#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a8h n GLU 2 N 0.00 0.00 -2.33 3.17 -0.58 -1.26 -4.97 120.64 114.68 1a8h n GLU 2 Ca 0.00 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.36 1a8h n GLU 2 Cb 0.00 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 30.84 1a8h n GLU 2 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1a8h s LYS 3 N -0.54 3.00 -0.05 3.49 1.02 -1.26 -4.96 119.74 120.44 1a8h s LYS 3 Ca 0.00 -0.14 0.05 0.00 0.02 0.00 0.00 55.97 55.90 1a8h s LYS 3 Cb 0.00 -4.57 -0.01 0.00 -0.52 0.00 0.00 37.83 32.73 1a8h s LYS 3 CO 0.00 -2.51 -0.22 0.08 -0.92 0.00 0.00 175.35 171.78 1a8h s VAL 4 N 7.23 1.79 -0.04 3.17 1.01 -1.26 0.02 120.40 132.32 1a8h s VAL 4 Ca 0.52 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.58 1a8h s VAL 4 Cb -0.08 -1.53 0.02 0.00 0.00 0.00 0.00 36.38 34.80 1a8h s VAL 4 CO 0.10 0.50 -0.03 0.12 0.00 0.00 0.00 175.10 175.79 1a8h s PHE 5 N -0.08 0.60 -0.08 5.22 5.36 -0.27 -4.91 117.98 123.82 1a8h s PHE 5 Ca -0.04 -0.14 -0.00 0.00 -0.96 0.00 0.00 56.93 55.79 1a8h s PHE 5 Cb -0.13 -0.57 0.02 0.00 -0.34 0.00 0.00 43.02 42.01 1a8h s PHE 5 CO 0.03 -0.16 -0.04 -0.47 -1.46 0.00 0.00 175.22 173.12 1a8h s TYR 6 N 0.90 1.01 0.01 10.12 5.04 -1.26 -0.20 117.35 132.96 1a8h s TYR 6 Ca -0.11 -0.39 0.04 0.00 -2.44 0.00 0.00 57.07 54.17 1a8h s TYR 6 Cb -0.14 -0.94 -0.01 0.00 0.35 0.00 0.00 41.96 41.22 1a8h s TYR 6 CO -0.00 -0.36 -0.11 0.54 -1.34 0.00 0.00 175.55 174.27 1a8h s VAL 7 N 1.58 0.90 0.10 3.14 0.11 -0.08 -1.36 120.40 124.79 1a8h s VAL 7 Ca 0.00 -0.62 0.05 0.00 -2.93 0.00 0.00 61.98 58.49 1a8h s VAL 7 Cb -0.13 -0.78 -0.03 0.00 -1.53 0.00 0.00 36.38 33.91 1a8h s VAL 7 CO -0.05 0.16 -0.14 0.42 -3.33 0.00 0.00 175.10 172.16 1a8h s THR 8 N -0.45 1.21 0.34 5.04 -4.23 -0.71 -0.34 115.64 116.50 1a8h s THR 8 Ca 0.03 -1.53 0.09 0.00 -1.18 0.00 0.00 61.69 59.10 1a8h s THR 8 Cb -0.05 -1.32 -0.05 0.00 1.34 0.00 0.00 72.50 72.41 1a8h s THR 8 CO 0.00 -0.34 0.03 0.42 -0.54 0.00 0.00 174.62 174.19 1a8h s THR 9 N -1.77 2.69 0.86 3.99 -4.23 -0.82 -1.61 115.64 114.75 1a8h s THR 9 Ca 0.04 -1.94 -0.10 0.00 -1.18 0.00 0.00 61.69 58.51 1a8h s THR 9 Cb -0.07 -2.82 0.11 0.00 1.34 0.00 0.00 72.50 71.06 1a8h s THR 9 CO 0.02 -0.20 1.11 -2.84 -0.54 0.00 0.00 174.62 172.18 1a8h s PRO 10 N -3.73 1.50 -0.35 3.99 0.02 -1.22 -4.72 135.00 130.49 1a8h s PRO 10 Ca 0.35 1.28 -0.21 0.00 0.02 0.00 0.00 61.00 62.45 1a8h s PRO 10 Cb -0.00 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.72 1a8h s PRO 10 CO 0.20 -2.21 0.66 -1.50 -0.33 0.00 0.00 177.00 173.82 1a8h s ILE 11 N -2.78 4.87 0.21 2.83 2.07 -1.26 -4.32 121.20 122.82 1a8h s ILE 11 Ca 0.64 0.64 -0.28 0.00 -1.41 0.00 0.00 60.65 60.25 1a8h s ILE 11 Cb -0.20 -4.09 -0.09 0.00 0.13 0.00 0.00 42.46 38.22 1a8h s ILE 11 CO 0.57 -0.32 0.87 -0.31 -1.91 0.00 0.00 174.94 173.84 1a8h s TYR 12 N 2.75 3.94 -0.11 3.50 2.02 -0.88 -4.35 117.35 124.23 1a8h s TYR 12 Ca 0.25 1.79 -0.35 0.00 -0.37 0.00 0.00 57.07 58.39 1a8h s TYR 12 Cb -0.14 -2.89 -0.12 0.00 -0.40 0.00 0.00 41.96 38.41 1a8h s TYR 12 CO 0.15 0.47 1.85 0.98 -1.57 0.00 0.00 175.55 177.43 1a8h n TYR 13 N 1.48 2.29 -0.02 2.71 9.36 -1.26 -0.05 117.16 131.68 1a8h n TYR 13 Ca -0.03 0.08 -0.09 0.00 3.32 0.00 0.00 57.90 61.17 1a8h n TYR 13 Cb 0.48 -2.63 -0.03 0.00 -0.63 0.00 0.00 39.34 36.53 1a8h n TYR 13 CO 0.00 0.00 0.00 -0.39 0.22 0.00 0.00 176.86 176.69 1a8h h VAL 14 N 5.38 0.69 0.00 2.97 -1.51 -1.49 -2.81 116.25 119.47 1a8h h VAL 14 Ca -0.48 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 1a8h h VAL 14 Cb 1.28 0.69 0.00 0.00 -2.13 0.00 0.00 31.29 31.13 1a8h h VAL 14 CO 0.95 0.00 0.00 -3.20 -1.23 0.00 0.00 177.57 174.09 1a8h n ASN 15 N -5.25 2.75 -4.09 4.19 4.05 -1.26 -4.68 115.26 110.97 1a8h n ASN 15 Ca -0.03 -1.70 -0.32 0.00 0.45 0.00 0.00 54.58 52.98 1a8h n ASN 15 Cb 0.17 -0.50 -0.16 0.00 1.23 0.00 0.00 39.78 40.53 1a8h n ASN 15 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1a8h s ALA 16 N 0.24 2.21 0.10 5.20 0.00 -1.06 -5.09 121.76 123.37 1a8h s ALA 16 Ca 0.00 -1.17 -0.31 0.00 0.00 0.00 0.00 51.96 50.48 1a8h s ALA 16 Cb 0.00 -1.17 -0.10 0.00 0.00 0.00 0.00 23.12 21.84 1a8h s ALA 16 CO 0.00 -0.41 1.87 -1.91 0.00 0.00 0.00 175.76 175.31 1a8h n GLU 17 N 4.65 2.82 -1.61 0.00 2.13 -1.26 -4.86 120.64 122.50 1a8h n GLU 17 Ca -0.19 1.03 -0.52 0.00 0.66 0.00 0.00 57.16 58.13 1a8h n GLU 17 Cb 0.49 -2.94 -0.06 0.00 0.27 0.00 0.00 31.44 29.21 1a8h n GLU 17 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 1a8h n PRO 18 N 6.10 1.25 -4.56 5.31 -0.02 -1.26 -4.97 135.00 136.84 1a8h n PRO 18 Ca 0.19 0.45 -0.27 0.00 -2.02 0.00 0.00 63.50 61.85 1a8h n PRO 18 Cb 0.38 -2.11 -0.08 0.00 -0.02 0.00 0.00 33.50 31.67 1a8h n PRO 18 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1a8h s HIS 19 N 0.77 1.84 0.32 6.00 -3.43 -1.26 -5.00 115.29 114.53 1a8h s HIS 19 Ca 0.85 -1.17 0.09 0.00 -0.80 0.00 0.00 55.06 54.03 1a8h s HIS 19 Cb -0.94 -1.27 0.90 0.00 -1.43 0.00 0.00 32.58 29.84 1a8h s HIS 19 CO 0.47 -0.15 1.70 1.25 -2.00 0.00 0.00 174.74 176.01 1a8h h LEU 20 N 1.74 0.51 -0.92 5.38 6.46 -1.94 -0.03 115.31 126.52 1a8h h LEU 20 Ca -0.38 0.16 -0.04 0.00 -0.12 0.00 0.00 57.88 57.50 1a8h h LEU 20 Cb 1.28 0.10 -0.03 0.00 -0.73 0.00 0.00 40.66 41.27 1a8h h LEU 20 CO 0.62 -0.01 0.27 1.23 -0.62 0.00 0.00 178.44 179.94 1a8h h GLY 21 N 0.44 1.14 1.07 3.75 0.00 -1.94 0.12 103.07 107.65 1a8h h GLY 21 Ca 0.65 -0.61 -0.19 0.00 0.00 0.00 0.00 47.33 47.18 1a8h h GLY 21 CO -0.54 0.58 -0.63 0.45 0.00 0.00 0.00 176.54 176.40 1a8h h HIS 22 N 1.04 0.96 -0.02 5.60 3.86 -1.48 -3.09 115.15 122.02 1a8h h HIS 22 Ca 0.24 -0.40 0.00 0.00 -1.16 0.00 0.00 60.37 59.05 1a8h h HIS 22 Cb 0.21 -0.16 -0.00 0.00 1.06 0.00 0.00 27.41 28.53 1a8h h HIS 22 CO 0.02 1.22 0.01 0.00 0.86 0.00 0.00 177.93 180.03 1a8h h ALA 23 N 0.55 0.02 0.45 2.45 0.00 -0.78 -2.04 119.26 119.92 1a8h h ALA 23 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1a8h h ALA 23 Cb 1.26 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1a8h h ALA 23 CO 0.13 -0.48 -0.38 -0.92 0.00 0.00 0.00 179.25 177.60 1a8h h TYR 24 N 0.02 -1.03 -1.01 0.00 3.20 -0.82 0.17 116.97 117.50 1a8h h TYR 24 Ca 0.01 0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.96 1a8h h TYR 24 Cb 0.00 0.39 -0.07 0.00 1.54 0.00 0.00 36.73 38.59 1a8h h TYR 24 CO -0.08 -0.55 0.65 1.15 -1.64 0.00 0.00 178.16 177.69 1a8h h THR 25 N -0.83 1.05 -0.32 1.81 2.02 -1.55 -0.43 112.91 114.66 1a8h h THR 25 Ca -0.04 -0.39 -0.14 0.00 0.77 0.00 0.00 66.41 66.60 1a8h h THR 25 Cb 0.72 -0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 1a8h h THR 25 CO -0.02 0.21 -0.36 0.74 0.37 0.00 0.00 175.52 176.45 1a8h h THR 26 N 1.14 1.28 -0.42 3.16 2.02 -1.10 -1.92 112.91 117.07 1a8h h THR 26 Ca 0.45 -1.53 -0.10 0.00 0.77 0.00 0.00 66.41 66.00 1a8h h THR 26 Cb 0.23 1.43 -0.02 0.00 -1.74 0.00 0.00 68.15 68.05 1a8h h THR 26 CO -0.19 0.50 -0.14 0.58 0.37 0.00 0.00 175.52 176.64 1a8h h VAL 27 N 0.62 1.26 -0.26 3.16 2.07 0.11 -0.37 116.25 122.83 1a8h h VAL 27 Ca 0.06 -1.20 -0.10 0.00 0.82 0.00 0.00 66.70 66.28 1a8h h VAL 27 Cb 0.90 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 1a8h h VAL 27 CO 0.08 0.41 -0.28 0.58 0.02 0.00 0.00 177.57 178.38 1a8h h VAL 28 N 0.68 1.27 -0.24 2.57 2.07 -0.89 0.29 116.25 122.00 1a8h h VAL 28 Ca 0.11 -1.33 -0.13 0.00 0.82 0.00 0.00 66.70 66.16 1a8h h VAL 28 Cb 0.62 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1a8h h VAL 28 CO 0.04 0.42 -0.37 0.00 0.02 0.00 0.00 177.57 177.68 1a8h h ALA 29 N 1.25 0.37 -0.28 1.67 0.00 -1.08 -1.34 119.26 119.85 1a8h h ALA 29 Ca 0.06 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.54 1a8h h ALA 29 Cb 0.72 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1a8h h ALA 29 CO 0.06 0.45 0.16 0.22 0.00 0.00 0.00 179.25 180.13 1a8h h ASP 30 N 0.39 0.25 -0.27 0.00 3.58 -0.76 0.89 116.42 120.51 1a8h h ASP 30 Ca 0.02 0.00 0.01 0.00 0.42 0.00 0.00 57.03 57.48 1a8h h ASP 30 Cb 0.97 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.95 1a8h h ASP 30 CO 0.09 0.18 0.17 0.15 -2.88 0.00 0.00 179.24 176.95 1a8h h PHE 31 N 0.32 0.32 -0.88 0.28 3.57 -0.88 0.10 116.94 119.77 1a8h h PHE 31 Ca 0.11 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.64 1a8h h PHE 31 Cb 0.00 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.59 1a8h h PHE 31 CO -0.08 0.19 0.58 -0.07 -2.23 0.00 0.00 178.31 176.71 1a8h h LEU 32 N 0.34 0.99 -0.04 0.59 3.38 -0.85 -1.07 115.31 118.67 1a8h h LEU 32 Ca 0.10 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 1a8h h LEU 32 Cb -0.02 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.49 1a8h h LEU 32 CO -0.04 0.70 -0.17 0.00 0.09 0.00 0.00 178.44 179.03 1a8h h ALA 33 N 1.46 0.07 -0.92 1.53 0.00 -0.39 -2.56 119.26 118.45 1a8h h ALA 33 Ca 0.34 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.88 1a8h h ALA 33 Cb -0.07 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 1a8h h ALA 33 CO -0.08 0.02 0.60 0.00 0.00 0.00 0.00 179.25 179.78 1a8h h ARG 34 N -0.40 1.17 -0.35 0.00 3.08 -0.68 0.97 114.38 118.16 1a8h h ARG 34 Ca -0.01 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1a8h h ARG 34 Cb 0.82 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.59 1a8h h ARG 34 CO 0.03 0.77 0.19 2.35 -1.07 0.00 0.00 179.97 182.25 1a8h h TRP 35 N 1.20 0.49 -0.08 3.04 2.91 -1.24 -1.05 115.95 121.22 1a8h h TRP 35 Ca 0.35 -0.01 -0.14 0.00 1.13 0.00 0.00 58.89 60.22 1a8h h TRP 35 Cb -0.08 -0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 28.41 1a8h h TRP 35 CO -0.01 0.39 -0.57 0.45 -1.03 0.00 0.00 178.44 177.66 1a8h h HIS 36 N 0.45 0.32 -0.51 2.65 3.86 -0.98 -0.57 115.15 120.37 1a8h h HIS 36 Ca 0.12 -0.12 -0.04 0.00 -1.16 0.00 0.00 60.37 59.18 1a8h h HIS 36 Cb 0.06 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 1a8h h HIS 36 CO -0.03 0.77 0.17 0.00 0.86 0.00 0.00 177.93 179.70 1a8h h ARG 37 N 0.19 0.75 0.00 2.45 3.08 -0.55 0.52 114.38 120.83 1a8h h ARG 37 Ca -0.00 -0.12 -0.10 0.00 0.07 0.00 0.00 59.98 59.83 1a8h h ARG 37 Cb 1.07 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.97 1a8h h ARG 37 CO 0.09 0.65 -0.46 1.25 -1.07 0.00 0.00 179.97 180.42 1a8h h LEU 38 N 0.74 0.00 -1.53 3.04 5.85 -0.59 -2.91 115.31 119.91 1a8h h LEU 38 Ca 0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1a8h h LEU 38 Cb 0.20 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.23 1a8h h LEU 38 CO -0.01 0.46 0.00 -0.67 -0.34 0.00 0.00 178.44 177.88 1a8h n ASP 39 N -3.59 2.21 -0.82 1.25 2.03 -0.28 -1.96 116.55 115.39 1a8h n ASP 39 Ca -0.00 -2.18 -0.07 0.00 0.52 0.00 0.00 54.79 53.06 1a8h n ASP 39 Cb 0.56 -0.38 -0.00 0.00 -0.72 0.00 0.00 41.12 40.58 1a8h n ASP 39 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1a8h n GLY 40 N 0.64 0.10 3.84 0.27 0.00 -1.10 -5.03 105.19 103.91 1a8h n GLY 40 Ca 0.11 -0.59 -0.38 0.00 0.00 0.00 0.00 46.02 45.16 1a8h n GLY 40 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1a8h s TYR 41 N -2.36 3.71 -0.43 1.61 1.51 0.08 -4.82 117.35 116.65 1a8h s TYR 41 Ca 0.00 0.94 -0.29 0.00 -1.01 0.00 0.00 57.07 56.71 1a8h s TYR 41 Cb 0.00 -2.25 0.02 0.00 -0.11 0.00 0.00 41.96 39.63 1a8h s TYR 41 CO 0.00 0.64 1.18 0.50 -1.11 0.00 0.00 175.55 176.77 1a8h s ARG 42 N -1.14 3.77 0.18 -0.62 3.52 0.10 -4.41 118.95 120.35 1a8h s ARG 42 Ca 0.24 0.75 0.10 0.00 -0.13 0.00 0.00 55.73 56.69 1a8h s ARG 42 Cb -0.16 -3.90 -0.04 0.00 -1.56 0.00 0.00 34.95 29.29 1a8h s ARG 42 CO 0.13 -1.32 -0.21 -0.08 -0.81 0.00 0.00 175.30 173.01 1a8h s THR 43 N 4.47 2.10 -0.06 4.11 -1.32 -1.26 -1.12 115.64 122.57 1a8h s THR 43 Ca 0.50 -1.97 0.00 0.00 -1.21 0.00 0.00 61.69 59.01 1a8h s THR 43 Cb -0.09 -1.98 0.02 0.00 -1.51 0.00 0.00 72.50 68.94 1a8h s THR 43 CO 0.29 -0.20 -0.03 0.12 -2.21 0.00 0.00 174.62 172.58 1a8h s PHE 44 N -1.82 0.83 -0.22 9.09 5.36 0.72 -4.97 117.98 126.97 1a8h s PHE 44 Ca 0.18 -0.27 0.01 0.00 -0.96 0.00 0.00 56.93 55.90 1a8h s PHE 44 Cb -0.07 -0.79 0.03 0.00 -0.34 0.00 0.00 43.02 41.85 1a8h s PHE 44 CO 0.08 -0.28 -0.15 0.12 -1.46 0.00 0.00 175.22 173.53 1a8h s PHE 45 N 1.39 2.97 0.06 10.12 5.36 -1.26 -0.90 117.98 135.72 1a8h s PHE 45 Ca -0.03 -1.80 0.06 0.00 -0.96 0.00 0.00 56.93 54.20 1a8h s PHE 45 Cb -0.13 -1.95 -0.04 0.00 -0.34 0.00 0.00 43.02 40.56 1a8h s PHE 45 CO -0.03 -0.81 -0.12 -1.17 -1.46 0.00 0.00 175.22 171.63 1a8h s LEU 46 N 1.25 2.91 0.22 6.12 2.96 0.54 -0.67 118.68 132.00 1a8h s LEU 46 Ca 0.00 -0.35 -0.13 0.00 -0.22 0.00 0.00 54.13 53.44 1a8h s LEU 46 Cb -0.16 -1.70 0.00 0.00 0.50 0.00 0.00 46.19 44.83 1a8h s LEU 46 CO -0.09 0.23 0.43 0.28 -1.32 0.00 0.00 176.35 175.89 1a8h s THR 47 N -1.05 0.02 -0.16 3.68 -1.32 -1.16 -1.94 115.64 113.72 1a8h s THR 47 Ca 0.18 -1.29 0.00 0.00 -1.21 0.00 0.00 61.69 59.37 1a8h s THR 47 Cb -0.11 -2.00 0.00 0.00 -1.51 0.00 0.00 72.50 68.88 1a8h s THR 47 CO 0.09 -0.10 0.00 0.61 -2.21 0.00 0.00 174.62 173.01 1a8h n GLY 48 N -0.33 -1.23 3.05 6.08 0.00 -1.26 -0.87 105.19 110.64 1a8h n GLY 48 Ca -0.05 -0.84 -0.18 0.00 0.00 0.00 0.00 46.02 44.95 1a8h n GLY 48 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1a8h s THR 49 N -2.85 0.77 -0.38 2.61 -4.23 -0.04 -2.07 115.64 109.46 1a8h s THR 49 Ca 0.00 -0.61 -0.21 0.00 -1.18 0.00 0.00 61.69 59.69 1a8h s THR 49 Cb 0.00 -0.68 0.01 0.00 1.34 0.00 0.00 72.50 73.17 1a8h s THR 49 CO 0.00 0.08 0.68 -0.62 -0.54 0.00 0.00 174.62 174.21 1a8h s ASP 50 N -0.59 6.43 0.00 3.99 -1.08 0.93 -2.57 116.67 123.78 1a8h s ASP 50 Ca 0.01 0.10 0.05 0.00 -0.52 0.00 0.00 52.55 52.19 1a8h s ASP 50 Cb -0.05 -2.34 -0.02 0.00 -1.46 0.00 0.00 42.92 39.05 1a8h s ASP 50 CO 0.00 -0.67 0.37 -0.62 0.52 0.00 0.00 175.17 174.77 1a8h n GLU 51 N 6.20 3.46 -2.48 4.34 1.02 -1.26 -1.17 120.64 130.74 1a8h n GLU 51 Ca -0.00 -0.28 -0.24 0.00 -0.02 0.00 0.00 57.16 56.62 1a8h n GLU 51 Cb 0.48 -0.86 0.08 0.00 -0.02 0.00 0.00 31.44 31.13 1a8h n GLU 51 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1a8h s HIS 52 N -1.11 2.32 0.00 -0.32 3.76 -1.26 -4.90 115.29 113.77 1a8h s HIS 52 Ca 0.03 0.01 0.00 0.00 -0.15 0.00 0.00 55.06 54.95 1a8h s HIS 52 Cb 0.04 -3.02 0.00 0.00 1.11 0.00 0.00 32.58 30.71 1a8h s HIS 52 CO 0.15 -1.41 0.00 0.41 -0.85 0.00 0.00 174.74 173.04 1a8h n GLY 53 N -2.74 3.01 0.10 -2.22 0.00 -0.70 -4.80 105.19 97.84 1a8h n GLY 53 Ca 0.11 -2.00 -0.02 0.00 0.00 0.00 0.00 46.02 44.11 1a8h n GLY 53 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1a8h h GLU 54 N 0.00 0.00 -0.28 1.61 9.09 -1.90 -2.95 114.58 120.15 1a8h h GLU 54 Ca 0.00 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 59.37 1a8h h GLU 54 Cb 0.00 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.09 1a8h h GLU 54 CO 0.00 0.58 0.03 1.79 0.05 0.00 0.00 179.01 181.46 1a8h h THR 55 N 0.00 1.24 -0.76 -1.06 1.35 -1.93 -0.31 112.91 111.45 1a8h h THR 55 Ca -0.09 -0.83 -0.03 0.00 -0.55 0.00 0.00 66.41 64.91 1a8h h THR 55 Cb 1.63 1.25 -0.03 0.00 -1.73 0.00 0.00 68.15 69.27 1a8h h THR 55 CO 0.08 0.27 0.35 0.58 -0.25 0.00 0.00 175.52 176.55 1a8h h VAL 56 N 0.27 1.25 -0.18 6.82 2.07 -1.87 -1.85 116.25 122.75 1a8h h VAL 56 Ca 0.08 -0.71 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 1a8h h VAL 56 Cb 0.36 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1a8h h VAL 56 CO 0.01 0.30 0.10 0.22 0.02 0.00 0.00 177.57 178.22 1a8h h TYR 57 N 1.07 0.25 0.00 1.57 3.20 -1.31 -1.82 116.97 119.92 1a8h h TYR 57 Ca 0.26 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.07 1a8h h TYR 57 Cb 0.14 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.32 1a8h h TYR 57 CO 0.01 0.22 -0.24 0.00 -1.64 0.00 0.00 178.16 176.51 1a8h h ARG 58 N 0.20 0.00 -0.10 1.82 3.08 -0.88 -1.21 114.38 117.29 1a8h h ARG 58 Ca 0.06 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.91 1a8h h ARG 58 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 1a8h h ARG 58 CO -0.01 0.24 -0.77 0.00 -1.07 0.00 0.00 179.97 178.36 1a8h h ALA 59 N 1.76 0.46 -0.37 0.04 0.00 -1.02 -2.29 119.26 117.84 1a8h h ALA 59 Ca -0.00 -0.61 -0.10 0.00 0.00 0.00 0.00 54.91 54.19 1a8h h ALA 59 Cb 0.56 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1a8h h ALA 59 CO 0.03 0.73 -0.17 0.00 0.00 0.00 0.00 179.25 179.85 1a8h h ALA 60 N 0.76 0.53 -0.89 0.00 0.00 -0.86 -2.86 119.26 115.94 1a8h h ALA 60 Ca -0.04 -0.35 0.04 0.00 0.00 0.00 0.00 54.91 54.55 1a8h h ALA 60 Cb 1.37 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 1a8h h ALA 60 CO 0.14 0.45 0.59 1.96 0.00 0.00 0.00 179.25 182.39 1a8h h GLN 61 N 0.57 1.08 0.05 0.00 4.20 -1.19 -1.83 115.11 118.00 1a8h h GLN 61 Ca 0.09 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 1a8h h GLN 61 Cb 0.71 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1a8h h GLN 61 CO 0.05 0.71 -0.03 0.00 -0.67 0.00 0.00 178.83 178.90 1a8h h ALA 62 N 1.48 -0.07 0.00 3.87 0.00 -1.26 -2.54 119.26 120.73 1a8h h ALA 62 Ca 0.36 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1a8h h ALA 62 Cb 0.03 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1a8h h ALA 62 CO -0.11 -0.47 0.00 0.00 0.00 0.00 0.00 179.25 178.67 1a8h n ALA 63 N -2.19 2.19 -3.65 0.00 0.00 -1.04 -4.84 120.51 110.98 1a8h n ALA 63 Ca -0.08 -0.05 -0.22 0.00 0.00 0.00 0.00 53.44 53.09 1a8h n ALA 63 Cb 0.11 -1.14 0.05 0.00 0.00 0.00 0.00 19.45 18.47 1a8h n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a8h n GLY 64 N 0.19 -0.36 3.16 0.00 0.00 -0.96 -4.99 105.19 102.23 1a8h n GLY 64 Ca 0.06 0.14 -0.17 0.00 0.00 0.00 0.00 46.02 46.06 