#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a5t s ARG 2 N 0.00 0.45 -0.87 2.12 3.52 -1.26 -5.08 118.95 117.83 1a5t s ARG 2 Ca 0.00 0.54 -0.19 0.00 -0.13 0.00 0.00 55.73 55.95 1a5t s ARG 2 Cb 0.00 0.22 0.13 0.00 -1.56 0.00 0.00 34.95 33.73 1a5t s ARG 2 CO 0.00 -0.06 1.07 -0.46 -0.81 0.00 0.00 175.30 175.04 1a5t s TRP 3 N 0.23 3.09 0.44 5.12 -0.11 -1.26 -4.69 118.94 121.75 1a5t s TRP 3 Ca -0.00 -1.29 -0.24 0.00 1.22 0.00 0.00 56.10 55.78 1a5t s TRP 3 Cb -0.03 -4.25 -0.08 0.00 -1.50 0.00 0.00 33.47 27.62 1a5t s TRP 3 CO 0.00 -1.48 1.20 0.71 -4.62 0.00 0.00 176.95 172.77 1a5t s TYR 4 N 2.74 2.89 0.11 5.86 2.02 -1.26 -4.95 117.35 124.77 1a5t s TYR 4 Ca 0.30 1.51 0.33 0.00 -0.37 0.00 0.00 57.07 58.84 1a5t s TYR 4 Cb -0.08 -3.46 1.60 0.00 -0.40 0.00 0.00 41.96 39.62 1a5t s TYR 4 CO -0.06 -1.63 1.99 -1.00 -1.57 0.00 0.00 175.55 173.28 1a5t h PRO 5 N 2.32 0.00 -0.00 -1.71 0.13 -2.00 -2.79 132.00 127.95 1a5t h PRO 5 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1a5t h PRO 5 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1a5t h PRO 5 CO 0.61 0.00 -0.07 -2.67 -0.23 0.00 0.00 178.00 175.64 1a5t n TRP 6 N -2.77 0.00 0.11 1.56 2.14 -1.26 -3.81 117.44 113.41 1a5t n TRP 6 Ca -0.01 0.00 -0.02 0.00 2.07 0.00 0.00 57.50 59.54 1a5t n TRP 6 Cb 0.17 -0.17 0.03 0.00 -0.81 0.00 0.00 31.31 30.53 1a5t n TRP 6 CO 0.00 0.00 0.00 -0.07 2.07 0.00 0.00 177.69 179.69 1a5t h LEU 7 N 0.49 0.00 -0.72 5.67 3.38 -1.85 -3.38 115.31 118.90 1a5t h LEU 7 Ca 0.00 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.10 1a5t h LEU 7 Cb 0.31 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.93 1a5t h LEU 7 CO 0.00 0.75 -0.27 -0.09 0.09 0.00 0.00 178.44 178.92 1a5t h ARG 8 N 0.00 -0.06 -0.55 1.13 2.43 -1.78 -0.52 114.38 115.03 1a5t h ARG 8 Ca -0.01 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.27 1a5t h ARG 8 Cb 1.44 0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 30.91 1a5t h ARG 8 CO 0.10 -0.04 0.02 -1.35 -1.51 0.00 0.00 179.97 177.18 1a5t h PRO 9 N -0.07 0.13 -0.15 0.20 0.11 -1.88 0.90 132.00 131.24 1a5t h PRO 9 Ca 0.31 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.36 1a5t h PRO 9 Cb 0.56 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.64 1a5t h PRO 9 CO -0.77 0.09 -0.13 -0.44 -0.21 0.00 0.00 178.00 176.54 1a5t h ASP 10 N 0.14 0.38 -0.13 -2.05 5.19 -1.66 -2.50 116.42 115.79 1a5t h ASP 10 Ca 0.28 -0.47 0.03 0.00 -0.62 0.00 0.00 57.03 56.25 1a5t h ASP 10 Cb 0.43 -0.11 -0.03 0.00 0.18 0.00 0.00 39.33 39.80 1a5t h ASP 10 CO -0.45 0.77 -0.07 0.15 -3.12 0.00 0.00 179.24 176.52 1a5t h PHE 11 N -0.00 -0.15 -0.04 4.55 3.57 -0.74 -0.83 116.94 123.29 1a5t h PHE 11 Ca 0.03 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.49 1a5t h PHE 11 Cb 0.65 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 1a5t h PHE 11 CO 0.08 -0.11 -0.23 0.93 -2.23 0.00 0.00 178.31 176.75 1a5t h GLU 12 N -0.06 0.06 -0.21 1.11 4.39 -0.86 0.02 114.58 119.03 1a5t h GLU 12 Ca 0.07 -0.02 -0.11 0.00 0.34 0.00 0.00 59.36 59.64 1a5t h GLU 12 Cb 0.16 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1a5t h GLU 12 CO -0.16 0.29 -0.31 0.87 -1.16 0.00 0.00 179.01 178.54 1a5t h LYS 13 N 0.06 0.58 -0.02 2.33 1.79 -0.94 -2.40 116.57 117.96 1a5t h LYS 13 Ca 0.01 -0.34 -0.07 0.00 -2.18 0.00 0.00 60.65 58.06 1a5t h LYS 13 Cb 0.45 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 