#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h4m n ASP 2 N 0.00 0.00 0.00 6.12 8.00 -1.26 -1.97 116.55 127.44 1h4m n ASP 2 Ca 0.00 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.53 1h4m n ASP 2 Cb 0.00 0.00 0.14 0.00 -0.02 0.00 0.00 41.12 41.24 1h4m n ASP 2 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1h4m n ASP 3 N 0.34 0.00 -0.07 -2.24 2.03 -1.26 -0.98 116.55 114.37 1h4m n ASP 3 Ca 0.00 0.21 0.06 0.00 0.52 0.00 0.00 54.79 55.58 1h4m n ASP 3 Cb 0.00 -0.29 -0.06 0.00 -0.72 0.00 0.00 41.12 40.06 1h4m n ASP 3 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1h4m n PHE 4 N -1.29 0.00 -0.25 -0.67 3.01 -1.00 -4.64 117.46 112.62 1h4m n PHE 4 Ca 0.03 0.00 0.16 0.00 1.01 0.00 0.00 57.45 58.64 1h4m n PHE 4 Cb 0.05 0.00 0.45 0.00 -0.01 0.00 0.00 39.48 39.96 1h4m n PHE 4 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1h4m h ALA 5 N 2.03 2.01 0.00 4.37 0.00 -0.40 -2.27 119.26 125.01 1h4m h ALA 5 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1h4m h ALA 5 Cb 0.35 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1h4m h ALA 5 CO 0.00 -0.28 0.00 -1.13 0.00 0.00 0.00 179.25 177.84 1h4m n SER 6 N -4.55 0.00 -4.90 0.00 3.41 -1.26 -4.85 113.62 101.47 1h4m n SER 6 Ca 0.18 0.39 -0.29 0.00 -0.26 0.00 0.00 58.87 58.89 1h4m n SER 6 Cb 0.58 -0.46 -0.03 0.00 -0.26 0.00 0.00 64.21 64.05 1h4m n SER 6 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1h4m s LEU 7 N -2.91 4.00 0.00 1.04 1.43 -0.86 -5.09 118.68 116.29 1h4m s LEU 7 Ca 0.13 0.83 -0.17 0.00 -1.03 0.00 0.00 54.13 53.89 1h4m s LEU 7 Cb 0.14 -3.67 0.24 0.00 0.03 0.00 0.00 46.19 42.94 1h4m s LEU 7 CO 0.39 -0.25 1.32 -0.81 0.23 0.00 0.00 176.35 177.23 1h4m n PRO 8 N -1.02 -1.50 0.18 1.29 -0.04 -1.26 -4.97 135.00 127.68 1h4m n PRO 8 Ca -0.01 -2.05 -0.15 0.00 -0.04 0.00 0.00 63.50 61.26 1h4m n PRO 8 Cb 0.54 -1.41 -0.08 0.00 -0.04 0.00 0.00 33.50 32.51 1h4m n PRO 8 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1h4m h LEU 9 N 0.00 -0.34 -8.86 1.53 6.46 -1.89 -3.39 115.31 108.82 1h4m h LEU 9 Ca -0.43 -0.02 -0.59 0.00 -0.12 0.00 0.00 57.88 56.72 1h4m h LEU 9 Cb 1.20 0.09 -0.08 0.00 -0.73 0.00 0.00 40.66 41.14 1h4m h LEU 9 CO 0.30 -0.21 0.68 -0.69 -0.62 0.00 0.00 178.44 177.90 1h4m s VAL 10 N -5.95 4.55 0.35 1.05 1.01 -1.26 -0.91 120.40 119.24 1h4m s VAL 10 Ca -0.15 1.34 0.08 0.00 0.00 0.00 0.00 61.98 63.25 1h4m s VAL 10 Cb 0.04 -4.37 -0.05 0.00 0.00 0.00 0.00 36.38 32.01 1h4m s VAL 10 CO 0.63 -0.54 0.13 0.27 0.00 0.00 0.00 175.10 175.60 1h4m s ILE 11 N 3.57 2.82 0.29 2.22 -4.36 0.03 -4.92 121.20 120.85 1h4m s ILE 11 Ca 0.40 -1.73 0.06 0.00 -0.26 0.00 0.00 60.65 59.12 1h4m s ILE 11 Cb -0.12 -2.95 -0.02 0.00 1.25 0.00 0.00 42.46 40.62 1h4m s ILE 11 CO 0.18 -0.15 0.40 -1.61 0.24 0.00 0.00 174.94 174.00 1h4m s GLU 12 N -3.84 3.25 0.29 0.37 0.41 -1.26 -0.79 118.70 117.12 1h4m s GLU 12 Ca 0.38 -0.90 0.04 0.00 -0.41 0.00 0.00 54.97 54.07 1h4m s GLU 12 Cb -0.01 -2.83 0.73 0.00 -1.78 0.00 0.00 34.13 30.24 1h4m s GLU 12 CO 0.22 0.26 1.69 -1.35 -0.49 0.00 0.00 175.26 175.59 1h4m h PRO 13 N 1.07 0.38 -0.85 0.39 0.11 -1.95 -0.91 132.00 130.24 1h4m h PRO 13 Ca -0.49 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.62 1h4m h PRO 13 Cb 1.24 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 32.22 1h4m h PRO 13 CO 0.57 0.25 0.56 0.00 -0.21 0.00 0.00 178.00 179.18 1h4m h ALA 14 N 1.71 1.42 -0.49 -0.75 0.00 -1.99 -0.38 119.26 118.79 1h4m h ALA 14 Ca 0.56 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 55.31 1h4m h ALA 14 Cb 1.07 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1h4m h ALA 14 CO -0.53 0.52 -0.11 -0.44 0.00 0.00 0.00 179.25 178.68 1h4m h ASP 15 N 1.12 0.94 -0.15 0.00 3.32 -1.55 -2.48 116.42 117.62 1h4m h ASP 15 Ca 0.32 -0.36 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 1h4m h ASP 15 Cb -0.07 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.21 1h4m h ASP 15 CO -0.08 1.08 0.02 0.25 -1.72 0.00 0.00 179.24 178.80 1h4m h LEU 16 N 0.79 0.24 -1.59 1.55 5.85 -1.23 -3.13 115.31 117.79 1h4m h LEU 16 Ca 0.12 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.64 1h4m h LEU 16 Cb 0.67 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 1h4m h LEU 16 CO 0.05 0.44 0.37 -0.61 -0.34 0.00 0.00 178.44 178.35 1h4m h GLN 17 N 0.03 0.49 0.00 1.25 4.15 -0.93 0.69 115.11 120.78 1h4m h GLN 17 Ca 0.04 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.44 1h4m h GLN 17 Cb 0.31 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.89 1h4m h GLN 17 CO 0.00 0.32 0.00 0.00 -1.93 0.00 0.00 178.83 177.23 1h4m h ALA 18 N 1.70 1.00 -0.01 3.38 0.00 -1.39 -3.19 119.26 120.75 1h4m h ALA 18 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1h4m h ALA 18 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1h4m h ALA 18 CO -0.07 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.72 1h4m n ARG 19 N -2.99 2.22 0.22 0.00 1.74 0.23 -4.76 116.66 113.32 1h4m n ARG 19 Ca 0.01 -2.02 0.13 0.00 -0.77 0.00 0.00 57.85 55.20 1h4m n ARG 19 Cb 0.29 -1.24 0.75 0.00 -1.02 0.00 0.00 32.46 31.23 1h4m n ARG 19 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1h4m h LEU 20 N 0.07 0.00 -2.81 0.55 3.38 -1.24 -1.07 115.31 114.18 1h4m h LEU 20 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1h4m h LEU 20 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1h4m h LEU 20 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.99 1h4m n SER 21 N -4.21 4.35 -4.69 -0.43 3.41 -1.26 -4.94 113.62 105.84 1h4m n SER 21 Ca -0.00 -2.51 -0.42 0.00 -0.26 0.00 0.00 58.87 55.68 1h4m n SER 21 Cb 0.20 -0.57 -0.03 0.00 -0.26 0.00 0.00 64.21 63.55 1h4m n SER 21 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1h4m s ALA 22 N -2.03 3.60 0.32 7.33 0.00 -0.41 -4.89 121.76 125.69 1h4m s ALA 22 Ca 0.43 0.99 0.35 0.00 0.00 0.00 0.00 51.96 53.74 1h4m s ALA 22 Cb 0.30 -3.60 1.67 0.00 0.00 0.00 0.00 23.12 21.49 1h4m s ALA 22 CO 0.18 -0.87 2.11 -1.00 0.00 0.00 0.00 175.76 176.17 1h4m h PRO 23 N 7.67 0.00 -0.01 0.00 0.13 -1.92 -1.63 132.00 136.23 1h4m h PRO 23 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1h4m h PRO 23 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1h4m h PRO 23 CO 0.90 0.03 -0.16 -0.85 -0.23 0.00 0.00 178.00 177.69 1h4m n GLU 24 N -3.20 1.10 -2.27 0.86 0.00 -1.26 -4.89 120.64 110.98 1h4m n GLU 24 Ca -0.01 -0.62 -0.42 0.00 0.00 0.00 0.00 57.16 56.11 1h4m n GLU 24 Cb 0.23 -1.49 -0.03 0.00 0.00 0.00 0.00 31.44 30.16 1h4m n GLU 24 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 1h4m s LEU 25 N -2.33 4.33 -0.52 -1.84 2.96 -0.62 -0.89 118.68 119.78 1h4m s LEU 25 Ca 0.29 2.11 -0.03 0.00 -0.22 0.00 0.00 54.13 56.28 1h4m s LEU 25 Cb 0.20 -3.57 0.14 0.00 0.50 0.00 0.00 46.19 43.46 1h4m s LEU 25 CO 0.45 -0.66 0.33 -0.63 -1.32 0.00 0.00 176.35 174.52 1h4m s ILE 26 N 1.93 3.53 -0.23 6.68 1.01 0.04 -4.93 121.20 129.24 1h4m s ILE 26 Ca 0.62 -2.49 -0.21 0.00 0.00 0.00 0.00 60.65 58.57 1h4m s ILE 26 Cb -0.31 -3.36 -0.02 0.00 0.01 0.00 0.00 42.46 38.78 1h4m s ILE 26 CO 0.27 -0.79 0.67 -0.22 0.00 0.00 0.00 174.94 174.87 1h4m s LEU 27 N 0.56 4.10 -0.15 2.97 2.96 -1.26 -1.39 118.68 126.46 1h4m s LEU 27 Ca 0.12 0.82 -0.02 0.00 -0.22 0.00 0.00 54.13 54.83 1h4m s LEU 27 Cb -0.22 -2.93 -0.02 0.00 0.50 0.00 0.00 46.19 43.52 1h4m s LEU 27 CO -0.04 -0.36 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.86 1h4m s VAL 28 N 2.34 3.40 -0.22 1.68 1.01 0.18 0.08 120.40 128.87 1h4m s VAL 28 Ca 0.29 -0.53 -0.04 0.00 0.00 0.00 0.00 61.98 61.70 1h4m s VAL 28 Cb -0.16 -2.47 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 1h4m s VAL 28 CO 0.09 0.50 -0.02 -0.62 0.00 0.00 0.00 175.10 175.04 1h4m s ASP 29 N 0.55 4.45 -0.51 3.32 3.68 -0.22 -1.47 116.67 126.48 1h4m s ASP 29 Ca -0.06 -0.36 0.06 0.00 2.13 0.00 0.00 52.55 54.33 1h4m s ASP 29 Cb -0.15 -1.77 0.37 0.00 -1.45 0.00 0.00 42.92 39.92 1h4m s ASP 29 CO 0.03 -0.02 0.98 0.18 0.13 0.00 0.00 175.17 176.47 1h4m n LEU 30 N 4.79 4.06 0.00 -1.34 4.32 -0.22 -1.24 117.00 127.37 1h4m n LEU 30 Ca -0.18 -5.39 0.00 0.00 -0.02 0.00 0.00 56.01 50.42 1h4m n LEU 30 Cb 0.51 -0.36 0.00 0.00 -1.62 0.00 0.00 43.42 41.95 1h4m n LEU 30 CO 0.29 2.28 0.00 0.35 -1.22 0.00 0.00 177.39 179.09 1h4m n THR 31 N -0.26 0.00 -3.62 -5.08 -2.24 -1.26 -4.50 114.28 97.32 1h4m n THR 31 Ca 0.32 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 62.00 1h4m n THR 31 Cb 0.52 -0.13 -0.02 0.00 -2.10 0.00 0.00 70.33 68.60 1h4m n THR 31 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1h4m s SER 32 N -1.00 -0.41 0.18 3.42 1.04 -1.26 -4.72 113.70 110.95 1h4m s SER 32 Ca 0.00 -0.26 -0.13 0.00 0.48 0.00 0.00 55.95 56.04 1h4m s SER 32 Cb 0.00 0.63 0.15 0.00 0.10 0.00 0.00 66.02 66.89 1h4m s SER 32 CO 0.00 -1.08 1.78 0.00 0.98 0.00 0.00 173.24 174.92 1h4m h ALA 33 N 2.00 0.65 -0.16 5.32 0.00 -1.99 0.26 119.26 125.34 1h4m h ALA 33 Ca -0.27 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1h4m h ALA 33 Cb 1.28 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1h4m h ALA 33 CO 0.31 -0.11 0.10 0.00 0.00 0.00 0.00 179.25 179.55 1h4m h ALA 34 N 1.29 0.21 -0.45 0.00 0.00 -1.99 -1.06 119.26 117.25 1h4m h ALA 34 Ca 0.23 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1h4m h ALA 34 Cb 0.16 