1a8h n GLY 64 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1a8h s GLU 65 N -5.95 0.80 0.27 1.61 2.12 -0.72 -5.05 118.70 111.78 1a8h s GLU 65 Ca 0.16 -0.98 -0.29 0.00 0.36 0.00 0.00 54.97 54.22 1a8h s GLU 65 Cb -0.08 -0.73 -0.10 0.00 0.26 0.00 0.00 34.13 33.49 1a8h s GLU 65 CO 0.79 0.15 1.28 0.34 -0.54 0.00 0.00 175.26 177.28 1a8h s ASP 66 N -1.87 6.89 0.22 -1.70 2.15 -1.26 -4.25 116.67 116.86 1a8h s ASP 66 Ca -0.01 2.51 -0.12 0.00 0.43 0.00 0.00 52.55 55.36 1a8h s ASP 66 Cb -0.09 -2.63 0.28 0.00 -0.30 0.00 0.00 42.92 40.19 1a8h s ASP 66 CO 0.02 -0.48 1.62 -0.65 -0.17 0.00 0.00 175.17 175.51 1a8h h PRO 67 N 4.29 0.00 -0.71 4.34 0.11 -1.92 0.26 132.00 138.36 1a8h h PRO 67 Ca -0.47 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.61 1a8h h PRO 67 Cb 1.22 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 1a8h h PRO 67 CO 0.71 0.00 0.31 -0.22 -0.21 0.00 0.00 178.00 178.59 1a8h h LYS 68 N 0.00 1.04 -0.15 1.05 3.11 -2.00 -1.95 116.57 117.68 1a8h h LYS 68 Ca 0.34 -0.17 -0.07 0.00 -2.81 0.00 0.00 60.65 57.93 1a8h h LYS 68 Cb 0.52 -0.18 -0.01 0.00 -1.00 0.00 0.00 32.23 31.56 1a8h h LYS 68 CO -0.71 0.84 -0.24 0.00 -2.81 0.00 0.00 179.45 176.52 1a8h h ALA 69 N 1.15 1.32 0.35 5.00 0.00 -1.49 -1.87 119.26 123.72 1a8h h ALA 69 Ca 0.24 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1a8h h ALA 69 Cb 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1a8h h ALA 69 CO -0.02 0.46 -0.17 0.35 0.00 0.00 0.00 179.25 179.87 1a8h h PHE 70 N 0.24 -0.43 0.00 0.00 3.57 -0.07 -2.89 116.94 117.35 1a8h h PHE 70 Ca 0.04 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 1a8h h PHE 70 Cb 0.56 0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.44 1a8h h PHE 70 CO 0.01 -0.11 -0.12 -0.39 -2.23 0.00 0.00 178.31 175.47 1a8h h VAL 71 N -0.95 0.90 -0.85 1.41 -1.51 -1.39 -1.79 116.25 112.06 1a8h h VAL 71 Ca -0.05 -0.45 -0.02 0.00 -1.23 0.00 0.00 66.70 64.95 1a8h h VAL 71 Cb 0.52 1.26 -0.04 0.00 -2.13 0.00 0.00 31.29 30.90 1a8h h VAL 71 CO 0.08 0.12 0.47 0.44 -1.23 0.00 0.00 177.57 177.45 1a8h h ASP 72 N 0.00 1.06 0.23 4.19 3.32 -1.34 0.18 116.42 124.07 1a8h h ASP 72 Ca -0.00 -0.10 -0.33 0.00 0.02 0.00 0.00 57.03 56.62 1a8h h ASP 72 Cb 0.25 -0.27 0.03 0.00 0.22 0.00 0.00 39.33 39.56 1a8h h ASP 72 CO 0.02 0.85 -1.47 -0.09 -1.72 0.00 0.00 179.24 176.83 1a8h h ARG 73 N 1.18 0.49 0.00 3.56 2.43 -1.18 -3.32 114.38 117.54 1a8h h ARG 73 Ca 0.30 -0.84 -0.13 0.00 -0.81 0.00 0.00 59.98 58.50 1a8h h ARG 73 Cb 0.03 0.31 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 1a8h h ARG 73 CO -0.05 1.40 -0.63 -0.39 -1.51 0.00 0.00 179.97 178.79 1a8h h VAL 74 N 0.08 1.19 0.00 0.20 -1.51 -1.30 -3.02 116.25 111.89 1a8h h VAL 74 Ca -0.27 -2.39 -0.04 0.00 -1.23 0.00 0.00 66.70 62.77 1a8h h VAL 74 Cb 2.10 2.40 -0.01 0.00 -2.13 0.00 0.00 31.29 33.66 1a8h h VAL 74 CO 0.24 0.62 -0.21 0.77 -1.23 0.00 0.00 177.57 177.76 1a8h h SER 75 N 0.00 0.00 0.56 4.19 4.64 -0.77 -1.87 113.55 120.30 1a8h h SER 75 Ca -0.01 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1a8h h SER 75 Cb 1.35 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1a8h h SER 75 CO 0.08 0.21 -0.02 1.23 -0.87 0.00 0.00 176.83 177.46 1a8h h GLY 76 N 0.86 0.00 2.00 -0.77 0.00 -1.62 -1.81 103.07 101.73 1a8h h GLY 76 Ca -0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1a8h h GLY 76 CO 0.03 0.00 -0.24 3.21 0.00 0.00 0.00 176.54 179.53 1a8h h ARG 77 N 0.00 0.00 0.21 4.80 3.08 -1.46 0.26 114.38 121.28 1a8h h ARG 77 Ca -0.00 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.75 1a8h h ARG 77 Cb 0.31 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.40 1a8h h ARG 77 CO 0.00 0.24 -1.32 0.74 -1.07 0.00 0.00 179.97 178.57 1a8h h PHE 78 N 0.00 0.93 -0.40 3.04 0.04 -1.47 -1.86 116.94 117.21 1a8h h PHE 78 Ca -0.00 -0.65 -0.03 0.00 2.80 0.00 0.00 57.97 60.08 1a8h h PHE 78 Cb 0.55 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.64 1a8h h PHE 78 CO 0.00 1.50 0.12 0.87 -0.60 0.00 0.00 178.31 180.20 1a8h h LYS 79 N 0.09 0.62 -0.80 1.51 1.57 -1.35 -0.34 116.57 117.86 1a8h h LYS 79 Ca -0.22 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.40 1a8h h LYS 79 Cb 2.03 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 34.21 1a8h h LYS 79 CO 0.25 0.63 0.44 0.00 -0.57 0.00 0.00 179.45 180.20 1a8h h ARG 80 N 0.50 1.12 -0.63 3.15 3.08 -1.03 -0.99 114.38 119.58 1a8h h ARG 80 Ca 0.13 -0.13 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 1a8h h ARG 80 Cb 0.27 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 1a8h h ARG 80 CO -0.00 0.82 0.22 0.00 -1.07 0.00 0.00 179.97 179.94 1a8h h ALA 81 N 1.23 0.82 -0.01 0.04 0.00 -0.94 -1.99 119.26 118.42 1a8h h ALA 81 Ca 0.28 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 1a8h h ALA 81 Cb 0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1a8h h ALA 81 CO -0.05 0.46 -0.48 -1.49 0.00 0.00 0.00 179.25 177.70 1a8h h TRP 82 N 0.89 0.02 -0.54 0.00 -0.00 -0.79 -2.16 115.95 113.36 1a8h h TRP 82 Ca 0.21 -0.01 -0.05 0.00 -0.00 0.00 0.00 58.89 59.04 1a8h h TRP 82 Cb 0.25 -0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 29.38 1a8h h TRP 82 CO 0.02 0.49 0.14 -0.44 -0.00 0.00 0.00 178.44 178.65 1a8h h ASP 83 N 0.01 0.81 -0.16 -3.49 5.19 -0.69 -0.53 116.42 117.56 1a8h h ASP 83 Ca -0.00 -0.22 -0.10 0.00 -0.62 0.00 0.00 57.03 56.08 1a8h h ASP 83 Cb 0.85 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 40.13 1a8h h ASP 83 CO 0.06 0.82 -0.22 -0.07 -3.12 0.00 0.00 179.24 176.72 1a8h h LEU 84 N 0.76 0.60 -0.26 1.55 3.38 -1.04 -2.68 115.31 117.61 1a8h h LEU 84 Ca 0.17 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1a8h h LEU 84 Cb 0.32 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1a8h h LEU 84 CO -0.00 0.81 -0.03 0.18 0.09 0.00 0.00 178.44 179.49 1a8h n LEU 85 N -4.13 0.43 -2.29 1.67 4.77 -0.84 -4.75 117.00 111.86 1a8h n LEU 85 Ca 0.00 -0.08 -0.13 0.00 -0.03 0.00 0.00 56.01 55.77 1a8h n LEU 85 Cb 0.40 -0.07 0.05 0.00 -2.33 0.00 0.00 43.42 41.47 1a8h n LEU 85 CO 0.43 0.07 0.13 0.61 -1.33 0.00 0.00 177.39 177.30 1a8h n GLY 86 N 1.13 0.08 3.62 -0.72 0.00 -0.77 -4.96 105.19 103.57 1a8h n GLY 86 Ca 0.20 -0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1a8h n GLY 86 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a8h s ILE 87 N -3.19 4.70 -1.06 -0.61 -1.09 -0.28 -4.98 121.20 114.70 1a8h s ILE 87 Ca 0.30 1.41 -0.03 0.00 -2.23 0.00 0.00 60.65 60.10 1a8h s ILE 87 Cb -0.13 -4.23 0.31 0.00 -1.58 0.00 0.00 42.46 36.82 1a8h s ILE 87 CO 0.42 -0.31 1.51 0.00 -1.23 0.00 0.00 174.94 175.33 1a8h n ALA 88 N 6.40 5.27 -1.93 9.38 0.00 -1.26 -4.79 120.51 133.57 1a8h n ALA 88 Ca 0.07 -4.79 -0.32 0.00 0.00 0.00 0.00 53.44 48.40 1a8h n ALA 88 Cb 0.48 -2.29 -0.04 0.00 0.00 0.00 0.00 19.45 17.59 1a8h n ALA 88 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1a8h s TYR 89 N -2.98 3.43 0.03 0.00 -0.85 -1.26 -4.90 117.35 110.82 1a8h s TYR 89 Ca 0.32 1.39 0.06 0.00 -0.52 0.00 0.00 57.07 58.31 1a8h s TYR 89 Cb 0.07 -2.71 -0.24 0.00 0.38 0.00 0.00 41.96 39.46 1a8h s TYR 89 CO 0.08 -0.24 0.95 -0.44 -1.52 0.00 0.00 175.55 174.37 1a8h h ASP 90 N 1.24 0.12 -5.01 -0.18 3.32 -1.29 -3.47 116.42 111.15 1a8h h ASP 90 Ca -0.47 -0.17 -0.13 0.00 0.02 0.00 0.00 57.03 56.27 1a8h h ASP 90 Cb 1.18 -0.04 -0.20 0.00 0.22 0.00 0.00 39.33 40.50 1a8h h ASP 90 CO 0.62 1.15 -0.46 -0.62 -1.72 0.00 0.00 179.24 178.21 1a8h s ASP 91 N -6.60 0.03 -0.31 6.45 -1.08 -1.19 -5.02 116.67 108.95 1a8h s ASP 91 Ca -0.04 -0.26 0.03 0.00 -0.52 0.00 0.00 52.55 51.76 1a8h s ASP 91 Cb 0.08 0.23 0.09 0.00 -1.46 0.00 0.00 42.92 41.86 1a8h s ASP 91 CO 0.83 -0.43 0.02 0.12 0.52 0.00 0.00 175.17 176.24 1a8h s PHE 92 N -1.75 3.14 -0.03 -5.34 2.19 -1.26 -2.97 117.98 111.96 1a8h s PHE 92 Ca -0.12 -2.51 -0.21 0.00 0.33 0.00 0.00 56.93 54.42 1a8h s PHE 92 Cb -0.05 -2.39 -0.05 0.00 -1.31 0.00 0.00 43.02 39.22 1a8h s PHE 92 CO 0.00 -0.90 0.60 -1.50 1.83 0.00 0.00 175.22 175.25 1a8h s ILE 93 N 1.13 4.96 -0.11 3.12 1.10 -0.05 -4.94 121.20 126.41 1a8h s ILE 93 Ca 0.06 1.25 0.03 0.00 -0.51 0.00 0.00 60.65 61.48 1a8h s ILE 93 Cb -0.19 -3.94 0.00 0.00 0.15 0.00 0.00 42.46 38.49 1a8h s ILE 93 CO -0.10 0.38 -0.23 -0.13 -2.11 0.00 0.00 174.94 172.74 1a8h s ARG 94 N 0.07 3.04 0.00 3.50 0.52 -1.26 -0.86 118.95 123.96 1a8h s ARG 94 Ca 0.32 -0.87 0.05 0.00 -0.52 0.00 0.00 55.73 54.71 1a8h s ARG 94 Cb -0.18 -2.35 0.23 0.00 0.52 0.00 0.00 34.95 33.18 1a8h s ARG 94 CO 0.17 0.12 1.12 0.25 0.02 0.00 0.00 175.30 176.97 1a8h n THR 95 N 3.70 1.43 1.12 0.02 -2.24 -1.06 -1.46 114.28 115.79 1a8h n THR 95 Ca -0.19 0.36 0.12 0.00 -2.27 0.00 0.00 64.05 62.07 1a8h n THR 95 Cb 0.53 -1.27 0.27 0.00 -2.10 0.00 0.00 70.33 67.75 1a8h n THR 95 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1a8h n THR 96 N -1.44 0.00 -2.18 4.28 -2.24 -1.26 -4.59 114.28 106.86 1a8h n THR 96 Ca 0.02 -0.08 -0.36 0.00 -2.27 0.00 0.00 64.05 61.36 1a8h n THR 96 Cb 0.06 0.45 0.01 0.00 -2.10 0.00 0.00 70.33 68.75 1a8h n THR 96 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1a8h s GLU 97 N -2.72 3.31 0.14 -0.78 2.02 -0.54 -4.90 118.70 115.24 1a8h s GLU 97 Ca 0.18 1.72 -0.16 0.00 0.02 0.00 0.00 54.97 56.73 1a8h s GLU 97 Cb 0.18 -2.06 -0.00 0.00 0.10 0.00 0.00 34.13 32.35 1a8h s GLU 97 CO 0.61 -0.91 1.74 1.49 0.02 0.00 0.00 175.26 178.22 1a8h h GLU 98 N 1.27 0.55 -0.51 1.61 4.57 -1.92 -1.92 114.58 118.24 1a8h h GLU 98 Ca -0.50 -0.07 0.10 0.00 -1.18 0.00 0.00 59.36 57.71 1a8h h GLU 98 Cb 1.27 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.73 1a8h h GLU 98 CO 0.57 0.46 0.35 0.07 -1.18 0.00 0.00 179.01 179.27 1a8h h ARG 99 N 0.50 0.25 0.02 1.92 0.11 -1.95 0.48 114.38 115.71 1a8h h ARG 99 Ca 0.14 -0.01 -0.09 0.00 0.10 0.00 0.00 59.98 60.11 1a8h h ARG 99 Cb 0.07 -0.06 0.01 0.00 1.11 0.00 0.00 29.97 31.10 1a8h h ARG 99 CO -0.02 0.16 -0.37 1.25 0.10 0.00 0.00 179.97 181.09 1a8h h HIS 100 N 0.25 0.33 -0.59 4.08 2.76 -1.75 -3.11 115.15 117.12 1a8h h HIS 100 Ca 0.24 -0.20 0.08 0.00 -2.20 0.00 0.00 60.37 58.29 1a8h h HIS 100 Cb 0.59 -0.03 -0.07 0.00 1.55 0.00 0.00 27.41 29.46 1a8h h HIS 100 CO -0.00 1.04 0.24 -0.22 -1.30 0.00 0.00 177.93 177.70 1a8h h LYS 101 N -0.48 0.43 -0.54 5.26 3.64 -0.63 -1.37 116.57 122.89 1a8h h LYS 101 Ca -0.05 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.37 1a8h h LYS 101 Cb 1.16 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 32.83 1a8h h LYS 101 CO 0.07 0.28 0.22 -0.22 -2.27 0.00 0.00 179.45 177.54 1a8h h LYS 102 N 0.44 0.41 -0.28 1.90 3.64 -1.01 -1.77 116.57 119.91 1a8h h LYS 102 Ca 0.29 -0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.49 1a8h h LYS 102 Cb 0.32 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1a8h h LYS 102 CO -0.27 0.27 -0.45 0.28 -2.27 0.00 0.00 179.45 177.01 1a8h h VAL 103 N 0.42 1.29 0.00 2.00 2.07 -1.35 -2.14 116.25 118.54 1a8h h VAL 103 Ca 0.25 -1.64 -0.00 0.00 0.82 0.00 0.00 66.70 66.13 1a8h h VAL 103 Cb 0.25 1.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 1a8h h VAL 103 CO -0.23 0.53 -0.00 0.58 0.02 0.00 0.00 177.57 178.46 1a8h h VAL 104 N 0.57 1.10 -0.93 2.57 2.07 -0.91 -0.76 116.25 119.96 1a8h h VAL 104 Ca 0.04 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 67.27 1a8h h VAL 104 Cb 1.00 1.30 -0.05 0.00 -1.52 0.00 0.00 31.29 32.03 1a8h h VAL 104 CO 0.10 0.08 0.62 1.56 0.02 0.00 0.00 177.57 179.94 1a8h h GLN 105 N -0.13 1.21 -0.60 1.57 4.20 -1.36 -0.26 115.11 119.73 1a8h h GLN 105 Ca -0.00 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 1a8h h GLN 105 Cb 0.13 -0.27 -0.03 0.00 0.30 0.00 0.00 27.48 27.61 1a8h h GLN 105 CO 0.00 0.80 0.31 1.25 -0.67 0.00 0.00 178.83 180.53 1a8h h LEU 106 N 1.25 0.77 -0.55 1.46 6.46 -1.13 -0.38 115.31 123.19 1a8h h LEU 106 Ca 0.34 -0.11 -0.16 0.00 -0.12 0.00 0.00 57.88 57.84 1a8h h LEU 106 Cb -0.13 -0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 39.59 1a8h h LEU 106 CO -0.08 0.66 -0.71 0.58 -0.62 0.00 0.00 178.44 178.27 1a8h h VAL 107 N 0.82 1.46 -0.25 1.05 2.07 -0.82 -2.67 116.25 117.91 1a8h h VAL 107 Ca 0.21 -2.32 -0.05 0.00 0.82 0.00 0.00 66.70 65.36 1a8h h VAL 107 Cb 0.07 2.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 1a8h h VAL 107 CO -0.03 0.67 -0.05 -0.07 0.02 0.00 0.00 177.57 178.10 1a8h h LEU 108 N 0.08 0.48 -0.45 2.57 3.38 -0.71 -1.53 115.31 119.11 1a8h h LEU 108 Ca -0.02 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1a8h h LEU 108 Cb 1.26 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 1a8h h LEU 108 CO 0.10 0.73 0.20 0.50 0.09 0.00 0.00 178.44 180.06 1a8h h LYS 109 N 0.22 0.66 -0.82 1.13 3.64 -1.09 0.12 116.57 120.44 1a8h h LYS 109 Ca 0.06 -0.11 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 1a8h h LYS 109 Cb 0.52 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.18 1a8h h LYS 109 CO 0.02 0.58 0.36 -0.22 -2.27 0.00 0.00 179.45 177.93 1a8h h LYS 110 N 0.59 1.19 0.01 1.90 3.64 -1.45 0.22 116.57 122.67 1a8h h LYS 110 Ca 0.15 -0.19 -0.19 0.00 -1.27 0.00 0.00 60.65 59.15 1a8h h LYS 110 Cb 0.15 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1a8h h LYS 110 CO -0.02 0.94 -0.91 0.28 -2.27 0.00 0.00 179.45 177.48 1a8h h VAL 111 N 1.17 1.62 -0.19 2.00 2.07 -1.06 -2.60 116.25 119.25 1a8h h VAL 111 Ca 0.28 -3.01 -0.20 0.00 0.82 0.00 0.00 66.70 64.58 1a8h h VAL 111 Cb 0.16 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 1a8h h VAL 111 CO -0.03 0.86 -0.68 0.22 0.02 0.00 0.00 177.57 177.97 1a8h h TYR 112 N 0.02 0.99 0.00 1.57 3.20 -0.48 -2.52 116.97 119.75 1a8h h TYR 112 Ca -0.02 -0.40 -0.04 0.00 3.14 0.00 0.00 58.73 61.42 1a8h h TYR 112 Cb 1.59 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 39.69 1a8h h TYR 112 CO 0.01 1.22 -0.17 0.93 -1.64 0.00 0.00 178.16 178.50 1a8h h GLU 113 N 0.54 0.00 0.00 1.82 5.08 -0.99 -1.93 114.58 119.11 1a8h h GLU 113 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1a8h h GLU 113 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1a8h h GLU 113 CO 0.14 0.17 0.00 0.00 -1.00 0.00 0.00 179.01 178.32 1a8h n ALA 114 N -2.19 2.51 -0.95 3.43 0.00 -0.98 -4.89 120.51 117.43 1a8h n ALA 114 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1a8h n ALA 114 Cb 0.41 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1a8h n ALA 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a8h n GLY 115 N 1.05 0.51 0.37 0.00 0.00 -0.72 -4.92 105.19 101.47 1a8h n GLY 115 Ca 0.17 -0.15 0.10 0.00 0.00 0.00 0.00 46.02 46.15 1a8h n GLY 115 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1a8h n ASP 116 N 0.27 1.11 -4.17 1.61 8.00 -0.96 -4.82 116.55 117.58 1a8h n ASP 116 Ca 0.00 -1.60 -0.27 0.00 0.71 0.00 0.00 54.79 53.63 1a8h n ASP 116 Cb 0.00 -0.07 -0.16 0.00 -0.02 0.00 0.00 41.12 40.87 1a8h n ASP 116 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1a8h s ILE 117 N -1.87 1.55 0.05 0.53 1.01 -1.26 -0.53 121.20 120.69 1a8h s ILE 117 Ca 0.31 -0.80 -0.09 0.00 0.00 0.00 0.00 60.65 60.08 1a8h s ILE 117 Cb 0.16 -1.32 0.00 0.00 0.01 0.00 0.00 42.46 41.31 1a8h s ILE 117 CO 0.25 0.44 0.18 -0.72 0.00 0.00 0.00 174.94 175.10 1a8h s TYR 118 N -0.09 0.09 0.05 3.97 1.13 -0.76 -4.96 117.35 116.80 1a8h s TYR 118 Ca -0.02 -0.37 -0.22 0.00 -1.41 0.00 0.00 57.07 55.05 1a8h s TYR 118 Cb -0.11 -0.05 -0.06 0.00 -1.10 0.00 0.00 41.96 40.64 1a8h s TYR 118 CO 0.02 -0.45 0.67 -0.47 -2.51 0.00 0.00 175.55 172.81 1a8h s TYR 119 N -2.87 3.76 0.00 -3.49 5.04 -1.26 0.41 117.35 118.94 1a8h s TYR 119 Ca -0.03 1.36 0.00 0.00 -2.44 0.00 0.00 57.07 55.97 1a8h s TYR 119 Cb 0.00 -2.67 0.00 0.00 0.35 0.00 0.00 41.96 39.64 1a8h s TYR 119 CO -0.06 0.41 0.00 0.41 -1.34 0.00 0.00 175.55 174.97 1a8h n GLY 120 N 2.14 3.44 3.20 8.97 0.00 0.47 -4.92 105.19 118.47 1a8h n GLY 120 Ca -0.06 -1.07 -0.28 0.00 0.00 0.00 0.00 46.02 44.61 1a8h n GLY 120 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a8h s GLU 121 N 0.05 1.92 -0.09 1.61 2.02 -1.26 -1.41 118.70 121.53 1a8h s GLU 121 Ca 0.00 -0.72 -0.02 0.00 0.02 0.00 0.00 54.97 54.25 1a8h s GLU 121 Cb 0.00 -1.71 -0.03 0.00 0.10 0.00 0.00 34.13 32.48 1a8h s GLU 121 CO 0.00 0.35 -0.01 -0.47 0.02 0.00 0.00 175.26 175.15 1a8h s TYR 122 N -0.20 3.13 0.08 1.61 5.04 -0.22 -4.92 117.35 121.88 1a8h s TYR 122 Ca 0.00 0.13 0.06 0.00 -2.44 0.00 0.00 57.07 54.82 1a8h s TYR 122 Cb -0.11 -1.81 -0.03 0.00 0.35 0.00 0.00 41.96 40.36 1a8h s TYR 122 CO 0.01 0.40 -0.16 -2.00 -1.34 0.00 0.00 175.55 172.46 1a8h s GLU 123 N -0.71 0.93 0.00 4.97 2.12 -1.26 -0.98 118.70 123.77 1a8h s GLU 123 Ca 0.11 -1.01 0.00 0.00 0.36 0.00 0.00 54.97 54.43 1a8h s GLU 123 Cb -0.12 -1.02 0.00 0.00 0.26 0.00 0.00 34.13 33.26 1a8h s GLU 123 CO 0.02 0.23 0.00 0.41 -0.54 0.00 0.00 175.26 175.38 1a8h n GLY 124 N 1.26 -1.74 3.72 -1.50 0.00 -0.65 -4.96 105.19 101.32 1a8h n GLY 124 Ca -0.20 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.02 1a8h n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a8h s LEU 125 N 0.00 4.37 -0.01 0.99 1.43 -1.25 -0.95 118.68 123.25 1a8h s LEU 125 Ca 0.00 2.58 0.03 0.00 -1.03 0.00 0.00 54.13 55.71 1a8h s LEU 125 Cb 0.00 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.62 1a8h s LEU 125 CO 0.00 -0.82 -0.10 -0.47 0.23 0.00 0.00 176.35 175.19 1a8h s TYR 126 N 1.28 0.90 -0.25 0.29 5.04 0.27 -1.05 117.35 123.83 1a8h s TYR 126 Ca 0.70 -0.18 -0.05 0.00 -2.44 0.00 0.00 57.07 55.09 1a8h s TYR 126 Cb -0.43 -0.59 -0.01 0.00 0.35 0.00 0.00 41.96 41.28 1a8h s TYR 126 CO 0.31 -0.03 0.02 0.00 -1.34 0.00 0.00 175.55 