1a5t h LYS 13 CO 0.03 0.95 -0.26 -0.07 -1.08 0.00 0.00 179.45 179.02 1a5t h LEU 14 N 0.26 0.27 -1.04 2.94 3.38 -0.94 -3.20 115.31 116.98 1a5t h LEU 14 Ca 0.02 -0.72 0.04 0.00 0.09 0.00 0.00 57.88 57.31 1a5t h LEU 14 Cb 0.89 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.50 1a5t h LEU 14 CO 0.07 0.95 0.64 1.62 0.09 0.00 0.00 178.44 181.82 1a5t h VAL 15 N -0.39 1.16 -0.70 1.22 3.04 -1.08 -1.30 116.25 118.20 1a5t h VAL 15 Ca -0.03 -0.42 -0.03 0.00 -1.01 0.00 0.00 66.70 65.21 1a5t h VAL 15 Cb 0.97 -0.18 -0.03 0.00 -2.01 0.00 0.00 31.29 30.04 1a5t h VAL 15 CO 0.05 0.22 0.30 0.00 -1.01 0.00 0.00 177.57 177.14 1a5t h ALA 16 N 1.43 1.22 -0.58 3.17 0.00 -1.54 -1.45 119.26 121.50 1a5t h ALA 16 Ca 0.40 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 55.05 1a5t h ALA 16 Cb 0.03 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1a5t h ALA 16 CO -0.13 0.58 0.01 0.66 0.00 0.00 0.00 179.25 180.37 1a5t h SER 17 N 1.00 0.97 0.07 0.00 4.64 -1.24 0.67 113.55 119.67 1a5t h SER 17 Ca 0.24 -0.26 -0.13 0.00 -0.47 0.00 0.00 61.79 61.17 1a5t h SER 17 Cb 0.16 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 61.98 1a5t h SER 17 CO -0.02 1.02 -0.43 1.88 -0.87 0.00 0.00 176.83 178.41 1a5t h TYR 18 N 0.92 0.53 -0.35 4.77 0.05 -1.09 0.49 116.97 122.29 1a5t h TYR 18 Ca 0.17 -0.16 -0.09 0.00 0.05 0.00 0.00 58.73 58.71 1a5t h TYR 18 Cb 0.52 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 38.14 1a5t h TYR 18 CO 0.03 0.80 -0.12 0.37 -1.05 0.00 0.00 178.16 178.20 1a5t h GLN 19 N 0.36 0.69 -0.57 4.88 4.15 -0.89 -3.02 115.11 120.71 1a5t h GLN 19 Ca 0.03 -0.28 0.00 0.00 0.77 0.00 0.00 58.65 59.17 1a5t h GLN 19 Cb 0.91 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.56 1a5t h GLN 19 CO 0.08 0.87 0.00 0.00 -1.93 0.00 0.00 178.83 177.85 1a5t n ALA 20 N -2.44 2.79 -0.94 3.38 0.00 0.19 -4.91 120.51 118.58 1a5t n ALA 20 Ca -0.02 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.66 1a5t n ALA 20 Cb 0.36 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.80 1a5t n ALA 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a5t n GLY 21 N 0.69 0.65 1.23 0.00 0.00 -0.93 -4.89 105.19 101.94 1a5t n GLY 21 Ca 0.12 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.19 1a5t n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a5t n ARG 22 N -2.08 3.06 -3.00 1.61 5.12 0.17 -4.94 116.66 116.60 1a5t n ARG 22 Ca 0.00 -1.72 -0.36 0.00 -1.93 0.00 0.00 57.85 53.84 1a5t n ARG 22 Cb 0.04 -1.87 -0.06 0.00 -1.16 0.00 0.00 32.46 29.40 1a5t n ARG 22 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1a5t s GLY 23 N -0.48 2.63 -0.04 -0.13 0.00 -0.89 -4.78 107.32 103.63 1a5t s GLY 23 Ca 0.30 0.27 -0.13 0.00 0.00 0.00 0.00 44.72 45.16 1a5t s GLY 23 CO 0.10 0.63 0.33 -1.58 0.00 0.00 0.00 173.10 172.58 1a5t s HIS 24 N -1.62 3.68 0.19 1.90 2.46 -1.26 -4.96 115.29 115.67 1a5t s HIS 24 Ca 0.47 0.85 0.36 0.00 0.47 0.00 0.00 55.06 57.20 1a5t s HIS 24 Cb -0.16 -2.20 1.57 0.00 -0.13 0.00 0.00 32.58 31.66 1a5t s HIS 24 CO 0.21 0.64 2.05 1.12 -2.47 0.00 0.00 174.74 176.29 1a5t h HIS 25 N 4.92 0.00 -3.39 3.88 2.07 -1.91 -3.38 115.15 117.34 1a5t h HIS 25 Ca -0.52 0.00 -0.61 0.00 -2.85 0.00 0.00 60.37 56.39 1a5t h HIS 25 Cb 1.22 0.00 -0.40 0.00 2.57 0.00 0.00 27.41 30.80 1a5t h HIS 25 CO 0.72 0.00 -0.75 0.00 -3.07 0.00 0.00 177.93 174.83 1a5t s ALA 26 N -3.75 