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1h4m h ALA 34 CO -0.17 -0.28 0.17 -0.09 0.00 0.00 0.00 179.25 178.88 1h4m h ARG 35 N 0.19 0.69 -0.90 0.00 9.65 -1.84 -0.03 114.38 122.13 1h4m h ARG 35 Ca 0.06 -0.13 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 1h4m h ARG 35 Cb 0.03 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 28.46 1h4m h ARG 35 CO -0.01 0.63 0.58 -0.92 2.80 0.00 0.00 179.97 183.05 1h4m h TYR 36 N 0.59 1.16 -0.49 2.20 3.20 -0.37 -2.21 116.97 121.06 1h4m h TYR 36 Ca 0.15 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.93 1h4m h TYR 36 Cb 0.21 -0.39 -0.02 0.00 1.54 0.00 0.00 36.73 38.07 1h4m h TYR 36 CO 0.00 0.75 -0.09 0.00 -1.64 0.00 0.00 178.16 177.18 1h4m h ALA 37 N 1.32 0.68 -0.44 1.82 0.00 -1.03 -3.05 119.26 118.56 1h4m h ALA 37 Ca 0.33 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1h4m h ALA 37 Cb -0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1h4m h ALA 37 CO -0.07 0.57 0.26 1.49 0.00 0.00 0.00 179.25 181.50 1h4m h GLU 38 N 0.79 0.59 0.00 0.00 4.81 -0.63 -3.45 114.58 116.69 1h4m h GLU 38 Ca 0.13 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1h4m h GLU 38 Cb 0.65 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1h4m h GLU 38 CO 0.04 0.42 0.00 0.41 -0.73 0.00 0.00 179.01 179.16 1h4m n GLY 39 N -1.38 2.52 3.74 1.92 0.00 -0.86 -4.87 105.19 106.25 1h4m n GLY 39 Ca 0.03 0.30 -0.30 0.00 0.00 0.00 0.00 46.02 46.05 1h4m n GLY 39 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1h4m s HIS 40 N 0.00 2.12 0.20 1.61 -3.43 -0.21 -4.68 115.29 110.90 1h4m s HIS 40 Ca 0.00 -0.81 -0.30 0.00 -0.80 0.00 0.00 55.06 53.15 1h4m s HIS 40 Cb 0.00 -1.75 -0.09 0.00 -1.43 0.00 0.00 32.58 29.32 1h4m s HIS 40 CO 0.00 0.20 1.34 0.42 -2.00 0.00 0.00 174.74 174.69 1h4m s ILE 41 N -2.78 3.12 0.14 -5.38 1.01 -1.26 -1.12 121.20 114.92 1h4m s ILE 41 Ca 0.22 0.92 -0.31 0.00 0.00 0.00 0.00 60.65 61.47 1h4m s ILE 41 Cb 0.04 -3.58 -0.11 0.00 0.01 0.00 0.00 42.46 38.81 1h4m s ILE 41 CO 0.12 0.14 1.82 -2.65 0.00 0.00 0.00 174.94 174.36 1h4m n PRO 42 N 2.63 2.78 -0.12 2.79 -0.02 -1.26 -0.91 135.00 140.90 1h4m n PRO 42 Ca 0.06 1.01 0.00 0.00 -2.02 0.00 0.00 63.50 62.55 1h4m n PRO 42 Cb 0.42 -2.90 0.00 0.00 -0.02 0.00 0.00 33.50 31.01 1h4m n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h4m n GLY 43 N 4.18 0.59 3.76 -1.23 0.00 -1.26 -4.99 105.19 106.23 1h4m n GLY 43 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1h4m n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h4m s ALA 44 N -2.31 3.56 -0.20 4.61 0.00 -0.08 -4.59 121.76 122.74 1h4m s ALA 44 Ca 0.00 1.30 -0.06 0.00 0.00 0.00 0.00 51.96 53.20 1h4m s ALA 44 Cb 0.00 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.57 1h4m s ALA 44 CO 0.00 -0.70 0.03 1.03 0.00 0.00 0.00 175.76 176.12 1h4m s ARG 45 N -1.07 3.74 -0.06 0.00 0.52 0.11 -4.63 118.95 117.57 1h4m s ARG 45 Ca 0.54 -0.46 -0.30 0.00 -0.52 0.00 0.00 55.73 55.00 1h4m s ARG 45 Cb -0.41 -3.16 -0.02 0.00 0.52 0.00 0.00 34.95 31.88 1h4m s ARG 45 CO 0.48 0.07 1.07 0.12 0.02 0.00 0.00 175.30 177.06 1h4m s PHE 46 N 0.88 3.46 -0.30 -0.53 5.36 -1.26 -1.05 117.98 124.53 1h4m s PHE 46 Ca 0.02 1.50 0.01 0.00 -0.96 0.00 0.00 56.93 57.50 1h4m s PHE 46 Cb -0.14 -3.25 0.09 0.00 -0.34 0.00 0.00 43.02 39.38 1h4m s PHE 46 CO 0.02 -0.54 0.04 0.08 -1.46 0.00 0.00 175.22 173.36 1h4m s VAL 47 N 1.77 1.56 0.23 3.12 1.01 -0.38 -4.95 120.40 122.77 1h4m s VAL 47 Ca 0.52 -1.70 -0.32 0.00 0.00 0.00 0.00 61.98 60.48 1h4m s VAL 47 Cb -0.21 -2.07 -0.12 0.00 0.00 0.00 0.00 36.38 33.97 1h4m s VAL 47 CO 0.22 -0.50 1.65 -0.67 0.00 0.00 0.00 175.10 175.80 1h4m n ASP 48 N 4.58 3.77 -0.33 3.32 -0.08 -1.26 -4.40 116.55 122.14 1h4m n ASP 48 Ca -0.02 1.10 0.13 0.00 -1.51 0.00 0.00 54.79 54.48 1h4m n ASP 48 Cb 0.43 -1.55 0.31 0.00 2.34 0.00 0.00 41.12 42.65 1h4m n ASP 48 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1h4m h PRO 49 N 5.87 0.63 -0.80 -0.67 0.11 -1.85 0.60 132.00 135.89 1h4m h PRO 49 Ca -0.45 -0.04 0.21 0.00 0.11 0.00 0.00 66.00 65.84 1h4m h PRO 49 Cb 1.22 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.15 1h4m h PRO 49 CO 0.88 0.42 0.56 0.87 -0.21 0.00 0.00 178.00 180.52 1h4m h LYS 50 N 0.65 0.12 0.00 1.05 1.57 -1.96 -1.65 116.57 116.36 1h4m h LYS 50 Ca 0.57 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.34 1h4m h LYS 50 Cb 0.94 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.23 1h4m h LYS 50 CO -0.42 0.08 0.00 0.54 -0.57 0.00 0.00 179.45 179.08 1h4m n ARG 51 N -4.37 0.15 0.00 3.15 1.74 0.21 -2.55 116.66 114.99 1h4m n ARG 51 Ca 0.16 0.19 0.12 0.00 -0.77 0.00 0.00 57.85 57.55 1h4m n ARG 51 Cb 0.79 -1.50 0.22 0.00 -1.02 0.00 0.00 32.46 30.94 1h4m n ARG 51 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1h4m n THR 52 N -1.32 0.00 -5.27 0.55 -2.24 -0.62 -4.81 114.28 100.57 1h4m n THR 52 Ca 0.05 -0.21 -0.31 0.00 -2.27 0.00 0.00 64.05 61.31 1h4m n THR 52 Cb 0.10 0.82 -0.16 0.00 -2.10 0.00 0.00 70.33 68.99 1h4m n THR 52 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1h4m s GLN 53 N -2.43 2.08 0.16 -0.78 -0.21 -1.06 -4.20 119.66 113.22 1h4m s GLN 53 Ca 0.23 -0.95 -0.16 0.00 0.02 0.00 0.00 55.36 54.51 1h4m s GLN 53 Cb 0.19 -2.03 0.08 0.00 1.00 0.00 0.00 33.01 32.24 1h4m s GLN 53 CO 0.52 0.56 1.74 1.25 -2.12 0.00 0.00 175.29 177.23 1h4m h LEU 54 N 5.43 0.08 0.97 2.90 5.85 -0.67 -3.42 115.31 126.46 1h4m h LEU 54 Ca -0.43 0.05 -0.24 0.00 0.84 0.00 0.00 57.88 58.10 1h4m h LEU 54 Cb 1.12 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.14 1h4m h LEU 54 CO 0.47 0.08 -0.25 0.61 -0.34 0.00 0.00 178.44 179.01 1h4m n GLY 55 N -1.23 0.77 3.21 3.75 0.00 -0.23 -4.95 105.19 106.51 1h4m n GLY 55 Ca 0.02 -0.45 -0.22 0.00 0.00 0.00 0.00 46.02 45.37 1h4m n GLY 55 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1h4m s GLN 56 N -3.58 1.06 0.76 1.61 2.00 -1.26 -4.95 119.66 115.29 1h4m s GLN 56 Ca 0.00 -0.94 -0.11 0.00 -2.00 0.00 0.00 55.36 52.31 1h4m s GLN 56 Cb 0.00 -1.16 0.05 0.00 0.80 0.00 0.00 33.01 32.70 1h4m s GLN 56 CO 0.00 0.28 1.09 -1.25 -0.50 0.00 0.00 175.29 174.91 1h4m s PRO 57 N -1.46 2.36 0.00 1.67 0.04 -1.26 -2.40 135.00 133.95 1h4m s PRO 57 Ca 0.03 1.17 0.26 0.00 0.04 0.00 0.00 61.00 62.50 1h4m s PRO 57 Cb -0.09 -1.91 0.81 0.00 0.04 0.00 0.00 34.50 33.35 1h4m s PRO 57 CO 0.02 -1.56 1.60 -0.35 0.04 0.00 0.00 177.00 176.75 1h4m n PRO 58 N -3.39 1.84 -3.61 0.56 -0.04 -1.26 -4.89 135.00 124.21 1h4m n PRO 58 Ca 0.09 -1.24 -0.29 0.00 -0.04 0.00 0.00 63.50 62.03 1h4m n PRO 58 Cb 0.53 -1.46 -0.12 0.00 -0.04 0.00 0.00 33.50 32.40 1h4m n PRO 58 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1h4m s ALA 59 N -1.94 1.91 0.13 0.55 0.00 -1.20 -4.50 121.76 116.71 1h4m s ALA 59 Ca 0.35 -2.54 0.34 0.00 0.00 0.00 0.00 51.96 50.10 1h4m s ALA 59 Cb 0.20 -1.79 1.39 0.00 0.00 0.00 0.00 23.12 22.92 1h4m s ALA 59 CO 0.32 -2.06 1.99 -1.00 0.00 0.00 0.00 175.76 175.01 1h4m h PRO 60 N 6.41 0.00 0.00 0.00 0.13 -1.80 -2.87 132.00 133.86 1h4m h PRO 60 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1h4m h PRO 60 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1h4m h PRO 60 CO 0.44 0.01 0.00 0.41 -0.23 0.00 0.00 178.00 178.63 1h4m n GLY 61 N -0.01 -1.00 3.69 1.56 0.00 -1.26 -1.07 105.19 107.10 1h4m n GLY 61 Ca 0.00 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 1h4m n GLY 61 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h4m s LEU 62 N -2.49 2.51 0.75 0.99 1.43 -1.08 -4.64 118.68 116.15 1h4m s LEU 62 Ca 0.23 1.85 -0.14 0.00 -1.03 0.00 0.00 54.13 55.04 1h4m s LEU 62 Cb 0.15 -4.27 0.05 0.00 0.03 0.00 0.00 46.19 42.16 1h4m s LEU 62 CO 0.34 -2.84 1.20 0.00 0.23 0.00 0.00 176.35 175.27 1h4m s GLN 63 N -4.76 2.04 0.86 1.70 -2.07 -1.26 -0.81 119.66 115.36 1h4m s GLN 63 Ca 0.65 1.72 -0.11 0.00 -1.82 0.00 0.00 55.36 55.80 1h4m s GLN 63 Cb -0.20 -1.83 0.11 0.00 -1.09 0.00 0.00 33.01 30.00 1h4m s GLN 63 CO 0.58 -1.90 1.11 -2.14 -1.32 0.00 0.00 175.29 171.61 1h4m s PRO 64 N -4.01 1.50 0.82 9.60 0.02 -1.26 -3.93 135.00 137.75 1h4m s PRO 64 Ca 0.73 1.21 -0.11 0.00 0.02 0.00 0.00 61.00 62.85 1h4m s PRO 64 Cb -0.28 -1.81 0.09 0.00 0.02 0.00 0.00 34.50 32.52 1h4m s PRO 64 CO 0.47 -2.18 1.13 -2.14 -0.33 0.00 0.00 177.00 173.95 1h4m s PRO 65 N -4.80 1.75 0.27 5.54 0.02 -1.26 -4.75 135.00 131.77 1h4m s PRO 65 Ca 0.64 1.42 -0.01 0.00 0.02 0.00 0.00 61.00 63.07 1h4m s PRO 65 Cb -0.19 -1.82 0.59 0.00 0.02 0.00 0.00 34.50 33.10 1h4m s PRO 65 CO 0.57 -2.06 1.67 -0.09 -0.33 0.00 0.00 177.00 176.76 1h4m h ARG 66 N -1.25 0.27 -0.03 5.54 2.43 -1.98 -1.28 114.38 118.07 1h4m h ARG 66 Ca -0.44 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 1h4m h ARG 66 Cb 1.26 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1h4m h ARG 66 CO 0.47 0.18 0.00 1.49 -1.51 0.00 0.00 179.97 180.60 1h4m h GLU 67 N 0.28 0.02 -0.80 0.20 4.81 -1.99 0.26 114.58 117.35 1h4m h GLU 67 Ca 0.49 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.71 1h4m h GLU 67 Cb 0.91 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.24 1h4m h GLU 67 CO -0.57 0.01 0.45 1.96 -0.73 0.00 0.00 179.01 180.13 1h4m h GLN 68 N 0.02 1.11 -0.74 1.92 7.50 -1.81 -1.98 115.11 121.12 1h4m h GLN 68 Ca 0.01 -0.12 -0.03 0.00 0.50 0.00 0.00 58.65 59.01 1h4m h GLN 68 Cb 0.01 -0.22 -0.03 0.00 0.05 0.00 0.00 27.48 27.29 1h4m h GLN 68 CO -0.02 0.81 0.33 -0.07 -1.50 0.00 0.00 178.83 178.38 1h4m h LEU 69 N 1.11 0.98 -0.44 1.46 3.38 -0.34 -0.73 115.31 120.73 1h4m h LEU 69 Ca 0.28 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 58.04 1h4m h LEU 69 Cb 0.01 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1h4m h LEU 69 CO -0.05 0.85 -0.07 -0.33 0.09 0.00 0.00 178.44 178.94 1h4m h GLU 70 N 1.06 0.82 -0.44 1.13 5.08 0.19 -0.96 114.58 121.47 1h4m h GLU 70 Ca 0.25 -0.30 -0.11 0.00 -1.00 0.00 0.00 59.36 58.20 1h4m h GLU 70 Cb 0.16 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1h4m h GLU 70 CO -0.03 0.92 -0.16 0.77 -1.00 0.00 0.00 179.01 179.51 1h4m h SER 71 N 0.65 0.90 0.27 1.42 0.02 -1.30 0.11 113.55 115.62 1h4m h SER 71 Ca 0.12 -0.39 -0.01 0.00 -0.84 0.00 0.00 61.79 60.67 1h4m h SER 71 Cb 0.59 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1h4m h SER 71 CO 0.04 1.08 -0.13 0.25 -1.14 0.00 0.00 176.83 176.93 1h4m h LEU 72 N 0.71 -0.31 -1.08 5.07 5.85 -0.92 0.37 115.31 125.00 1h4m h LEU 72 Ca 0.10 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.72 1h4m h LEU 72 Cb 0.72 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 1h4m h LEU 72 CO 0.05 -0.19 -0.37 -0.26 -0.34 0.00 0.00 178.44 177.34 1h4m h PHE 73 N -0.39 0.19 -0.59 1.25 0.04 -1.23 -0.88 116.94 115.32 1h4m h PHE 73 Ca -0.04 -0.05 -0.04 0.00 2.80 0.00 0.00 57.97 60.65 1h4m h PHE 73 Cb 0.30 -0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.38 1h4m h PHE 73 CO -0.05 0.52 0.22 0.78 -0.60 0.00 0.00 178.31 179.18 1h4m h GLY 74 N 1.15 0.97 0.77 -1.45 0.00 -0.61 -2.11 103.07 101.78 1h4m h GLY 74 Ca 0.02 -0.54 0.04 0.00 0.00 0.00 0.00 47.33 46.84 1h4m h GLY 74 CO 0.05 0.51 0.21 0.83 0.00 0.00 0.00 176.54 178.14 1h4m h GLU 75 N 0.83 0.41 0.00 4.80 5.08 0.57 -2.39 114.58 123.88 1h4m h GLU 75 Ca 0.20 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1h4m h GLU 75 Cb 0.23 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1h4m h GLU 75 CO -0.01 0.27 0.00 -0.07 -1.00 0.00 0.00 179.01 178.20 1h4m h LEU 76 N 0.42 0.00 0.00 1.33 3.38 -1.00 0.15 115.31 119.59 1h4m h LEU 76 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1h4m h LEU 76 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1h4m h LEU 76 CO -0.14 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.00 1h4m n GLY 77 N -0.38 0.84 3.54 0.83 0.00 -0.93 -4.71 105.19 104.39 1h4m n GLY 77 Ca 0.01 -0.51 -0.54 0.00 0.00 0.00 0.00 46.02 44.97 1h4m n GLY 77 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1h4m n HIS 78 N -2.49 1.01 -3.58 1.61 -0.00 -0.82 -4.93 115.22 106.02 1h4m n HIS 78 Ca 0.00 0.83 -0.06 0.00 0.46 0.00 0.00 57.72 58.95 1h4m n HIS 78 Cb 0.07 -2.20 -0.02 0.00 -0.12 0.00 0.00 29.99 27.72 1h4m n HIS 78 CO 0.00 0.00 0.00 -0.98 0.46 0.00 0.00 176.34 175.82 1h4m s ARG 79 N 0.06 0.80 0.39 1.57 1.70 -1.26 -4.92 118.95 117.28 1h4m s ARG 79 Ca 0.84 -0.34 0.09 0.00 -0.47 0.00 0.00 55.73 55.84 1h4m s ARG 79 Cb -1.06 0.33 0.85 0.00 -0.57 0.00 0.00 34.95 34.50 1h4m s ARG 79 CO 0.52 -0.35 1.97 -1.35 -1.08 0.00 0.00 175.30 175.00 1h4m h PRO 80 N 2.00 0.61 0.00 3.89 0.11 -2.03 -2.03 132.00 134.55 1h4m h PRO 80 Ca -0.21 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1h4m h PRO 80 Cb 1.23 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1h4m h PRO 80 CO 0.28 0.40 -0.49 -0.85 -0.21 0.00 0.00 178.00 177.13 1h4m n GLU 81 N -4.48 0.21 -1.53 1.05 0.00 -1.26 -4.94 120.64 109.68 1h4m n GLU 81 Ca 0.10 0.07 -0.44 0.00 0.00 0.00 0.00 57.16 56.90 1h4m n GLU 81 Cb 0.28 -1.65 -0.01 0.00 0.00 0.00 0.00 31.44 30.06 1h4m n GLU 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1h4m n ALA 82 N -1.73 -0.92 -3.88 -1.84 0.00 -0.77 -4.86 120.51 106.50 1h4m n ALA 82 Ca 0.04 0.33 -0.26 0.00 0.00 0.00 0.00 53.44 53.55 1h4m n ALA 82 Cb 0.41 -1.90 -0.17 0.00 0.00 0.00 0.00 19.45 17.79 1h4m n ALA 82 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1h4m s VAL 83 N -1.17 0.94 0.12 0.00 1.01 -0.07 -4.70 120.40 116.54 1h4m s VAL 83 Ca 0.61 -0.27 -0.23 0.00 0.00 0.00 0.00 61.98 62.09 1h4m s VAL 83 Cb -0.70 -1.00 -0.07 0.00 0.00 0.00 0.00 36.38 34.60 1h4m s VAL 83 CO 0.59 0.32 0.68 -0.31 0.00 0.00 0.00 175.10 176.38 1h4m s TYR 84 N 1.74 3.86 -0.07 5.22 1.51 -0.91 -0.78 117.35 127.91 1h4m s TYR 84 Ca 0.05 1.46 0.05 0.00 -1.01 0.00 0.00 57.07 57.61 1h4m s TYR 84 Cb -0.13 -2.64 -0.00 0.00 -0.11 0.00 0.00 41.96 39.08 1h4m s TYR 84 CO -0.08 0.54 -0.22 0.08 -1.11 0.00 0.00 175.55 174.77 1h4m s VAL 85 N -1.09 1.84 -0.02 0.71 1.01 -0.48 -0.09 120.40 122.27 1h4m s VAL 85 Ca 0.33 -0.93 0.06 0.00 0.00 0.00 0.00 61.98 61.44 1h4m s VAL 85 Cb -0.21 -1.58 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 1h4m s VAL 85 CO 0.23 0.51 -0.21 -0.69 0.00 0.00 0.00 175.10 174.94 1h4m s VAL 86 N 0.11 1.68 0.13 2.92 1.01 -0.43 -0.65 120.40 125.18 1h4m s VAL 86 Ca -0.10 -0.90 -0.09 0.00 0.00 0.00 0.00 61.98 60.89 1h4m s VAL 86 Cb -0.15 -1.40 -0.00 0.00 0.00 0.00 0.00 36.38 34.82 1h4m s VAL 86 CO 0.05 0.48 0.26 -0.72 0.00 0.00 0.00 175.10 175.16 1h4m s TYR 87 N -0.41 0.27 0.00 5.22 -0.85 -0.54 -1.76 117.35 119.28 1h4m s TYR 87 Ca 0.06 -0.65 0.00 0.00 -0.52 0.00 0.00 57.07 55.95 1h4m s TYR 87 Cb -0.09 -0.04 0.00 0.00 0.38 0.00 0.00 41.96 42.21 1h4m s TYR 87 CO -0.00 -0.66 0.00 -0.40 -1.52 0.00 0.00 175.55 172.97 1h4m n ASP 88 N -0.16 0.00 -0.56 -0.18 5.68 -1.26 -1.05 116.55 119.02 1h4m n ASP 88 Ca -0.11 -0.40 0.06 0.00 -0.50 0.00 0.00 54.79 53.84 1h4m n ASP 88 Cb 0.63 0.00 0.11 0.00 -1.14 0.00 0.00 41.12 40.72 1h4m n ASP 88 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1h4m n ASP 89 N -1.11 1.46 -0.19 -1.12 5.75 -1.26 -0.97 116.55 119.10 1h4m n ASP 89 Ca 0.00 -2.92 0.06 0.00 -0.01 0.00 0.00 54.79 51.92 1h4m n ASP 89 Cb 0.00 -0.39 0.09 0.00 -1.03 0.00 0.00 41.12 39.79 1h4m n ASP 89 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 1h4m n GLU 90 N -0.72 0.97 -0.45 0.11 0.28 -1.26 -4.74 120.64 114.82 1h4m n GLU 90 Ca 0.12 -2.01 0.00 0.00 -0.16 0.00 0.00 57.16 55.11 1h4m n GLU 90 Cb 0.75 -1.16 0.00 0.00 1.43 0.00 0.00 31.44 32.47 1h4m n GLU 90 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1h4m n GLY 91 N -0.94 0.75 0.00 -1.84 0.00 -1.26 -4.48 105.19 97.42 1h4m n GLY 91 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1h4m n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h4m n GLY 92 N -2.19 0.95 0.16 -0.02 0.00 -1.26 -4.91 105.19 97.92 1h4m n GLY 92 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1h4m n GLY 92 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1h4m h GLY 93 N 0.00 -0.32 1.34 -0.02 0.00 -1.82 0.24 103.07 102.49 1h4m h GLY 93 Ca 0.00 0.12 -0.15 0.00 0.00 0.00 0.00 47.33 47.30 1h4m h GLY 93 CO 0.00 -0.12 -0.40 1.49 0.00 0.00 0.00 176.54 177.51 1h4m h TRP 94 N -0.61 0.86 -0.90 5.60 4.06 -1.90 -1.11 115.95 121.95 1h4m h TRP 94 Ca -0.03 -0.26 0.02 0.00 2.06 0.00 0.00 58.89 60.69 1h4m h TRP 94 Cb 0.44 -0.18 -0.05 0.00 -1.00 0.00 0.00 29.16 28.37 1h4m h TRP 94 CO 0.02 1.01 0.59 0.00 -3.56 0.00 0.00 178.44 176.50 1h4m h ALA 95 N 0.96 1.17 -0.12 1.49 0.00 -1.82 -0.23 119.26 120.71 1h4m h ALA 95 Ca 0.05 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1h4m h ALA 95 Cb 0.94 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1h4m h ALA 95 CO 0.09 0.49 -0.46 0.78 0.00 0.00 0.00 179.25 180.15 1h4m h GLY 96 N 1.18 0.31 1.33 0.00 0.00 -0.67 -1.40 103.07 103.83 1h4m h GLY 96 Ca 0.35 -0.32 -0.15 0.00 0.00 0.00 0.00 47.33 47.21 1h4m h GLY 96 CO -0.10 0.29 -0.40 -0.09 0.00 0.00 0.00 176.54 176.24 1h4m h ARG 97 N 0.24 0.73 -0.39 4.80 2.43 -0.75 -1.26 114.38 120.18 1h4m h ARG 97 Ca 0.02 -0.38 -0.07 0.00 -0.81 0.00 0.00 59.98 58.74 1h4m h ARG 97 Cb 0.90 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.44 1h4m h ARG 97 CO 0.07 1.00 -0.03 0.35 -1.51 0.00 0.00 179.97 179.85 1h4m h PHE 98 N 0.60 0.67 -0.31 2.20 3.57 -0.62 -1.32 116.94 121.75 1h4m h PHE 98 Ca 0.05 -0.09 -0.10 0.00 3.53 0.00 0.00 57.97 61.37 1h4m h PHE 98 Cb 0.94 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 1h4m h PHE 98 CO 0.05 0.66 -0.21 0.82 -2.23 0.00 0.00 178.31 177.40 1h4m h ILE 99 N 0.60 1.26 -0.25 1.41 2.04 -0.73 0.26 117.51 122.10 1h4m h ILE 99 Ca 0.12 -1.23 -0.06 0.00 1.00 0.00 0.00 64.86 64.69 1h4m h ILE 99 Cb 0.43 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1h4m h ILE 99 CO 0.02 0.40 -0.09 -0.25 0.00 0.00 0.00 178.15 178.23 1h4m h TRP 100 N 0.51 0.43 -0.51 1.37 7.01 -0.48 -0.72 115.95 123.56 1h4m h TRP 100 Ca 0.08 -0.05 -0.10 0.00 2.11 0.00 0.00 58.89 60.93 1h4m h TRP 100 Cb 0.65 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 27.57 1h4m h TRP 100 CO 0.02 0.50 -0.09 -0.07 -2.79 0.00 0.00 178.44 176.02 1h4m h LEU 101 N 0.38 0.92 -0.37 0.65 3.38 -0.10 -0.62 115.31 119.56 1h4m h LEU 101 Ca 0.08 -0.28 0.03 0.00 0.09 0.00 0.00 57.88 57.79 1h4m h LEU 101 Cb 0.40 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1h4m h LEU 101 CO 0.02 1.03 0.18 -0.07 0.09 0.00 0.00 178.44 179.69 1h4m h LEU 102 N 0.84 0.27 -1.62 1.67 3.38 -0.25 0.16 115.31 119.75 1h4m h LEU 102 Ca 0.14 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.14 1h4m h LEU 102 Cb 0.61 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1h4m h LEU 