174.51 1a8h h VAL 128 N 5.75 1.02 -0.05 0.00 -1.51 -1.90 0.34 116.25 119.90 1a8h h VAL 128 Ca -0.37 -0.27 -0.24 0.00 -1.23 0.00 0.00 66.70 64.59 1a8h h VAL 128 Cb 1.15 1.15 0.02 0.00 -2.13 0.00 0.00 31.29 31.47 1a8h h VAL 128 CO 0.59 0.08 -0.90 0.28 -1.23 0.00 0.00 177.57 176.39 1a8h h SER 129 N 0.00 0.88 0.15 4.19 0.02 -1.97 -3.32 113.55 113.50 1a8h h SER 129 Ca -0.00 -0.70 -0.31 0.00 -0.84 0.00 0.00 61.79 59.94 1a8h h SER 129 Cb 0.14 -0.27 0.03 0.00 0.14 0.00 0.00 62.40 62.45 1a8h h SER 129 CO 0.01 1.46 -1.29 0.00 -1.14 0.00 0.00 176.83 175.86 1a8h n GLU 131 N -3.78 -4.00 -3.80 0.00 -0.58 0.12 -4.96 120.64 103.64 1a8h n GLU 131 Ca -0.14 0.43 -0.10 0.00 -0.42 0.00 0.00 57.16 56.92 1a8h n GLU 131 Cb 1.01 -4.25 -0.07 0.00 -0.57 0.00 0.00 31.44 27.56 1a8h n GLU 131 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1a8h s ARG 132 N -5.50 0.80 0.23 3.49 1.70 -1.24 -4.91 118.95 113.52 1a8h s ARG 132 Ca 0.25 -0.69 -0.10 0.00 -0.47 0.00 0.00 55.73 54.72 1a8h s ARG 132 Cb -0.11 0.34 -0.07 0.00 -0.57 0.00 0.00 34.95 34.54 1a8h s ARG 132 CO 0.38 -0.26 0.55 -0.06 -1.08 0.00 0.00 175.30 174.83 1a8h s PHE 133 N -3.03 3.43 0.18 5.89 0.08 -1.26 -2.68 117.98 120.59 1a8h s PHE 133 Ca -0.02 0.88 0.05 0.00 0.12 0.00 0.00 56.93 57.96 1a8h s PHE 133 Cb 0.01 -2.27 -0.05 0.00 -0.57 0.00 0.00 43.02 40.15 1a8h s PHE 133 CO -0.06 0.27 -0.08 0.71 -0.10 0.00 0.00 175.22 175.96 1a8h s TYR 134 N -1.81 1.42 0.39 0.36 2.02 -0.21 -5.00 117.35 114.51 1a8h s TYR 134 Ca 0.47 -0.78 0.08 0.00 -0.37 0.00 0.00 57.07 56.47 1a8h s TYR 134 Cb -0.11 -0.75 -0.05 0.00 -0.40 0.00 0.00 41.96 40.65 1a8h s TYR 134 CO 0.21 0.09 0.18 0.95 -1.57 0.00 0.00 175.55 175.41 1a8h s THR 135 N -3.30 2.59 0.10 -0.71 -4.23 -1.26 -3.93 115.64 104.90 1a8h s THR 135 Ca 0.21 -1.67 -0.27 0.00 -1.18 0.00 0.00 61.69 58.78 1a8h s THR 135 Cb 0.03 -2.98 -0.10 0.00 1.34 0.00 0.00 72.50 70.79 1a8h s THR 135 CO 0.04 -0.07 1.45 -0.33 -0.54 0.00 0.00 174.62 175.17 1a8h h GLU 136 N 1.43 -0.40 -1.00 3.99 3.07 -2.00 -2.02 114.58 117.65 1a8h h GLU 136 Ca -0.43 0.03 0.14 0.00 -0.50 0.00 0.00 59.36 58.60 1a8h h GLU 136 Cb 1.25 0.09 -0.09 0.00 -0.84 0.00 0.00 28.75 29.17 1a8h h GLU 136 CO 0.66 -0.27 0.63 -0.22 -1.40 0.00 0.00 179.01 178.41 1a8h h LYS 137 N -0.42 0.90 0.00 2.33 3.64 -2.03 -1.23 116.57 119.76 1a8h h LYS 137 Ca 0.04 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1a8h h LYS 137 Cb 0.53 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1a8h h LYS 137 CO -0.41 0.60 -0.06 0.93 -2.27 0.00 0.00 179.45 178.24 1a8h h GLU 138 N 0.93 0.00 -6.12 1.90 5.08 -1.78 -3.42 114.58 111.17 1a8h h GLU 138 Ca 0.51 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 58.31 1a8h h GLU 138 Cb 0.59 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.79 1a8h h GLU 138 CO -0.29 0.06 0.51 -0.51 -1.00 0.00 0.00 179.01 177.79 1a8h s LEU 139 N -7.15 4.21 -0.96 1.33 1.43 -0.47 -4.52 118.68 112.55 1a8h s LEU 139 Ca -0.04 1.38 -0.22 0.00 -1.03 0.00 0.00 54.13 54.23 1a8h s LEU 139 Cb 0.13 -3.43 -0.12 0.00 0.03 0.00 0.00 46.19 42.81 1a8h s LEU 139 CO 0.54 -0.44 1.93 1.33 0.23 0.00 0.00 176.35 179.94 1a8h n VAL 140 N 4.67 2.00 -3.02 -1.59 0.24 -0.77 -4.16 118.33 115.69 1a8h n VAL 140 Ca 0.07 -1.90 -0.01 0.00 -2.04 0.00 0.00 64.34 60.47 1a8h n VAL 140 Cb 0.49 -2.28 0.00 0.00 -1.47 0.00 0.00 33.84 30.58 1a8h n VAL 140 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 1a8h n GLU 141 N 7.49 -1.42 0.00 7.34 4.07 -1.26 -3.88 120.64 132.99 1a8h n GLU 141 Ca 0.48 1.55 0.00 0.00 -0.06 0.00 0.00 57.16 59.13 1a8h n GLU 141 Cb 0.43 -5.71 0.00 0.00 -0.06 0.00 0.00 31.44 26.10 1a8h n GLU 141 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1a8h n GLY 142 N -1.61 2.26 3.98 8.31 0.00 -1.26 -5.00 105.19 111.88 1a8h n GLY 142 Ca 0.01 -0.41 -0.21 0.00 0.00 0.00 0.00 46.02 45.42 1a8h n GLY 142 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a8h s LEU 143 N 0.00 3.62 0.26 0.99 1.43 -1.25 -4.36 118.68 119.36 1a8h s LEU 143 Ca 0.00 -0.02 -0.30 0.00 -1.03 0.00 0.00 54.13 52.78 1a8h s LEU 143 Cb 0.00 -2.91 -0.10 0.00 0.03 0.00 0.00 46.19 43.22 1a8h s LEU 143 CO 0.00 -0.78 1.31 0.00 0.23 0.00 0.00 176.35 177.11 1a8h h PRO 145 N 4.48 -0.24 -6.75 0.00 0.11 -1.91 -2.22 132.00 125.48 1a8h h PRO 145 Ca -0.47 0.02 -0.46 0.00 0.11 0.00 0.00 66.00 65.20 1a8h h PRO 145 Cb 1.22 0.05 0.03 0.00 0.11 0.00 0.00 31.00 32.41 1a8h h PRO 145 CO 0.72 -0.16 -0.06 0.42 -0.21 0.00 0.00 178.00 178.71 1a8h s ILE 146 N -6.00 4.02 0.00 4.15 1.01 -1.26 -4.08 121.20 119.03 1a8h s ILE 146 Ca -0.15 -0.42 0.00 0.00 0.00 0.00 0.00 60.65 60.09 1a8h s ILE 146 Cb 0.14 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 39.11 1a8h s ILE 146 CO 0.68 -0.37 0.00 1.41 0.00 0.00 0.00 174.94 176.66 1a8h n HIS 147 N -2.13 0.00 -4.16 3.97 8.25 -1.26 -4.09 115.22 115.80 1a8h n HIS 147 Ca 0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.15 1a8h n HIS 147 Cb 0.58 -0.14 -0.03 0.00 1.12 0.00 0.00 29.99 31.51 1a8h n HIS 147 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a8h n GLY 148 N -0.44 -0.35 3.49 -1.41 0.00 -0.83 -4.95 105.19 100.71 1a8h n GLY 148 Ca 0.00 0.14 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 1a8h n GLY 148 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1a8h s ARG 149 N -6.86 1.77 0.31 1.61 1.04 -1.26 -4.75 118.95 110.81 1a8h s ARG 149 Ca 0.45 -1.55 -0.29 0.00 -1.04 0.00 0.00 55.73 53.30 1a8h s ARG 149 Cb -0.25 -1.92 -0.10 0.00 -2.04 0.00 0.00 34.95 30.65 1a8h s ARG 149 CO 0.93 0.38 1.32 -2.14 -0.04 0.00 0.00 175.30 175.75 1a8h s PRO 150 N -3.10 4.35 0.25 3.89 0.02 -1.26 -0.68 135.00 138.47 1a8h s PRO 150 Ca 0.26 2.21 -0.00 0.00 0.02 0.00 0.00 61.00 63.48 1a8h s PRO 150 Cb -0.07 -3.09 -0.04 0.00 0.02 0.00 0.00 34.50 31.32 1a8h s PRO 150 CO 0.14 -0.22 0.45 0.14 -0.33 0.00 0.00 177.00 177.17 1a8h s VAL 151 N -0.85 5.16 0.08 3.83 -7.23 -1.26 -4.86 120.40 115.27 1a8h s VAL 151 Ca 0.51 -0.40 0.06 0.00 -1.81 0.00 0.00 61.98 60.35 1a8h s VAL 151 Cb -0.40 -3.78 -0.03 0.00 0.56 0.00 0.00 36.38 32.74 1a8h s VAL 151 CO 0.50 -0.30 -0.17 -1.61 -0.31 0.00 0.00 175.10 173.21 1a8h s GLU 152 N -3.65 0.95 0.19 4.82 2.02 -0.20 -4.82 118.70 118.01 1a8h s GLU 152 Ca 0.39 -1.01 -0.31 0.00 0.02 0.00 0.00 54.97 54.06 1a8h s GLU 152 Cb -0.10 -1.04 -0.10 0.00 0.10 0.00 0.00 34.13 32.98 1a8h s GLU 152 CO 0.31 0.24 1.52 1.03 0.02 0.00 0.00 175.26 178.38 1a8h s ARG 153 N -1.73 4.23 0.09 1.61 1.81 -1.26 -0.56 118.95 123.13 1a8h s ARG 153 Ca 0.01 2.34 -0.11 0.00 -1.72 0.00 0.00 55.73 56.25 1a8h s ARG 153 Cb -0.10 -3.14 0.01 0.00 -0.45 0.00 0.00 34.95 31.28 1a8h s ARG 153 CO 0.03 -0.54 0.26 1.03 -0.68 0.00 0.00 175.30 175.40 1a8h s ARG 154 N 0.61 0.88 0.14 3.54 0.52 -0.12 -4.90 118.95 119.62 1a8h s ARG 154 Ca 0.66 -0.79 0.10 0.00 -0.52 0.00 0.00 55.73 55.19 1a8h s ARG 154 Cb -0.43 0.37 -0.04 0.00 0.52 0.00 0.00 34.95 35.37 1a8h s ARG 154 CO 0.36 -0.30 -0.23 -1.59 0.02 0.00 0.00 175.30 173.56 1a8h s LYS 155 N -3.51 1.56 -0.17 3.54 0.00 -1.26 -1.63 119.74 118.28 1a8h s LYS 155 Ca 0.02 -1.34 -0.15 0.00 0.00 0.00 0.00 55.97 54.50 1a8h s LYS 155 Cb 0.03 -1.96 0.04 0.00 0.00 0.00 0.00 37.83 35.94 1a8h s LYS 155 CO -0.09 0.45 0.45 -2.00 0.00 0.00 0.00 175.35 174.15 1a8h s GLU 156 N -2.25 0.52 -0.02 1.78 2.12 -0.15 -4.95 118.70 115.74 1a8h s GLU 156 Ca 0.17 0.62 -0.30 0.00 0.36 0.00 0.00 54.97 55.82 1a8h s GLU 156 Cb -0.10 0.25 -0.05 0.00 0.26 0.00 0.00 34.13 34.49 1a8h s GLU 156 CO 0.08 -0.06 1.49 0.20 -0.54 0.00 0.00 175.26 176.43 1a8h s GLY 157 N 0.25 1.70 0.03 -1.50 0.00 -1.26 -1.05 107.32 105.49 1a8h s GLY 157 Ca -0.00 0.90 0.00 0.00 0.00 0.00 0.00 44.72 45.62 1a8h s GLY 157 CO 0.00 2.71 -0.04 -1.31 0.00 0.00 0.00 173.10 174.47 1a8h s ASN 158 N 2.36 0.40 0.02 1.64 -0.87 -0.50 -4.46 114.94 113.52 1a8h s ASN 158 Ca 0.67 -0.64 -0.16 0.00 -1.57 0.00 0.00 52.86 51.15 1a8h s ASN 158 Cb -0.32 0.12 -0.06 0.00 -0.02 0.00 0.00 41.25 40.97 1a8h s ASN 158 CO 0.27 -0.37 0.45 -0.31 -2.57 0.00 0.00 177.10 174.57 1a8h s TYR 159 N -2.12 3.75 0.29 2.20 2.02 -1.26 -0.40 117.35 121.82 1a8h s TYR 159 Ca -0.09 1.07 0.11 0.00 -0.37 0.00 0.00 57.07 57.79 1a8h s TYR 159 Cb -0.05 -2.35 -0.05 0.00 -0.40 0.00 0.00 41.96 39.10 1a8h s TYR 159 CO -0.03 0.62 -0.14 -0.06 -1.57 0.00 0.00 175.55 174.36 1a8h s PHE 160 N -1.04 2.38 -0.15 2.71 0.40 0.17 -1.13 117.98 121.32 1a8h s PHE 160 Ca 0.25 -0.34 -0.00 0.00 -0.60 0.00 0.00 56.93 56.24 1a8h s PHE 160 Cb -0.17 -1.11 -0.01 0.00 0.51 0.00 0.00 43.02 42.24 1a8h s PHE 160 CO 0.15 0.67 -0.14 0.12 0.70 0.00 0.00 175.22 176.72 1a8h s PHE 161 N -2.50 2.79 -1.16 0.36 5.36 0.14 -1.82 117.98 121.16 1a8h s PHE 161 Ca 0.31 -0.94 -0.23 0.00 -0.96 0.00 0.00 56.93 55.11 1a8h s PHE 161 Cb -0.04 -1.89 -0.08 0.00 -0.34 0.00 0.00 43.02 40.67 1a8h s PHE 161 CO 0.16 -0.42 1.94 1.03 -1.46 0.00 0.00 175.22 176.47 1a8h s ARG 162 N 0.74 2.49 0.04 10.12 0.52 0.31 -0.84 118.95 132.33 1a8h s ARG 162 Ca -0.06 -1.10 -0.07 0.00 -0.52 0.00 0.00 55.73 53.98 1a8h s ARG 162 Cb -0.15 -5.23 -0.30 0.00 0.52 0.00 0.00 34.95 29.79 1a8h s ARG 162 CO 0.01 -3.94 1.00 1.98 0.02 0.00 0.00 175.30 174.37 1a8h h MET 163 N 9.85 0.33 -0.81 3.54 4.05 -1.89 -3.34 114.93 126.66 1a8h h MET 163 Ca 0.21 -0.57 0.12 0.00 -0.28 0.00 0.00 59.70 59.18 1a8h h MET 163 Cb 0.94 0.21 -0.08 0.00 -0.80 0.00 0.00 31.60 31.87 1a8h h MET 163 CO 1.22 1.24 0.43 1.49 0.23 0.00 0.00 176.91 181.53 1a8h h GLU 164 N 0.09 0.65 -0.42 0.39 4.57 -1.75 0.21 114.58 118.33 1a8h h GLU 164 Ca -0.21 -0.04 0.12 0.00 -1.18 0.00 0.00 59.36 58.06 1a8h h GLU 164 Cb 2.04 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 30.46 1a8h h GLU 164 CO 0.21 0.43 0.52 -0.22 -1.18 0.00 0.00 179.01 178.77 1a8h h LYS 165 N 0.67 0.00 -0.01 1.92 3.64 -1.90 0.11 116.57 120.99 1a8h h LYS 165 Ca 0.42 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.80 1a8h h LYS 165 Cb 0.50 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1a8h h LYS 165 CO -0.31 0.00 -0.28 0.66 -2.27 0.00 0.00 179.45 177.26 1a8h n TYR 166 N -3.55 0.00 -0.07 1.91 4.01 0.06 -4.45 117.16 115.07 1a8h n TYR 166 Ca 0.08 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.75 1a8h n TYR 166 Cb 0.69 -0.04 -0.01 0.00 -0.31 0.00 0.00 39.34 39.67 1a8h n TYR 166 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 1a8h h ARG 167 N 2.26 0.07 -0.24 -0.72 2.43 -0.79 -1.74 114.38 115.66 1a8h h ARG 167 Ca 0.00 -0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.23 1a8h h ARG 167 Cb 0.66 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 30.12 1a8h h ARG 167 CO 0.00 0.05 -0.30 -1.35 -1.51 0.00 0.00 179.97 176.85 1a8h h PRO 168 N 0.07 -0.30 -0.23 0.20 0.11 -1.78 0.48 132.00 130.55 1a8h h PRO 168 Ca 0.13 0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.31 1a8h h PRO 168 Cb 0.18 0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.31 1a8h h PRO 168 CO -0.23 -0.20 -0.04 2.35 -0.21 0.00 0.00 178.00 179.67 1a8h h TRP 169 N -0.31 -0.09 -0.43 0.65 7.01 -1.80 -2.57 115.95 118.40 1a8h h TRP 169 Ca 0.13 0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.16 1a8h h TRP 169 Cb 0.52 0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.63 1a8h h TRP 169 CO -0.44 -0.08 0.27 1.25 -2.79 0.00 0.00 178.44 176.65 1a8h h LEU 170 N 0.02 0.45 -0.22 0.65 6.46 -0.82 0.27 115.31 122.12 1a8h h LEU 170 Ca 0.11 -0.01 0.06 0.00 -0.12 0.00 0.00 57.88 57.92 1a8h h LEU 170 Cb 0.16 -0.10 -0.07 0.00 -0.73 0.00 0.00 40.66 39.92 1a8h h LEU 170 CO -0.22 0.33 -0.28 -0.61 -0.62 0.00 0.00 178.44 177.04 1a8h h GLN 171 N 0.55 -0.29 -0.24 1.25 4.15 -0.67 -1.57 115.11 118.28 1a8h h GLN 171 Ca 0.16 0.02 -0.07 0.00 0.77 0.00 0.00 58.65 59.53 1a8h h GLN 171 Cb -0.03 0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 1a8h h GLN 171 CO -0.05 -0.19 -0.17 1.49 -1.93 0.00 0.00 178.83 177.98 1a8h h GLU 172 N -0.30 0.42 -0.46 1.69 4.81 -1.19 -2.22 114.58 117.33 1a8h h GLU 172 Ca 0.13 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1a8h h GLU 172 Cb 0.50 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.81 1a8h h GLU 172 CO -0.39 0.58 0.20 -0.92 -0.73 0.00 0.00 179.01 177.75 1a8h h TYR 173 N 0.39 0.69 -0.10 0.92 5.03 -0.15 0.11 116.97 123.86 1a8h h TYR 173 Ca 0.07 -0.05 -0.09 0.00 2.58 0.00 0.00 58.73 61.24 1a8h h TYR 173 Cb 0.52 -0.21 -0.01 0.00 1.55 0.00 0.00 36.73 38.58 1a8h h TYR 173 CO 0.01 0.58 -0.34 0.82 -1.32 0.00 0.00 178.16 177.91 1a8h h ILE 174 N 0.60 1.28 -0.08 1.81 2.04 -1.18 0.51 117.51 122.49 1a8h h ILE 174 Ca 0.15 -1.33 -0.13 0.00 1.00 0.00 0.00 64.86 64.56 1a8h h ILE 174 Cb 0.17 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 1a8h h ILE 174 CO -0.01 0.40 -0.52 1.56 0.00 0.00 0.00 178.15 179.58 1a8h h GLN 175 N 0.18 0.22 0.00 2.37 4.20 -0.77 -2.96 115.11 118.35 1a8h h GLN 175 Ca 0.02 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.60 1a8h h GLN 175 Cb 0.70 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.49 1a8h h GLN 175 CO 0.05 0.68 -0.51 0.93 -0.67 0.00 0.00 178.83 179.31 1a8h h GLU 176 N 0.17 0.00 -2.90 1.46 5.08 -0.27 -3.40 114.58 114.72 1a8h h GLU 176 Ca 0.00 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.75 1a8h h GLU 176 Cb 0.97 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.82 1a8h h GLU 176 CO 0.08 0.00 -0.73 -0.80 -1.00 0.00 0.00 179.01 176.56 1a8h s ASN 177 N -4.77 3.59 0.09 1.42 0.01 0.12 -4.95 114.94 110.46 1a8h s ASN 177 Ca 0.06 -3.22 0.17 0.00 -0.71 0.00 0.00 52.86 49.16 1a8h s ASN 177 Cb 0.11 -1.15 0.71 0.00 0.41 0.00 0.00 41.25 41.33 1a8h s ASN 177 CO 0.71 -0.17 1.52 -0.81 -1.51 0.00 0.00 177.10 176.83 1a8h n PRO 178 N 2.76 0.07 0.00 -0.60 -0.04 -1.24 -2.43 135.00 133.52 1a8h n PRO 178 Ca 0.18 0.34 0.11 0.00 -0.04 0.00 0.00 63.50 64.08 1a8h n PRO 178 Cb 0.38 -1.64 0.01 0.00 -0.04 0.00 0.00 33.50 32.21 1a8h n PRO 178 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1a8h n ASP 179 N -1.77 1.35 -0.11 3.54 8.00 -1.26 -4.57 116.55 121.73 1a8h n ASP 179 Ca 0.03 -1.11 -0.14 0.00 0.71 0.00 0.00 54.79 54.28 1a8h n ASP 179 Cb 0.17 0.64 -0.10 0.00 -0.02 0.00 0.00 41.12 41.82 1a8h n ASP 179 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1a8h h LEU 180 N 1.05 -1.78 -7.96 0.64 7.12 -1.71 -3.26 115.31 109.42 1a8h h LEU 180 Ca 0.00 0.23 -0.76 0.00 0.13 0.00 0.00 57.88 57.48 1a8h h LEU 180 Cb 0.60 0.72 -0.24 0.00 -0.53 0.00 0.00 40.66 41.22 1a8h h LEU 180 CO 0.00 -0.40 0.11 -0.63 -0.13 0.00 0.00 178.44 177.39 1a8h s ILE 181 N -5.55 5.30 0.00 4.05 1.01 -1.26 -0.16 121.20 124.60 1a8h s ILE 181 Ca -0.14 -1.93 0.00 0.00 0.00 0.00 0.00 60.65 58.58 1a8h s ILE 181 Cb 0.08 -4.48 0.00 0.00 0.01 0.00 0.00 42.46 38.07 1a8h s ILE 181 CO 0.59 -1.06 0.40 -1.14 0.00 0.00 0.00 174.94 173.72 1a8h n ARG 182 N 4.91 0.00 -1.57 2.79 3.00 -0.65 -4.11 116.66 121.03 1a8h n ARG 182 Ca 0.05 0.40 -0.44 0.00 -0.00 0.00 0.00 57.85 57.86 1a8h n ARG 182 Cb 0.45 -0.75 -0.04 0.00 0.00 0.00 0.00 32.46 32.12 1a8h n ARG 182 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 1a8h n PRO 183 N -1.10 1.79 -0.35 -0.14 -0.02 -1.26 -4.79 135.00 129.13 1a8h n PRO 183 Ca 0.00 0.48 0.03 0.00 -2.02 0.00 0.00 63.50 61.98 1a8h n PRO 183 Cb 0.00 -3.12 0.09 0.00 -0.02 0.00 0.00 33.50 30.45 1a8h n PRO 183 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1a8h n GLU 184 N 8.69 -0.15 -0.30 -0.52 2.13 -1.26 -0.67 120.64 128.56 1a8h n GLU 184 Ca 0.32 1.48 0.12 0.00 0.66 0.00 0.00 57.16 59.75 1a8h n GLU 184 Cb 0.42 -2.21 0.28 0.00 0.27 0.00 0.00 31.44 30.20 1a8h n GLU 184 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1a8h h GLY 185 N 0.00 1.33 1.94 8.31 0.00 -1.91 0.13 103.07 112.87 1a8h h GLY 185 Ca 0.40 -0.02 -0.10 0.00 0.00 0.00 0.00 47.33 47.61 1a8h h GLY 185 CO -0.97 -0.36 -0.46 -0.97 0.00 0.00 0.00 176.54 173.78 1a8h h TYR 186 N 0.20 0.07 0.00 5.60 0.05 -1.23 -2.89 116.97 118.77 1a8h h TYR 186 Ca 0.54 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 59.27 1a8h h TYR 186 Cb 1.09 -0.02 -0.00 0.00 1.01 0.00 0.00 36.73 38.81 1a8h h TYR 186 CO -0.28 0.51 -0.16 -0.09 -1.05 0.00 0.00 178.16 177.09 1a8h h ARG 187 N 0.05 0.00 0.00 4.88 2.43 -0.61 -1.98 114.38 119.15 1a8h h ARG 187 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1a8h h ARG 187 Cb 0.83 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.38 1a8h h ARG 187 CO 0.06 0.16 -0.23 -0.91 -1.51 0.00 0.00 179.97 177.54 1a8h h ASN 188 N 0.00 0.00 0.76 -3.80 2.35 -1.35 -3.19 115.58 110.35 1a8h h ASN 188 Ca -0.00 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.50 1a8h h ASN 188 Cb 0.37 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 1a8h h ASN 188 CO 0.02 0.08 -1.21 -0.08 -1.65 0.00 0.00 177.43 174.59 1a8h h GLU 189 N 0.00 0.14 -0.22 0.81 4.81 -1.38 -3.14 114.58 115.60 1a8h h GLU 189 Ca -0.00 -0.23 -0.10 0.00 -0.13 0.00 0.00 59.36 58.89 1a8h h GLU 189 Cb 1.06 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.53 1a8h h GLU 189 CO 0.01 1.07 -0.25 0.28 -0.73 0.00 0.00 179.01 179.39 1a8h h VAL 190 N 0.04 1.32 -0.43 0.32 2.07 -1.56 -3.04 116.25 114.97 1a8h h VAL 190 Ca -0.10 -1.42 0.04 0.00 0.82 0.00 0.00 66.70 66.03 1a8h h VAL 190 Cb 1.90 1.74 -0.02 0.00 -1.52 0.00 0.00 31.29 33.39 1a8h h VAL 190 CO 0.16 0.44 0.29 -0.07 0.02 0.00 0.00 177.57 178.41 1a8h h LEU 191 N 0.24 0.36 -1.00 2.57 3.38 -1.65 -1.66 115.31 117.54 1a8h h LEU 191 Ca 0.03 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1a8h h LEU 191 Cb 0.81 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1a8h h