2.00 -0.25 6.11 0.00 -1.26 0.13 121.76 124.74 1a5t s ALA 26 Ca -0.00 -1.86 -0.09 0.00 0.00 0.00 0.00 51.96 50.01 1a5t s ALA 26 Cb 0.10 -1.69 -0.04 0.00 0.00 0.00 0.00 23.12 21.49 1a5t s ALA 26 CO 0.51 -1.59 0.12 -1.17 0.00 0.00 0.00 175.76 173.63 1a5t s LEU 27 N 1.37 3.73 -0.35 0.00 2.96 -0.60 -0.90 118.68 124.90 1a5t s LEU 27 Ca 0.08 -0.09 -0.09 0.00 -0.22 0.00 0.00 54.13 53.81 1a5t s LEU 27 Cb -0.18 -2.01 0.03 0.00 0.50 0.00 0.00 46.19 44.52 1a5t s LEU 27 CO -0.17 -0.02 0.15 -0.22 -1.32 0.00 0.00 176.35 174.78 1a5t s LEU 28 N 1.53 4.40 -0.20 -0.68 2.96 0.51 -0.73 118.68 126.47 1a5t s LEU 28 Ca 0.06 -0.96 -0.14 0.00 -0.22 0.00 0.00 54.13 52.87 1a5t s LEU 28 Cb -0.15 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.55 1a5t s LEU 28 CO 0.06 -0.32 0.33 -0.63 -1.32 0.00 0.00 176.35 174.47 1a5t s ILE 29 N 1.50 5.25 -0.22 6.68 1.01 0.63 0.16 121.20 136.21 1a5t s ILE 29 Ca 0.01 0.57 -0.08 0.00 0.00 0.00 0.00 60.65 61.15 1a5t s ILE 29 Cb -0.19 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 1a5t s ILE 29 CO 0.05 0.29 0.09 -1.58 0.00 0.00 0.00 174.94 173.78 1a5t s GLN 30 N 1.14 3.86 -0.12 2.79 0.74 0.19 -1.30 119.66 126.96 1a5t s GLN 30 Ca 0.16 -0.38 -0.29 0.00 0.05 0.00 0.00 55.36 54.90 1a5t s GLN 30 Cb -0.14 -3.33 0.07 0.00 1.10 0.00 0.00 33.01 30.71 1a5t s GLN 30 CO 0.07 0.04 0.71 0.00 -0.55 0.00 0.00 175.29 175.56 1a5t s ALA 31 N 1.02 -1.78 0.73 1.58 0.00 -0.43 -0.55 121.76 122.33 1a5t s ALA 31 Ca 0.05 1.55 -0.11 0.00 0.00 0.00 0.00 51.96 53.44 1a5t s ALA 31 Cb -0.14 -0.40 0.03 0.00 0.00 0.00 0.00 23.12 22.61 1a5t s ALA 31 CO 0.03 -0.36 1.09 -0.51 0.00 0.00 0.00 175.76 176.01 1a5t s LEU 32 N -0.70 3.13 0.47 0.00 1.02 -1.26 -3.79 118.68 117.54 1a5t s LEU 32 Ca -0.07 1.81 -0.22 0.00 0.02 0.00 0.00 54.13 55.66 1a5t s LEU 32 Cb -0.02 -4.52 -0.07 0.00 0.02 0.00 0.00 46.19 41.60 1a5t s LEU 32 CO 0.07 -1.82 1.13 -2.16 0.02 0.00 0.00 176.35 173.58 1a5t s PRO 33 N -4.78 3.75 0.00 1.29 0.04 -1.26 -3.07 135.00 130.97 1a5t s PRO 33 Ca 0.61 1.66 0.00 0.00 0.04 0.00 0.00 61.00 63.32 1a5t s PRO 33 Cb -0.17 -2.32 0.00 0.00 0.04 0.00 0.00 34.50 32.05 1a5t s PRO 33 CO 0.53 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 177.44 1a5t n GLY 34 N 0.31 0.72 0.05 0.56 0.00 -1.26 -4.08 105.19 101.49 1a5t n GLY 34 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.22 1a5t n GLY 34 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1a5t n MET 35 N -2.46 0.25 -1.25 1.61 2.81 -1.17 -1.21 117.12 115.71 1a5t n MET 35 Ca 0.00 0.05 0.00 0.00 -1.81 0.00 0.00 57.70 55.94 1a5t n MET 35 Cb 0.00 -1.64 0.00 0.00 -0.71 0.00 0.00 33.22 30.87 1a5t n MET 35 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1a5t n GLY 36 N 1.37 1.03 0.19 3.03 0.00 -1.26 -4.92 105.19 104.62 1a5t n GLY 36 Ca 0.03 -0.49 0.04 0.00 0.00 0.00 0.00 46.02 45.60 1a5t n GLY 36 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1a5t h ASP 37 N 0.00 0.00 -0.34 1.61 2.03 -1.94 -1.86 116.42 115.92 1a5t h ASP 37 Ca 0.00 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.26 1a5t h ASP 37 Cb 0.59 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.07 1a5t h ASP 37 CO 0.00 0.36 0.05 -2.24 -1.03 0.00 0.00 179.24 176.37 1a5t h ASP 38 N 0.00 0.54 0.05 4.15 2.03 -1.97 0.03 116.42 121.26 1a5t h ASP 38 Ca -0.00 -0.27 -0.12 0.00 -0.73 0.00 0.00 57.03 55.91 1a5t h ASP 38 Cb 0.69 -0.14 -0.01 0.00 -0.83 0.00 0.00 39.33 39.03 1a5t h ASP 38 CO 0.05 0.67 -0.38 0.00 -1.03 0.00 0.00 179.24 178.55 1a5t h ALA 39 N 0.89 0.99 -0.06 4.15 0.00 -1.76 -0.98 119.26 122.49 1a5t h ALA 39 Ca 0.10 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1a5t h ALA 39 Cb 0.37 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1a5t h ALA 39 CO 0.01 0.61 -0.02 1.25 0.00 0.00 0.00 179.25 181.10 1a5t h LEU 40 N 0.36 0.12 -1.15 0.00 5.85 -1.19 -0.11 115.31 119.18 1a5t h LEU 40 Ca 0.04 -0.39 -0.05 0.00 0.84 0.00 0.00 57.88 58.32 1a5t h LEU 40 Cb 0.83 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 1a5t h LEU 40 CO 0.07 0.48 0.02 0.40 -0.34 0.00 0.00 178.44 179.06 1a5t h ILE 41 N -0.24 1.21 -0.15 4.05 2.04 -0.92 -1.77 117.51 121.72 1a5t h ILE 41 Ca 0.01 -0.82 -0.08 0.00 1.00 0.00 0.00 64.86 64.97 1a5t h ILE 41 Cb 0.43 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 37.41 1a5t h ILE 41 CO 0.01 0.29 -0.20 0.22 0.00 0.00 0.00 178.15 178.47 1a5t h TYR 42 N 0.58 0.50 -0.36 1.37 3.20 -1.06 0.13 116.97 121.33 1a5t h TYR 42 Ca 0.12 -0.16 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 1a5t h TYR 42 Cb 0.34 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 1a5t h TYR 42 CO 0.01 0.82 0.22 0.00 -1.64 0.00 0.00 178.16 177.57 1a5t h ALA 43 N 0.59 1.71 0.02 1.82 0.00 -0.86 0.27 119.26 122.81 1a5t h ALA 43 Ca 0.02 -0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.64 1a5t h ALA 43 Cb 0.75 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.41 1a5t h ALA 43 CO 0.05 0.26 -1.02 -0.07 0.00 0.00 0.00 179.25 178.46 1a5t h LEU 44 N 0.49 0.70 -0.22 0.00 3.38 -1.16 -2.20 115.31 116.30 1a5t h LEU 44 Ca 0.13 -0.58 -0.00 0.00 0.09 0.00 0.00 57.88 57.52 1a5t h LEU 44 Cb -0.03 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1a5t h LEU 44 CO -0.03 1.38 0.13 0.28 0.09 0.00 0.00 178.44 180.29 1a5t h SER 45 N 0.29 0.28 -0.94 -0.43 0.02 0.42 -2.05 113.55 111.14 1a5t h SER 45 Ca -0.11 -0.07 0.01 0.00 -0.84 0.00 0.00 61.79 60.78 1a5t h SER 45 Cb 1.67 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 64.09 1a5t h SER 45 CO 0.19 0.27 0.62 0.03 -1.14 0.00 0.00 176.83 176.79 1a5t h ARG 46 N 0.26 1.22 -0.05 3.45 2.47 -0.55 -1.65 114.38 119.53 1a5t h ARG 46 Ca 0.08 -0.07 -0.00 0.00 -1.26 0.00 0.00 59.98 58.73 1a5t h ARG 46 Cb 0.05 -0.27 -0.00 0.00 -1.65 0.00 0.00 29.97 28.09 1a5t h ARG 46 CO -0.01 0.80 0.03 -0.92 0.56 0.00 0.00 179.97 180.43 1a5t h TYR 47 N 1.25 0.07 0.00 3.04 3.20 -0.99 -2.30 116.97 121.24 1a5t h TYR 47 Ca 0.35 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.17 1a5t h TYR 47 Cb -0.12 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.12 1a5t h TYR 47 CO -0.01 0.11 -0.23 -0.07 -1.64 0.00 0.00 178.16 176.33 1a5t h LEU 48 N 0.01 0.00 -1.67 2.82 3.38 -0.97 -2.11 115.31 116.78 1a5t h LEU 48 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1a5t h LEU 48 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1a5t h LEU 48 CO -0.00 0.23 0.00 0.18 0.09 0.00 0.00 178.44 178.94 1a5t n LEU 49 N -3.97 2.51 -4.66 1.67 4.77 -0.66 -4.56 117.00 112.11 1a5t n LEU 49 Ca -0.02 -1.02 -0.42 0.00 -0.03 0.00 0.00 56.01 54.52 1a5t n LEU 49 Cb 0.31 -0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.23 1a5t n LEU 49 CO 0.35 0.51 0.72 0.00 -1.33 0.00 0.00 177.39 177.64 1a5t n GLN 51 N 5.81 0.09 -2.95 0.00 6.02 -1.26 -3.97 117.38 121.12 1a5t n GLN 51 Ca 