102 CO 0.04 0.20 0.27 0.44 0.09 0.00 0.00 178.44 179.47 1h4m h ASP 103 N 0.37 0.44 0.29 -0.43 3.45 -0.86 -1.74 116.42 117.94 1h4m h ASP 103 Ca 0.15 -0.01 -0.09 0.00 0.43 0.00 0.00 57.03 57.52 1h4m h ASP 103 Cb 0.06 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 38.71 1h4m h ASP 103 CO -0.11 0.32 -0.36 0.58 -1.57 0.00 0.00 179.24 178.09 1h4m h VAL 104 N 0.52 1.28 -0.56 -1.35 2.07 0.72 -2.99 116.25 115.93 1h4m h VAL 104 Ca 0.15 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.34 1h4m h VAL 104 Cb -0.02 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1h4m h VAL 104 CO -0.03 0.39 0.00 2.30 0.02 0.00 0.00 177.57 180.25 1h4m n ILE 105 N -4.08 0.74 -0.59 4.57 -5.35 0.33 -0.51 119.36 114.47 1h4m n ILE 105 Ca -0.02 -0.83 0.00 0.00 -0.27 0.00 0.00 62.75 61.63 1h4m n ILE 105 Cb 0.42 0.64 0.00 0.00 -1.74 0.00 0.00 39.64 38.96 1h4m n ILE 105 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1h4m n GLY 106 N 1.55 0.74 3.72 3.28 0.00 -0.73 -4.68 105.19 109.07 1h4m n GLY 106 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1h4m n GLY 106 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1h4m s GLN 107 N -0.41 4.31 -0.11 1.61 2.00 -0.77 -4.92 119.66 121.37 1h4m s GLN 107 Ca 0.00 2.10 0.06 0.00 -2.00 0.00 0.00 55.36 55.52 1h4m s GLN 107 Cb 0.00 -3.25 -0.24 0.00 0.80 0.00 0.00 33.01 30.33 1h4m s GLN 107 CO 0.00 -0.45 0.39 1.04 -0.50 0.00 0.00 175.29 175.77 1h4m n GLN 108 N 3.98 0.68 -3.61 1.67 1.13 -1.26 -4.45 117.38 115.52 1h4m n GLN 108 Ca 0.12 0.23 -0.39 0.00 -1.94 0.00 0.00 57.00 55.02 1h4m n GLN 108 Cb 0.42 -1.70 -0.11 0.00 0.11 0.00 0.00 30.24 28.96 1h4m n GLN 108 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1h4m s ARG 109 N -2.56 3.51 0.25 -1.09 0.52 -1.26 -5.04 118.95 113.28 1h4m s ARG 109 Ca -0.14 -0.62 -0.22 0.00 -0.52 0.00 0.00 55.73 54.24 1h4m s ARG 109 Cb 0.07 -3.65 0.03 0.00 0.52 0.00 0.00 34.95 31.92 1h4m s ARG 109 CO 0.78 -0.38 0.72 1.52 0.02 0.00 0.00 175.30 177.97 1h4m s TYR 110 N 1.68 -0.24 -0.01 -0.53 -0.85 -1.26 -2.15 117.35 114.00 1h4m s TYR 110 Ca 0.06 -0.18 -0.13 0.00 -0.52 0.00 0.00 57.07 56.29 1h4m s TYR 110 Cb -0.17 0.68 0.02 0.00 0.38 0.00 0.00 41.96 42.87 1h4m s TYR 110 CO 0.08 -1.16 0.28 -1.01 -1.52 0.00 0.00 175.55 172.22 1h4m s HIS 111 N -3.86 -0.13 -0.18 -3.49 3.76 0.87 -4.79 115.29 107.46 1h4m s HIS 111 Ca 0.10 0.17 -0.06 0.00 -0.15 0.00 0.00 55.06 55.11 1h4m s HIS 111 Cb -0.05 0.07 -0.04 0.00 1.11 0.00 0.00 32.58 33.67 1h4m s HIS 111 CO 0.04 -0.38 0.04 -0.47 -0.85 0.00 0.00 174.74 173.12 1h4m s TYR 112 N -1.43 3.17 -0.49 1.40 6.04 -0.08 -1.32 117.35 124.64 1h4m s TYR 112 Ca -0.13 -0.08 -0.28 0.00 0.04 0.00 0.00 57.07 56.61 1h4m s TYR 112 Cb -0.05 -2.07 0.01 0.00 -1.04 0.00 0.00 41.96 38.81 1h4m s TYR 112 CO 0.03 0.04 1.40 -1.17 -1.54 0.00 0.00 175.55 174.31 1h4m s LEU 113 N 0.53 3.49 -0.05 6.97 2.96 -0.72 -0.78 118.68 131.07 1h4m s LEU 113 Ca 0.02 0.52 -0.34 0.00 -0.22 0.00 0.00 54.13 54.11 1h4m s LEU 113 Cb -0.13 -3.29 -0.12 0.00 0.50 0.00 0.00 46.19 43.15 1h4m s LEU 113 CO 0.01 -1.57 1.85 -3.20 -1.32 0.00 0.00 176.35 172.12 1h4m n ASN 114 N 9.17 3.43 0.00 3.68 5.15 0.03 0.24 115.26 136.95 1h4m n ASN 114 Ca 0.14 0.98 0.00 0.00 -0.60 0.00 0.00 54.58 55.11 1h4m n ASN 114 Cb 0.49 -1.38 0.00 0.00 -0.53 0.00 0.00 39.78 38.35 1h4m n ASN 114 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1h4m n GLY 115 N 4.28 1.93 7.00 8.20 0.00 -1.26 -4.67 105.19 120.68 1h4m n GLY 115 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1h4m n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h4m n GLY 116 N -2.00 1.17 0.32 -0.02 0.00 0.14 -1.11 105.19 103.68 1h4m n GLY 116 Ca 0.00 -0.54 0.08 0.00 0.00 0.00 0.00 46.02 45.56 1h4m n GLY 116 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1h4m h LEU 117 N 0.00 0.33 -0.37 0.99 5.85 -1.37 -2.08 115.31 118.65 1h4m h LEU 117 Ca 0.00 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.74 1h4m h LEU 117 Cb 0.00 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 1h4m h LEU 117 CO 0.00 0.22 0.19 0.74 -0.34 0.00 0.00 178.44 179.25 1h4m h THR 118 N 0.38 0.98 -0.70 1.05 2.02 -1.61 0.94 112.91 115.98 1h4m h THR 118 Ca 0.17 -0.13 -0.07 0.00 0.77 0.00 0.00 66.41 67.15 1h4m h THR 118 Cb 0.21 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 1h4m h THR 118 CO -0.04 0.07 0.16 0.00 0.37 0.00 0.00 175.52 176.08 1h4m h ALA 119 N 1.19 0.92 -0.48 6.16 0.00 -0.68 -1.67 119.26 124.70 1h4m h ALA 119 Ca 0.16 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1h4m h ALA 119 Cb 0.06 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1h4m h ALA 119 CO -0.11 0.66 0.18 2.35 0.00 0.00 0.00 179.25 182.33 1h4m h TRP 120 N 1.06 0.75 -0.44 0.00 2.91 -0.92 -2.79 115.95 116.53 1h4m h TRP 120 Ca 0.22 -0.07 -0.11 0.00 1.13 0.00 0.00 58.89 60.06 1h4m h TRP 120 Cb 0.39 -0.22 -0.02 0.00 -0.51 0.00 0.00 29.16 28.80 1h4m h TRP 120 CO 0.03 0.65 -0.18 -0.07 -1.03 0.00 0.00 178.44 177.84 1h4m h LEU 121 N 0.64 0.86 -1.98 0.65 3.38 -0.68 -2.18 115.31 116.01 1h4m h LEU 121 Ca 0.16 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1h4m h LEU 121 Cb 0.23 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1h4m h LEU 121 CO -0.01 1.02 -0.10 0.00 0.09 0.00 0.00 178.44 179.44 1h4m h ALA 122 N 1.04 1.47 -0.63 1.53 0.00 -1.05 -0.72 119.26 120.90 1h4m h ALA 122 Ca 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1h4m h ALA 122 Cb 0.70 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1h4m h ALA 122 CO 0.05 0.13 0.00 0.39 0.00 0.00 0.00 179.25 179.82 1h4m n GLU 123 N -3.89 2.45 -3.00 0.00 1.02 -1.07 -4.96 120.64 111.19 1h4m n GLU 123 Ca -0.02 -2.26 -0.20 0.00 -0.02 0.00 0.00 57.16 54.66 1h4m n GLU 123 Cb 0.20 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.13 1h4m n GLU 123 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1h4m n ASP 124 N 1.34 -4.37 -4.79 1.62 2.03 -0.28 -4.97 116.55 107.13 1h4m n ASP 124 Ca 0.21 -0.19 -0.30 0.00 0.52 0.00 0.00 54.79 55.03 1h4m n ASP 124 Cb 0.53 -3.61 0.10 0.00 -0.72 0.00 0.00 41.12 37.42 1h4m n ASP 124 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1h4m s ARG 125 N -5.63 1.88 0.46 -0.67 0.52 -0.84 -4.96 118.95 109.70 1h4m s ARG 125 Ca 0.25 0.64 -0.25 0.00 -0.52 0.00 0.00 55.73 55.86 1h4m s ARG 125 Cb -0.13 -1.89 -0.08 0.00 0.52 0.00 0.00 34.95 33.37 1h4m s ARG 125 CO 0.31 -1.76 1.38 -2.14 0.02 0.00 0.00 175.30 173.11 1h4m s PRO 126 N -5.13 3.66 0.15 3.54 0.02 -1.26 -4.89 135.00 131.09 1h4m s PRO 126 Ca 0.61 2.31 0.09 0.00 0.02 0.00 0.00 61.00 64.03 1h4m s PRO 126 Cb -0.15 -2.60 -0.04 0.00 0.02 0.00 0.00 34.50 31.73 1h4m s PRO 126 CO 0.55 -0.80 -0.19 -0.51 -0.33 0.00 0.00 177.00 175.71 1h4m s LEU 127 N -2.80 2.41 0.06 -5.54 1.43 -1.26 -4.40 118.68 108.57 1h4m s LEU 127 Ca 0.62 -0.83 0.04 0.00 -1.03 0.00 0.00 54.13 52.93 1h4m s LEU 127 Cb -0.41 -0.85 -0.03 0.00 0.03 0.00 0.00 46.19 44.93 1h4m s LEU 127 CO 0.52 -0.01 -0.12 -0.55 0.23 0.00 0.00 176.35 176.43 1h4m s SER 128 N -2.51 1.37 -0.07 2.29 0.15 -0.28 -4.90 113.70 109.76 1h4m s SER 128 Ca 0.14 -0.60 0.11 0.00 0.70 0.00 0.00 55.95 56.30 1h4m s SER 128 Cb -0.07 -0.02 0.23 0.00 -1.71 0.00 0.00 66.02 64.46 1h4m s SER 128 CO 0.06 -0.13 1.16 0.54 1.20 0.00 0.00 173.24 176.07 1h4m n ARG 129 N 1.33 2.42 -3.47 5.44 1.74 -1.26 -1.05 116.66 121.80 1h4m n ARG 129 Ca -0.22 -2.15 -0.33 0.00 -0.77 0.00 0.00 57.85 54.38 1h4m n ARG 129 Cb 0.54 -1.34 -0.05 0.00 -1.02 0.00 0.00 32.46 30.59 1h4m n ARG 129 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1h4m s GLU 130 N -1.89 3.80 -0.23 5.56 2.12 -1.26 -4.98 118.70 121.82 1h4m s GLU 130 Ca 0.21 0.25 -0.11 0.00 0.36 0.00 0.00 54.97 55.67 1h4m s GLU 130 Cb 0.16 -2.80 -0.05 0.00 0.26 0.00 0.00 34.13 31.71 1h4m s GLU 130 CO 0.05 0.42 0.18 -0.51 -0.54 0.00 0.00 175.26 174.86 1h4m s LEU 131 N -2.45 4.14 0.70 2.70 1.43 -1.26 -4.84 118.68 119.09 1h4m s LEU 131 Ca 0.42 0.17 -0.17 0.00 -1.03 0.00 0.00 54.13 53.53 1h4m s LEU 131 Cb -0.13 -2.15 0.02 0.00 0.03 0.00 0.00 46.19 43.97 1h4m s LEU 131 CO 0.21 0.07 1.27 -2.84 0.23 0.00 0.00 176.35 175.29 1h4m s PRO 132 N 0.97 2.26 0.03 1.29 0.02 -1.26 -4.95 135.00 133.36 1h4m s PRO 132 Ca 0.09 1.99 -0.30 0.00 0.02 0.00 0.00 61.00 62.79 1h4m s PRO 132 Cb -0.13 -1.82 -0.05 0.00 0.02 0.00 0.00 34.50 32.52 1h4m s PRO 132 CO 0.04 -1.80 1.18 0.00 -0.33 0.00 0.00 177.00 176.08 1h4m s ALA 133 N -1.60 3.39 0.69 -1.55 0.00 -1.26 -5.02 121.76 116.41 1h4m s ALA 133 Ca 0.80 0.77 -0.17 0.00 0.00 0.00 0.00 51.96 53.36 1h4m s ALA 133 Cb -0.35 -3.45 -0.02 0.00 0.00 0.00 0.00 23.12 19.29 1h4m s ALA 133 CO 0.43 -0.49 0.82 -2.30 0.00 0.00 0.00 175.76 174.23 1h4m n PRO 134 N 4.21 0.53 0.03 0.00 -0.02 -1.26 -4.96 135.00 133.52 1h4m n PRO 134 Ca 0.09 0.23 -0.01 0.00 -2.02 0.00 0.00 63.50 61.79 1h4m n PRO 134 Cb 0.47 -2.08 -0.01 0.00 -0.02 0.00 0.00 33.50 31.87 1h4m n PRO 134 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1h4m h ALA 135 N -0.11 -0.44 -3.00 3.55 0.00 -1.12 -3.49 119.26 114.66 1h4m h ALA 135 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1h4m h ALA 135 Cb 1.35 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1h4m h ALA 135 CO 0.47 -0.44 0.00 0.41 0.00 0.00 0.00 179.25 179.69 1h4m n GLY 136 N 0.68 2.11 3.51 0.00 0.00 -1.04 -4.97 105.19 105.49 1h4m n GLY 136 Ca -0.01 -0.48 -0.28 0.00 0.00 0.00 0.00 46.02 45.25 1h4m n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h4m n GLY 137 N 0.00 -2.13 3.77 -0.02 0.00 -1.26 -3.61 105.19 101.94 1h4m n GLY 137 Ca 0.00 -1.60 -0.39 0.00 0.00 0.00 0.00 46.02 44.03 1h4m n GLY 137 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1h4m s PRO 138 N -5.57 4.11 0.10 1.61 0.02 -1.26 -4.31 135.00 129.69 1h4m s PRO 138 Ca 0.70 2.02 0.03 0.00 0.02 0.00 0.00 61.00 63.76 1h4m s PRO 138 Cb -0.04 -2.81 -0.04 0.00 0.02 0.00 0.00 34.50 31.63 1h4m s PRO 138 CO 0.51 -0.33 0.13 0.14 -0.33 0.00 0.00 177.00 177.12 1h4m s VAL 139 N -1.29 4.75 0.05 3.83 -7.23 -0.52 -4.89 120.40 115.10 1h4m s VAL 139 Ca 0.55 -0.74 -0.27 0.00 -1.81 0.00 0.00 61.98 59.71 1h4m s VAL 139 Cb -0.35 -3.33 -0.05 0.00 0.56 0.00 0.00 36.38 33.21 1h4m s VAL 139 CO 0.45 0.07 0.84 0.00 -0.31 0.00 0.00 175.10 176.15 1h4m s ALA 140 N -1.50 3.31 0.15 1.32 0.00 -1.26 -4.55 121.76 119.23 1h4m s ALA 140 Ca 0.31 0.38 0.10 0.00 0.00 0.00 0.00 51.96 52.76 1h4m s ALA 140 Cb -0.12 -3.11 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 1h4m s ALA 140 CO 0.24 -0.00 -0.24 -0.51 0.00 0.00 0.00 175.76 175.25 1h4m s LEU 141 N 0.13 2.38 -0.29 0.00 1.43 -1.26 -5.10 118.68 115.97 1h4m s LEU 141 Ca 0.42 -0.80 -0.07 0.00 -1.03 0.00 0.00 54.13 52.65 1h4m s LEU 141 Cb -0.21 -1.09 0.01 0.00 0.03 0.00 0.00 46.19 44.93 1h4m s LEU 141 CO 0.25 0.11 0.08 -0.44 0.23 0.00 0.00 176.35 176.57 1h4m s SER 142 N -2.35 5.12 -0.11 2.29 0.01 -1.26 -5.10 113.70 112.29 1h4m s SER 142 Ca 0.15 -0.66 -0.04 0.00 1.31 0.00 0.00 55.95 56.71 1h4m s SER 142 Cb -0.09 -1.88 -0.04 0.00 0.21 0.00 0.00 66.02 64.22 1h4m s SER 142 CO 0.07 -0.18 0.05 -0.76 0.41 0.00 0.00 173.24 172.83 1h4m s LEU 143 N 1.51 3.81 0.07 2.44 1.43 -1.26 -4.34 118.68 122.35 1h4m s LEU 143 Ca 0.03 0.20 0.10 0.00 -1.03 0.00 0.00 54.13 53.43 1h4m s LEU 143 Cb -0.17 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.11 1h4m s LEU 143 CO 0.02 0.34 -0.25 -1.00 0.23 0.00 0.00 176.35 175.69 1h4m s HIS 144 N -0.64 2.35 -0.81 0.29 3.76 0.33 -5.00 115.29 115.57 1h4m s HIS 144 Ca 0.11 -0.38 0.22 0.00 -0.15 0.00 0.00 55.06 54.86 1h4m s HIS 144 Cb -0.12 -1.35 -0.09 0.00 1.11 0.00 0.00 32.58 32.13 1h4m s HIS 144 CO 0.02 0.22 0.94 -0.25 -0.85 0.00 0.00 174.74 174.82 1h4m n ASP 145 N 1.43 0.74 -0.31 1.40 8.00 -1.26 -4.52 116.55 122.04 1h4m n ASP 145 Ca -0.17 -0.64 0.04 0.00 0.71 0.00 0.00 54.79 54.74 1h4m n ASP 145 Cb 0.52 0.98 0.19 0.00 -0.02 0.00 0.00 41.12 42.80 1h4m n ASP 145 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1h4m h GLU 146 N 0.00 0.78 0.00 -1.24 4.81 -1.94 -0.61 114.58 116.39 1h4m h GLU 146 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1h4m h GLU 146 Cb 0.60 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1h4m h GLU 146 CO 0.00 0.52 0.00 -2.30 -0.73 0.00 0.00 179.01 176.50 1h4m n PRO 147 N -4.74 0.03 -5.25 0.92 -0.02 -1.26 -4.78 135.00 119.91 1h4m n PRO 147 Ca 0.15 0.32 -0.32 0.00 -2.02 0.00 0.00 63.50 61.64 1h4m n PRO 147 Cb 0.32 -1.57 -0.16 0.00 -0.02 0.00 0.00 33.50 32.07 1h4m n PRO 147 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1h4m s THR 148 N -3.06 2.10 -0.26 3.45 2.01 -0.24 -1.17 115.64 118.47 1h4m s THR 148 Ca 0.05 -1.05 -0.12 0.00 0.31 0.00 0.00 61.69 60.88 1h4m s THR 148 Cb 0.08 -1.76 -0.05 0.00 0.01 0.00 0.00 72.50 70.79 1h4m s THR 148 CO 0.25 0.57 0.25 0.00 -0.69 0.00 0.00 174.62 175.00 1h4m s ALA 149 N -0.18 3.57 0.84 7.40 0.00 -0.07 -4.87 121.76 128.45 1h4m s ALA 149 Ca -0.03 -0.89 -0.12 0.00 0.00 0.00 0.00 51.96 50.92 1h4m s ALA 149 Cb -0.14 -2.51 0.09 0.00 0.00 0.00 0.00 23.12 20.57 1h4m s ALA 149 CO 0.04 -0.44 1.12 -1.54 0.00 0.00 0.00 175.76 174.94 1h4m s SER 150 N 1.43 4.17 0.14 0.00 1.04 -1.26 -3.90 113.70 115.32 1h4m s SER 150 Ca 0.11 1.12 -0.18 0.00 0.48 0.00 0.00 55.95 57.47 1h4m s SER 150 Cb -0.15 -1.77 -0.02 0.00 0.10 0.00 0.00 66.02 64.18 1h4m s SER 150 CO 0.08 -2.15 1.80 -0.09 0.98 0.00 0.00 173.24 173.86 1h4m h ARG 151 N -1.22 0.42 -0.51 4.02 2.43 -2.00 -1.99 114.38 115.53 1h4m h ARG 151 Ca -0.48 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 58.62 1h4m h ARG 151 Cb 1.30 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.73 1h4m h ARG 151 CO 0.61 0.28 0.15 -0.44 -1.51 0.00 0.00 179.97 179.06 1h4m h ASP 152 N 0.43 0.76 -0.61 -3.80 3.32 -1.99 -1.99 116.42 112.53 1h4m h ASP 152 Ca 0.12 -0.21 0.09 0.00 0.02 0.00 0.00 57.03 57.05 1h4m h ASP 152 Cb -0.05 -0.20 -0.07 0.00 0.22 0.00 0.00 39.33 39.23 1h4m h ASP 152 CO -0.03 0.77 0.23 0.22 -1.72 0.00 0.00 179.24 178.72 1h4m h TYR 153 N 0.70 0.40 -0.37 4.55 3.20 -1.89 -1.76 116.97 121.82 1h4m h TYR 153 Ca 0.16 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.90 1h4m h TYR 153 Cb 0.29 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 1h4m h TYR 153 CO 0.02 0.10 -0.41 1.25 -1.64 0.00 0.00 178.16 177.48 1h4m h LEU 154 N 0.41 0.99 -0.86 2.82 5.85 -1.21 -2.48 115.31 120.83 1h4m h LEU 154 Ca 0.31 -0.47 0.07 0.00 0.84 0.00 0.00 57.88 58.63 1h4m h LEU 154 Cb 0.38 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.06 1h4m h LEU 154 CO -0.30 1.27 0.53 -0.07 -0.34 0.00 0.00 178.44 179.52 1h4m h LEU 155 N 0.74 0.81 -1.62 2.25 3.38 -1.21 -0.63 115.31 119.04 1h4m h LEU 155 Ca 0.05 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1h4m h LEU 155 Cb 1.01 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1h4m h LEU 155 CO 0.10 0.51 -0.17 1.23 0.09 0.00 0.00 178.44 180.20 1h4m h GLY 156 N 0.94 0.00 -0.92 0.83 0.00 -0.98 -3.25 103.07 99.68 1h4m h GLY 156 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1h4m h GLY 156 CO -0.19 0.00 -0.47 0.54 0.00 0.00 0.00 176.54 176.42 1h4m n ARG 157 N -3.57 1.18 -1.71 4.80 5.12 -0.29 -4.98 116.66 117.21 1h4m n ARG 157 Ca -0.01 -0.96 -0.41 0.00 -1.93 0.00 0.00 57.85 54.53 1h4m n ARG 157 Cb 0.31 -1.48 0.01 0.00 -1.16 0.00 0.00 32.46 30.14 1h4m n ARG 157 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1h4m n LEU 158 N -0.07 4.10 0.00 0.55 4.77 -0.94 -1.50 117.00 123.91 1h4m n LEU 158 Ca 0.09 1.13 0.00 0.00 -0.03 0.00 0.00 56.01 57.20 1h4m n LEU 158 Cb 0.46 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 40.04 1h4m n LEU 158 CO 0.28 -0.53 0.00 0.61 -1.33 0.00 0.00 177.39 176.42 1h4m n GLY 159 N 0.76 1.76 3.73 -0.72 0.00 -1.26 -5.00 105.19 104.46 1h4m n GLY 159 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1h4m n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h4m s ALA 160 N -3.12 2.04 0.09 4.61 0.00 -0.56 -4.93 121.76 119.88 1h4m s ALA 160 Ca 0.00 0.53 0.01 0.00 0.00 0.00 0.00 51.96 52.50 1h4m s ALA 160 Cb 0.00 -3.37 -0.25 0.00 0.00 0.00 0.00 23.12 19.50 1h4m s ALA 160 CO 0.00 -2.00 1.19 0.00 0.00 0.00 0.00 175.76 174.95 1h4m h ALA 161 N -0.99 0.23 -0.47 0.00 0.00 -1.94 -3.19 119.26 112.89 1h4m h ALA 161 Ca -0.45 -0.91 0.00 0.00 0.00 0.00 0.00 54.91 53.55 1h4m h ALA 161 Cb 1.26 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1h4m h ALA 161 CO 0.49 1.11 0.00 -0.40 0.00 0.00 0.00 179.25 180.45 1h4m n ASP 162 N -3.44 4.65 -4.40 0.00 5.75 -1.26 -4.90 116.55 112.95 1h4m n ASP 162 Ca -0.05 -2.68 -0.31 0.00 -0.01 0.00 0.00 54.79 51.74 1h4m n ASP 162 Cb 0.99 -0.63 -0.14 0.00 -1.03 0.00 0.00 41.12 40.31 1h4m n ASP 162 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1h4m s LEU 163 N -2.10 2.42 -0.04 -2.12 2.96 -1.21 -1.33 118.68 117.25 1h4m s LEU 163 Ca 0.43 -0.38 0.06 0.00 -0.22 0.00 0.00 54.13 54.01 1h4m s LEU 163 Cb 0.32 -1.45 -0.01 0.00 0.50 0.00 0.00 46.19 45.56 1h4m s LEU 163 CO 0.14 0.31 -0.22 0.00 -1.32 0.00 0.00 176.35 175.25 1h4m s ALA 164 N -0.75 1.90 -0.27 5.97 0.00 -0.49 -4.88 121.76 123.24 1h4m s ALA 164 Ca 0.12 -0.92 -0.06 0.00 0.00 0.00 0.00 51.96 51.09 1h4m s ALA 164 Cb -0.10 -0.57 -0.00 0.00 0.00 0.00 0.00 23.12 22.44 1h4m s ALA 164 CO 0.01 0.39 0.06 0.42 0.00 0.00 0.00 175.76 176.64 1h4m s ILE 165 N -0.21 3.97 -0.61 0.00 1.01 -1.26 -0.70 121.20 123.40 1h4m s ILE 165 Ca -0.00 -0.52 -0.13 0.00 0.00 0.00 0.00 60.65 60.00 1h4m s ILE 165 Cb -0.12 -2.96 0.16 0.00 0.01 0.00 0.00 42.46 39.55 1h4m s ILE 165 CO 0.02 0.20 0.54 0.86 0.00 0.00 0.00 174.94 176.56 1h4m s TRP 166 N 1.53 3.46 -0.39 3.97 -0.11 -0.27 -1.34 118.94 125.78 1h4m s TRP 166 Ca 0.04 -1.75 -0.29 0.00 1.22 0.00 0.00 56.10 55.32 1h4m s TRP 166 Cb -0.16 -3.69 0.02 0.00 -1.50 0.00 0.00 33.47 28.14 1h4m s TRP 166 CO 0.02 -0.99 1.17 0.34 -4.62 0.00 0.00 176.95 172.87 1h4m s ASP 167 N 2.72 6.70 0.00 5.86 3.68 -0.16 -2.04 116.67 133.43 1h4m s ASP 167 Ca 0.09 0.80 0.15 0.00 2.13 0.00 0.00 52.55 55.73 1h4m s ASP 167 Cb -0.23 -2.55 0.44 0.00 -1.45 0.00 0.00 42.92 39.14 1h4m s ASP 167 CO -0.02 -1.13 1.36 0.00 0.13 0.00 0.00 175.17 175.51 1h4m n ALA 168 N 7.62 2.43 -1.63 3.66 0.00 -0.27 -2.34 120.51 129.98 1h4m n ALA 168 Ca 0.13 -0.84 -0.20 0.00 0.00 0.00 0.00 53.44 52.53 1h4m n ALA 168 Cb 0.48 -0.96 0.21 0.00 0.00 0.00 0.00 19.45 19.18 1h4m n ALA 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1h4m n ARG 169 N 0.90 -1.84 -2.11 0.00 1.74 -1.26 -1.72 116.66 112.37 1h4m n ARG 169 Ca 0.16 -1.90 -0.34 0.00 -0.77 0.00 0.00 57.85 55.00 1h4m n ARG 169 Cb 0.41 -1.41 0.02 0.00 -1.02 0.00 0.00 32.46 30.45 1h4m n ARG 169 