LEU 191 CO 0.06 0.24 -0.17 0.00 0.09 0.00 0.00 178.44 178.66 1a8h h ALA 192 N 1.76 1.16 -0.02 1.53 0.00 -1.48 -2.75 119.26 119.46 1a8h h ALA 192 Ca 0.18 -0.30 -0.24 0.00 0.00 0.00 0.00 54.91 54.55 1a8h h ALA 192 Cb 0.20 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.87 1a8h h ALA 192 CO -0.04 0.53 -0.95 0.52 0.00 0.00 0.00 179.25 179.31 1a8h h MET 193 N 0.47 0.56 0.00 0.00 2.86 -1.29 -3.08 114.93 114.46 1a8h h MET 193 Ca 0.08 -0.57 0.00 0.00 -2.06 0.00 0.00 59.70 57.15 1a8h h MET 193 Cb 0.57 0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.39 1a8h h MET 193 CO 0.04 1.19 0.00 1.28 1.06 0.00 0.00 176.91 180.48 1a8h n LEU 194 N -3.81 0.00 0.18 1.22 4.77 -0.91 -2.09 117.00 116.36 1a8h n LEU 194 Ca -0.08 0.38 0.07 0.00 -0.03 0.00 0.00 56.01 56.34 1a8h n LEU 194 Cb 0.83 -0.38 0.25 0.00 -2.33 0.00 0.00 43.42 41.80 1a8h n LEU 194 CO 0.53 -0.20 0.66 0.00 -1.33 0.00 0.00 177.39 177.04 1a8h h ALA 195 N 2.58 0.88 -2.67 -1.18 0.00 -1.39 -3.45 119.26 114.03 1a8h h ALA 195 Ca 0.00 -0.31 -0.61 0.00 0.00 0.00 0.00 54.91 54.00 1a8h h ALA 195 Cb 0.18 -0.05 -0.13 0.00 0.00 0.00 0.00 17.79 17.78 1a8h h ALA 195 CO 0.00 0.42 -0.71 -1.21 0.00 0.00 0.00 179.25 177.75 1a8h s GLU 196 N -3.34 2.03 0.23 0.00 2.02 -0.89 -5.08 118.70 113.67 1a8h s GLU 196 Ca 0.02 -1.40 -0.32 0.00 0.02 0.00 0.00 54.97 53.29 1a8h s GLU 196 Cb 0.09 -2.08 -0.13 0.00 0.10 0.00 0.00 34.13 32.11 1a8h s GLU 196 CO 0.69 0.40 1.48 -2.30 0.02 0.00 0.00 175.26 175.54 1a8h n PRO 197 N -0.31 2.15 0.00 0.39 -0.02 -1.26 -4.87 135.00 131.08 1a8h n PRO 197 Ca -0.09 0.77 0.12 0.00 -2.02 0.00 0.00 63.50 62.28 1a8h n PRO 197 Cb 0.57 -2.47 0.17 0.00 -0.02 0.00 0.00 33.50 31.76 1a8h n PRO 197 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1a8h n ILE 198 N 2.32 0.00 -1.49 4.25 -5.35 -1.26 -5.06 119.36 112.77 1a8h n ILE 198 Ca 0.13 -0.05 0.07 0.00 -0.27 0.00 0.00 62.75 62.62 1a8h n ILE 198 Cb 0.31 0.53 -0.02 0.00 -1.74 0.00 0.00 39.64 38.72 1a8h n ILE 198 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1a8h n GLY 199 N 1.46 -2.00 3.93 3.28 0.00 -1.26 -4.89 105.19 105.71 1a8h n GLY 199 Ca 0.07 -1.35 -0.25 0.00 0.00 0.00 0.00 46.02 44.49 1a8h n GLY 199 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a8h s ASP 200 N -4.16 6.29 -0.22 1.61 1.01 -1.26 -2.42 116.67 117.52 1a8h s ASP 200 Ca 0.00 0.60 -0.05 0.00 0.71 0.00 0.00 52.55 53.80 1a8h s ASP 200 Cb 0.00 -2.10 -0.02 0.00 1.01 0.00 0.00 42.92 41.81 1a8h s ASP 200 CO 0.00 -0.37 0.01 -0.22 0.21 0.00 0.00 175.17 174.80 1a8h s LEU 201 N -4.40 3.23 0.00 1.23 2.96 -0.02 -4.90 118.68 116.78 1a8h s LEU 201 Ca 0.42 -0.24 -0.30 0.00 -0.22 0.00 0.00 54.13 53.79 1a8h s LEU 201 Cb -0.10 -1.83 -0.05 0.00 0.50 0.00 0.00 46.19 44.71 1a8h s LEU 201 CO 0.38 0.02 1.23 -0.55 -1.32 0.00 0.00 176.35 176.11 1a8h s SER 202 N 1.25 7.03 0.00 3.68 0.15 -1.26 0.26 113.70 124.81 1a8h s SER 202 Ca 0.04 1.94 0.02 0.00 0.70 0.00 0.00 55.95 58.65 1a8h s SER 202 Cb -0.15 -2.57 0.02 0.00 -1.71 0.00 0.00 66.02 61.61 1a8h s SER 202 CO 0.01 -0.55 0.56 2.30 1.20 0.00 0.00 173.24 176.76 1a8h n ILE 203 N 4.32 0.00 -4.12 6.45 -5.35 -0.28 -4.92 119.36 115.46 1a8h n ILE 203 Ca 0.10 -0.50 -0.12 0.00 -0.27 0.00 0.00 62.75 61.97 1a8h n ILE 203 Cb 0.46 1.04 -0.07 0.00 -1.74 0.00 0.00 39.64 39.33 1a8h n ILE 203 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1a8h s SER 204 N -0.18 0.27 -0.07 7.28 1.04 -1.24 -0.97 113.70 119.84 1a8h s SER 204 Ca 0.02 -1.27 -0.16 0.00 0.48 0.00 0.00 55.95 55.02 1a8h s SER 204 Cb 0.02 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.67 1a8h s SER 204 CO 0.03 -1.02 0.38 -0.13 0.98 0.00 0.00 173.24 173.48 1a8h s ARG 205 N -3.91 0.64 0.36 4.02 0.52 -0.92 -4.45 118.95 115.21 1a8h s ARG 205 Ca 0.32 0.13 -0.28 0.00 -0.52 0.00 0.00 55.73 55.38 1a8h s ARG 205 Cb 0.03 0.29 -0.11 0.00 0.52 0.00 0.00 34.95 35.68 1a8h s ARG 205 CO 0.13 -0.15 1.50 -0.35 0.02 0.00 0.00 175.30 176.45 1a8h n PRO 206 N 1.80 2.67 0.29 3.54 -0.04 -1.26 -1.36 135.00 140.64 1a8h n PRO 206 Ca -0.18 0.94 0.18 0.00 -0.04 0.00 0.00 63.50 64.40 1a8h n PRO 206 Cb 0.57 -2.68 0.97 0.00 -0.04 0.00 0.00 33.50 32.32 1a8h n PRO 206 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1a8h h LYS 207 N 3.26 0.00 -0.61 0.54 3.64 -0.75 0.16 116.57 122.82 1a8h h LYS 207 Ca -0.50 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.84 1a8h h LYS 207 Cb 1.24 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.03 1a8h h LYS 207 CO 0.67 0.00 0.22 0.66 -2.27 0.00 0.00 179.45 178.73 1a8h h SER 208 N 0.00 0.82 0.09 4.20 4.64 -1.89 -2.67 113.55 118.74 1a8h h SER 208 Ca 0.03 -0.12 -0.34 0.00 -0.47 0.00 0.00 61.79 60.90 1a8h h SER 208 Cb 0.31 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.17 1a8h h SER 208 CO -0.00 0.75 -1.86 0.54 -0.87 0.00 0.00 176.83 175.39 1a8h n ARG 209 N -4.31 0.70 -3.86 4.77 3.00 0.36 -4.72 116.66 112.60 1a8h n ARG 209 Ca 0.05 0.33 -0.30 0.00 -0.01 0.00 0.00 57.85 57.93 1a8h n ARG 209 Cb 0.18 -1.70 -0.13 0.00 0.00 0.00 0.00 32.46 30.80 1a8h n ARG 209 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1a8h s VAL 210 N -2.51 2.22 -0.73 1.55 1.01 0.03 -4.89 120.40 117.08 1a8h s VAL 210 Ca -0.25 -3.19 0.25 0.00 0.00 0.00 0.00 61.98 58.80 1a8h s VAL 210 Cb 0.07 -2.53 0.26 0.00 0.00 0.00 0.00 36.38 34.18 1a8h s VAL 210 CO 0.71 -0.86 1.77 -0.81 0.00 0.00 0.00 175.10 175.91 1a8h n PRO 211 N 3.10 0.19 -3.47 2.72 -0.04 -1.01 -4.19 135.00 132.31 1a8h n PRO 211 Ca 0.08 0.23 -0.43 0.00 -0.04 0.00 0.00 63.50 63.35 1a8h n PRO 211 Cb 0.33 -1.76 -0.08 0.00 -0.04 0.00 0.00 33.50 31.95 1a8h n PRO 211 CO 0.00 0.00 0.00 -0.46 -0.04 0.00 0.00 175.50 175.00 1a8h s TRP 212 N -3.13 3.28 -4.24 0.54 -0.00 -1.26 -5.00 118.94 109.13 1a8h s TRP 212 Ca 0.09 -1.15 0.00 0.00 -0.00 0.00 0.00 56.10 55.04 1a8h s TRP 212 Cb 0.12 -3.10 0.00 0.00 -0.00 0.00 0.00 33.47 30.49 1a8h s TRP 212 CO 0.52 -0.82 0.00 0.41 -0.00 0.00 0.00 176.95 177.06 1a8h n GLY 213 N 5.10 -2.12 3.62 5.86 0.00 -1.26 -1.71 105.19 114.68 1a8h n GLY 213 Ca -0.12 -1.23 -0.40 0.00 0.00 0.00 0.00 46.02 44.27 1a8h n GLY 213 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a8h s ILE 214 N -2.43 5.01 0.62 -0.61 1.01 -1.26 -4.87 121.20 118.68 1a8h s ILE 214 Ca 0.00 1.00 -0.18 0.00 0.00 0.00 0.00 60.65 61.46 1a8h s ILE 214 Cb 0.00 -3.90 -0.02 0.00 0.01 0.00 0.00 42.46 38.55 1a8h s ILE 214 CO 0.00 0.03 1.24 -2.16 0.00 0.00 0.00 174.94 174.05 1a8h s PRO 215 N 2.44 2.75 0.17 2.79 0.04 -1.26 0.11 135.00 142.04 1a8h s PRO 215 Ca 0.24 1.91 -0.30 0.00 0.04 0.00 0.00 61.00 62.89 1a8h s PRO 215 Cb -0.15 -1.89 -0.08 0.00 0.04 0.00 0.00 34.50 32.42 1a8h s PRO 215 CO 0.09 -1.40 1.10 -0.51 0.04 0.00 0.00 177.00 176.32 1a8h s LEU 216 N -4.27 4.48 0.46 -3.56 1.43 -0.85 -4.73 118.68 111.64 1a8h s LEU 216 Ca 0.79 2.08 0.18 0.00 -1.03 0.00 0.00 54.13 56.15 1a8h s LEU 216 Cb -0.33 -3.60 1.14 0.00 0.03 0.00 0.00 46.19 43.42 1a8h s LEU 216 CO 0.37 -0.23 1.96 -0.65 0.23 0.00 0.00 176.35 178.03 1a8h h PRO 217 N 5.16 0.29 -0.51 1.29 0.11 -1.93 -1.44 132.00 134.98 1a8h h PRO 217 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1a8h h PRO 217 Cb 1.21 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1a8h h PRO 217 CO 0.73 0.19 0.00 -2.67 -0.21 0.00 0.00 178.00 176.04 1a8h n TRP 218 N -4.45 0.67 -2.97 0.65 2.14 -1.26 -4.76 117.44 107.46 1a8h n TRP 218 Ca 0.12 -0.35 0.01 0.00 2.07 0.00 0.00 57.50 59.35 1a8h n TRP 218 Cb 0.50 -0.00 -0.00 0.00 -0.81 0.00 0.00 31.31 31.00 1a8h n TRP 218 CO 0.00 0.00 0.00 0.34 2.07 0.00 0.00 177.69 180.10 1a8h s ASP 219 N -1.28 -0.95 0.18 -0.67 -1.08 -0.55 -5.00 116.67 107.32 1a8h s ASP 219 Ca 0.42 -0.54 0.18 0.00 -0.52 0.00 0.00 52.55 52.09 1a8h s ASP 219 Cb 0.23 1.22 0.82 0.00 -1.46 0.00 0.00 42.92 43.73 1a8h s ASP 219 CO 0.31 -0.10 1.56 -0.62 0.52 0.00 0.00 175.17 176.84 1a8h n GLU 220 N 3.94 0.12 0.03 4.34 -0.58 -1.19 -1.51 120.64 125.80 1a8h n GLU 220 Ca 0.09 0.44 0.10 0.00 -0.42 0.00 0.00 57.16 57.38 1a8h n GLU 220 Cb 0.60 -1.76 0.44 0.00 -0.57 0.00 0.00 31.44 30.15 1a8h n GLU 220 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1a8h n ASN 221 N -1.99 0.19 -4.53 1.62 5.03 -1.26 -4.74 115.26 109.59 1a8h n ASN 221 Ca 0.01 0.53 -0.27 0.00 0.87 0.00 0.00 54.58 55.73 1a8h n ASN 221 Cb 0.14 -0.58 -0.10 0.00 -1.02 0.00 0.00 39.78 38.22 1a8h n ASN 221 CO 0.00 0.00 0.00 -1.00 -1.83 0.00 0.00 177.26 174.43 1a8h s HIS 222 N -3.06 2.55 0.01 3.10 3.76 -0.57 -0.20 115.29 120.88 1a8h s HIS 222 Ca 0.09 -0.26 0.08 0.00 -0.15 0.00 0.00 55.06 54.82 1a8h s HIS 222 Cb 0.13 -1.26 -0.02 0.00 1.11 0.00 0.00 32.58 32.54 1a8h s HIS 222 CO 0.40 0.50 -0.23 0.08 -0.85 0.00 0.00 174.74 174.64 1a8h s VAL 223 N -1.65 1.84 0.12 -0.90 1.01 -0.46 -2.01 120.40 118.35 1a8h s VAL 223 Ca 0.23 -1.11 -0.31 0.00 0.00 0.00 0.00 61.98 60.79 1a8h s VAL 223 Cb -0.09 -1.55 -0.09 0.00 0.00 0.00 0.00 36.38 34.65 1a8h s VAL 223 CO 0.13 0.41 1.63 -0.89 0.00 0.00 0.00 175.10 176.39 1a8h s THR 224 N -0.65 2.78 -0.32 3.92 2.01 0.31 -2.16 115.64 121.54 1a8h s THR 224 Ca 0.09 0.43 -0.04 0.00 0.31 0.00 0.00 61.69 62.48 1a8h s THR 224 Cb -0.09 -3.27 0.04 0.00 0.01 0.00 0.00 72.50 69.19 1a8h s THR 224 CO 0.00 0.02 0.04 -0.47 -0.69 0.00 0.00 174.62 173.52 1a8h s TYR 225 N 1.91 3.26 0.00 4.92 5.04 -0.14 -4.36 117.35 127.97 1a8h s TYR 225 Ca 0.73 -1.66 0.00 0.00 -2.44 0.00 0.00 57.07 53.69 1a8h s TYR 225 Cb -0.42 -2.18 0.00 0.00 0.35 0.00 0.00 41.96 39.71 1a8h s TYR 225 CO 0.32 -0.77 0.00 0.28 -1.34 0.00 0.00 175.55 174.04 1a8h n VAL 226 N 4.71 0.00 0.00 3.14 0.31 -1.26 -4.50 118.33 120.72 1a8h n VAL 226 Ca -0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1a8h n VAL 226 Cb 0.44 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.37 1a8h n VAL 226 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 1a8h n TRP 227 N 0.00 0.00 1.15 3.52 5.03 -1.26 -0.03 117.44 125.85 1a8h n TRP 227 Ca 0.00 0.00 0.04 0.00 3.03 0.00 0.00 57.50 60.57 1a8h n TRP 227 Cb 0.00 -0.35 0.26 0.00 -1.03 0.00 0.00 31.31 30.19 1a8h n TRP 227 CO 0.00 0.00 0.00 1.19 -0.03 0.00 0.00 177.69 178.85 1a8h n PHE 228 N -2.64 0.00 -0.01 -5.99 3.01 -1.26 -2.44 117.46 108.12 1a8h n PHE 228 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.44 1a8h n PHE 228 Cb 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.46 1a8h n PHE 228 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1a8h n ASP 229 N -0.74 0.58 -0.13 4.37 2.03 0.22 -4.54 116.55 118.35 1a8h n ASP 229 Ca 0.07 0.09 -0.10 0.00 0.52 0.00 0.00 54.79 55.37 1a8h n ASP 229 Cb 0.03 -0.41 -0.01 0.00 -0.72 0.00 0.00 41.12 40.01 1a8h n ASP 229 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1a8h h ALA 230 N -1.01 0.50 -0.85 -1.67 0.00 -0.53 -3.20 119.26 112.50 1a8h h ALA 230 Ca 0.00 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.75 1a8h h ALA 230 Cb 0.22 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 1a8h h ALA 230 CO 0.00 0.19 0.56 -0.07 0.00 0.00 0.00 179.25 179.93 1a8h h LEU 231 N 0.47 0.91 0.00 0.00 4.07 -1.66 -2.77 115.31 116.33 1a8h h LEU 231 Ca 0.12 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.07 1a8h h LEU 231 Cb 0.33 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 41.86 1a8h h LEU 231 CO 0.00 0.62 0.00 0.18 -1.08 0.00 0.00 178.44 178.16 1a8h n LEU 232 N -4.45 0.00 -0.19 1.67 4.77 -1.21 -3.36 117.00 114.24 1a8h n LEU 232 Ca 0.11 0.29 0.03 0.00 -0.03 0.00 0.00 56.01 56.41 1a8h n LEU 232 Cb 0.12 -0.29 0.30 0.00 -2.33 0.00 0.00 43.42 41.22 1a8h n LEU 232 CO 0.35 -0.16 1.22 -0.55 -1.33 0.00 0.00 177.39 176.92 1a8h h ASN 233 N 0.00 0.76 -0.65 -1.43 -1.07 -1.63 0.32 115.58 111.88 1a8h h ASN 233 Ca 0.00 -0.01 0.12 0.00 0.07 0.00 0.00 56.30 56.48 1a8h h ASN 233 Cb 0.13 -0.18 -0.04 0.00 -2.07 0.00 0.00 38.32 36.16 1a8h h ASN 233 CO 0.00 0.53 0.44 1.88 0.07 0.00 0.00 177.43 180.34 1a8h h TYR 234 N 0.88 0.43 0.01 4.14 0.05 -1.81 -1.26 116.97 119.41 1a8h h TYR 234 Ca 0.28 0.01 -0.35 0.00 0.05 0.00 0.00 58.73 58.73 1a8h h TYR 234 Cb 0.03 -0.14 -0.06 0.00 1.01 0.00 0.00 36.73 37.58 1a8h h TYR 234 CO -0.00 0.19 -2.14 0.28 -1.05 0.00 0.00 178.16 175.44 1a8h n VAL 235 N -4.47 1.51 -0.10 -2.88 0.31 -0.51 -4.39 118.33 107.80 1a8h n VAL 235 Ca 0.11 -0.79 -0.04 0.00 -0.01 0.00 0.00 64.34 63.61 1a8h n VAL 235 Cb 0.44 -0.86 0.18 0.00 -0.91 0.00 0.00 33.84 32.68 1a8h n VAL 235 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1a8h h SER 236 N 0.01 0.74 0.60 4.52 0.02 0.19 -2.53 113.55 117.09 1a8h h SER 236 Ca -0.45 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.33 1a8h h SER 236 Cb 2.12 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 64.46 1a8h h SER 236 CO 0.04 0.79 0.00 0.00 -1.14 0.00 0.00 176.83 176.52 1a8h h ALA 237 N 1.29 1.00 -0.61 3.77 0.00 -1.46 -2.16 119.26 121.09 1a8h h ALA 237 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1a8h h ALA 237 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1a8h h ALA 237 CO 0.02 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.55 1a8h n LEU 238 N -2.30 3.80 -3.83 0.00 4.77 -0.98 -4.93 117.00 113.53 1a8h n LEU 238 Ca 0.01 -1.82 -0.27 0.00 -0.03 0.00 0.00 56.01 53.90 1a8h n LEU 238 Cb 0.20 -0.41 0.03 0.00 -2.33 0.00 0.00 43.42 40.91 1a8h n LEU 238 CO 0.18 0.91 0.08 0.47 -1.33 0.00 0.00 177.39 177.70 1a8h n ASP 239 N 1.62 -4.08 0.00 -1.43 8.00 -0.81 -2.36 116.55 117.48 1a8h n ASP 239 Ca 0.23 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.96 1a8h n ASP 239 Cb 0.62 -4.04 0.00 0.00 -0.02 0.00 0.00 41.12 37.68 1a8h n ASP 239 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a8h n TYR 240 N -4.62 0.00 0.00 1.24 9.36 -1.07 -0.74 117.16 121.34 1a8h n TYR 240 Ca -0.04 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.18 1a8h n TYR 240 Cb 0.57 -0.20 0.00 0.00 -0.63 0.00 0.00 39.34 39.07 1a8h n TYR 240 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 1a8h n PRO 241 N -2.25 0.00 -0.15 2.98 -0.02 -1.26 -4.07 135.00 130.23 1a8h n PRO 241 Ca 0.00 0.04 0.08 0.00 -2.02 0.00 0.00 63.50 61.60 1a8h n PRO 241 Cb 0.00 -0.63 0.25 0.00 -0.02 0.00 0.00 33.50 33.10 1a8h n PRO 241 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1a8h n GLU 242 N -0.17 1.84 -2.30 -0.52 0.28 -1.23 -4.92 120.64 113.62 1a8h n GLU 242 Ca 0.00 -1.29 -0.40 0.00 -0.16 0.00 0.00 57.16 55.30 1a8h n GLU 242 Cb 0.00 -1.34 -0.03 0.00 1.43 0.00 0.00 31.44 31.50 1a8h n GLU 242 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1a8h s GLY 243 N -1.22 3.03 0.16 -1.84 0.00 0.08 -4.93 107.32 102.60 1a8h s GLY 243 Ca 0.28 1.07 -0.12 0.00 0.00 0.00 0.00 44.72 45.96 1a8h s GLY 243 CO 0.21 1.69 1.64 -2.09 0.00 0.00 0.00 173.10 174.55 1a8h h GLU 244 N 3.57 0.92 -0.94 2.90 4.22 -1.87 -2.95 114.58 120.44 1a8h h GLU 244 Ca -0.48 -0.26 0.06 0.00 0.08 0.00 0.00 59.36 58.76 1a8h h GLU 244 Cb 1.22 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 30.31 1a8h h GLU 244 CO 0.66 0.90 0.61 0.00 -2.18 0.00 0.00 179.01 179.00 1a8h h ALA 245 N 0.98 1.46 -0.45 2.92 0.00 -1.92 -1.40 119.26 120.84 1a8h h ALA 245 Ca 0.16 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1a8h h ALA 245 Cb 0.45 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1a8h h ALA 245 CO 0.02 0.42 0.11 -0.92 0.00 0.00 0.00 179.25 178.87 1a8h h TYR 246 N 1.10 0.76 -0.69 0.00 3.20 -1.29 -0.25 116.97 119.80 1a8h h TYR 246 Ca 0.39 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 62.11 1a8h h TYR 246 Cb 0.14 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.17 1a8h h TYR 246 CO -0.00 0.70 0.18 -0.09 -1.64 0.00 0.00 178.16 177.31 1a8h h ARG 247 N 0.60 1.09 0.09 1.82 2.43 -1.34 -2.46 114.38 116.61 1a8h h ARG 247 Ca 0.14 -0.24 -0.00 0.00 -0.81 0.00 0.00 59.98 59.06 1a8h h ARG 247 Cb 0.32 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1a8h h ARG 247 CO 0.00 0.95 -0.04 1.15 -1.51 0.00 0.00 179.97 180.52 1a8h h THR 248 N 1.04 0.83 0.16 0.20 2.02 -1.15 -3.42 112.91 112.60 1a8h h THR 248 Ca 0.22 -1.38 -0.33 0.00 0.77 0.00 0.00 66.41 65.69 1a8h h THR 248 Cb 0.34 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1a8h h THR 248 CO -0.00 0.25 -1.63 -0.26 0.37 0.00 0.00 175.52 174.25 1a8h h PHE 249 N -0.94 0.62 -0.81 3.16 0.04 -1.14 -3.39 116.94 114.48 1a8h h PHE 249 Ca -0.01 -0.45 0.18 0.00 2.80 0.00 0.00 57.97 60.48 1a8h h PHE 249 Cb 0.51 -0.02 -0.11 0.00 2.20 0.00 0.00 35.95 38.52 1a8h h PHE 249 CO 0.11 1.53 0.30 2.35 -0.60 0.00 0.00 178.31 182.00 1a8h h TRP 250 N 0.09 0.49 0.00 -0.55 2.91 -1.57 -0.71 115.95 116.61 1a8h h TRP 250 Ca -0.29 0.04 0.00 0.00 1.13 0.00 0.00 58.89 59.77 1a8h h TRP 250 Cb 2.07 -0.09 0.00 0.00 -0.51 0.00 0.00 29.16 30.62 1a8h h TRP 250 CO 0.09 -0.02 0.14 -1.35 -1.03 0.00 0.00 178.44 176.27 1a8h h PRO 251 N 0.38 0.00 0.00 2.65 0.11 -1.78 -1.77 132.00 131.59 1a8h h PRO 251 Ca 0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.58 1a8h h PRO 251 Cb 0.80 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.91 1a8h h PRO 251 CO -0.48 0.00 -0.00 0.72 -0.21 0.00 0.00 178.00 178.02 1a8h n HIS 252 N -2.24 0.00 -1.70 0.65 8.25 -0.28 -4.71 115.22 115.20 1a8h n HIS 252 Ca -0.01 -0.84 -0.55 0.00 -0.26 0.00 0.00 57.72 56.06 1a8h n HIS 252 Cb 0.17 -0.12 -0.06 0.00 1.12 0.00 0.00 29.99 31.10 1a8h n HIS 252 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a8h n ALA 253 N -1.14 0.16 -3.74 -1.41 0.00 -0.67 -4.12 120.51 109.59 1a8h n ALA 253 Ca 0.11 0.35 -0.34 0.00 0.00 0.00 0.00 53.44 53.55 1a8h n ALA 253 Cb 0.52 -2.31 -0.14 0.00 0.00 0.00 0.00 19.45 17.51 1a8h