0.07 0.09 -0.14 0.00 -0.01 0.00 0.00 57.00 57.02 1a5t n GLN 51 Cb 0.48 -1.50 0.03 0.00 1.02 0.00 0.00 30.24 30.26 1a5t n GLN 51 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1a5t n GLN 52 N -1.45 0.96 -1.69 -1.09 -0.06 -1.26 -5.13 117.38 107.67 1a5t n GLN 52 Ca 0.07 -2.58 -0.39 0.00 -2.00 0.00 0.00 57.00 52.10 1a5t n GLN 52 Cb 0.25 -1.35 0.03 0.00 -4.06 0.00 0.00 30.24 25.12 1a5t n GLN 52 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 1a5t n PRO 53 N 0.52 1.51 -3.74 3.69 -0.04 -1.25 -4.36 135.00 131.32 1a5t n PRO 53 Ca 0.15 0.55 -0.36 0.00 -0.04 0.00 0.00 63.50 63.80 1a5t n PRO 53 Cb 0.67 -2.37 -0.10 0.00 -0.04 0.00 0.00 33.50 31.65 1a5t n PRO 53 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1a5t s GLN 54 N -2.60 2.33 6.78 0.54 -0.21 -0.59 -4.95 119.66 120.97 1a5t s GLN 54 Ca 0.69 -2.25 0.00 0.00 0.02 0.00 0.00 55.36 53.83 1a5t s GLN 54 Cb -0.45 -3.67 0.00 0.00 1.00 0.00 0.00 33.01 29.89 1a5t s GLN 54 CO 0.52 -1.13 0.00 0.41 -2.12 0.00 0.00 175.29 172.96 1a5t n GLY 55 N 3.93 2.14 0.39 3.09 0.00 -1.26 -1.68 105.19 111.79 1a5t n GLY 55 Ca 0.04 -0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.05 1a5t n GLY 55 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1a5t n HIS 56 N 4.99 0.00 -3.58 1.61 8.25 -1.26 -4.99 115.22 120.24 1a5t n HIS 56 Ca 0.00 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.20 1a5t n HIS 56 Cb 0.00 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 1a5t n HIS 56 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1a5t s LYS 57 N -1.90 3.53 0.35 -0.41 1.02 -0.68 -4.79 119.74 116.85 1a5t s LYS 57 Ca 0.14 -0.30 -0.25 0.00 0.02 0.00 0.00 55.97 55.57 1a5t s LYS 57 Cb 0.13 -2.77 -0.10 0.00 -0.52 0.00 0.00 37.83 34.57 1a5t s LYS 57 CO 0.40 0.32 0.95 0.45 -0.92 0.00 0.00 175.35 176.55 1a5t s SER 58 N -3.40 7.24 0.17 2.83 0.15 -1.26 -1.54 113.70 117.89 1a5t s SER 58 Ca 0.39 1.81 -0.01 0.00 0.70 0.00 0.00 55.95 58.85 1a5t s SER 58 Cb -0.10 -2.57 0.02 0.00 -1.71 0.00 0.00 66.02 61.65 1a5t s SER 58 CO 0.31 -0.14 1.40 0.00 1.20 0.00 0.00 173.24 176.00 1a5t n GLY 60 N 0.72 0.59 0.60 0.00 0.00 -1.26 -4.87 105.19 100.96 1a5t n GLY 60 Ca -0.04 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1a5t n GLY 60 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1a5t n HIS 61 N -2.81 0.00 -0.78 1.61 8.25 -1.26 -4.80 115.22 115.42 1a5t n HIS 61 Ca 0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.13 1a5t n HIS 61 Cb 0.00 0.08 0.13 0.00 1.12 0.00 0.00 29.99 31.32 1a5t n HIS 61 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a5t h ARG 63 N -1.64 0.62 -0.37 0.00 2.43 -1.98 -1.48 114.38 111.96 1a5t h ARG 63 Ca -0.45 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.66 1a5t h ARG 63 Cb 1.30 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 1a5t h ARG 63 CO 0.34 0.44 0.20 0.78 -1.51 0.00 0.00 179.97 180.23 1a5t h GLY 64 N 0.68 0.54 1.35 2.80 0.00 -1.89 0.53 103.07 107.09 1a5t h GLY 64 Ca 0.17 -0.24 -0.09 0.00 0.00 0.00 0.00 47.33 47.17 1a5t h GLY 64 CO -0.03 0.23 -0.08 0.00 0.00 0.00 0.00 176.54 176.66 1a5t h GLN 66 N 0.71 0.05 -0.12 0.00 4.20 -0.58 0.20 115.11 119.56 1a5t h GLN 66 Ca 0.12 -0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.77 1a5t h GLN 66 Cb 0.55 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 1a5t h GLN 66 CO 0.03 0.09 -0.18 -0.07 -0.67 0.00 0.00 178.83 