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1h4m s SER 170 N -5.28 5.54 0.30 0.55 1.04 -1.26 -3.86 113.70 110.73 1h4m s SER 170 Ca 0.72 2.12 0.03 0.00 0.48 0.00 0.00 55.95 59.30 1h4m s SER 170 Cb -0.03 -2.57 0.62 0.00 0.10 0.00 0.00 66.02 64.13 1h4m s SER 170 CO 0.52 -1.34 1.85 -0.65 0.98 0.00 0.00 173.24 174.59 1h4m h PRO 171 N 0.85 0.90 -0.49 4.02 0.11 -1.97 -0.27 132.00 135.16 1h4m h PRO 171 Ca -0.49 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1h4m h PRO 171 Cb 1.26 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1h4m h PRO 171 CO 0.56 0.60 0.30 -0.56 -0.21 0.00 0.00 178.00 178.69 1h4m h GLN 172 N 0.93 0.65 -0.06 1.05 -0.00 -1.96 0.23 115.11 115.95 1h4m h GLN 172 Ca 0.48 -0.05 -0.03 0.00 -0.00 0.00 0.00 58.65 59.06 1h4m h GLN 172 Cb 0.54 -0.14 -0.00 0.00 -0.00 0.00 0.00 27.48 27.87 1h4m h GLN 172 CO -0.25 0.45 -0.07 0.93 -0.00 0.00 0.00 178.83 179.89 1h4m h GLU 173 N 0.67 0.16 -0.96 0.06 5.08 -1.38 0.90 114.58 119.10 1h4m h GLU 173 Ca 0.18 -0.09 0.15 0.00 -1.00 0.00 0.00 59.36 58.60 1h4m h GLU 173 Cb -0.04 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.12 1h4m h GLU 173 CO -0.04 0.62 0.58 -0.92 -1.00 0.00 0.00 179.01 178.26 1h4m h TYR 174 N -0.29 1.03 -0.10 4.33 3.20 -0.28 0.25 116.97 125.11 1h4m h TYR 174 Ca 0.01 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1h4m h TYR 174 Cb 0.60 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 38.55 1h4m h TYR 174 CO 0.10 0.32 0.00 0.54 -1.64 0.00 0.00 178.16 177.47 1h4m n ARG 175 N -4.73 1.45 -2.50 1.82 1.74 -0.01 -3.40 116.66 111.04 1h4m n ARG 175 Ca 0.20 -0.68 -0.20 0.00 -0.77 0.00 0.00 57.85 56.40 1h4m n ARG 175 Cb 0.44 -1.35 -0.00 0.00 -1.02 0.00 0.00 32.46 30.53 1h4m n ARG 175 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1h4m n GLY 176 N 1.00 -0.45 0.08 -0.13 0.00 0.88 -4.70 105.19 101.86 1h4m n GLY 176 Ca 0.15 -0.03 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 1h4m n GLY 176 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1h4m h GLU 177 N -0.28 0.04 -4.87 1.61 5.08 -1.07 -3.43 114.58 111.67 1h4m h GLU 177 Ca -0.48 -0.07 -0.68 0.00 -1.00 0.00 0.00 59.36 57.14 1h4m h GLU 177 Cb 1.35 0.03 -0.33 0.00 0.50 0.00 0.00 28.75 30.29 1h4m h GLU 177 CO 0.55 0.86 -0.75 0.21 -1.00 0.00 0.00 179.01 178.88 1h4m s LYS 178 N -2.66 2.61 -0.26 2.33 2.20 -0.75 -4.99 119.74 118.22 1h4m s LYS 178 Ca -0.02 -1.13 -0.04 0.00 -0.36 0.00 0.00 55.97 54.42 1h4m s LYS 178 Cb 0.09 -3.00 0.01 0.00 -1.51 0.00 0.00 37.83 33.42 1h4m s LYS 178 CO 0.83 -0.49 -0.00 0.08 -0.36 0.00 0.00 175.35 175.40 1h4m s VAL 179 N 1.26 3.37 -0.18 4.02 1.01 -1.26 -4.30 120.40 124.31 1h4m s VAL 179 Ca -0.03 -0.81 0.17 0.00 0.00 0.00 0.00 61.98 61.31 1h4m s VAL 179 Cb -0.18 -2.70 0.47 0.00 0.00 0.00 0.00 36.38 33.98 1h4m s VAL 179 CO -0.04 0.19 1.36 0.18 0.00 0.00 0.00 175.10 176.79 1h4m n LEU 180 N 4.76 3.53 -3.96 3.92 4.77 -1.26 -4.99 117.00 123.77 1h4m n LEU 180 Ca -0.16 -3.02 -0.12 0.00 -0.03 0.00 0.00 56.01 52.69 1h4m n LEU 180 Cb 0.48 -0.51 -0.01 0.00 -2.33 0.00 0.00 43.42 41.04 1h4m n LEU 180 CO 0.29 0.68 0.32 0.00 -1.33 0.00 0.00 177.39 177.35 1h4m s ALA 181 N -2.81 0.07 0.49 -1.18 0.00 -1.26 -4.97 121.76 112.11 1h4m s ALA 181 Ca 0.40 -1.16 0.32 0.00 0.00 0.00 0.00 51.96 51.51 1h4m s ALA 181 Cb 0.32 0.94 1.75 0.00 0.00 0.00 0.00 23.12 26.13 1h4m s ALA 181 CO 0.08 -0.88 2.18 0.00 0.00 0.00 0.00 175.76 177.13 1h4m h ALA 182 N 2.06 1.27 -3.88 0.00 0.00 -1.89 -3.41 119.26 113.41 1h4m h ALA 182 Ca -0.30 -0.05 -0.58 0.00 0.00 0.00 0.00 54.91 53.98 1h4m h ALA 182 Cb 1.24 -0.01 -0.31 0.00 0.00 0.00 0.00 17.79 18.71 1h4m h ALA 182 CO 0.39 0.07 -0.84 0.15 0.00 0.00 0.00 179.25 179.02 1h4m s LYS 183 N -4.26 1.90 0.14 0.00 1.02 -0.17 -5.03 119.74 113.33 1h4m s LYS 183 Ca -0.04 -0.64 0.04 0.00 0.02 0.00 0.00 55.97 55.35 1h4m s LYS 183 Cb 0.13 -1.63 -0.04 0.00 -0.52 0.00 0.00 37.83 35.77 1h4m s LYS 183 CO 0.54 0.25 0.14 0.20 -0.92 0.00 0.00 175.35 175.56 1h4m s GLY 184 N 0.04 1.80 0.00 -3.33 0.00 -1.26 -4.73 107.32 99.83 1h4m s GLY 184 Ca -0.04 -1.14 0.00 0.00 0.00 0.00 0.00 44.72 43.54 1h4m s GLY 184 CO 0.03 -1.14 0.00 0.61 0.00 0.00 0.00 173.10 172.60 1h4m n GLY 185 N -0.17 0.62 3.34 0.20 0.00 -1.25 -4.75 105.19 103.19 1h4m n GLY 185 Ca -0.08 -1.92 -0.16 0.00 0.00 0.00 0.00 46.02 43.85 1h4m n GLY 185 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1h4m s HIS 186 N -1.89 1.39 0.11 1.61 -3.43 0.11 -4.48 115.29 108.72 1h4m s HIS 186 Ca 0.00 -1.47 -0.30 0.00 -0.80 0.00 0.00 55.06 52.49 1h4m s HIS 186 Cb 0.00 -0.46 -0.06 0.00 -1.43 0.00 0.00 32.58 30.62 1h4m s HIS 186 CO 0.00 -0.92 1.13 0.42 -2.00 0.00 0.00 174.74 173.37 1h4m s ILE 187 N -3.47 4.05 0.05 -5.38 1.01 -1.26 -0.69 121.20 115.51 1h4m s ILE 187 Ca 0.37 1.59 -0.34 0.00 0.00 0.00 0.00 60.65 62.27 1h4m s ILE 187 Cb 0.02 -4.02 -0.13 0.00 0.01 0.00 0.00 42.46 38.34 1h4m s ILE 187 CO 0.22 0.19 1.68 -2.65 0.00 0.00 0.00 174.94 174.39 1h4m n PRO 188 N 3.19 2.06 0.00 2.79 -0.02 -1.26 -0.79 135.00 140.97 1h4m n PRO 188 Ca 0.06 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 1h4m n PRO 188 Cb 0.47 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 1h4m n PRO 188 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h4m n GLY 189 N 3.75 1.49 3.73 -1.23 0.00 -1.26 -4.60 105.19 107.07 1h4m n GLY 189 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1h4m n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h4m s ALA 190 N -2.42 2.12 0.30 4.61 0.00 0.03 -4.69 121.76 121.71 1h4m s ALA 190 Ca 0.00 0.69 0.10 0.00 0.00 0.00 0.00 51.96 52.75 1h4m s ALA 190 Cb 0.00 -3.41 -0.06 0.00 0.00 0.00 0.00 23.12 19.65 1h4m s ALA 190 CO 0.00 -1.86 -0.13 0.14 0.00 0.00 0.00 175.76 173.91 1h4m s VAL 191 N -2.27 2.19 -0.13 0.00 -7.23 -0.45 -4.95 120.40 107.56 1h4m s VAL 191 Ca 0.70 -2.27 0.01 0.00 -1.81 0.00 0.00 61.98 58.61 1h4m s VAL 191 Cb -0.25 -2.42 -0.00 0.00 0.56 0.00 0.00 36.38 34.26 1h4m s VAL 191 CO 0.47 -0.33 -0.17 0.21 -0.31 0.00 0.00 175.10 174.97 1h4m s ASN 192 N -3.52 3.61 -0.37 4.85 2.47 -1.26 -0.99 114.94 119.73 1h4m s ASN 192 Ca 0.30 -0.45 0.02 0.00 0.42 0.00 0.00 52.86 53.15 1h4m s ASN 192 Cb -0.00 -1.54 0.15 0.00 -1.45 0.00 0.00 41.25 38.41 1h4m s ASN 192 CO 0.14 0.13 0.33 0.12 -3.72 0.00 0.00 177.10 174.09 1h4m s PHE 193 N 0.56 0.16 0.21 0.43 5.36 -0.99 -4.99 117.98 118.72 1h4m s PHE 193 Ca -0.10 -1.26 -0.30 0.00 -0.96 0.00 0.00 56.93 54.31 1h4m s PHE 193 Cb -0.16 -0.61 -0.16 0.00 -0.34 0.00 0.00 43.02 41.75 1h4m s PHE 193 CO 0.04 -0.92 0.85 -1.91 -1.46 0.00 0.00 175.22 171.82 1h4m n GLU 194 N 3.98 0.68 -0.23 10.12 2.13 -1.25 -4.47 120.64 131.60 1h4m n GLU 194 Ca 0.14 0.24 0.04 0.00 0.66 0.00 0.00 57.16 58.24 1h4m n GLU 194 Cb 0.43 -1.50 0.16 0.00 0.27 0.00 0.00 31.44 30.80 1h4m n GLU 194 CO 0.00 0.00 0.00 0.11 -0.41 0.00 0.00 177.13 176.83 1h4m h TRP 195 N 1.92 0.22 0.00 4.31 5.08 -1.59 -0.93 115.95 124.95 1h4m h TRP 195 Ca -0.36 0.04 -0.01 0.00 1.08 0.00 0.00 58.89 59.64 1h4m h TRP 195 Cb 1.39 0.01 -0.00 0.00 -3.00 0.00 0.00 29.16 27.56 1h4m h TRP 195 CO 0.47 -0.09 -0.03 1.79 -1.28 0.00 0.00 178.44 179.31 1h4m h THR 196 N 0.25 0.82 0.00 0.12 1.35 -1.88 -2.21 112.91 111.36 1h4m h THR 196 Ca 0.39 -0.10 -0.01 0.00 -0.55 0.00 0.00 66.41 66.14 1h4m h THR 196 Cb 0.64 1.06 -0.00 0.00 -1.73 0.00 0.00 68.15 68.11 1h4m h THR 196 CO -0.49 0.03 -0.05 0.00 -0.25 0.00 0.00 175.52 174.76 1h4m h ALA 197 N 1.97 1.10 0.00 6.62 0.00 -1.49 -2.87 119.26 124.58 1h4m h ALA 197 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1h4m h ALA 197 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1h4m h ALA 197 CO 0.00 0.06 -0.04 0.00 0.00 0.00 0.00 179.25 179.27 1h4m n ALA 198 N -2.16 2.42 -2.73 0.00 0.00 -0.83 -4.86 120.51 112.35 1h4m n ALA 198 Ca -0.01 -0.11 -0.26 0.00 0.00 0.00 0.00 53.44 53.06 1h4m n ALA 198 Cb 0.21 -1.44 -0.02 0.00 0.00 0.00 0.00 19.45 18.20 1h4m n ALA 198 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1h4m s MET 199 N -3.01 3.51 -0.30 0.00 -1.94 -1.09 -0.72 119.30 115.75 1h4m s MET 199 Ca 0.13 -0.35 0.03 0.00 -1.71 0.00 0.00 55.69 53.79 1h4m s MET 199 Cb 0.18 -2.77 0.08 0.00 2.01 0.00 0.00 34.83 34.33 1h4m s MET 199 CO 0.55 0.31 -0.02 0.34 -0.01 0.00 0.00 175.02 176.19 1h4m s ASP 200 N -3.53 4.65 0.00 3.03 3.68 -0.28 -4.66 116.67 119.55 1h4m s ASP 200 Ca 0.39 -1.77 0.14 0.00 2.13 0.00 0.00 52.55 53.44 1h4m s ASP 200 Cb -0.10 -1.60 0.65 0.00 -1.45 0.00 0.00 42.92 40.41 1h4m s ASP 200 CO 0.31 -0.29 1.43 -0.81 0.13 0.00 0.00 175.17 175.94 1h4m n PRO 201 N 4.36 0.07 0.07 4.34 -0.04 -1.26 -0.98 135.00 141.56 1h4m n PRO 201 Ca -0.05 0.22 0.12 0.00 -0.04 0.00 0.00 63.50 63.75 1h4m n PRO 201 Cb 0.42 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.67 1h4m n PRO 201 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1h4m n SER 202 N -1.43 0.69 -2.46 3.54 3.41 -1.26 -3.79 113.62 112.32 1h4m n SER 202 Ca 0.05 0.28 -0.21 0.00 -0.26 0.00 0.00 58.87 58.73 1h4m n SER 202 Cb 0.15 -0.21 0.01 0.00 -0.26 0.00 0.00 64.21 63.90 1h4m n SER 202 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1h4m n ARG 203 N -2.09 2.87 -3.33 4.33 1.74 -0.15 -4.95 116.66 115.08 1h4m n ARG 203 Ca 0.04 -4.11 -0.24 0.00 -0.77 0.00 0.00 57.85 52.77 1h4m n ARG 203 Cb 0.42 -2.00 0.04 0.00 -1.02 0.00 0.00 32.46 29.91 1h4m n ARG 203 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1h4m n ALA 204 N -0.45 -1.12 -1.36 7.54 0.00 -1.21 -1.83 120.51 122.09 1h4m n ALA 204 Ca 0.31 0.30 -0.12 0.00 0.00 0.00 0.00 53.44 53.93 1h4m n ALA 204 Cb 0.76 -4.36 -0.05 0.00 0.00 0.00 0.00 19.45 15.80 1h4m n ALA 204 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1h4m n LEU 205 N -4.38 -0.89 -4.51 0.00 4.77 -0.61 -3.42 117.00 107.97 1h4m n LEU 205 Ca -0.05 0.30 -0.29 0.00 -0.03 0.00 0.00 56.01 55.94 1h4m n LEU 205 Cb 0.58 -1.92 0.23 0.00 -2.33 0.00 0.00 43.42 39.98 1h4m n LEU 205 CO 0.56 -0.66 0.48 0.54 -1.33 0.00 0.00 177.39 176.98 1h4m n ARG 206 N -2.60 -1.83 -2.18 3.23 1.74 -0.76 -3.99 116.66 110.27 1h4m n ARG 206 Ca -0.12 -0.49 -0.42 0.00 -0.77 0.00 0.00 57.85 56.04 1h4m n ARG 206 Cb 0.41 -2.19 -0.03 0.00 -1.02 0.00 0.00 32.46 29.63 1h4m n ARG 206 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1h4m s ILE 207 N -2.46 3.66 0.27 0.55 1.01 -1.26 -1.12 121.20 121.85 1h4m s ILE 207 Ca 0.67 1.01 -0.29 0.00 0.00 0.00 0.00 60.65 62.05 1h4m s ILE 207 Cb -0.24 -3.65 -0.14 0.00 0.01 0.00 0.00 42.46 38.44 1h4m s ILE 207 CO 0.63 -0.02 1.09 -2.11 0.00 0.00 0.00 174.94 174.54 1h4m n ARG 208 N 5.67 1.46 0.25 2.79 1.85 0.10 -4.80 116.66 123.98 1h4m n ARG 208 Ca 0.14 0.51 0.16 0.00 -1.00 0.00 0.00 57.85 57.66 1h4m n ARG 208 Cb 0.43 -1.95 0.58 0.00 -1.05 0.00 0.00 32.46 30.47 1h4m n ARG 208 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1h4m h THR 209 N 2.22 0.00 -0.49 8.89 1.35 -1.91 -2.49 112.91 120.47 1h4m h THR 209 Ca -0.41 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 64.88 1h4m h THR 209 Cb 1.33 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 69.29 1h4m h THR 209 CO 0.63 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 175.00 1h4m n ASP 210 N -3.00 4.92 -0.33 5.36 3.85 -1.26 -4.60 116.55 121.49 1h4m n ASP 210 Ca 0.01 -2.75 0.00 0.00 -0.71 0.00 0.00 54.79 51.35 1h4m n ASP 210 Cb 0.34 -0.65 0.13 0.00 -1.35 0.00 0.00 41.12 39.60 1h4m n ASP 210 CO 0.00 0.00 0.00 -0.29 -1.01 0.00 0.00 177.20 175.90 1h4m h ILE 211 N 3.37 1.10 -0.12 2.12 6.09 -1.82 -2.73 117.51 125.52 1h4m h ILE 211 Ca 0.00 -0.37 0.01 0.00 -1.37 0.00 0.00 64.86 63.13 1h4m h ILE 211 Cb 1.71 -0.07 -0.01 0.00 0.47 0.00 0.00 36.82 38.91 1h4m h ILE 211 CO 0.40 0.20 0.03 0.00 -3.07 0.00 0.00 178.15 175.71 1h4m h ALA 212 N 1.39 0.13 -0.98 0.18 0.00 -1.87 -0.99 119.26 117.12 1h4m h ALA 212 Ca 0.37 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.37 1h4m h ALA 212 Cb 0.09 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.83 1h4m h ALA 212 CO -0.15 -0.42 0.63 0.78 0.00 0.00 0.00 179.25 180.10 1h4m h GLY 213 N 0.09 1.48 1.30 0.00 0.00 -1.87 0.18 103.07 104.26 1h4m h GLY 213 Ca 0.05 -0.46 -0.11 0.00 0.00 0.00 0.00 47.33 46.82 1h4m h GLY 213 CO -0.06 0.32 -0.16 3.21 0.00 0.00 0.00 176.54 179.84 1h4m h ARG 214 N 1.13 0.81 -0.39 4.80 2.47 -1.00 0.46 114.38 122.67 1h4m h ARG 214 Ca 0.43 -0.30 -0.13 0.00 -1.26 0.00 0.00 59.98 58.71 1h4m h ARG 214 Cb 0.19 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.45 1h4m h ARG 214 CO -0.17 0.92 -0.28 -0.07 0.56 0.00 0.00 179.97 180.93 1h4m h LEU 215 N 0.72 0.92 -1.14 3.04 3.38 -0.74 -3.10 115.31 118.40 1h4m h LEU 215 Ca 0.11 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1h4m h LEU 215 Cb 0.67 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1h4m h LEU 215 CO 0.05 1.16 0.40 -0.33 0.09 0.00 0.00 178.44 179.81 1h4m h GLU 216 N 0.68 1.00 -0.81 1.13 5.08 -0.22 0.11 114.58 121.55 1h4m h GLU 216 Ca 0.07 -0.11 0.23 0.00 -1.00 0.00 0.00 59.36 58.56 1h4m h GLU 216 Cb 0.86 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.88 1h4m h GLU 216 CO 0.08 0.73 0.58 0.93 -1.00 0.00 0.00 179.01 180.33 1h4m h GLU 217 N 1.00 0.01 -0.54 2.33 5.08 -0.84 -1.88 114.58 119.75 1h4m h GLU 217 Ca 0.26 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 1h4m h GLU 217 Cb 0.02 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1h4m h GLU 217 CO -0.04 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.25 1h4m n LEU 218 N -4.30 3.69 -0.00 1.33 4.77 -0.04 -4.94 117.00 117.51 1h4m n LEU 218 Ca 0.17 -1.71 -0.00 0.00 -0.03 0.00 0.00 56.01 54.43 1h4m n LEU 218 Cb 0.88 -0.35 -0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1h4m n LEU 218 CO 0.38 0.85 -0.00 0.61 -1.33 0.00 0.00 177.39 177.90 1h4m n GLY 219 N 1.57 0.46 3.29 -0.72 0.00 -0.71 -4.93 105.19 104.15 1h4m n GLY 219 Ca 0.22 -0.42 -0.44 0.00 0.00 0.00 0.00 46.02 45.38 1h4m n GLY 219 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1h4m n ILE 220 N -3.00 4.30 -4.29 -0.61 5.41 -0.81 -4.81 119.36 115.55 1h4m n ILE 220 Ca -0.00 -4.67 -0.27 0.00 1.00 0.00 0.00 62.75 58.81 1h4m n ILE 220 Cb 0.00 -2.43 -0.10 0.00 -0.71 0.00 0.00 39.64 36.40 1h4m n ILE 220 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 1h4m s THR 221 N 1.13 3.12 -0.86 1.39 -4.23 -1.26 -4.08 115.64 110.84 1h4m s THR 221 Ca 0.42 -1.63 0.22 0.00 -1.18 0.00 0.00 61.69 59.51 1h4m s THR 221 Cb 0.01 -2.52 0.20 0.00 1.34 0.00 0.00 72.50 71.52 1h4m s THR 221 CO 0.00 -0.07 1.68 -0.81 -0.54 0.00 0.00 174.62 174.89 1h4m n PRO 222 N 0.19 0.07 0.00 3.99 -0.04 -1.26 -1.60 135.00 136.35 1h4m n PRO 222 Ca -0.12 0.21 0.14 0.00 -0.04 0.00 0.00 63.50 63.69 1h4m n PRO 222 Cb 0.55 -1.61 0.76 0.00 -0.04 0.00 0.00 33.50 33.15 1h4m n PRO 222 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1h4m n ASP 223 N -1.75 0.00 -4.61 3.54 5.68 -1.26 -4.39 116.55 113.76 1h4m n ASP 223 Ca 0.04 -0.35 -0.27 0.00 -0.50 0.00 0.00 54.79 53.72 1h4m n ASP 223 Cb 0.26 -0.20 -0.09 0.00 -1.14 0.00 0.00 41.12 39.96 1h4m n ASP 223 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1h4m s LYS 224 N -2.40 2.20 0.05 0.11 1.02 -0.63 -5.00 119.74 115.09 1h4m s LYS 224 Ca 0.32 -1.21 -0.31 0.00 0.02 0.00 0.00 55.97 54.79 1h4m s LYS 224 Cb 0.19 -2.23 -0.06 0.00 -0.52 0.00 0.00 37.83 35.20 1h4m s LYS 224 CO 0.40 0.44 1.37 -2.00 -0.92 0.00 0.00 175.35 174.64 1h4m s GLU 225 N -2.90 4.32 -0.25 1.68 2.12 -0.45 -4.62 118.70 118.59 1h4m s GLU 225 Ca 0.26 1.98 -0.11 0.00 0.36 0.00 0.00 54.97 57.47 1h4m s GLU 225 Cb -0.09 -3.42 -0.05 0.00 0.26 0.00 0.00 34.13 30.83 1h4m s GLU 225 CO 0.17 -0.48 0.18 0.42 -0.54 0.00 0.00 175.26 175.00 1h4m s ILE 226 N 1.75 5.33 -0.20 -3.70 -1.09 0.45 -1.40 121.20 122.34 1h4m s ILE 226 Ca 0.64 0.20 -0.01 0.00 -2.23 0.00 0.00 60.65 59.24 1h4m s ILE 226 Cb -0.33 -3.52 0.01 0.00 -1.58 0.00 0.00 42.46 37.03 1h4m s ILE 226 CO 0.28 0.30 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.48 1h4m s VAL 227 N 1.34 2.70 0.17 2.92 1.01 0.12 -0.70 120.40 127.96 1h4m s VAL 227 Ca 0.08 -0.73 0.10 0.00 0.00 0.00 0.00 61.98 61.43 1h4m s VAL 227 Cb -0.14 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 1h4m s VAL 227 CO 0.07 0.48 -0.19 0.28 0.00 0.00 0.00 175.10 175.73 1h4m s THR 228 N 1.38 2.65 0.26 3.92 -1.32 -0.27 -1.11 115.64 121.15 1h4m s THR 228 Ca 0.05 -1.81 -0.21 0.00 -1.21 0.00 0.00 61.69 58.51 1h4m s THR 228 Cb -0.14 -2.26 0.03 0.00 -1.51 0.00 0.00 72.50 68.62 1h4m s THR 228 CO -0.08 -0.05 0.69 -1.38 -2.21 0.00 0.00 174.62 171.59 1h4m s HIS 229 N -1.52 -0.22 0.00 9.09 -3.43 -0.87 -0.51 115.29 117.84 1h4m s HIS 229 Ca 0.21 -0.21 0.00 0.00 -0.80 0.00 0.00 55.06 54.26 1h4m s HIS 229 Cb -0.09 0.67 0.00 0.00 -1.43 0.00 0.00 32.58 31.73 1h4m s HIS 229 CO 0.11 -1.18 0.00 0.00 -2.00 0.00 0.00 174.74 171.67 1h4m h GLN 231 N 0.00 0.10 0.00 0.00 5.75 -1.93 0.13 115.11 119.15 1h4m h GLN 231 Ca 0.00 -0.16 -0.00 0.00 -0.15 0.00 0.00 58.65 58.33 1h4m h GLN 231 Cb 0.00 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.61 1h4m h GLN 231 CO 0.00 1.08 -0.23 0.25 -2.65 0.00 0.00 178.83 177.28 1h4m n THR 232 N -4.20 1.10 -3.14 2.39 -2.24 -1.26 -0.79 114.28 106.14 1h4m n THR 232 Ca -0.28 -1.35 -0.23 0.00 -2.27 0.00 0.00 64.05 59.92 1h4m n THR 232 Cb 0.76 0.08 0.04 0.00 -2.10 0.00 0.00 70.33 69.11 1h4m n THR 232 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1h4m n HIS 233 N -0.82 -2.07 -0.09 4.78 -0.00 -1.26 -4.09 115.22 111.67 1h4m n HIS 233 Ca 0.09 0.58 -0.14 0.00 0.46 0.00 0.00 57.72 58.71 1h4m n HIS 233 Cb 0.67 -4.41 -0.06 0.00 -0.12 0.00 0.00 29.99 26.07 1h4m n HIS 233 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 1h4m n HIS 234 N -4.53 0.65 0.18 1.57 -0.00 -1.26 -4.27 115.22 107.57 1h4m n HIS 234 Ca -0.09 0.28 0.03 0.00 -0.00 0.00 0.00 57.72 57.94 1h4m n HIS 234 Cb 0.61 -0.86 0.34 0.00 -0.00 0.00 0.00 29.99 30.08 1h4m n HIS 234 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1h4m h ARG 235 N -1.00 0.00 -0.06 1.57 3.08 -1.92 0.14 114.38 116.19 1h4m h ARG 235 Ca -0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.84 1h4m h ARG 235 Cb 1.