n ALA 253 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1a8h s TRP 254 N 3.82 3.05 -0.22 0.00 0.52 -0.46 -0.65 118.94 124.99 1a8h s TRP 254 Ca 0.97 -1.54 -0.09 0.00 0.02 0.00 0.00 56.10 55.46 1a8h s TRP 254 Cb -0.96 -2.05 -0.05 0.00 -1.15 0.00 0.00 33.47 29.27 1a8h s TRP 254 CO 0.62 -0.73 0.12 -1.01 0.02 0.00 0.00 176.95 175.97 1a8h s HIS 255 N 1.33 3.28 -0.19 -1.98 3.76 -0.09 -1.74 115.29 119.65 1a8h s HIS 255 Ca 0.01 0.12 -0.07 0.00 -0.15 0.00 0.00 55.06 54.97 1a8h s HIS 255 Cb -0.16 -2.21 -0.04 0.00 1.11 0.00 0.00 32.58 31.28 1a8h s HIS 255 CO -0.05 0.05 0.05 -0.51 -0.85 0.00 0.00 174.74 173.44 1a8h s LEU 256 N 0.91 3.70 0.22 0.89 1.43 -0.63 0.40 118.68 125.61 1a8h s LEU 256 Ca 0.06 0.02 -0.04 0.00 -1.03 0.00 0.00 54.13 53.14 1a8h s LEU 256 Cb -0.13 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.12 1a8h s LEU 256 CO 0.03 0.14 0.24 0.27 0.23 0.00 0.00 176.35 177.26 1a8h s ILE 257 N 0.57 0.00 0.22 -0.59 -4.36 -0.43 -3.44 121.20 113.17 1a8h s ILE 257 Ca 0.03 -1.83 0.05 0.00 -0.26 0.00 0.00 60.65 58.64 1a8h s ILE 257 Cb -0.13 -2.43 -0.03 0.00 1.25 0.00 0.00 42.46 41.12 1a8h s ILE 257 CO 0.01 0.00 0.28 -0.83 0.24 0.00 0.00 174.94 174.64 1a8h s GLY 258 N -3.14 1.39 0.33 6.27 0.00 -1.26 -0.70 107.32 110.22 1a8h s GLY 258 Ca 0.34 -1.25 0.24 0.00 0.00 0.00 0.00 44.72 44.05 1a8h s GLY 258 CO 0.12 -1.27 1.72 0.07 0.00 0.00 0.00 173.10 173.74 1a8h h LYS 259 N 1.53 0.00 0.00 2.90 2.10 -1.75 -2.70 116.57 118.65 1a8h h LYS 259 Ca -0.50 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.06 1a8h h LYS 259 Cb 1.22 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.54 1a8h h LYS 259 CO 0.62 0.00 -0.42 0.38 -2.00 0.00 0.00 179.45 178.04 1a8h h ASP 260 N 0.00 0.00 -1.02 7.07 2.03 -1.94 -3.10 116.42 119.47 1a8h h ASP 260 Ca 0.00 0.00 -0.59 0.00 -0.73 0.00 0.00 57.03 55.71 1a8h h ASP 260 Cb 0.12 0.00 -0.39 0.00 -0.83 0.00 0.00 39.33 38.23 1a8h h ASP 260 CO 0.00 0.42 -0.38 2.30 -1.03 0.00 0.00 179.24 180.55 1a8h n ILE 261 N -3.96 2.77 0.12 4.15 -5.35 -1.02 -4.74 119.36 111.33 1a8h n ILE 261 Ca -0.02 -4.12 -0.24 0.00 -0.27 0.00 0.00 62.75 58.10 1a8h n ILE 261 Cb 0.46 -1.17 -0.15 0.00 -1.74 0.00 0.00 39.64 37.03 1a8h n ILE 261 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 1a8h h LEU 262 N 2.27 0.78 -0.31 7.28 5.85 -1.65 -3.24 115.31 126.29 1a8h h LEU 262 Ca 0.41 -0.92 -0.01 0.00 0.84 0.00 0.00 57.88 58.20 1a8h h LEU 262 Cb 1.20 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 1a8h h LEU 262 CO 0.97 1.64 0.15 0.50 -0.34 0.00 0.00 178.44 181.36 1a8h h LYS 263 N 0.05 0.45 -0.43 1.25 3.64 -1.85 0.13 116.57 119.81 1a8h h LYS 263 Ca -0.23 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.11 1a8h h LYS 263 Cb 2.04 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.76 1a8h h LYS 263 CO 0.25 0.42 0.28 -1.35 -2.27 0.00 0.00 179.45 176.79 1a8h h PRO 264 N 0.37 0.48 0.00 1.90 0.11 -1.93 0.60 132.00 133.52 1a8h h PRO 264 Ca 0.11 -0.03 -0.23 0.00 0.11 0.00 0.00 66.00 65.96 1a8h h PRO 264 Cb 0.12 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 31.09 1a8h h PRO 264 CO -0.01 0.31 -1.60 0.72 -0.21 0.00 0.00 178.00 177.21 1a8h n HIS 265 N -4.48 0.94 0.02 0.65 8.25 -1.10 -0.69 115.22 118.82 1a8h n HIS 265 Ca 0.04 0.33 0.06 0.00 -0.26 0.00 0.00 57.72 57.89 1a8h n HIS 265 Cb 0.13 -1.12 -0.10 0.00 1.12 0.00 0.00 29.99 30.01 1a8h n HIS 265 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a8h n ALA 266 N -2.48 2.38 0.01 -1.41 0.00 0.42 -4.21 120.51 115.23 1a8h n ALA 266 Ca -0.14 -0.55 -0.02 0.00 0.00 0.00 0.00 53.44 52.74 1a8h n ALA 266 Cb 0.95 -0.82 -0.01 0.00 0.00 0.00 0.00 19.45 19.57 1a8h n ALA 266 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1a8h n VAL 267 N -2.57 1.01 0.23 0.00 0.31 0.18 -4.65 118.33 112.85 1a8h n VAL 267 Ca -0.08 0.29 -0.11 0.00 -0.01 0.00 0.00 64.34 64.44 1a8h n VAL 267 Cb 0.69 -1.62 -0.05 0.00 -0.91 0.00 0.00 33.84 31.95 1a8h n VAL 267 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1a8h h PHE 268 N -0.18 -0.72 -0.74 3.52 0.04 -1.56 -3.11 116.94 114.19 1a8h h PHE 268 Ca 0.00 -0.01 0.14 0.00 2.80 0.00 0.00 57.97 60.91 1a8h h PHE 268 Cb 0.18 0.26 -0.14 0.00 2.20 0.00 0.00 35.95 38.45 1a8h h PHE 268 CO -0.08 -0.40 -0.23 2.35 -0.60 0.00 0.00 178.31 179.36 1a8h h TRP 269 N -0.65 -0.53 -0.40 -0.55 -0.00 -1.12 -1.30 115.95 111.40 1a8h h TRP 269 Ca -0.06 0.07 -0.03 0.00 -0.00 0.00 0.00 58.89 58.88 1a8h h TRP 269 Cb 0.52 0.35 -0.02 0.00 -0.00 0.00 0.00 29.16 30.01 1a8h h TRP 269 CO -0.02 -0.34 0.14 -1.35 -0.00 0.00 0.00 178.44 176.87 1a8h h PRO 270 N -0.03 0.57 0.00 2.65 0.11 -1.73 -1.69 132.00 131.88 1a8h h PRO 270 Ca 0.34 -0.08 -0.13 0.00 0.11 0.00 0.00 66.00 66.24 1a8h h PRO 270 Cb 0.56 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.55 1a8h h PRO 270 CO -0.78 0.49 -0.62 1.79 -0.21 0.00 0.00 178.00 178.68 1a8h h THR 271 N 0.56 1.22 -0.19 -1.15 1.35 -1.19 -1.94 112.91 111.57 1a8h h THR 271 Ca 0.14 -2.29 -0.19 0.00 -0.55 0.00 0.00 66.41 63.51 1a8h h THR 271 Cb 0.15 2.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 1a8h h THR 271 CO -0.01 0.61 -0.66 0.24 -0.25 0.00 0.00 175.52 175.45 1a8h h MET 272 N 0.00 0.71 -0.48 4.72 2.86 -0.91 -1.17 114.93 120.68 1a8h h MET 272 Ca -0.01 -0.51 -0.06 0.00 -2.06 0.00 0.00 59.70 57.06 1a8h h MET 272 Cb 1.27 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.99 1a8h h MET 272 CO 0.08 1.13 0.05 -0.07 1.06 0.00 0.00 176.91 179.17 1a8h h LEU 273 N 0.52 0.78 0.29 1.22 3.38 -1.26 -0.20 115.31 120.03 1a8h h LEU 273 Ca -0.02 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1a8h h LEU 273 Cb 1.25 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1a8h h LEU 273 CO 0.13 0.86 -0.19 0.50 0.09 0.00 0.00 178.44 179.84 1a8h h LYS 274 N 0.67 -0.45 0.00 1.13 1.63 -1.23 0.13 116.57 118.45 1a8h h LYS 274 Ca 0.14 0.03 -0.04 0.00 -0.85 0.00 0.00 60.65 59.94 1a8h h LYS 274 Cb 0.43 0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 32.15 1a8h h LYS 274 CO 0.01 -0.30 -0.17 0.00 -3.45 0.00 0.00 179.45 175.55 1a8h h ALA 275 N 0.22 1.48 0.00 5.00 0.00 -1.14 -2.31 119.26 122.52 1a8h h ALA 275 Ca -0.03 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1a8h h ALA 275 Cb 0.39 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1a8h h ALA 275 CO 0.02 0.21 -0.19 0.00 0.00 0.00 0.00 179.25 179.30 1a8h h ALA 276 N 1.83 0.88 0.00 0.00 0.00 -0.56 -3.44 119.26 117.96 1a8h h ALA 276 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1a8h h ALA 276 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1a8h h ALA 276 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1a8h n GLY 277 N 1.30 0.62 3.76 0.00 0.00 -0.38 -4.97 105.19 105.52 1a8h n GLY 277 Ca 0.05 -0.57 -0.36 0.00 0.00 0.00 0.00 46.02 45.14 1a8h n GLY 277 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a8h s ILE 278 N -2.00 5.16 0.73 -0.61 1.01 0.30 -5.02 121.20 120.77 1a8h s ILE 278 Ca 0.00 0.09 -0.16 0.00 0.00 0.00 0.00 60.65 60.58 1a8h s ILE 278 Cb 0.00 -3.29 0.02 0.00 0.01 0.00 0.00 42.46 39.21 1a8h s ILE 278 CO 0.00 0.53 1.09 -2.65 0.00 0.00 0.00 174.94 173.92 1a8h n PRO 279 N 2.79 0.54 -1.83 2.79 -0.02 -1.26 -4.10 135.00 133.90 1a8h n PRO 279 Ca -0.18 0.25 -0.33 0.00 -2.02 0.00 0.00 63.50 61.22 1a8h n PRO 279 Cb 0.53 -2.34 0.04 0.00 -0.02 0.00 0.00 33.50 31.71 1a8h n PRO 279 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1a8h s MET 280 N -3.55 2.97 0.90 -0.52 -1.94 -1.26 -4.97 119.30 110.94 1a8h s MET 280 Ca 0.75 1.29 -0.12 0.00 -1.71 0.00 0.00 55.69 55.90 1a8h s MET 280 Cb -0.34 -1.98 0.13 0.00 2.01 0.00 0.00 34.83 34.66 1a8h s MET 280 CO 0.48 -1.10 1.11 1.52 -0.01 0.00 0.00 175.02 177.02 1a8h s TYR 281 N -2.44 2.46 -0.12 -0.03 -0.85 -1.26 -4.93 117.35 110.17 1a8h s TYR 281 Ca 0.65 1.01 -0.23 0.00 -0.52 0.00 0.00 57.07 57.97 1a8h s TYR 281 Cb -0.18 -3.27 -0.21 0.00 0.38 0.00 0.00 41.96 38.68 1a8h s TYR 281 CO 0.41 -2.36 0.66 -0.09 -1.52 0.00 0.00 175.55 172.65 1a8h h ARG 282 N -1.51 -0.01 -3.58 -3.49 9.65 -1.16 -3.48 114.38 110.79 1a8h h ARG 282 Ca -0.51 0.00 -0.18 0.00 -1.10 0.00 0.00 59.98 58.20 1a8h h ARG 282 Cb 1.31 0.00 -0.24 0.00 -1.39 0.00 0.00 29.97 29.66 1a8h h ARG 282 CO 0.59 0.76 -0.58 -1.01 2.80 0.00 0.00 179.97 182.53 1a8h s HIS 283 N -2.26 0.01 -0.28 2.20 3.76 -1.05 -4.54 115.29 113.13 1a8h s HIS 283 Ca -0.15 -0.02 -0.03 0.00 -0.15 0.00 0.00 55.06 54.72 1a8h s HIS 283 Cb -0.02 -0.04 0.03 0.00 1.11 0.00 0.00 32.58 33.67 1a8h s HIS 283 CO 0.55 -0.16 -0.01 -1.17 -0.85 0.00 0.00 174.74 173.10 1a8h s LEU 284 N -0.74 3.58 -0.37 0.89 2.96 0.78 -0.91 118.68 124.87 1a8h s LEU 284 Ca -0.08 -1.01 -0.10 0.00 -0.22 0.00 0.00 54.13 52.72 1a8h s LEU 284 Cb -0.05 -1.72 0.03 0.00 0.50 0.00 0.00 46.19 44.96 1a8h s LEU 284 CO 0.00 -0.19 0.18 0.20 -1.32 0.00 0.00 176.35 175.22 1a8h s ASN 285 N 1.32 5.61 -0.24 3.68 0.01 0.16 -1.64 114.94 123.85 1a8h s ASN 285 Ca -0.02 -1.06 -0.16 0.00 -0.71 0.00 0.00 52.86 50.92 1a8h s ASN 285 Cb -0.18 -1.98 -0.04 0.00 0.41 0.00 0.00 41.25 39.47 1a8h s ASN 285 CO -0.02 -0.38 0.40 -0.69 -1.51 0.00 0.00 177.10 174.91 1a8h s VAL 286 N 1.50 5.17 0.23 1.60 1.01 -1.26 -1.31 120.40 127.34 1a8h s VAL 286 Ca 0.01 0.66 -0.01 0.00 0.00 0.00 0.00 61.98 62.64 1a8h s VAL 286 Cb -0.19 -3.73 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1a8h s VAL 286 CO 0.05 0.18 0.43 -0.83 0.00 0.00 0.00 175.10 174.94 1a8h s GLY 287 N 1.39 1.70 0.13 4.51 0.00 0.13 -3.39 107.32 111.78 1a8h s GLY 287 Ca 0.17 -0.84 -0.01 0.00 0.00 0.00 0.00 44.72 44.05 1a8h s GLY 287 CO 0.09 -0.79 0.17 0.61 0.00 0.00 0.00 173.10 173.18 1a8h n GLY 288 N -0.90 0.27 3.83 0.20 0.00 -1.26 -2.22 105.19 105.12 1a8h n GLY 288 Ca -0.05 -1.90 -0.37 0.00 0.00 0.00 0.00 46.02 43.71 1a8h n GLY 288 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1a8h s PHE 289 N -0.58 3.70 -0.80 1.61 0.08 -1.26 -4.80 117.98 115.94 1a8h s PHE 289 Ca 0.11 1.19 -0.18 0.00 0.12 0.00 0.00 56.93 58.17 1a8h s PHE 289 Cb -0.01 -2.45 0.14 0.00 -0.57 0.00 0.00 43.02 40.13 1a8h s PHE 289 CO 0.07 0.49 0.91 -0.51 -0.10 0.00 0.00 175.22 176.09 1a8h s LEU 290 N -1.57 5.55 0.63 -0.37 1.02 -1.26 -1.65 118.68 121.04 1a8h s LEU 290 Ca 0.34 -1.99 -0.16 0.00 0.02 0.00 0.00 54.13 52.35 1a8h s LEU 290 Cb -0.17 -2.32 -0.02 0.00 0.02 0.00 0.00 46.19 43.70 1a8h s LEU 290 CO 0.19 -0.97 1.11 -0.76 0.02 0.00 0.00 176.35 175.94 1a8h s LEU 291 N 2.11 3.47 1.24 1.79 1.43 0.23 -4.56 118.68 124.39 1a8h s LEU 291 Ca 0.22 2.01 -0.17 0.00 -1.03 0.00 0.00 54.13 55.17 1a8h s LEU 291 Cb -0.12 -4.55 0.30 0.00 0.03 0.00 0.00 46.19 41.85 1a8h s LEU 291 CO -0.04 -1.50 1.01 -0.83 0.23 0.00 0.00 176.35 175.22 1a8h s GLY 292 N -2.45 1.50 0.60 -3.19 0.00 0.35 -0.21 107.32 103.93 1a8h s GLY 292 Ca 0.68 -0.47 0.32 0.00 0.00 0.00 0.00 44.72 45.24 1a8h s GLY 292 CO 0.38 0.35 2.24 -2.55 0.00 0.00 0.00 173.10 173.53 1a8h h PRO 293 N -2.82 0.00 -0.75 2.90 0.11 -1.65 -0.80 132.00 128.99 1a8h h PRO 293 Ca -0.54 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1a8h h PRO 293 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1a8h h PRO 293 CO 0.43 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.82 1a8h n ASP 294 N -3.71 2.92 -0.37 -2.05 5.68 -1.26 -4.85 116.55 112.90 1a8h n ASP 294 Ca -0.02 -2.35 -0.05 0.00 -0.50 0.00 0.00 54.79 51.86 1a8h n ASP 294 Cb 0.12 -0.53 -0.02 0.00 -1.14 0.00 0.00 41.12 39.55 1a8h n ASP 294 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1a8h n GLY 295 N 0.38 0.59 3.67 6.12 0.00 -0.31 -4.98 105.19 110.67 1a8h n GLY 295 Ca 0.12 -0.10 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 1a8h n GLY 295 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a8h s ARG 296 N -2.03 2.42 0.24 1.61 0.52 -1.25 -4.82 118.95 115.64 1a8h s ARG 296 Ca 0.00 -1.11 -0.32 0.00 -0.52 0.00 0.00 55.73 53.79 1a8h s ARG 296 Cb 0.00 -2.36 -0.12 0.00 0.52 0.00 0.00 34.95 32.98 1a8h s ARG 296 CO 0.00 0.45 1.63 1.63 0.02 0.00 0.00 175.30 179.03 1a8h n LYS 297 N -0.15 2.59 -1.51 3.54 5.02 -1.26 0.13 118.16 126.52 1a8h n LYS 297 Ca -0.10 0.93 -0.38 0.00 -2.02 0.00 0.00 58.31 56.74 1a8h n LYS 297 Cb 0.55 -2.72 0.04 0.00 -0.02 0.00 0.00 35.03 32.88 1a8h n LYS 297 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1a8h n MET 298 N 3.05 0.62 -3.64 1.97 2.81 -1.26 -4.69 117.12 115.97 1a8h n MET 298 Ca 0.13 0.24 -0.02 0.00 -1.81 0.00 0.00 57.70 56.24 1a8h n MET 298 Cb 0.34 -1.84 -0.04 0.00 -0.71 0.00 0.00 33.22 30.98 1a8h n MET 298 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1a8h s SER 299 N -1.20 -0.04 0.05 7.83 0.01 -1.26 -4.95 113.70 114.13 1a8h s SER 299 Ca 0.71 0.04 -0.30 0.00 1.31 0.00 0.00 55.95 57.71 1a8h s SER 299 Cb -0.44 0.04 -0.16 0.00 0.21 0.00 0.00 66.02 65.67 1a8h s SER 299 CO 0.52 -0.05 1.45 0.50 0.41 0.00 0.00 173.24 176.07 1a8h h LYS 300 N 2.06 -1.02 -1.02 12.44 3.64 -1.97 -1.53 116.57 129.17 1a8h h LYS 300 Ca -0.07 0.07 0.31 0.00 -1.27 0.00 0.00 60.65 59.69 1a8h h LYS 300 Cb 1.18 0.23 -0.14 0.00 -0.41 0.00 0.00 32.23 33.09 1a8h h LYS 300 CO 0.22 -0.68 0.59 1.79 -2.27 0.00 0.00 179.45 179.10 1a8h h THR 301 N -1.06 0.34 0.00 1.00 1.35 -2.01 0.76 112.91 113.30 1a8h h THR 301 Ca -0.10 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 1a8h h THR 301 Cb 0.82 -0.05 0.00 0.00 -1.73 0.00 0.00 68.15 67.19 1a8h h THR 301 CO 0.16 0.07 -0.10 -0.07 -0.25 0.00 0.00 175.52 175.32 1a8h h LEU 302 N 0.36 0.00 1.74 3.87 3.38 -1.93 -3.47 115.31 119.27 1a8h h LEU 302 Ca 0.72 -0.03 -0.32 0.00 0.09 0.00 0.00 57.88 58.34 1a8h h LEU 302 Cb 1.64 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.31 1a8h h LEU 302 CO -0.57 0.02 -0.34 0.61 0.09 0.00 0.00 178.44 178.25 1a8h n GLY 303 N 1.30 0.64 1.47 0.83 0.00 0.27 -4.80 105.19 104.90 1a8h n GLY 303 Ca 0.05 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.16 1a8h n GLY 303 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1a8h n ASN 304 N -1.26 4.53 -4.76 1.61 6.94 -1.21 -4.98 115.26 116.13 1a8h n ASN 304 Ca -0.17 -2.40 -0.40 0.00 -0.02 0.00 0.00 54.58 51.59 1a8h n ASN 304 Cb 0.57 -0.55 -0.03 0.00 -2.36 0.00 0.00 39.78 37.41 1a8h n ASN 304 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1a8h s VAL 305 N -1.75 3.18 -0.18 3.53 0.11 -1.26 -4.15 120.40 119.88 1a8h s VAL 305 Ca 0.49 1.19 -0.00 0.00 -2.93 0.00 0.00 61.98 60.73 1a8h s VAL 305 Cb 0.31 -3.76 0.00 0.00 -1.53 0.00 0.00 36.38 31.41 1a8h s VAL 305 CO 0.24 0.28 -0.14 -0.69 -3.33 0.00 0.00 175.10 171.46 1a8h s VAL 306 N -1.16 2.61 -0.29 2.04 1.01 -1.26 -5.02 120.40 118.33 1a8h s VAL 306 Ca 0.46 -0.77 -0.16 0.00 0.00 0.00 0.00 61.98 61.51 1a8h s VAL 306 Cb -0.35 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.88 1a8h s VAL 306 CO 0.46 0.50 0.43 -0.62 0.00 0.00 0.00 175.10 175.87 1a8h s ASP 307 N 1.14 6.30 0.28 3.32 -1.08 -1.26 -4.52 116.67 120.85 1a8h s ASP 307 Ca 0.01 0.24 0.04 0.00 -0.52 0.00 0.00 52.55 52.32 1a8h s ASP 307 Cb -0.14 -2.24 0.40 0.00 -1.46 0.00 0.00 42.92 39.48 1a8h s ASP 307 CO -0.05 -0.28 1.69 1.55 0.52 0.00 0.00 175.17 178.60 1a8h h PRO 308 N 8.21 0.39 0.00 4.34 0.13 -1.94 -2.70 132.00 140.43 1a8h h PRO 308 Ca -0.30 -0.17 -0.11 0.00 -0.87 0.00 0.00 66.00 64.55 1a8h h PRO 308 Cb 1.15 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.25 1a8h h PRO 308 CO 0.69 0.69 -0.52 0.74 -0.23 0.00 0.00 178.00 179.36 1a8h h PHE 309 N 0.33 0.00 -0.09 1.56 0.04 -1.94 0.34 116.94 117.18 1a8h h PHE 309 Ca 0.04 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.72 1a8h h PHE 309 Cb 0.77 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.92 1a8h h PHE 309 CO 0.02 0.52 -0.30 0.00 -0.60 0.00 0.00 178.31 177.95 1a8h h ALA 310 N 1.48 0.16 0.00 2.45 0.00 -1.97 -2.75 119.26 118.62 1a8h h ALA 310 Ca -0.01 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 1a8h h ALA 310 Cb 0.94 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1a8h h ALA 310 CO 0.07 0.19 -0.20 -0.07 0.00 0.00 0.00 179.25 179.24 1a8h h LEU 311 N -0.09 0.00 -0.58 0.00 4.07 -1.21 -2.42 115.31 115.08 1a8h h LEU 311 Ca -0.01 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.79 1a8h h LEU 311 Cb 0.93 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.66 1a8h h LEU 311 CO 0.06 0.20 -0.59 0.25 -1.08 0.00 0.00 178.44 177.28 1a8h h LEU 312 N 0.00 0.43 -0.64 1.67 6.46 -0.24 -2.14 115.31 120.85 1a8h h LEU 312 Ca -0.00 -0.24 0.00 0.00 -0.12 0.00 0.00 57.88 57.52 1a8h h LEU 312 Cb 0.37 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 40.17 1a8h h LEU 312 CO 0.03 0.92 0.00 -0.08 -0.62 0.00 0.00 178.44 178.69 1a8h h GLU 313 N 0.29 0.00 0.03 1.25 4.57 -1.14 0.13 114.58 119.70 1a8h h GLU 313 Ca -0.00 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 57.97 1a8h h GLU 313 Cb 1.11 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.68 1a8h h GLU 313 CO 0.10 0.00 -1.11 -0.22 -1.18 0.00 0.00 179.01 176.60 1a8h h LYS 314 N 0.00 0.06 0.00 1.92 3.64 -1.32 -3.41 116.57 117.46 1a8h h LYS 314 Ca 0.00 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1a8h h LYS 314 Cb 0.76 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1a8h h LYS 314 CO 0.00 1.05 -1.27 0.66 -2.27 0.00 0.00 179.45 177.62 1a8h n TYR 315 N -4.31 0.00 0.00 1.91 4.02 -0.82 -5.03 117.16 112.93 1a8h n TYR 315 Ca -0.27 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.62 1a8h n TYR 315 Cb 0.71 -0.20 0.00 0.00 -0.02 0.00 0.00 39.34 39.83 1a8h n TYR 315 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1a8h n GLY 316 N 1.55 2.32 0.22 2.72 0.00 0.45 -4.46 