178.03 1a5t h LEU 67 N -0.01 0.19 -0.19 1.46 3.38 -0.80 -1.10 115.31 118.24 1a5t h LEU 67 Ca 0.01 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 1a5t h LEU 67 Cb 0.05 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1a5t h LEU 67 CO -0.00 0.39 -0.17 0.24 0.09 0.00 0.00 178.44 178.98 1a5t h MET 68 N 0.18 0.45 -0.97 1.13 2.86 -0.66 0.50 114.93 118.42 1a5t h MET 68 Ca 0.03 -0.23 0.07 0.00 -2.06 0.00 0.00 59.70 57.52 1a5t h MET 68 Cb 0.44 0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.04 1a5t h MET 68 CO 0.03 0.80 0.63 1.96 1.06 0.00 0.00 176.91 181.38 1a5t h GLN 69 N 0.11 1.06 0.00 1.72 4.20 -0.35 0.08 115.11 121.94 1a5t h GLN 69 Ca 0.03 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.55 1a5t h GLN 69 Cb 0.71 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 1a5t h GLN 69 CO 0.04 0.70 -0.62 0.00 -0.67 0.00 0.00 178.83 178.28 1a5t h ALA 70 N 1.49 0.89 0.00 3.87 0.00 -1.07 -3.47 119.26 120.96 1a5t h ALA 70 Ca 0.43 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1a5t h ALA 70 Cb 0.23 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1a5t h ALA 70 CO -0.18 0.78 0.00 0.41 0.00 0.00 0.00 179.25 180.26 1a5t n GLY 71 N 0.43 0.96 0.01 0.00 0.00 0.50 -4.98 105.19 102.09 1a5t n GLY 71 Ca -0.01 -0.56 0.01 0.00 0.00 0.00 0.00 46.02 45.46 1a5t n GLY 71 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1a5t n THR 72 N -2.84 0.98 -1.79 2.61 -2.24 0.14 -5.00 114.28 106.15 1a5t n THR 72 Ca 0.00 -1.00 -0.42 0.00 -2.27 0.00 0.00 64.05 60.36 1a5t n THR 72 Cb 0.28 0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 68.98 1a5t n THR 72 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1a5t s HIS 73 N -1.03 1.52 -0.62 4.78 2.46 -1.01 -4.87 115.29 116.52 1a5t s HIS 73 Ca 0.02 -0.01 0.18 0.00 0.47 0.00 0.00 55.06 55.72 1a5t s HIS 73 Cb 0.01 -4.08 0.81 0.00 -0.13 0.00 0.00 32.58 29.19 1a5t s HIS 73 CO 0.00 -4.58 1.55 -0.35 -2.47 0.00 0.00 174.74 168.89 1a5t n PRO 74 N 7.69 0.11 -0.12 2.88 -0.04 -1.26 -2.57 135.00 141.69 1a5t n PRO 74 Ca 0.21 0.43 0.10 0.00 -0.04 0.00 0.00 63.50 64.20 1a5t n PRO 74 Cb 0.43 -1.75 0.16 0.00 -0.04 0.00 0.00 33.50 32.30 1a5t n PRO 74 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1a5t n ASP 75 N -1.97 3.08 -4.52 3.54 8.00 -1.26 -4.87 116.55 118.56 1a5t n ASP 75 Ca 0.01 -1.91 -0.34 0.00 0.71 0.00 0.00 54.79 53.27 1a5t n ASP 75 Cb 0.15 -0.16 -0.12 0.00 -0.02 0.00 0.00 41.12 40.97 1a5t n ASP 75 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1a5t s TYR 76 N -1.43 3.05 0.03 1.24 5.04 -1.06 -1.74 117.35 122.48 1a5t s TYR 76 Ca 0.31 -0.25 0.07 0.00 -2.44 0.00 0.00 57.07 54.76 1a5t s TYR 76 Cb 0.19 -1.97 -0.02 0.00 0.35 0.00 0.00 41.96 40.51 1a5t s TYR 76 CO 0.27 -0.00 -0.21 0.71 -1.34 0.00 0.00 175.55 174.97 1a5t s TYR 77 N 0.33 1.88 -0.08 4.97 1.51 0.07 -4.91 117.35 121.12 1a5t s TYR 77 Ca -0.03 -0.38 0.01 0.00 -1.01 0.00 0.00 57.07 55.66 1a5t s TYR 77 Cb -0.14 -1.14 0.02 0.00 -0.11 0.00 0.00 41.96 40.59 1a5t s TYR 77 CO 0.03 0.07 -0.09 0.99 -1.11 0.00 0.00 175.55 175.44 1a5t s THR 78 N -0.75 0.98 -0.32 -0.71 2.01 -1.26 -1.23 115.64 114.36 1a5t s THR 78 Ca 0.08 -0.34 0.00 0.00 0.31 0.00 0.00 61.69 61.74 1a5t s THR 78 Cb -0.09 -0.95 0.07 0.00 0.01 0.00 0.00 72.50 71.55 1a5t s THR 78 CO 0.01 0.33 0.02 -0.76 -0.69 0.00 0.00 174.62 173.54 1a5t s LEU 79 N 1.06 4.19 0.06 4.42 1.43 0.04 -4.96 