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.05 1h4m h ARG 235 CO -0.13 0.41 0.00 -1.13 -1.07 0.00 0.00 179.97 178.05 1h4m n SER 236 N -3.91 0.60 -0.07 7.04 3.41 -1.26 -1.88 113.62 117.55 1h4m n SER 236 Ca -0.01 -1.53 -0.13 0.00 -0.26 0.00 0.00 58.87 56.94 1h4m n SER 236 Cb 0.46 -0.04 -0.06 0.00 -0.26 0.00 0.00 64.21 64.31 1h4m n SER 236 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1h4m h GLY 237 N 5.28 0.52 1.01 5.00 0.00 -0.88 -1.83 103.07 112.16 1h4m h GLY 237 Ca 0.00 -0.51 -0.04 0.00 0.00 0.00 0.00 47.33 46.78 1h4m h GLY 237 CO 0.00 0.46 0.23 -2.00 0.00 0.00 0.00 176.54 175.23 1h4m h LEU 238 N 0.16 0.87 -0.59 3.11 5.85 -1.42 -2.38 115.31 120.91 1h4m h LEU 238 Ca 0.04 -0.18 -0.15 0.00 0.84 0.00 0.00 57.88 58.42 1h4m h LEU 238 Cb 0.69 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1h4m h LEU 238 CO 0.04 0.82 -0.60 0.71 -0.34 0.00 0.00 178.44 179.07 1h4m h THR 239 N 0.88 1.36 -0.38 1.05 1.35 -1.62 -0.14 112.91 115.41 1h4m h THR 239 Ca 0.21 -1.94 0.01 0.00 -0.55 0.00 0.00 66.41 64.14 1h4m h THR 239 Cb 0.23 1.94 -0.02 0.00 -1.73 0.00 0.00 68.15 68.57 1h4m h THR 239 CO -0.01 0.58 0.24 0.22 -0.25 0.00 0.00 175.52 176.29 1h4m h TYR 240 N 0.26 0.45 -0.55 4.73 3.20 -1.29 -0.98 116.97 122.79 1h4m h TYR 240 Ca -0.01 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.83 1h4m h TYR 240 Cb 1.12 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 39.22 1h4m h TYR 240 CO 0.03 0.27 0.14 1.25 -1.64 0.00 0.00 178.16 178.21 1h4m h LEU 241 N 0.48 0.78 -0.09 2.82 5.85 -1.27 -1.61 115.31 122.27 1h4m h LEU 241 Ca 0.14 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 1h4m h LEU 241 Cb -0.03 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 40.80 1h4m h LEU 241 CO -0.05 0.76 -0.02 0.40 -0.34 0.00 0.00 178.44 179.19 1h4m h ILE 242 N 0.81 1.29 -0.36 4.05 2.04 -0.53 -0.06 117.51 124.74 1h4m h ILE 242 Ca 0.18 -0.92 0.06 0.00 1.00 0.00 0.00 64.86 65.18 1h4m h ILE 242 Cb 0.28 1.72 -0.06 0.00 -0.74 0.00 0.00 36.82 38.02 1h4m h ILE 242 CO -0.00 0.26 0.01 0.00 0.00 0.00 0.00 178.15 178.42 1h4m h ALA 243 N 0.69 0.34 -0.45 1.87 0.00 -0.91 -0.68 119.26 120.10 1h4m h ALA 243 Ca 0.02 0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.12 1h4m h ALA 243 Cb 0.42 0.17 -0.09 0.00 0.00 0.00 0.00 17.79 18.28 1h4m h ALA 243 CO 0.01 -0.39 -0.11 0.87 0.00 0.00 0.00 179.25 179.63 1h4m h LYS 244 N 0.11 0.00 -0.33 0.00 1.79 -1.22 -0.36 116.57 116.56 1h4m h LYS 244 Ca 0.18 -0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.60 1h4m h LYS 244 Cb 0.24 -0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.87 1h4m h LYS 244 CO -0.29 0.00 0.02 0.00 -1.08 0.00 0.00 179.45 178.10 1h4m h ALA 245 N 1.45 1.41 -0.00 3.86 0.00 -0.48 -1.60 119.26 123.91 1h4m h ALA 245 Ca 0.22 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1h4m h ALA 245 Cb 0.33 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1h4m h ALA 245 CO -0.47 0.41 -0.01 1.28 0.00 0.00 0.00 179.25 180.47 1h4m n LEU 246 N -4.30 0.05 0.00 0.00 4.77 -0.31 -4.87 117.00 112.34 1h4m n LEU 246 Ca 0.01 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1h4m n LEU 246 Cb 0.23 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1h4m n LEU 246 CO 0.38 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 1h4m n GLY 247 N 1.21 0.68 3.72 -0.72 0.00 -0.60 -5.02 105.19 104.46 1h4m n GLY 247 Ca 0.17 -0.71 -0.42 0.00 0.00 0.00 0.00 46.02 45.06 1h4m n GLY 247 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1h4m s TYR 248 N -2.00 3.08 -0.56 1.61 1.51 -0.16 -4.89 117.35 115.94 1h4m s TYR 248 Ca 0.00 0.67 0.24 0.00 -1.01 0.00 0.00 57.07 56.98 1h4m s TYR 248 Cb 0.00 -3.90 0.54 0.00 -0.11 0.00 0.00 41.96 38.49 1h4m s TYR 248 CO 0.00 -3.29 1.67 -1.00 -1.11 0.00 0.00 175.55 171.82 1h4m h PRO 249 N 6.72 0.00 -3.78 -1.71 0.13 -1.88 -3.43 132.00 128.04 1h4m h PRO 249 Ca -0.43 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.10 1h4m h PRO 249 Cb 1.21 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.94 1h4m h PRO 249 CO 0.90 0.00 -0.74 1.03 -0.23 0.00 0.00 178.00 178.96 1h4m s ARG 250 N -3.16 0.97 -0.02 0.86 0.52 -1.26 -5.10 118.95 111.76 1h4m s ARG 250 Ca 0.08 -1.37 0.01 0.00 -0.52 0.00 0.00 55.73 53.93 1h4m s ARG 250 Cb 0.08 -2.33 0.01 0.00 0.52 0.00 0.00 34.95 33.23 1h4m s ARG 250 CO 0.64 -0.99 -0.03 0.08 0.02 0.00 0.00 175.30 175.02 1h4m s VAL 251 N 1.30 0.30 0.02 3.52 1.01 -1.26 -0.41 120.40 124.88 1h4m s VAL 251 Ca 0.11 -0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.02 1h4m s VAL 251 Cb -0.18 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 35.87 1h4m s VAL 251 CO -0.18 0.12 -0.05 -0.54 0.00 0.00 0.00 175.10 174.45 1h4m s LYS 252 N 0.39 0.40 -0.20 2.72 1.02 0.13 -4.73 119.74 119.47 1h4m s LYS 252 Ca -0.04 -0.52 -0.13 0.00 0.02 0.00 0.00 55.97 55.29 1h4m s LYS 252 Cb -0.07 -0.18 -0.05 0.00 -0.52 0.00 0.00 37.83 37.01 1h4m s LYS 252 CO -0.01 0.03 0.28 0.20 -0.92 0.00 0.00 175.35 174.94 1h4m s GLY 253 N -1.09 2.09 -0.97 -3.33 0.00 -0.32 -1.12 107.32 102.59 1h4m s GLY 253 Ca -0.08 -0.62 -0.21 0.00 0.00 0.00 0.00 44.72 43.81 1h4m s GLY 253 CO -0.00 0.54 1.29 -0.47 0.00 0.00 0.00 173.10 174.46 1h4m s TYR 254 N 0.92 2.80 0.33 1.90 5.04 0.33 -0.89 117.35 127.79 1h4m s TYR 254 Ca 0.14 -1.08 0.10 0.00 -2.44 0.00 0.00 57.07 53.79 1h4m s TYR 254 Cb -0.14 -4.50 0.59 0.00 0.35 0.00 0.00 41.96 38.26 1h4m s TYR 254 CO 0.05 -1.73 1.77 0.00 -1.34 0.00 0.00 175.55 174.30 1h4m h ALA 255 N 9.35 1.25 -0.13 3.97 0.00 -1.86 -2.31 119.26 129.53 1h4m h ALA 255 Ca 0.17 -0.37 0.03 0.00 0.00 0.00 0.00 54.91 54.73 1h4m h ALA 255 Cb 1.02 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1h4m h ALA 255 CO 1.28 0.53 -0.03 0.78 0.00 0.00 0.00 179.25 181.81 1h4m h GLY 256 N 1.18 0.10 0.00 0.00 0.00 -1.83 -3.33 103.07 99.20 1h4m h GLY 256 Ca 0.01 0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1h4m h GLY 256 CO 0.05 -0.04 0.00 1.44 0.00 0.00 0.00 176.54 177.99 1h4m n SER 257 N -5.15 -3.43 0.26 0.19 7.64 -0.87 -2.77 113.62 109.49 1h4m n SER 257 Ca -0.04 0.00 0.13 0.00 1.01 0.00 0.00 58.87 59.97 1h4m n SER 257 Cb 0.09 0.00 0.68 0.00 -1.01 0.00 0.00 64.21 63.97 1h4m n SER 257 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 1h4m h TRP 258 N 0.00 0.00 -0.64 1.43 2.91 -0.60 0.18 115.95 119.22 1h4m h TRP 258 Ca 0.00 0.00 0.09 0.00 1.13 0.00 0.00 58.89 60.11 1h4m h TRP 258 Cb 0.00 0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 28.61 1h4m h TRP 258 CO 0.00 0.13 0.43 0.78 -1.03 0.00 0.00 178.44 178.75 1h4m h GLY 259 N 1.13 0.71 0.00 2.65 0.00 -1.03 0.11 103.07 106.63 1h4m h GLY 259 Ca -0.00 -0.21 -0.19 0.00 0.00 0.00 0.00 47.33 46.93 1h4m h GLY 259 CO 0.02 0.13 -1.19 -2.21 0.00 0.00 0.00 176.54 173.29 1h4m n GLU 260 N -4.48 0.54 -0.31 4.80 2.13 -0.30 -4.23 120.64 118.80 1h4m n GLU 260 Ca 0.10 0.54 0.01 0.00 0.66 0.00 0.00 57.16 58.47 1h4m n GLU 260 Cb 0.34 -1.71 0.15 0.00 0.27 0.00 0.00 31.44 30.49 1h4m n GLU 260 CO 0.00 0.00 0.00 2.35 -0.41 0.00 0.00 177.13 179.07 1h4m h TRP 261 N -1.00 0.96 0.00 4.31 2.91 -0.43 -0.82 115.95 121.89 1h4m h TRP 261 Ca -0.29 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.76 1h4m h TRP 261 Cb 1.14 -0.31 0.00 0.00 -0.51 0.00 0.00 29.16 29.48 1h4m h TRP 261 CO -0.00 0.47 0.00 0.41 -1.03 0.00 0.00 178.44 178.29 1h4m n GLY 262 N -1.33 -1.41 0.16 2.65 0.00 0.35 -3.05 105.19 102.56 1h4m n GLY 262 Ca 0.13 -0.09 0.05 0.00 0.00 0.00 0.00 46.02 46.11 1h4m n GLY 262 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h4m n ASN 263 N -1.53 0.98 -4.81 1.61 3.02 -0.41 -1.00 115.26 113.11 1h4m n ASN 263 Ca 0.06 -0.99 -0.38 0.00 -0.03 0.00 0.00 54.58 53.24 1h4m n ASN 263 Cb 0.31 0.62 -0.06 0.00 -0.61 0.00 0.00 39.78 40.04 1h4m n ASN 263 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1h4m s HIS 264 N -1.49 3.69 0.35 3.10 2.46 -0.62 -4.96 115.29 117.83 1h4m s HIS 264 Ca 0.07 0.99 0.04 0.00 0.47 0.00 0.00 55.06 56.63 1h4m s HIS 264 Cb 0.08 -2.35 0.69 0.00 -0.13 0.00 0.00 32.58 30.87 1h4m s HIS 264 CO 0.28 0.55 1.97 -1.35 -2.47 0.00 0.00 174.74 173.72 1h4m h PRO 265 N 5.09 0.79 0.00 2.88 0.11 -1.91 -3.18 132.00 135.78 1h4m h PRO 265 Ca -0.49 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1h4m h PRO 265 Cb 1.21 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1h4m h PRO 265 CO 0.64 0.52 0.00 -0.25 -0.21 0.00 0.00 178.00 178.71 1h4m n ASP 266 N -4.47 0.00 -4.68 -2.05 8.00 -1.26 -4.90 116.55 107.20 1h4m n ASP 266 Ca 0.10 0.26 -0.37 0.00 0.71 0.00 0.00 54.79 55.48 1h4m n ASP 266 Cb 0.18 -0.42 -0.08 0.00 -0.02 0.00 0.00 41.12 40.78 1h4m n ASP 266 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1h4m s THR 267 N -2.84 5.26 0.39 -3.53 -4.23 -1.20 -5.04 115.64 104.45 1h4m s THR 267 Ca 0.19 0.54 -0.24 0.00 -1.18 0.00 0.00 61.69 61.00 1h4m s THR 267 Cb 0.19 -3.65 -0.09 0.00 1.34 0.00 0.00 72.50 70.29 1h4m s THR 267 CO 0.49 0.30 1.05 -2.16 -0.54 0.00 0.00 174.62 173.77 1h4m s PRO 268 N 1.08 4.20 0.14 3.99 0.04 -1.26 -4.97 135.00 138.22 1h4m s PRO 268 Ca 0.16 1.52 0.08 0.00 0.04 0.00 0.00 61.00 62.80 1h4m s PRO 268 Cb -0.14 -2.58 -0.04 0.00 0.04 0.00 0.00 34.50 31.78 1h4m s PRO 268 CO 0.06 -0.11 -0.19 0.08 0.04 0.00 0.00 177.00 176.88 1h4m s VAL 269 N -1.64 1.80 0.00 -0.36 1.01 -1.26 -4.33 120.40 115.63 1h4m s VAL 269 Ca 0.57 -1.79 0.00 0.00 0.00 0.00 0.00 61.98 60.77 1h4m s VAL 269 Cb -0.22 -1.75 -0.01 0.00 0.00 0.00 0.00 36.38 34.40 1h4m s VAL 269 CO 0.28 -0.21 -0.02 -0.70 0.00 0.00 0.00 175.10 174.45 1h4m s GLU 270 N -2.47 0.13 0.00 2.72 2.12 0.14 -4.87 118.70 116.47 1h4m s GLU 270 Ca 0.13 -0.17 0.09 0.00 0.36 0.00 0.00 54.97 55.37 1h4m s GLU 270 Cb -0.07 -0.04 0.07 0.00 0.26 0.00 0.00 34.13 34.35 1h4m s GLU 270 CO 0.06 0.01 0.78 1.28 -0.54 0.00 0.00 175.26 176.84