 62.08 1e9h n PRO 294 Cb 0.00 -1.30 0.24 0.00 -0.04 0.00 0.00 33.50 32.40 1e9h n PRO 294 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1e9h n HIS 295 N -4.36 1.16 0.95 0.54 8.25 -1.26 -5.02 115.22 115.48 1e9h n HIS 295 Ca 0.12 -1.18 0.11 0.00 -0.26 0.00 0.00 57.72 56.52 1e9h n HIS 295 Cb 0.47 -0.42 0.09 0.00 1.12 0.00 0.00 29.99 31.25 1e9h n HIS 295 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87