118.68 124.91 1a5t s LEU 79 Ca -0.08 -1.60 0.02 0.00 -1.03 0.00 0.00 54.13 51.45 1a5t s LEU 79 Cb -0.14 -1.68 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 1a5t s LEU 79 CO -0.01 -0.32 -0.08 0.00 0.23 0.00 0.00 176.35 176.18 1a5t s ALA 80 N 1.13 0.70 0.19 4.21 0.00 -1.26 -1.36 121.76 125.38 1a5t s ALA 80 Ca -0.01 -0.89 -0.32 0.00 0.00 0.00 0.00 51.96 50.74 1a5t s ALA 80 Cb -0.20 0.05 -0.12 0.00 0.00 0.00 0.00 23.12 22.85 1a5t s ALA 80 CO -0.04 -0.04 1.73 -0.35 0.00 0.00 0.00 175.76 177.06 1a5t n PRO 81 N 1.17 2.72 -1.55 0.00 -0.04 -1.26 -4.85 135.00 131.19 1a5t n PRO 81 Ca -0.21 0.98 -0.48 0.00 -0.04 0.00 0.00 63.50 63.75 1a5t n PRO 81 Cb 0.56 -2.83 -0.04 0.00 -0.04 0.00 0.00 33.50 31.15 1a5t n PRO 81 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1a5t n GLU 82 N 4.17 0.95 0.31 0.54 4.71 -1.26 -4.74 120.64 125.32 1a5t n GLU 82 Ca 0.16 0.34 0.11 0.00 -0.01 0.00 0.00 57.16 57.76 1a5t n GLU 82 Cb 0.35 -1.73 0.60 0.00 -1.01 0.00 0.00 31.44 29.64 1a5t n GLU 82 CO 0.00 0.00 0.00 -0.22 0.09 0.00 0.00 177.13 177.00 1a5t h LYS 83 N 2.70 0.00 0.00 3.49 3.64 -1.97 0.14 116.57 124.58 1a5t h LYS 83 Ca -0.41 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 1a5t h LYS 83 Cb 1.36 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 1a5t h LYS 83 CO 0.66 0.00 -0.12 0.78 -2.27 0.00 0.00 179.45 178.50 1a5t h GLY 84 N 0.00 0.00 -0.19 5.01 0.00 -1.99 -3.47 103.07 102.42 1a5t h GLY 84 Ca 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.65 1a5t h GLY 84 CO 0.00 0.00 -0.50 0.28 0.00 0.00 0.00 176.54 176.32 1a5t n LYS 85 N -2.46 0.71 -0.03 4.80 5.02 0.50 -5.06 118.16 121.65 1a5t n LYS 85 Ca 0.05 -3.81 0.02 0.00 -2.02 0.00 0.00 58.31 52.54 1a5t n LYS 85 Cb 0.46 1.11 0.03 0.00 -0.02 0.00 0.00 35.03 36.60 1a5t n LYS 85 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1a5t n ASN 86 N -1.33 1.78 -3.77 4.39 6.94 -1.26 -4.69 115.26 117.32 1a5t n ASN 86 Ca -0.20 -2.10 -0.23 0.00 -0.02 0.00 0.00 54.58 52.03 1a5t n ASN 86 Cb 0.66 -0.09 -0.08 0.00 -2.36 0.00 0.00 39.78 37.91 1a5t n ASN 86 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1a5t s THR 87 N -1.22 0.30 -0.25 5.53 -4.23 -1.26 -4.93 115.64 109.58 1a5t s THR 87 Ca 0.06 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.60 1a5t s THR 87 Cb 0.05 -2.40 0.06 0.00 1.34 0.00 0.00 72.50 71.55 1a5t s THR 87 CO 0.01 0.00 -0.11 -0.22 -0.54 0.00 0.00 174.62 173.75 1a5t s LEU 88 N -3.50 3.36 0.99 4.79 0.20 0.97 -4.21 118.68 121.28 1a5t s LEU 88 Ca 0.31 -1.34 -0.13 0.00 0.69 0.00 0.00 54.13 53.67 1a5t s LEU 88 Cb 0.02 -1.55 0.18 0.00 -0.43 0.00 0.00 46.19 44.41 1a5t s LEU 88 CO 0.20 -0.18 1.11 -0.83 -0.29 0.00 0.00 176.35 176.37 1a5t s GLY 89 N 1.12 1.57 0.16 7.98 0.00 -1.26 -1.31 107.32 115.59 1a5t s GLY 89 Ca -0.08 -0.50 -0.02 0.00 0.00 0.00 0.00 44.72 44.13 1a5t s GLY 89 CO -0.05 0.13 1.40 -2.08 0.00 0.00 0.00 173.10 172.49 1a5t h VAL 90 N -1.82 1.40 -0.12 1.40 2.07 -1.93 -3.25 116.25 113.99 1a5t h VAL 90 Ca -0.53 -2.27 0.00 0.00 0.82 0.00 0.00 66.70 64.73 1a5t h VAL 90 Cb 1.33 2.23 -0.01 0.00 -1.52 0.00 0.00 31.29 33.32 1a5t h VAL 90 CO 0.57 0.68 0.08 0.44 0.02 0.00 0.00 177.57 179.36 1a5t h ASP 91 N 0.24 0.13 -0.15 0.57 3.32 -1.98 -1.88 116.42 116.66 1a5t h ASP 91 Ca -0.04 -0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.04 1a5t h ASP 91 Cb 1.39 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.87 