105.19 107.99 1a8h n GLY 316 Ca -0.01 -1.81 -0.05 0.00 0.00 0.00 0.00 46.02 44.15 1a8h n GLY 316 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1a8h h ARG 317 N 0.00 0.62 -0.87 1.61 2.43 -1.86 -2.76 114.38 113.56 1a8h h ARG 317 Ca 0.00 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.17 1a8h h ARG 317 Cb 0.00 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 29.35 1a8h h ARG 317 CO 0.00 0.41 0.55 -0.44 -1.51 0.00 0.00 179.97 178.99 1a8h h ASP 318 N 0.64 0.91 -0.52 -3.80 5.19 -1.91 -1.74 116.42 115.20 1a8h h ASP 318 Ca 0.23 0.00 -0.09 0.00 -0.62 0.00 0.00 57.03 56.55 1a8h h ASP 318 Cb 0.05 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 39.34 1a8h h ASP 318 CO -0.11 0.61 -0.02 0.00 -3.12 0.00 0.00 179.24 176.60 1a8h h ALA 319 N 1.37 0.70 0.09 3.45 0.00 -1.73 -2.35 119.26 120.80 1a8h h ALA 319 Ca 0.36 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1a8h h ALA 319 Cb 0.05 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1a8h h ALA 319 CO -0.13 0.54 -0.04 1.25 0.00 0.00 0.00 179.25 180.86 1a8h h LEU 320 N 0.80 -0.10 -0.48 0.00 5.85 -1.20 -1.77 115.31 118.42 1a8h h LEU 320 Ca 0.14 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.82 1a8h h LEU 320 Cb 0.56 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 1a8h h LEU 320 CO 0.03 0.01 0.27 0.03 -0.34 0.00 0.00 178.44 178.44 1a8h h ARG 321 N -0.20 0.52 0.02 1.25 3.08 -1.29 -2.01 114.38 115.76 1a8h h ARG 321 Ca -0.01 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.01 1a8h h ARG 321 Cb 0.16 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1a8h h ARG 321 CO 0.02 0.35 -0.05 -0.92 -1.07 0.00 0.00 179.97 178.29 1a8h h TYR 322 N 0.54 -0.13 -0.45 3.04 3.20 -1.33 -1.65 116.97 120.19 1a8h h TYR 322 Ca 0.20 0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.15 1a8h h TYR 322 Cb 0.04 0.06 -0.07 0.00 1.54 0.00 0.00 36.73 38.30 1a8h h TYR 322 CO -0.08 -0.08 0.07 -0.92 -1.64 0.00 0.00 178.16 175.51 1a8h h TYR 323 N -0.10 0.10 -0.02 -3.82 3.20 -1.06 0.10 116.97 115.37 1a8h h TYR 323 Ca 0.01 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.84 1a8h h TYR 323 Cb 0.12 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 1a8h h TYR 323 CO -0.11 -0.02 -0.35 -0.07 -1.64 0.00 0.00 178.16 175.96 1a8h h LEU 324 N 0.19 0.04 0.10 2.82 3.38 -1.14 0.04 115.31 120.74 1a8h h LEU 324 Ca 0.23 -0.01 -0.30 0.00 0.09 0.00 0.00 57.88 57.88 1a8h h LEU 324 Cb 0.30 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1a8h h LEU 324 CO -0.32 0.40 -1.53 -0.07 0.09 0.00 0.00 178.44 177.01 1a8h h LEU 325 N 0.04 0.32 0.03 1.67 3.38 -0.74 -3.06 115.31 116.95 1a8h h LEU 325 Ca 0.00 -0.47 -0.26 0.00 0.09 0.00 0.00 57.88 57.24 1a8h h LEU 325 Cb 0.65 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1a8h h LEU 325 CO 0.05 1.39 -1.40 -0.09 0.09 0.00 0.00 178.44 178.48 1a8h h ARG 326 N 0.06 0.06 0.00 1.13 9.65 -0.81 -2.85 114.38 121.62 1a8h h ARG 326 Ca -0.24 -0.10 -0.03 0.00 -1.10 0.00 0.00 59.98 58.51 1a8h h ARG 326 Cb 2.00 0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 30.61 1a8h h ARG 326 CO 0.15 0.83 -1.41 -1.91 2.80 0.00 0.00 179.97 180.43 1a8h n GLU 327 N -3.26 0.63 -3.94 0.20 4.07 -0.00 -4.62 120.64 113.72 1a8h n GLU 327 Ca -0.10 0.03 -0.34 0.00 -0.06 0.00 0.00 57.16 56.68 1a8h n GLU 327 Cb 1.01 -1.72 -0.14 0.00 -0.06 0.00 0.00 31.44 30.53 1a8h n GLU 327 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1a8h s ILE 328 N -3.34 2.83 0.12 6.31 1.01 -1.15 -5.05 121.20 121.93 1a8h s ILE 328 Ca -0.03 -1.49 -0.31 0.00 0.00 0.00 0.00 60.65 58.82 1a8h s ILE 328 Cb 0.11 -2.66 -0.09 0.00 0.01 0.00 0.00 42.46 39.83 1a8h s ILE 328 CO 0.83 -0.13 1.55 -2.84 0.00 0.00 0.00 174.94 174.35 1a8h s PRO 329 N 1.21 4.23 0.02 2.79 0.02 -1.26 -4.76 135.00 137.25 1a8h s PRO 329 Ca -0.05 2.28 -0.30 0.00 0.02 0.00 0.00 61.00 62.94 1a8h s PRO 329 Cb -0.20 -3.33 -0.07 0.00 0.02 0.00 0.00 34.50 30.92 1a8h s PRO 329 CO -0.02 -0.61 1.65 -0.47 -0.33 0.00 0.00 177.00 177.22 1a8h s TYR 330 N 1.65 2.24 0.00 6.54 5.04 -1.26 -2.57 117.35 128.99 1a8h s TYR 330 Ca 0.70 0.28 0.00 0.00 -2.44 0.00 0.00 57.07 55.60 1a8h s TYR 330 Cb -0.41 -3.94 0.00 0.00 0.35 0.00 0.00 41.96 37.97 1a8h s TYR 330 CO 0.31 -3.83 0.00 0.41 -1.34 0.00 0.00 175.55 171.10 1a8h n GLY 331 N 4.04 1.68 3.51 8.97 0.00 -1.22 -4.88 105.19 117.29 1a8h n GLY 331 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 1a8h n GLY 331 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1a8h s GLN 332 N -0.58 2.53 -0.02 1.61 -0.21 -1.06 -3.98 119.66 117.95 1a8h s GLN 332 Ca 0.00 -0.69 -0.30 0.00 0.02 0.00 0.00 55.36 54.39 1a8h s GLN 332 Cb 0.00 -2.42 -0.06 0.00 1.00 0.00 0.00 33.01 31.53 1a8h s GLN 332 CO 0.00 0.62 1.55 -0.51 -2.12 0.00 0.00 175.29 174.84 1a8h s ASP 333 N -0.87 6.73 -0.02 5.90 1.01 -1.26 -4.29 116.67 123.86 1a8h s ASP 333 Ca 0.12 2.22 0.01 0.00 0.71 0.00 0.00 52.55 55.61 1a8h s ASP 333 Cb -0.11 -2.55 0.01 0.00 1.01 0.00 0.00 42.92 41.28 1a8h s ASP 333 CO 0.02 -0.84 -0.03 -0.89 0.21 0.00 0.00 175.17 173.63 1a8h s THR 334 N 3.19 0.35 0.37 -1.27 2.01 -0.66 -4.94 115.64 114.70 1a8h s THR 334 Ca 0.69 -0.11 -0.23 0.00 0.31 0.00 0.00 61.69 62.35 1a8h s THR 334 Cb -0.33 -0.35 -0.10 0.00 0.01 0.00 0.00 72.50 71.72 1a8h s THR 334 CO 0.28 0.14 0.94 -2.16 -0.69 0.00 0.00 174.62 173.13 1a8h s PRO 335 N 0.37 4.40 0.18 4.92 0.04 -1.26 -0.60 135.00 143.06 1a8h s PRO 335 Ca -0.04 1.21 0.09 0.00 0.04 0.00 0.00 61.00 62.30 1a8h s PRO 335 Cb -0.07 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.92 1a8h s PRO 335 CO -0.00 0.13 -0.17 0.14 0.04 0.00 0.00 177.00 177.14 1a8h s VAL 336 N -1.89 1.84 0.29 -0.36 -7.23 0.71 -4.85 120.40 108.91 1a8h s VAL 336 Ca 0.56 -2.04 -0.17 0.00 -1.81 0.00 0.00 61.98 58.52 1a8h s VAL 336 Cb -0.14 -1.93 0.02 0.00 0.56 0.00 0.00 36.38 34.88 1a8h s VAL 336 CO 0.19 -0.40 0.65 -0.94 -0.31 0.00 0.00 175.10 174.28 1a8h s SER 337 N -2.91 -0.12 0.30 4.85 1.04 -1.26 -2.50 113.70 113.10 1a8h s SER 337 Ca 0.19 -0.82 0.18 0.00 0.48 0.00 0.00 55.95 55.98 1a8h s SER 337 Cb -0.04 0.70 0.11 0.00 0.10 0.00 0.00 66.02 66.89 1a8h s SER 337 CO 0.07 -1.34 1.40 -0.08 0.98 0.00 0.00 173.24 174.27 1a8h h GLU 338 N 2.08 0.00 -0.21 4.02 4.81 -2.01 -3.23 114.58 120.04 1a8h h GLU 338 Ca -0.23 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 58.80 1a8h h GLU 338 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1a8h h GLU 338 CO 0.30 0.31 -0.63 1.05 -0.73 0.00 0.00 179.01 179.30 1a8h h GLU 339 N 0.00 0.76 -0.49 1.92 9.09 -1.99 -1.80 114.58 122.06 1a8h h GLU 339 Ca -0.02 -0.53 -0.10 0.00 0.05 0.00 0.00 59.36 58.76 1a8h h GLU 339 Cb 1.27 0.08 -0.02 0.00 -1.65 0.00 0.00 28.75 28.44 1a8h h GLU 339 CO 0.04 1.15 -0.10 0.00 0.05 0.00 0.00 179.01 180.15 1a8h h ALA 340 N 0.72 0.90 -0.14 1.06 0.00 -1.97 -2.31 119.26 117.52 1a8h h ALA 340 Ca -0.01 -0.33 -0.14 0.00 0.00 0.00 0.00 54.91 54.43 1a8h h ALA 340 Cb 1.23 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1a8h h ALA 340 CO 0.13 0.64 -0.51 1.25 0.00 0.00 0.00 179.25 180.75 1a8h h LEU 341 N 0.81 0.42 -0.57 0.00 6.46 -1.56 -2.41 115.31 118.45 1a8h h LEU 341 Ca 0.13 -0.21 -0.16 0.00 -0.12 0.00 0.00 57.88 57.53 1a8h h LEU 341 Cb 0.62 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.42 1a8h h LEU 341 CO 0.04 0.86 -0.59 -0.09 -0.62 0.00 0.00 178.44 178.04 1a8h h ARG 342 N 0.30 0.39 -0.04 1.25 2.43 -1.16 -1.55 114.38 115.99 1a8h h ARG 342 Ca 0.01 -0.26 -0.01 0.00 -0.81 0.00 0.00 59.98 58.91 1a8h h ARG 342 Cb 1.01 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.59 1a8h h ARG 342 CO 0.09 0.87 -0.03 1.15 -1.51 0.00 0.00 179.97 180.54 1a8h h THR 343 N 0.29 1.37 -0.81 0.20 2.02 -1.36 0.16 112.91 114.77 1a8h h THR 343 Ca -0.00 -1.14 0.03 0.00 0.77 0.00 0.00 66.41 66.07 1a8h h THR 343 Cb 1.12 2.05 -0.05 0.00 -1.74 0.00 0.00 68.15 69.53 1a8h h THR 343 CO 0.10 0.31 0.52 -0.09 0.37 0.00 0.00 175.52 176.73 1a8h h ARG 344 N -0.36 1.00 -0.46 6.66 9.65 -1.45 0.01 114.38 129.44 1a8h h ARG 344 Ca 0.01 -0.06 -0.03 0.00 -1.10 0.00 0.00 59.98 58.80 1a8h h ARG 344 Cb 0.51 -0.23 -0.02 0.00 -1.39 0.00 0.00 29.97 28.84 1a8h h ARG 344 CO 0.01 0.66 0.18 -0.92 2.80 0.00 0.00 179.97 182.71 1a8h h TYR 345 N 1.04 0.71 0.06 2.20 3.20 -1.19 -0.52 116.97 122.47 1a8h h TYR 345 Ca 0.32 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 62.13 1a8h h TYR 345 Cb -0.03 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.03 1a8h h TYR 345 CO -0.02 0.60 -0.03 1.49 -1.64 0.00 0.00 178.16 178.56 1a8h h GLU 346 N 0.61 -0.08 0.00 1.82 4.57 -0.49 0.38 114.58 121.40 1a8h h GLU 346 Ca 0.15 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.34 1a8h h GLU 346 Cb 0.20 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.80 1a8h h GLU 346 CO -0.01 0.20 0.00 0.00 -1.18 0.00 0.00 179.01 178.02 1a8h n ALA 347 N -2.27 -0.13 0.17 2.92 0.00 -0.05 -2.04 120.51 119.10 1a8h n ALA 347 Ca -0.08 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.22 1a8h n ALA 347 Cb 0.17 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.55 1a8h n ALA 347 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1a8h h ASP 348 N 0.00 -0.29 0.00 0.00 5.19 -1.29 -0.75 116.42 119.28 1a8h h ASP 348 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1a8h h ASP 348 Cb 0.00 0.08 0.00 0.00 0.18 0.00 0.00 39.33 39.59 1a8h h ASP 348 CO 0.00 -0.20 -0.17 -0.07 -3.12 0.00 0.00 179.24 175.68 1a8h h LEU 349 N -0.36 0.00 -1.03 1.55 3.38 -1.44 -2.24 115.31 115.16 1a8h h LEU 349 Ca -0.04 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1a8h h LEU 349 Cb 0.27 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1a8h h LEU 349 CO 0.06 0.48 0.29 0.00 0.09 0.00 0.00 178.44 179.36 1a8h h ALA 350 N -1.20 1.24 0.00 1.53 0.00 -0.33 0.37 119.26 120.87 1a8h h ALA 350 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1a8h h ALA 350 Cb 0.17 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1a8h h ALA 350 CO 0.00 0.57 -0.30 -3.47 0.00 0.00 0.00 179.25 176.05 1a8h n ASP 351 N -4.32 0.72 -0.18 0.00 2.03 -0.86 -2.17 116.55 111.77 1a8h n ASP 351 Ca 0.06 0.25 0.07 0.00 0.52 0.00 0.00 54.79 55.69 1a8h n ASP 351 Cb 0.16 -0.61 0.36 0.00 -0.72 0.00 0.00 41.12 40.31 1a8h n ASP 351 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1a8h h ASP 352 N -0.38 0.65 0.00 1.67 3.32 -1.13 -2.79 116.42 117.76 1a8h h ASP 352 Ca 0.00 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 1a8h h ASP 352 Cb 0.30 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1a8h h ASP 352 CO 0.00 0.42 -1.04 -0.11 -1.72 0.00 0.00 179.24 176.78 1a8h n LEU 353 N -4.48 1.84 0.13 1.55 7.94 -0.85 -4.23 117.00 118.89 1a8h n LEU 353 Ca 0.11 0.31 -0.13 0.00 -1.11 0.00 0.00 56.01 55.19 1a8h n LEU 353 Cb 0.24 -0.70 -0.06 0.00 0.53 0.00 0.00 43.42 43.43 1a8h n LEU 353 CO 0.33 -0.24 0.75 1.23 -1.11 0.00 0.00 177.39 178.36 1a8h h GLY 354 N -0.89 -0.35 1.15 -3.96 0.00 -0.36 -2.01 103.07 96.65 1a8h h GLY 354 Ca -0.07 0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.42 1a8h h GLY 354 CO -0.04 -0.17 0.33 -0.57 0.00 0.00 0.00 176.54 176.10 1a8h h ASN 355 N -0.36 0.99 -0.89 0.19 -0.73 -1.15 -0.53 115.58 113.09 1a8h h ASN 355 Ca 0.01 -0.13 -0.02 0.00 1.87 0.00 0.00 56.30 58.03 1a8h h ASN 355 Cb 0.35 -0.25 -0.04 0.00 0.27 0.00 0.00 38.32 38.64 1a8h h ASN 355 CO -0.05 0.86 0.48 0.25 -0.37 0.00 0.00 177.43 178.60 1a8h h LEU 356 N 1.07 1.12 -0.27 0.34 5.85 -1.54 0.46 115.31 122.35 1a8h h LEU 356 Ca 0.26 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.82 1a8h h LEU 356 Cb 0.15 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1a8h h LEU 356 CO -0.03 0.91 -0.03 0.58 -0.34 0.00 0.00 178.44 179.53 1a8h h VAL 357 N 1.26 1.27 -0.62 1.05 2.07 -0.85 0.30 116.25 120.72 1a8h h VAL 357 Ca 0.31 -1.00 -0.06 0.00 0.82 0.00 0.00 66.70 66.77 1a8h h VAL 357 Cb 0.04 1.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1a8h h VAL 357 CO -0.05 0.32 0.16 1.56 0.02 0.00 0.00 177.57 179.58 1a8h h GLN 358 N 0.27 0.96 -0.26 1.57 4.20 -0.73 -1.70 115.11 119.42 1a8h h GLN 358 Ca 0.07 -0.21 -0.06 0.00 0.06 0.00 0.00 58.65 58.52 1a8h h GLN 358 Cb 0.48 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 1a8h h GLN 358 CO 0.02 0.85 -0.07 -0.09 -0.67 0.00 0.00 178.83 178.87 1a8h h ARG 359 N 0.92 0.51 -0.70 1.46 2.43 0.10 -2.46 114.38 116.65 1a8h h ARG 359 Ca 0.20 -0.20 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 1a8h h ARG 359 Cb 0.32 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 1a8h h ARG 359 CO -0.00 0.73 0.20 1.15 -1.51 0.00 0.00 179.97 180.54 1a8h h THR 360 N 0.26 1.26 -0.26 0.20 2.02 -0.79 -2.23 112.91 113.36 1a8h h THR 360 Ca 0.07 -0.91 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 1a8h h THR 360 Cb 0.54 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1a8h h THR 360 CO 0.03 0.35 0.08 0.03 0.37 0.00 0.00 175.52 176.38 1a8h h ARG 361 N 1.04 0.41 -0.83 6.66 3.08 -1.27 -1.26 114.38 122.22 1a8h h ARG 361 Ca 0.22 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.19 1a8h h ARG 361 Cb 0.32 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.27 1a8h h ARG 361 CO -0.00 0.48 0.54 0.00 -1.07 0.00 0.00 179.97 179.91 1a8h h ALA 362 N 0.91 1.39 0.00 0.04 0.00 -1.28 -2.38 119.26 117.94 1a8h h ALA 362 Ca 0.09 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1a8h h ALA 362 Cb 0.24 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1a8h h ALA 362 CO -0.00 0.56 -0.21 0.52 0.00 0.00 0.00 179.25 180.11 1a8h h MET 363 N 1.13 0.00 0.06 0.00 2.86 -1.13 -2.77 114.93 115.08 1a8h h MET 363 Ca 0.30 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.68 1a8h h MET 363 Cb -0.11 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.56 1a8h h MET 363 CO -0.06 0.21 -1.09 -0.07 1.06 0.00 0.00 176.91 176.96 1a8h h LEU 364 N 0.00 0.64 -0.94 1.22 3.38 -0.73 -0.26 115.31 118.62 1a8h h LEU 364 Ca -0.00 -0.56 -0.10 0.00 0.09 0.00 0.00 57.88 57.31 1a8h h LEU 364 Cb 0.89 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1a8h h LEU 364 CO 0.03 1.38 -0.34 -0.26 0.09 0.00 0.00 178.44 179.33 1a8h h PHE 365 N 0.23 0.41 0.06 1.13 0.04 -1.42 0.12 116.94 117.50 1a8h h PHE 365 Ca -0.12 -0.10 -0.18 0.00 2.80 0.00 0.00 57.97 60.36 1a8h h PHE 365 Cb 1.75 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 39.80 1a8h h PHE 365 CO 0.08 0.66 -0.94 0.00 -0.60 0.00 0.00 178.31 177.51 1a8h h ARG 366 N 0.30 0.14 0.00 1.51 2.47 -1.48 -3.32 114.38 114.00 1a8h h ARG 366 Ca 0.04 -0.23 0.00 0.00 -1.26 0.00 0.00 59.98 58.52 1a8h h ARG 366 Cb 0.75 0.09 0.00 0.00 -1.65 0.00 0.00 29.97 29.16 1a8h h ARG 366 CO 0.06 1.11 -0.94 1.19 0.56 0.00 0.00 179.97 181.95 1a8h n PHE 367 N -4.24 0.00 -1.30 3.04 3.72 -0.11 -4.60 117.46 113.97 1a8h n PHE 367 Ca -0.21 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.25 1a8h n PHE 367 Cb 0.74 -0.06 0.09 0.00 -0.94 0.00 0.00 39.48 39.30 1a8h n PHE 367 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1a8h n ALA 368 N -1.50 2.14 -3.77 4.37 0.00 0.24 -4.86 120.51 117.13 1a8h n ALA 368 Ca 0.02 -2.02 -0.24 0.00 0.00 0.00 0.00 53.44 51.20 1a8h n ALA 368 Cb 0.29 -0.39 0.03 0.00 0.00 0.00 0.00 19.45 19.37 1a8h n ALA 368 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1a8h n GLU 369 N -0.93 -4.93 -2.23 0.00 1.02 -0.64 -2.20 120.64 110.72 1a8h n GLU 369 Ca 0.10 0.60 -0.17 0.00 -0.02 0.00 0.00 57.16 57.67 1a8h n GLU 369 Cb 0.64 -5.20 -0.02 0.00 -0.02 0.00 0.00 31.44 26.84 1a8h n GLU 369 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a8h n GLY 370 N -1.64 -0.06 3.05 0.62 0.00 -0.22 -4.92 105.19 102.02 1a8h n GLY 370 Ca -0.22 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.72 1a8h n GLY 370 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a8h s ARG 371 N -4.72 0.49 0.13 1.61 0.52 -0.94 -1.36 118.95 114.68 1a8h s ARG 371 Ca 0.00 -0.96 -0.31 0.00 -0.52 0.00 0.00 55.73 53.94 1a8h s ARG 371 Cb 0.00 0.17 -0.08 0.00 0.52 0.00 0.00 34.95 35.57 1a8h s ARG 371 CO 0.00 -0.09 1.32 0.42 0.02 0.00 0.00 175.30 176.97 1a8h s ILE 372 N -2.90 3.46 1.32 1.52 1.01 -0.90 -4.74 121.20 119.95 1a8h s ILE 372 Ca -0.03 1.09 -0.18 0.00 0.00 0.00 0.00 60.65 61.53 1a8h s ILE 372 Cb 0.01 -3.70 0.34 0.00 0.01 0.00 0.00 42.46 39.11 1a8h s ILE 372 CO -0.06 0.11 0.97 -2.16 0.00 0.00 0.00 174.94 173.79 1a8h s PRO 373 N 0.72 -2.10 0.25 2.79 0.04 -1.26 -4.22 135.00 131.22 1a8h s PRO 373 Ca 0.61 0.47 -0.30 0.00 0.04 0.00 0.00 61.00 61.82 1a8h s PRO 373 Cb -0.35 -1.45 -0.09 0.00 0.04 0.00 0.00 34.50 32.65 1a8h s PRO 373 CO 0.32 -4.41 1.24 -2.00 0.04 0.00 0.00 177.00 172.19 1a8h s GLU 374 N -4.75 4.46 0.50 4.56 2.56 -1.26 -4.33 118.70 120.43 1a8h s GLU 374 Ca 0.69 2.01 -0.22 0.00 0.00 0.00 0.00 54.97 57.45 1a8h s GLU 374 Cb -0.19 -3.17 -0.08 0.00 2.00 0.00 0.00 34.13 32.69 1a8h s GLU 374 CO 0.61 -0.10 1.04 -2.30 -0.56 0.00 0.00 175.26 173.96 1a8h n PRO 375 N 1.76 1.27 -3.98 4.30 -0.02 -1.26 -4.88 135.00 132.19 1a8h n PRO 375 Ca 0.02 0.47 -0.09 0.00 -2.02 0.00 0.00 63.50 61.88 1a8h n PRO 375 Cb 0.43 -2.17 -0.08 0.00 -0.02 0.00 0.00 33.50 31.67 1a8h n PRO 375 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1a8h s VAL 376 N -1.37 0.09 0.87 -1.45 -7.23 -1.26 -5.13 120.40 104.93 1a8h s VAL 376 Ca 0.68 -1.46 -0.12 0.00 -1.81 0.00 0.00 61.98 59.27 1a8h s VAL 376 Cb -0.48 -1.78 0.11 0.00 0.56 0.00 0.00 36.38 34.78 1a8h s VAL 376 CO 0.53 -0.41 1.12 0.00 -0.31 0.00 0.00 175.10 176.02 1a8h n ALA 377 N -0.15 -0.59 0.27 1.32 0.00 -1.26 -4.84 120.51 115.26 1a8h n ALA 377 Ca -0.09 -0.46 0.12 0.00 0.00 0.00 0.00 53.44 53.02 1a8h n ALA 377 Cb 0.63 -2.19 0.04 0.00 0.00 0.00 0.00 19.45 17.93 1a8h n ALA 377 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a8h n GLY 378 N 0.50 -1.41 7.00 0.00 0.00 -1.26 -4.90 105.19 105.12 1a8h n GLY 378 Ca 0.12 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1a8h n GLY 378 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1a8h n GLU 379 N -2.44 0.00 0.07 1.61 1.02 -1.26 -1.35 120.64 118.29 1a8h n GLU 379 Ca 0.01 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.26 1a8h n GLU 379 Cb 0.51 0.00 0.44 0.00 -0.02 0.00 0.00 31.44 32.36 1a8h n GLU 379 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1a8h n GLU 380 N 13.76 0.13 0.02 3.49 4.71 -1.26 -2.43 120.64 139.05 1a8h n GLU 380 Ca 0.00 0.30 0.11 0.00 -0.01 0.00 0.00 57.16 57.57 1a8h n GLU 380 Cb 0.00 -1.71 0.12 0.00 -1.01 0.00 0.00 31.44 28.84 1a8h n GLU 380 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1a8h n LEU 381 N -1.94 0.63 0.29 -4.62 4.32 -0.46 -4.06 117.00 111.16 1a8h n LEU 381 Ca 0.03 -0.04 0.19 0.00 -0.02 0.00 0.00 56.01 56.17 1a8h n LEU 381 Cb 0.25 -0.16 0.87 0.00 -1.62 0.00 0.00 43.42 42.76 1a8h n LEU 381 CO 0.20 0.09 1.06 0.00 -1.22 0.00 0.00 177.39 177.52 1a8h h ALA 382 N 2.79 1.00 0.00 -1.18 0.00 -1.51 -2.73 119.26 117.63 1a8h h ALA 382 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1a8h h ALA 382 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1a8h h ALA 382 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 179.25 178.40 1a8h n GLU 383 N -3.04 0.14 0.29 0.00 0.28 -1.26 -2.63 120.64 114.42 1a8h n GLU 383 Ca -0.01 0.52 0.18 0.00 -0.16 0.00 0.00 57.16 57.69 1a8h n GLU 383 Cb 0.21 -1.85 0.78 0.00 1.43 0.00 0.00 31.44 32.02 1a8h n GLU 383 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 1a8h h GLY 384 N 1.03 0.00 1.91 -1.84 0.00 -1.79 -2.47 103.07 99.91 1a8h h GLY 384 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1a8h h GLY 384 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 1a8h n THR 385 N -3.15 1.04 -0.31 4.70 -2.24 -1.08 -1.67 114.28 111.58 1a8h n THR 385 Ca -0.00 0.26 0.11 0.00 -2.27 0.00 0.00 64.05 62.15 1a8h n THR 385 Cb 0.26 -1.05 0.32 0.00 -2.10 0.00 0.00 70.33 67.76 1a8h n THR 385 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a8h n GLY 386 N -0.21 2.38 0.11 3.38 0.00 -0.93 -4.35 105.19 105.58 1a8h n GLY 386 Ca 0.04 -0.78 -0.19 0.00 0.00 0.00 0.00 46.02 45.08 1a8h n GLY 386 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1a8h h LEU 387 N 4.17 0.41 -0.65 0.99 4.07 -1.50 -3.12 115.31 119.68 1a8h h LEU 387 Ca 0.00 -0.96 0.13 0.00 0.08 0.00 0.00 57.88 57.13 1a8h h LEU 387 Cb 1.01 -0.13 -0.09 0.00 1.08 0.00 0.00 40.66 42.52 1a8h h LEU 387 CO 0.02 1.34 0.17 0.00 -1.08 0.00 0.00 178.44 178.89 1a8h h ALA 388 N 0.08 0.82 -0.14 1.53 0.00 -1.77 0.35 119.26 120.12 1a8h h ALA 388 Ca -0.12 0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1a8h h ALA 388 Cb 1.56 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 1a8h h ALA 388 CO 0.13 -0.29 -0.27 0.78 0.00 0.00 0.00 179.25 179.60 1a8h h GLY 389 N 0.30 0.27 1.72 0.00 0.00 -1.83 -1.18 103.07 102.36 1a8h h GLY 389 Ca 0.35 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1a8h h GLY 389 CO -0.42 0.19 -0.28 3.21 0.00 0.00 0.00 176.54 179.25 1a8h h ARG 390 N 0.23 0.00 0.16 4.80 3.08 -1.05 -3.33 114.38 118.26 1a8h h ARG 390 Ca 0.03 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.75 1a8h h ARG 390 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1a8h h ARG 390 CO 0.04 0.00 -1.65 -0.07 -1.07 0.00 0.00 179.97 177.22 1a8h h LEU 391 N 0.00 0.53 -0.64 3.04 3.38 0.02 -3.34 115.31 118.31 1a8h h LEU 391 Ca 0.00 -0.76 0.13 0.00 0.09 0.00 0.00 57.88 57.34 1a8h h LEU 391 Cb 1.00 -0.17 -0.12 0.00 0.09 0.00 0.00 40.66 41.45 1a8h h LEU 391 CO 0.00 1.63 -0.19 0.03 0.09 0.00 0.00 178.44 180.00 1a8h h ARG 392 N 0.09 -0.03 0.00 1.13 3.08 -1.34 0.15 114.38 117.46 1a8h h ARG 392 Ca -0.30 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.65 1a8h h ARG 392 Cb 2.07 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 32.11 1a8h h ARG 392 CO 0.17 -0.02 -0.48 -1.35 -1.07 0.00 0.00 179.97 177.22 1a8h h PRO 393 N -0.03 0.00 -0.37 0.04 0.11 -1.75 -2.29 132.00 127.70 1a8h h PRO 393 Ca 0.30 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.34 1a8h h PRO 393 Cb 0.49 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.59 1a8h h PRO 393 CO -0.67 0.48 -0.02 1.25 -0.21 0.00 0.00 178.00 178.83 1a8h h LEU 394 N 0.00 0.66 0.03 2.35 5.85 -1.07 -2.56 115.31 120.57 1a8h h LEU 394 Ca -0.00 -0.32 -0.00 0.00 0.84 0.00 0.00 57.88 58.39 1a8h h LEU 394 Cb 0.88 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.74 1a8h h LEU 394 CO 0.06 0.83 -0.01 0.58 -0.34 0.00 0.00 178.44 179.56 1a8h h VAL 395 N 0.48 1.23 -0.30 1.05 2.07 -0.72 -0.44 116.25 119.62 1a8h h VAL 395 Ca 0.10 -0.80 0.08 0.00 0.82 0.00 0.00 66.70 66.90 1a8h h VAL 395 Cb 0.50 1.77 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 1a8h h VAL 395 CO 0.02 0.21 0.21 0.03 0.02 0.00 0.00 177.57 178.06 1a8h h ARG 396 N -0.39 0.04 -0.67 1.57 2.47 -1.44 -0.34 114.38 115.63 1a8h h ARG 396 Ca -0.00 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 1a8h h ARG 396 Cb 0.36 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.67 1a8h h ARG 396 CO 0.01 0.03 0.00 0.39 0.56 0.00 0.00 179.97 180.95 1a8h n GLU 397 N -4.46 2.59 -3.05 0.04 1.02 -0.97 -4.91 120.64 110.91 1a8h n GLU 397 Ca 0.04 -1.46 -0.22 0.00 -0.02 0.00 0.00 57.16 55.50 1a8h n GLU 397 Cb 0.35 -1.70 0.04 0.00 -0.02 0.00 0.00 31.44 30.11 1a8h n GLU 397 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1a8h n LEU 398 N 0.38 -2.73 -3.24 -4.62 4.77 -0.14 -4.93 117.00 106.50 1a8h n LEU 398 Ca 0.13 -0.30 -0.32 0.00 -0.03 0.00 0.00 56.01 55.49 1a8h n LEU 398 Cb 0.59 -2.92 -0.02 0.00 -2.33 0.00 0.00 43.42 38.74 1a8h n LEU 398 CO 0.14 0.27 0.59 0.29 -1.33 0.00 0.00 177.39 177.34 1a8h n LYS 399 N -4.02 3.94 0.01 3.23 4.01 -0.18 -4.28 118.16 120.87 1a8h n LYS 399 Ca -0.10 -4.78 -0.01 0.00 -0.51 0.00 0.00 58.31 52.91 1a8h n LYS 399 Cb 0.61 -2.32 0.27 0.00 -0.51 0.00 0.00 35.03 33.08 1a8h n LYS 399 CO 0.00 0.00 0.00 0.74 -1.11 0.00 0.00 177.40 177.03 1a8h h PHE 400 N 3.55 0.52 -0.35 2.13 0.04 -1.85 -2.48 116.94 118.50 1a8h h PHE 400 Ca 0.27 -0.07 -0.09 0.00 2.80 0.00 0.00 57.97 60.87 1a8h h PHE 400 Cb 0.46 -0.14 -0.02 0.00 2.20 0.00 0.00 35.95 38.45 1a8h h PHE 400 CO 1.00 0.58 -0.17 1.12 -0.60 0.00 0.00 178.31 180.23 1a8h h HIS 401 N 0.46 0.72 -0.12 -0.55 2.07 -1.76 -1.97 115.15 113.99 1a8h h HIS 401 Ca 0.09 -0.14 -0.20 0.00 -2.85 0.00 0.00 60.37 57.27 1a8h h HIS 401 Cb 0.45 -0.18 0.00 0.00 2.57 0.00 0.00 27.41 30.25 1a8h h HIS 401 CO 0.01 0.78 -0.72 0.28 -3.07 0.00 0.00 177.93 175.21 1a8h h VAL 402 N 0.58 1.33 0.21 6.12 2.07 -1.84 -1.96 116.25 122.77 1a8h h VAL 402 Ca 0.09 -2.03 -0.01 0.00 0.82 0.00 0.00 66.70 65.58 1a8h h VAL 402 Cb 0.62 2.01 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 1a8h h VAL 402 CO 0.04 0.63 -0.10 0.00 0.02 0.00 0.00 177.57 178.16 1a8h h ALA 403 N 0.79 -0.28 -0.09 1.67 0.00 -1.24 -2.25 119.26 117.86 1a8h h ALA 403 Ca -0.03 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 1a8h h ALA 403 Cb 1.32 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 1a8h h ALA 403 CO 0.14 -0.58 -0.29 -0.07 0.00 0.00 0.00 179.25 178.45 1a8h h LEU 404 N -0.43 0.17 -1.36 0.00 3.38 -1.43 -1.75 115.31 113.88 1a8h h LEU 404 Ca -0.03 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1a8h h LEU 404 Cb 0.33 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1a8h h LEU 404 CO 0.05 0.46 -0.03 -0.08 0.09 0.00 0.00 178.44 178.92 1a8h h GLU 405 N 0.15 0.39 -0.05 1.13 4.81 -1.21 -0.21 114.58 119.58 1a8h h GLU 405 Ca 0.02 -0.08 -0.12 0.00 -0.13 0.00 0.00 59.36 59.05 1a8h h GLU 405 Cb 0.59 -0.06 0.01 0.00 0.63 0.00 0.00 28.75 29.92 1a8h h GLU 405 CO 0.04 0.44 -0.45 0.93 -0.73 0.00 0.00 179.01 179.24 1a8h h GLU 406 N 0.37 0.40 -0.46 1.92 4.39 -0.76 -1.23 114.58 119.21 1a8h h GLU 406 Ca 0.08 -0.36 -0.01 0.00 0.34 0.00 0.00 59.36 59.42 1a8h h GLU 406 Cb 0.30 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 1a8h h GLU 406 CO 0.01 1.01 0.25 0.00 -1.16 0.00 0.00 179.01 179.13 1a8h h ALA 407 N 0.39 0.58 0.00 3.43 0.00 -1.01 -1.80 119.26 120.85 1a8h h ALA 407 Ca -0.04 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1a8h h ALA 407 Cb 1.13 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1a8h h ALA 407 CO 0.09 0.10 -0.18 0.52 0.00 0.00 0.00 179.25 179.78 1a8h h MET 408 N 0.60 0.00 -0.19 0.00 2.86 -1.09 -2.12 114.93 114.99 1a8h h MET 408 Ca 0.16 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.72 1a8h h MET 408 Cb 0.04 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 1a8h h MET 408 CO -0.03 0.18 -0.26 0.00 1.06 0.00 0.00 176.91 177.87 1a8h h ALA 409 N 1.82 1.21 -0.11 6.32 0.00 -0.38 -0.90 119.26 127.22 1a8h h ALA 409 Ca -0.00 -0.33 -0.21 0.00 0.00 0.00 0.00 54.91 54.38 1a8h h ALA 409 Cb 0.64 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1a8h h ALA 409 CO 0.02 0.51 -0.76 -0.92 0.00 0.00 0.00 179.25 178.11 1a8h h TYR 410 N 0.31 0.82 -0.44 0.00 3.20 -0.88 -2.12 116.97 117.86 1a8h h TYR 410 Ca 0.05 -0.36 -0.05 0.00 3.14 0.00 0.00 58.73 61.51 1a8h h TYR 410 Cb 0.63 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.75 1a8h h TYR 410 CO 0.01 1.16 0.07 0.28 -1.64 0.00 0.00 178.16 178.04 1a8h h VAL 411 N 0.41 1.21 -0.23 1.81 2.07 -1.03 -0.58 116.25 119.92 1a8h h VAL 411 Ca -0.04 -0.79 -0.14 0.00 0.82 0.00 0.00 66.70 66.55 1a8h h VAL 411 Cb 1.37 0.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 1a8h h VAL 411 CO 0.14 0.28 -0.44 0.11 0.02 0.00 0.00 177.57 177.69 1a8h h LYS 412 N 0.65 0.56 -0.36 1.57 1.57 -1.04 -2.11 116.57 117.41 1a8h h LYS 412 Ca 0.14 -0.30 -0.06 0.00 -1.87 0.00 0.00 60.65 58.56 1a8h h LYS 412 Cb 0.31 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 1a8h h LYS 412 CO 0.00 0.89 -0.03 0.00 -0.57 0.00 0.00 179.45 179.75 1a8h h ALA 413 N 1.07 1.28 -0.43 3.86 0.00 -0.62 -1.43 119.26 122.98 1a8h h ALA 413 Ca 0.03 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 1a8h h ALA 413 Cb 0.95 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1a8h h ALA 413 CO 0.08 0.48 0.02 -0.07 0.00 0.00 0.00 179.25 179.76 1a8h h LEU 414 N 0.55 0.73 0.25 0.00 3.38 -0.73 -0.54 115.31 118.96 1a8h h LEU 414 Ca 0.11 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1a8h h LEU 414 Cb 0.39 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1a8h h LEU 414 CO 0.02 0.84 -0.12 0.78 0.09 0.00 0.00 178.44 180.05 1a8h h ASN 415 N 0.59 -0.29 -0.74 -0.43 2.35 -0.91 -2.03 115.58 114.13 1a8h h ASN 415 Ca 0.12 -0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.93 1a8h h ASN 415 Cb 0.46 0.07 -0.05 0.00 0.05 0.00 0.00 38.32 38.86 1a8h h ASN 415 CO 0.02 -0.19 0.49 0.03 -1.65 0.00 0.00 177.43 176.13 1a8h h ARG 416 N -0.35 0.79 0.84 0.81 3.08 -1.22 -1.37 114.38 116.95 1a8h h ARG 416 Ca -0.03 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 1a8h h ARG 416 Cb 0.27 -0.18 0.01 0.00 0.08 0.00 0.00 29.97 30.15 1a8h h ARG 416 CO 0.06 0.52 -0.41 -0.92 -1.07 0.00 0.00 179.97 178.14 1a8h h TYR 417 N 0.81 -1.07 0.00 3.04 3.20 -0.59 -0.93 116.97 121.43 1a8h h TYR 417 Ca 0.31 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.13 1a8h h TYR 417 Cb 0.21 0.36 -0.00 0.00 1.54 0.00 0.00 36.73 38.83 1a8h h TYR 417 CO -0.00 -0.66 -0.16 0.97 -1.64 0.00 0.00 178.16 176.67 1a8h h ILE 418 N -1.14 0.81 0.00 1.81 2.10 -1.15 0.17 117.51 120.11 1a8h h ILE 418 Ca -0.12 -0.61 -0.07 0.00 1.08 0.00 0.00 64.86 65.14 1a8h h ILE 418 Cb 0.88 1.36 -0.01 0.00 -1.09 0.00 0.00 36.82 37.96 1a8h h ILE 418 CO 0.19 0.15 -0.35 0.78 -1.08 0.00 0.00 178.15 177.84 1a8h h ASN 419 N 0.00 0.00 0.00 2.19 2.35 -1.08 -2.24 115.58 116.80 1a8h h ASN 419 Ca -0.00 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.58 1a8h h ASN 419 Cb 0.35 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.69 1a8h h ASN 419 CO 0.02 0.35 -1.01 -0.08 -1.65 0.00 0.00 177.43 175.06 1a8h h GLU 420 N 0.00 0.00 0.00 0.81 4.81 -0.54 -3.37 114.58 116.30 1a8h h GLU 420 Ca -0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1a8h h GLU 420 Cb 1.15 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.53 1a8h h GLU 420 CO 0.05 0.80 -0.14 0.87 -0.73 0.00 0.00 179.01 179.86 1a8h h LYS 421 N -1.00 0.00 -6.44 1.92 1.79 -1.10 -3.48 116.57 108.26 1a8h h LYS 421 Ca -0.26 0.00 -0.37 0.00 -2.18 0.00 0.00 60.65 57.85 1a8h h LYS 421 Cb 1.11 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.78 1a8h h LYS 421 CO -0.15 0.14 -1.06 1.63 -1.08 0.00 0.00 179.45 178.92 1a8h n LYS 422 N -3.94 -1.83 0.21 3.15 5.02 -0.84 -4.60 118.16 115.32 1a8h n LYS 422 Ca -0.02 1.30 0.16 0.00 -2.02 0.00 0.00 58.31 57.72 1a8h n LYS 422 Cb 0.23 -2.62 0.81 0.00 -0.02 0.00 0.00 35.03 33.43 1a8h n LYS 422 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1a8h h PRO 423 N 1.30 0.00 0.00 1.97 0.11 -1.91 -1.67 132.00 131.80 1a8h h PRO 423 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1a8h h PRO 423 Cb 1.35 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.46 1a8h h PRO 423 CO 0.27 0.00 0.00 0.11 -0.21 0.00 0.00 178.00 178.17 1a8h h TRP 424 N 0.00 0.00 0.04 0.65 0.09 -1.94 -2.21 115.95 112.58 1a8h h TRP 424 Ca 0.07 0.00 -0.38 0.00 0.09 0.00 0.00 58.89 58.67 1a8h h TRP 424 Cb 0.38 0.00 -0.05 0.00 0.08 0.00 0.00 29.16 29.57 1a8h h TRP 424 CO 0.00 0.00 -2.24 0.39 0.09 0.00 0.00 178.44 176.68 1a8h n GLU 425 N -2.50 0.66 0.31 0.12 -0.58 -0.67 -4.21 120.64 113.78 1a8h n GLU 425 Ca 0.03 0.24 0.19 0.00 -0.42 0.00 0.00 57.16 57.21 1a8h n GLU 425 Cb 0.35 -1.59 1.01 0.00 -0.57 0.00 0.00 31.44 30.63 1a8h n GLU 425 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1a8h h LEU 426 N -0.24 0.00 -0.57 -4.62 3.38 -1.43 -2.43 115.31 109.39 1a8h h LEU 426 Ca -0.54 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.38 1a8h h LEU 426 Cb 1.83 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.56 1a8h h LEU 426 CO -0.11 0.02 0.15 0.15 0.09 0.00 0.00 178.44 178.74 1a8h h PHE 427 N 0.00 0.95 -0.53 1.13 3.57 -1.57 0.64 116.94 121.14 1a8h h PHE 427 Ca -0.00 -0.11 0.05 0.00 3.53 0.00 0.00 57.97 61.44 1a8h h PHE 427 Cb 0.15 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 38.57 1a8h h PHE 427 CO 0.00 0.81 0.26 0.87 -2.23 0.00 0.00 178.31 178.02 1a8h h LYS 428 N 0.82 0.48 0.05 1.11 6.56 -1.64 -3.20 116.57 120.75 1a8h h LYS 428 Ca 0.18 -0.03 -0.00 0.00 -1.06 0.00 0.00 60.65 59.74 1a8h h LYS 428 Cb 0.34 -0.11 0.00 0.00 -0.57 0.00 0.00 32.23 31.89 1a8h h LYS 428 CO 0.00 0.32 -0.03 -0.22 -2.06 0.00 0.00 179.45 177.47 1a8h h LYS 429 N 0.50 -0.07 -3.74 3.15 1.63 -1.61 -3.45 116.57 112.99 1a8h h LYS 429 Ca 0.24 0.00 -0.59 0.00 -0.85 0.00 0.00 60.65 59.45 1a8h h LYS 429 Cb 0.16 0.02 -0.40 0.00 -0.60 0.00 0.00 32.23 31.41 1a8h h LYS 429 CO -0.17 -0.05 -0.76 -1.83 -3.45 0.00 0.00 179.45 173.20 1a8h s GLU 430 N -1.61 0.86 0.43 1.90 -1.05 0.20 -5.00 118.70 114.43 1a8h s GLU 430 Ca -0.01 -1.07 0.12 0.00 -0.15 0.00 0.00 54.97 53.85 1a8h s GLU 430 Cb 0.00 -2.17 0.98 0.00 -0.44 0.00 0.00 34.13 32.50 1a8h s GLU 430 CO 0.03 -0.91 2.00 -1.35 0.95 0.00 0.00 175.26 175.98 1a8h h PRO 431 N 8.05 0.43 -0.25 -4.83 0.11 -1.67 -1.97 132.00 131.86 1a8h h PRO 431 Ca -0.13 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.93 1a8h h PRO 431 Cb 1.03 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 1a8h h PRO 431 CO 0.46 0.29 0.07 0.93 -0.21 0.00 0.00 178.00 179.53 1a8h h GLU 432 N 0.45 0.36 0.03 1.05 3.07 -1.91 -1.78 114.58 115.85 1a8h h GLU 432 Ca 0.24 -0.05 -0.24 0.00 -0.50 0.00 0.00 59.36 58.81 1a8h h GLU 432 Cb 0.37 -0.07 0.01 0.00 -0.84 0.00 0.00 28.75 28.22 1a8h h GLU 432 CO -0.07 0.33 -1.03 1.49 -1.40 0.00 0.00 179.01 178.34 1a8h h GLU 433 N 0.36 0.42 -0.44 2.33 4.57 -1.68 -2.23 114.58 117.91 1a8h h GLU 433 Ca 0.09 -0.50 -0.03 0.00 -1.18 0.00 0.00 59.36 57.74 1a8h h GLU 433 Cb 0.14 0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.86 1a8h h GLU 433 CO -0.00 1.16 0.15 0.00 -1.18 0.00 0.00 179.01 179.13 1a8h h ALA 434 N 0.66 0.58 -0.56 2.92 0.00 -1.32 -1.61 119.26 119.92 1a8h h ALA 434 Ca -0.10 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 1a8h h ALA 434 Cb 1.68 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.28 1a8h h ALA 434 CO 0.18 0.21 0.17 0.00 0.00 0.00 0.00 179.25 179.81 1a8h h ARG 435 N 0.57 0.88 -0.27 0.00 3.08 -1.36 -2.16 114.38 115.11 1a8h h ARG 435 Ca 0.14 -0.19 0.05 0.00 0.07 0.00 0.00 59.98 60.05 1a8h h ARG 435 Cb 0.24 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.12 1a8h h ARG 435 CO -0.01 0.80 -0.03 0.00 -1.07 0.00 0.00 179.97 179.67 1a8h h ALA 436 N 1.04 0.21 -0.56 0.04 0.00 -1.14 -0.52 119.26 118.34 1a8h h ALA 436 Ca 0.18 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.23 1a8h h ALA 436 Cb 0.29 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 1a8h h ALA 436 CO -0.00 -0.44 0.29 0.28 0.00 0.00 0.00 179.25 179.38 1a8h h VAL 437 N 0.05 0.95 -0.72 0.00 2.07 -1.08 -2.31 116.25 115.21 1a8h h VAL 437 Ca 0.13 -0.19 -0.07 0.00 0.82 0.00 0.00 66.70 67.39 1a8h h VAL 437 Cb 0.18 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 1a8h h VAL 437 CO -0.24 0.10 0.18 -0.07 0.02 0.00 0.00 177.57 177.56 1a8h h LEU 438 N 0.55 1.08 -0.66 2.57 3.38 -0.72 -2.64 115.31 118.88 1a8h h LEU 438 Ca 0.25 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1a8h h LEU 438 Cb 0.16 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1a8h h LEU 438 CO -0.17 1.03 0.42 0.22 0.09 0.00 0.00 178.44 180.03 1a8h h TYR 439 N 1.09 0.85 -0.21 1.13 3.20 -0.69 -0.90 116.97 121.43 1a8h h TYR 439 Ca 0.23 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.11 1a8h h TYR 439 Cb 0.36 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 1a8h h TYR 439 CO 0.03 0.56 0.13 0.00 -1.64 0.00 0.00 178.16 177.24 1a8h h ARG 440 N 0.89 0.27 -0.09 1.82 3.08 -1.19 0.19 114.38 119.35 1a8h h ARG 440 Ca 0.24 -0.02 -0.18 0.00 0.07 0.00 0.00 59.98 60.09 1a8h h ARG 440 Cb -0.06 -0.06 0.01 0.00 0.08 0.00 0.00 29.97 29.94 1a8h h ARG 440 CO -0.05 0.18 -0.64 0.28 -1.07 0.00 0.00 179.97 178.68 1a8h h VAL 441 N 0.28 1.34 -0.36 2.04 2.07 -0.86 0.72 116.25 121.48 1a8h h VAL 441 Ca 0.07 -1.93 -0.12 0.00 0.82 0.00 0.00 66.70 65.54 1a8h h VAL 441 Cb -0.03 2.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1a8h h VAL 441 CO -0.02 0.59 -0.27 1.62 0.02 0.00 0.00 177.57 179.51 1a8h h VAL 442 N 0.23 1.28 0.00 2.57 3.04 -0.80 0.05 116.25 122.61 1a8h h VAL 442 Ca -0.05 -1.40 -0.12 0.00 -1.01 0.00 0.00 66.70 64.12 1a8h h VAL 442 Cb 1.29 1.29 -0.02 0.00 -2.01 0.00 0.00 31.29 31.84 1a8h h VAL 442 CO 0.13 0.46 -0.57 -0.08 -1.01 0.00 0.00 177.57 176.50 1a8h h GLU 443 N 0.65 0.00 -0.04 4.17 4.57 -1.00 -0.22 114.58 122.71 1a8h h GLU 443 Ca 0.08 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.05 1a8h h GLU 443 Cb 0.79 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.38 1a8h h GLU 443 CO 0.07 0.57 -0.86 0.78 -1.18 0.00 0.00 179.01 178.38 1a8h h GLY 444 N 2.59 0.51 1.64 1.92 0.00 -0.53 -2.84 103.07 106.36 1a8h h GLY 444 Ca -0.01 -0.81 -0.17 0.00 0.00 0.00 0.00 47.33 46.34 1a8h h GLY 444 CO 0.07 0.72 -0.68 1.41 0.00 0.00 0.00 176.54 178.07 1a8h h LEU 445 N 0.28 0.42 -0.02 3.11 3.38 -0.85 -1.95 115.31 119.68 1a8h h LEU 445 Ca -0.06 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.67 1a8h h LEU 445 Cb 1.48 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 1a8h h LEU 445 CO 0.15 0.97 -0.12 -0.09 0.09 0.00 0.00 178.44 179.45 1a8h h ARG 446 N 0.25 -0.19 -0.44 1.13 2.43 -0.95 0.22 114.38 116.84 1a8h h ARG 446 Ca -0.02 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1a8h h ARG 446 Cb 1.23 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.80 1a8h h ARG 446 CO 0.11 -0.13 0.28 0.82 -1.51 0.00 0.00 179.97 179.54 1a8h h ILE 447 N -0.20 1.09 -0.26 1.20 2.04 -1.46 -2.19 117.51 117.73 1a8h h ILE 447 Ca 0.05 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1a8h h ILE 447 Cb 0.26 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 1a8h h ILE 447 CO -0.13 0.10 0.16 0.00 0.00 0.00 0.00 178.15 178.28 1a8h h ALA 448 N 1.17 0.34 -0.96 1.87 0.00 -0.93 -2.30 119.26 118.44 1a8h h ALA 448 Ca 0.16 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.12 1a8h h ALA 448 Cb -0.04 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 17.58 1a8h h ALA 448 CO -0.05 -0.16 0.62 0.66 0.00 0.00 0.00 179.25 180.32 1a8h h SER 449 N 0.33 0.93 0.22 0.00 4.64 -0.34 -1.20 113.55 118.15 1a8h h SER 449 Ca 0.09 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.43 1a8h h SER 449 Cb 0.02 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 61.94 1a8h h SER 449 CO -0.02 0.56 -0.11 0.40 -0.87 0.00 0.00 176.83 176.80 1a8h h ILE 450 N 1.04 0.81 -0.16 0.95 2.04 -0.95 -0.35 117.51 120.89 1a8h h ILE 450 Ca 0.44 -0.18 0.05 0.00 1.00 0.00 0.00 64.86 66.17 1a8h h ILE 450 Cb 0.31 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 1a8h h ILE 450 CO -0.19 0.04 0.12 -0.07 0.00 0.00 0.00 178.15 178.05 1a8h h LEU 451 N -0.39 0.00 -0.44 1.44 3.38 -0.87 -1.87 115.31 116.56 1a8h h LEU 451 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1a8h h LEU 451 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1a8h h LEU 451 CO 0.05 0.00 -0.45 0.18 0.09 0.00 0.00 178.44 178.31 1a8h n LEU 452 N -4.44 1.13 -0.11 1.67 4.77 -0.51 -4.48 117.00 115.03 1a8h n LEU 452 Ca 0.01 -0.34 -0.05 0.00 -0.03 0.00 0.00 56.01 55.59 1a8h n LEU 452 Cb 0.25 -0.11 0.01 0.00 -2.33 0.00 0.00 43.42 41.24 1a8h n LEU 452 CO 0.34 0.23 0.73 0.74 -1.33 0.00 0.00 177.39 178.10 1a8h h THR 453 N 1.06 0.45 -0.58 -5.08 2.02 -0.20 -0.90 112.91 109.69 1a8h h THR 453 Ca 0.00 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.33 1a8h h THR 453 Cb 0.56 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 1a8h h THR 453 CO 0.00 0.00 0.41 -0.65 0.37 0.00 0.00 175.52 175.65 1a8h h PRO 454 N -0.10 0.12 0.16 6.66 0.11 -1.78 -1.06 132.00 136.11 1a8h h PRO 454 Ca 0.19 -0.01 -0.23 0.00 0.11 0.00 0.00 66.00 66.06 1a8h h PRO 454 Cb 0.40 -0.03 0.02 0.00 0.11 0.00 0.00 31.00 31.51 1a8h h PRO 454 CO -0.46 0.08 -1.04 0.00 -0.21 0.00 0.00 178.00 176.37 1a8h h ALA 455 N 1.72 -0.07 -2.55 -0.75 0.00 -1.51 -3.41 119.26 112.68 1a8h h ALA 455 Ca 0.28 -0.79 -0.60 0.00 0.00 0.00 0.00 54.91 53.80 1a8h h ALA 455 Cb 0.92 0.17 -0.40 0.00 0.00 0.00 0.00 17.79 18.48 1a8h h ALA 455 CO -0.03 0.51 -0.84 -1.33 0.00 0.00 0.00 179.25 177.56 1a8h n MET 456 N -4.01 0.91 0.08 0.00 2.81 -0.60 -4.45 117.12 111.87 1a8h n MET 456 Ca -0.16 -3.70 -0.12 0.00 -1.81 0.00 0.00 57.70 51.91 1a8h n MET 456 Cb 0.90 -1.86 -0.05 0.00 -0.71 0.00 0.00 33.22 31.49 1a8h n MET 456 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1a8h h PRO 457 N 5.30 -0.44 -0.29 0.03 0.11 -1.45 -1.47 132.00 133.80 1a8h h PRO 457 Ca 0.21 0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.32 1a8h h PRO 457 Cb 0.84 0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 1a8h h PRO 457 CO 0.52 -0.30 0.05 -0.44 -0.21 0.00 0.00 178.00 177.63 1a8h h ASP 458 N -0.46 0.45 -0.54 -2.05 3.32 -1.95 -2.64 116.42 112.56 1a8h h ASP 458 Ca 0.05 -0.25 -0.11 0.00 0.02 0.00 0.00 57.03 56.74 1a8h h ASP 458 Cb 0.52 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 1a8h h ASP 458 CO -0.21 0.59 -0.08 0.11 -1.72 0.00 0.00 179.24 177.93 1a8h h LYS 459 N 0.29 1.00 -0.22 3.56 1.79 -1.96 -1.86 116.57 119.18 1a8h h LYS 459 Ca 0.09 -0.36 -0.11 0.00 -2.18 0.00 0.00 60.65 58.09 1a8h h LYS 459 Cb 0.33 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.89 1a8h h LYS 459 CO 0.00 1.04 -0.31 0.52 -1.08 0.00 0.00 179.45 179.62 1a8h h MET 460 N 0.88 0.45 -0.27 3.15 2.86 -1.30 0.47 114.93 121.16 1a8h h MET 460 Ca 0.14 -0.19 -0.11 0.00 -2.06 0.00 0.00 59.70 57.48 1a8h h MET 460 Cb 0.64 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.27 1a8h h MET 460 CO 0.04 0.71 -0.31 0.00 1.06 0.00 0.00 176.91 178.42 1a8h h ALA 461 N 1.28 0.95 -0.42 6.32 0.00 -1.37 -2.33 119.26 123.70 1a8h h ALA 461 Ca 0.05 -0.39 -0.10 0.00 0.00 0.00 0.00 54.91 54.47 1a8h h ALA 461 Cb 0.74 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1a8h h ALA 461 CO 0.06 0.61 -0.14 1.49 0.00 0.00 0.00 179.25 181.26 1a8h h GLU 462 N 0.49 0.77 -0.44 0.00 4.81 -0.77 -1.15 114.58 118.29 1a8h h GLU 462 Ca 0.06 -0.27 -0.03 0.00 -0.13 0.00 0.00 59.36 58.99 1a8h h GLU 462 Cb 0.78 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.08 1a8h h GLU 462 CO 0.06 0.87 0.17 1.25 -0.73 0.00 0.00 179.01 180.64 1a8h h LEU 463 N 0.69 0.61 -0.38 1.64 6.46 -0.56 -0.15 115.31 123.61 1a8h h LEU 463 Ca 0.11 -0.17 -0.09 0.00 -0.12 0.00 0.00 57.88 57.61 1a8h h LEU 463 Cb 0.63 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.39 1a8h h LEU 463 CO 0.04 0.61 -0.13 0.03 -0.62 0.00 0.00 178.44 178.37 1a8h h ARG 464 N 0.56 0.76 -0.63 1.25 3.08 -1.27 -2.21 114.38 115.93 1a8h h ARG 464 Ca 0.15 -0.31 0.05 0.00 0.07 0.00 0.00 59.98 59.93 1a8h h ARG 464 Cb 0.20 -0.03 -0.05 0.00 0.08 0.00 0.00 29.97 30.16 1a8h h ARG 464 CO -0.01 0.92 0.35 0.00 -1.07 0.00 0.00 179.97 180.17 1a8h h ARG 465 N 0.56 0.65 0.00 0.04 3.08 -1.03 0.19 114.38 117.88 1a8h h ARG 465 Ca 0.09 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1a8h h ARG 465 Cb 0.66 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.56 1a8h h ARG 465 CO 0.05 0.43 -0.16 0.00 -1.07 0.00 0.00 179.97 179.22 1a8h h ALA 466 N 1.31 1.31 -0.58 0.04 0.00 -0.82 -2.44 119.26 118.08 1a8h h ALA 466 Ca 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1a8h h ALA 466 Cb 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1a8h h ALA 466 CO -0.16 0.20 0.00 1.28 0.00 0.00 0.00 179.25 180.57 1a8h n LEU 467 N -3.72 3.71 -1.01 0.00 4.77 -0.63 -4.49 117.00 115.63 1a8h n LEU 467 Ca -0.02 -2.09 -0.13 0.00 -0.03 0.00 0.00 56.01 53.74 1a8h n LEU 467 Cb 0.27 -0.42 -0.06 0.00 -2.33 0.00 0.00 43.42 40.89 1a8h n LEU 467 CO 0.32 0.87 -0.13 0.61 -1.33 0.00 0.00 177.39 177.73 1a8h n GLY 468 N 1.12 1.39 3.94 -0.72 0.00 -0.28 -4.87 105.19 105.77 1a8h n GLY 468 Ca 0.20 -0.38 -0.24 0.00 0.00 0.00 0.00 46.02 45.60 1a8h n GLY 468 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a8h s LEU 469 N -3.01 3.32 -0.03 0.99 1.43 0.52 -4.89 118.68 117.02 1a8h s LEU 469 Ca 0.00 0.39 -0.30 0.00 -1.03 0.00 0.00 54.13 53.19 1a8h s LEU 469 Cb 0.00 -3.22 -0.06 0.00 0.03 0.00 0.00 46.19 42.95 1a8h s LEU 469 CO 0.00 -1.04 1.53 -0.75 0.23 0.00 0.00 176.35 176.32 1a8h s LYS 470 N -4.84 4.22 0.03 1.70 2.47 -1.26 -4.30 119.74 117.77 1a8h s LYS 470 Ca 0.54 2.09 -0.22 0.00 -1.56 0.00 0.00 55.97 56.82 1a8h s LYS 470 Cb -0.10 -3.77 -0.12 0.00 -1.46 0.00 0.00 37.83 32.38 1a8h s LYS 470 CO 0.41 -0.73 1.31 0.93 0.16 0.00 0.00 175.35 177.44 1a8h h GLU 471 N 8.66 -0.76 -6.51 4.03 5.08 -1.89 -3.42 114.58 119.76 1a8h h GLU 471 Ca -0.38 0.05 -0.53 0.00 -1.00 0.00 0.00 59.36 57.50 1a8h h GLU 471 Cb 1.17 0.17 0.01 0.00 0.50 0.00 0.00 28.75 30.61 1a8h h GLU 471 CO 0.94 -0.51 0.68 -2.00 -1.00 0.00 0.00 179.01 177.12 1a8h s GLU 472 N -4.69 4.36 0.34 2.33 2.56 -1.26 -4.86 118.70 117.47 1a8h s GLU 472 Ca -0.11 1.96 0.04 0.00 0.00 0.00 0.00 54.97 56.86 1a8h s GLU 472 Cb 0.01 -3.31 -0.03 0.00 2.00 0.00 0.00 34.13 32.80 1a8h s GLU 472 CO 0.34 -0.39 0.18 0.14 -0.56 0.00 0.00 175.26 174.98 1a8h s VAL 473 N 1.19 0.30 0.01 3.70 -7.23 -1.26 -5.16 120.40 111.95 1a8h s VAL 473 Ca 0.62 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.80 1a8h s VAL 473 Cb -0.34 -2.46 -0.01 0.00 0.56 0.00 0.00 36.38 34.13 1a8h s VAL 473 CO 0.30 0.00 -0.03 -0.13 -0.31 0.00 0.00 175.10 174.93 1a8h s ARG 474 N -3.70 0.21 0.56 4.82 0.52 -1.26 -4.97 118.95 115.13 1a8h s ARG 474 Ca 0.34 -0.27 0.25 0.00 -0.52 0.00 0.00 55.73 55.53 1a8h s ARG 474 Cb 0.04 -0.08 1.48 0.00 0.52 0.00 0.00 34.95 36.91 1a8h s ARG 474 CO 0.19 0.01 2.05 1.25 0.02 0.00 0.00 175.30 178.83 1a8h h LEU 475 N 5.58 0.00 -1.45 2.53 5.85 -1.77 -1.16 115.31 124.88 1a8h h LEU 475 Ca -0.28 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 1a8h h LEU 475 Cb 1.21 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 1a8h h LEU 475 CO 0.47 0.00 -0.17 1.05 -0.34 0.00 0.00 178.44 179.45 1a8h h GLU 476 N 0.00 0.15 0.00 1.25 4.11 -1.97 -1.93 114.58 116.19 1a8h h GLU 476 Ca 0.15 -0.03 -0.00 0.00 0.07 0.00 0.00 59.36 59.54 1a8h h GLU 476 Cb 0.66 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.89 1a8h h GLU 476 CO -0.00 0.32 -0.01 0.93 0.07 0.00 0.00 179.01 180.32 1a8h h GLU 477 N 0.14 0.00 -0.03 1.06 5.08 -1.59 -0.66 114.58 118.58 1a8h h GLU 477 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1a8h h GLU 477 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1a8h h GLU 477 CO 0.03 0.01 0.00 0.00 -1.00 0.00 0.00 179.01 178.05 1a8h n ALA 478 N -2.11 2.61 0.40 3.43 0.00 -0.72 -3.36 120.51 120.76 1a8h n ALA 478 Ca -0.01 -0.24 0.06 0.00 0.00 0.00 0.00 53.44 53.25 1a8h n ALA 478 Cb 0.20 -1.29 0.07 0.00 0.00 0.00 0.00 19.45 18.43 1a8h n ALA 478 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1a8h n GLU 479 N -0.54 0.96 -4.97 0.00 1.02 -0.26 -4.36 120.64 112.50 1a8h n GLU 479 Ca 0.17 -1.33 -0.28 0.00 -0.02 0.00 0.00 57.16 55.69 1a8h n GLU 479 Cb 0.15 -1.24 -0.16 0.00 -0.02 0.00 0.00 31.44 30.17 1a8h n GLU 479 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1a8h s ARG 480 N -0.99 2.25 0.00 3.49 0.52 -1.21 -4.87 118.95 118.13 1a8h s ARG 480 Ca 0.15 -0.70 -0.13 0.00 -0.52 0.00 0.00 55.73 54.54 1a8h s ARG 480 Cb 0.10 -1.84 -0.05 0.00 0.52 0.00 0.00 34.95 33.68 1a8h s ARG 480 CO 0.15 0.21 0.37 -0.46 0.02 0.00 0.00 175.30 175.59 1a8h s TRP 481 N 0.21 3.68 0.00 -0.53 -0.11 -1.26 -4.43 118.94 116.50 1a8h s TRP 481 Ca -0.10 0.89 0.00 0.00 1.22 0.00 0.00 56.10 58.11 1a8h s TRP 481 Cb -0.15 -2.21 0.00 0.00 -1.50 0.00 0.00 33.47 29.61 1a8h s TRP 481 CO 0.05 0.63 0.00 0.41 -4.62 0.00 0.00 176.95 173.42 1a8h n GLY 482 N 1.65 0.98 0.09 5.86 0.00 -1.26 -5.01 105.19 107.50 1a8h n GLY 482 Ca -0.14 -0.02 -0.05 0.00 0.00 0.00 0.00 46.02 45.81 1a8h n GLY 482 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1a8h h LEU 483 N 0.00 0.00 -9.60 0.99 4.07 -1.93 -3.45 115.31 105.39 1a8h h LEU 483 Ca 0.00 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.44 1a8h h LEU 483 Cb 0.00 0.00 0.05 0.00 1.08 0.00 0.00 40.66 41.79 1a8h h LEU 483 CO 0.00 0.87 1.04 0.00 -1.08 0.00 0.00 178.44 179.28 1a8h s ALA 484 N -2.99 3.86 0.12 1.53 0.00 -1.26 -4.98 121.76 118.04 1a8h s ALA 484 Ca 0.00 1.52 0.00 0.00 0.00 0.00 0.00 51.96 53.49 1a8h s ALA 484 Cb 0.11 -3.72 -0.04 0.00 0.00 0.00 0.00 23.12 19.47 1a8h s ALA 484 CO 0.80 -1.03 0.28 -1.21 0.00 0.00 0.00 175.76 174.60 1a8h s GLU 485 N 1.79 3.47 -1.05 0.00 2.02 -1.26 -4.77 118.70 118.90 1a8h s GLU 485 Ca 0.77 -0.44 -0.23 0.00 0.02 0.00 0.00 54.97 55.09 1a8h s GLU 485 Cb -0.48 -2.97 0.03 0.00 0.10 0.00 0.00 34.13 30.82 1a8h s GLU 485 CO 0.34 0.53 1.58 -1.25 0.02 0.00 0.00 175.26 176.48 1a8h s PRO 486 N -2.89 3.46 0.15 0.39 0.04 -1.26 -4.71 135.00 130.18 1a8h s PRO 486 Ca 0.36 -1.12 0.06 0.00 0.04 0.00 0.00 61.00 60.34 1a8h s PRO 486 Cb -0.12 -5.34 -0.04 0.00 0.04 0.00 0.00 34.50 29.04 1a8h s PRO 486 CO 0.28 -2.45 -0.13 -0.98 0.04 0.00 0.00 177.00 173.76 1a8h s ARG 487 N 5.23 1.13 0.90 4.56 1.70 -1.26 -4.79 118.95 126.41 1a8h s ARG 487 Ca 0.51 -1.41 -0.12 0.00 -0.47 0.00 0.00 55.73 54.25 1a8h s ARG 487 Cb -0.00 -0.88 0.10 0.00 -0.57 0.00 0.00 34.95 33.59 1a8h s ARG 487 CO -0.05 0.15 0.93 -2.30 -1.08 0.00 0.00 175.30 172.94 1a8h n PRO 488 N 0.02 -0.27 -4.42 3.89 -0.02 -1.26 -2.13 135.00 130.82 1a8h n PRO 488 Ca -0.12 -0.01 -0.30 0.00 -2.02 0.00 0.00 63.50 61.05 1a8h n PRO 488 Cb 0.59 -2.22 -0.11 0.00 -0.02 0.00 0.00 33.50 31.74 1a8h n PRO 488 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1a8h s ILE 489 N -2.45 3.18 0.10 4.25 -4.36 -0.47 -4.67 121.20 116.78 1a8h s ILE 489 Ca 0.65 -1.17 -0.36 0.00 -0.26 0.00 0.00 60.65 59.51 1a8h s ILE 489 Cb -0.24 -2.42 -0.16 0.00 1.25 0.00 0.00 42.46 40.89 1a8h s ILE 489 CO 0.59 0.24 1.39 -0.81 0.24 0.00 0.00 174.94 176.59 1a8h n PRO 490 N 1.15 1.37 -0.04 0.37 -0.04 -1.26 -4.83 135.00 131.72 1a8h n PRO 490 Ca -0.15 0.49 0.20 0.00 -0.04 0.00 0.00 63.50 64.00 1a8h n PRO 490 Cb 0.52 -2.16 0.66 0.00 -0.04 0.00 0.00 33.50 32.48 1a8h n PRO 490 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1a8h h GLU 491 N 4.86 0.06 -3.35 0.54 5.08 -1.96 -3.40 114.58 116.41 1a8h h GLU 491 Ca -0.47 -0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 57.62 1a8h h GLU 491 Cb 1.32 -0.01 -0.32 0.00 0.50 0.00 0.00 28.75 30.23 1a8h h GLU 491 CO 0.80 0.04 -0.64 -1.21 -1.00 0.00 0.00 179.01 177.00 1a8h s GLU 492 N -5.07 0.05 -0.02 2.33 0.41 -1.26 -5.15 118.70 109.98 1a8h s GLU 492 Ca -0.05 0.31 0.00 0.00 -0.41 0.00 0.00 54.97 54.82 1a8h s GLU 492 Cb 0.20 -0.20 0.02 0.00 -1.78 0.00 0.00 34.13 32.36 1a8h s GLU 492 CO 0.74 -0.17 -0.00 0.00 -0.49 0.00 0.00 175.26 175.34 1a8h s ALA 493 N 1.14 0.26 0.70 5.21 0.00 -1.26 -5.09 121.76 122.70 1a8h s ALA 493 Ca -0.09 0.10 -0.15 0.00 0.00 0.00 0.00 51.96 51.82 1a8h s ALA 493 Cb -0.12 -0.23 0.02 0.00 0.00 0.00 0.00 23.12 22.79 1a8h s ALA 493 CO -0.05 -0.04 1.15 -2.14 0.00 0.00 0.00 175.76 174.69 1a8h s PRO 494 N 0.69 2.48 0.13 0.00 0.02 -1.26 -4.92 135.00 132.13 1a8h s PRO 494 Ca -0.07 1.55 -0.31 0.00 0.02 0.00 0.00 61.00 62.19 1a8h s PRO 494 Cb -0.10 -1.90 -0.10 0.00 0.02 0.00 0.00 34.50 32.43 1a8h s PRO 494 CO -0.01 -1.53 1.67 0.08 -0.33 0.00 0.00 177.00 176.87 1a8h s VAL 495 N -2.20 2.68 0.12 3.83 1.01 -1.26 -4.90 120.40 119.68 1a8h s VAL 495 Ca 0.70 0.33 -0.28 0.00 0.00 0.00 0.00 61.98 62.73 1a8h s VAL 495 Cb -0.24 -3.21 -0.08 0.00 0.00 0.00 0.00 36.38 32.85 1a8h s VAL 495 CO 0.43 0.01 1.62 0.25 0.00 0.00 0.00 175.10 177.41 1a8h h LEU 496 N 7.76 -0.92 -7.55 3.92 5.85 -1.91 -3.36 115.31 119.10 1a8h h LEU 496 Ca -0.43 0.11 -0.64 0.00 0.84 0.00 0.00 57.88 57.75 1a8h h LEU 496 Cb 1.21 0.35 -0.40 0.00 0.37 0.00 0.00 40.66 42.19 1a8h h LEU 496 CO 0.93 -0.40 -0.72 -0.36 -0.34 0.00 0.00 178.44 177.55 1a8h s PHE 497 N -6.01 3.30 1.07 1.25 0.08 -1.26 -5.08 117.98 111.33 1a8h s PHE 497 Ca -0.16 -2.77 -0.12 0.00 0.12 0.00 0.00 56.93 54.00 1a8h s PHE 497 Cb 0.08 -2.67 0.23 0.00 -0.57 0.00 0.00 43.02 40.10 1a8h s PHE 497 CO 0.65 -0.92 1.06 -1.25 -0.10 0.00 0.00 175.22 174.66 1a8h s PRO 498 N 0.94 -0.20 0.19 0.24 0.04 -1.26 -4.66 135.00 130.29 1a8h s PRO 498 Ca 0.11 0.77 -0.30 0.00 0.04 0.00 0.00 61.00 61.62 1a8h s PRO 498 Cb -0.19 -1.64 -0.08 0.00 0.04 0.00 0.00 34.50 32.63 1a8h s PRO 498 CO -0.11 -3.22 1.02 0.15 0.04 0.00 0.00 177.00 174.89 1a8h s LYS 499 N -4.68 4.69 0.00 4.56 3.01 -1.26 -4.96 119.74 121.10 1a8h s LYS 499 Ca 0.67 1.60 0.00 0.00 -1.01 0.00 0.00 55.97 57.23 1a8h s LYS 499 Cb -0.22 -3.29 0.00 0.00 -1.01 0.00 0.00 37.83 33.30 1a8h s LYS 499 CO 0.61 0.24 0.34 1.63 0.51 0.00 0.00 175.35 178.68