1a5t h ASP 91 CO 0.14 0.10 -0.09 0.00 -1.72 0.00 0.00 179.24 177.66 1a5t h ALA 92 N 1.05 0.04 0.42 3.45 0.00 -1.97 0.43 119.26 122.68 1a5t h ALA 92 Ca 0.04 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1a5t h ALA 92 Cb -0.02 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1a5t h ALA 92 CO -0.01 -0.53 -0.35 0.28 0.00 0.00 0.00 179.25 178.63 1a5t h VAL 93 N -0.08 0.00 -0.98 0.00 2.07 -1.57 -2.46 116.25 113.22 1a5t h VAL 93 Ca 0.09 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.82 1a5t h VAL 93 Cb 0.22 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 29.90 1a5t h VAL 93 CO -0.21 0.00 0.62 0.03 0.02 0.00 0.00 177.57 178.03 1a5t h ARG 94 N -0.75 0.56 -0.24 1.57 3.08 -1.27 0.30 114.38 117.63 1a5t h ARG 94 Ca -0.05 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 59.98 1a5t h ARG 94 Cb 0.64 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 1a5t h ARG 94 CO -0.01 0.37 0.16 1.49 -1.07 0.00 0.00 179.97 180.91 1a5t h GLU 95 N 0.58 0.25 0.12 0.04 4.81 -0.55 0.33 114.58 120.16 1a5t h GLU 95 Ca 0.54 -0.01 -0.30 0.00 -0.13 0.00 0.00 59.36 59.46 1a5t h GLU 95 Cb 1.10 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.42 1a5t h GLU 95 CO -0.29 0.16 -1.55 0.28 -0.73 0.00 0.00 179.01 176.88 1a5t h VAL 96 N 0.26 0.94 -0.26 0.32 2.07 -0.05 -3.31 116.25 116.22 1a5t h VAL 96 Ca 0.09 -2.39 -0.05 0.00 0.82 0.00 0.00 66.70 65.17 1a5t h VAL 96 Cb 0.06 2.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.47 1a5t h VAL 96 CO -0.02 0.73 -0.07 0.71 0.02 0.00 0.00 177.57 178.95 1a5t h THR 97 N -0.23 1.19 -0.18 2.57 1.35 -0.57 -0.23 112.91 116.82 1a5t h THR 97 Ca -0.33 -0.81 -0.01 0.00 -0.55 0.00 0.00 66.41 64.71 1a5t h THR 97 Cb 1.83 1.08 -0.01 0.00 -1.73 0.00 0.00 68.15 69.32 1a5t h THR 97 CO 0.06 0.27 0.07 -0.08 -0.25 0.00 0.00 175.52 175.59 1a5t h GLU 98 N 0.38 0.27 -0.09 4.72 4.81 -0.52 -2.07 114.58 122.09 1a5t h GLU 98 Ca 0.08 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.21 1a5t h GLU 98 Cb 0.37 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1a5t h GLU 98 CO 0.02 0.34 -0.20 0.87 -0.73 0.00 0.00 179.01 179.32 1a5t h LYS 99 N 0.14 0.16 0.00 1.92 1.57 -1.48 -1.72 116.57 117.16 1a5t h LYS 99 Ca 0.06 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1a5t h LYS 99 Cb 0.17 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1a5t h LYS 99 CO -0.00 0.35 0.00 1.28 -0.57 0.00 0.00 179.45 180.51 1a5t n LEU 100 N -4.24 0.00 -0.33 2.94 4.77 -0.16 -2.04 117.00 117.94 1a5t n LEU 100 Ca -0.01 0.45 0.13 0.00 -0.03 0.00 0.00 56.01 56.54 1a5t n LEU 100 Cb 0.30 -0.45 0.41 0.00 -2.33 0.00 0.00 43.42 41.35 1a5t n LEU 100 CO 0.38 -0.31 0.71 -3.20 -1.33 0.00 0.00 177.39 173.64 1a5t n ASN 101 N -1.45 1.21 -4.94 -1.43 4.05 -0.65 -4.83 115.26 107.23 1a5t n ASN 101 Ca 0.03 -1.09 -0.24 0.00 0.45 0.00 0.00 54.58 53.72 1a5t n ASN 101 Cb 0.09 0.10 -0.01 0.00 1.23 0.00 0.00 39.78 41.19 1a5t n ASN 101 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 1a5t s GLU 102 N -2.35 3.49 0.18 1.20 2.02 -0.87 -5.06 118.70 117.32 1a5t s GLU 102 Ca 0.28 -0.31 -0.30 0.00 0.02 0.00 0.00 54.97 54.66 1a5t s GLU 102 Cb 0.20 -2.65 -0.08 0.00 0.10 0.00 0.00 34.13 31.70 1a5t s GLU 102 CO 0.46 0.14 1.22 -3.38 0.02 0.00 0.00 175.26 173.72 1a5t s HIS 103 N -2.33 3.40 -0.13 1.61 0.00 -1.26 -4.89 115.29 111.68 1a5t s HIS 103 Ca 0.40 1.38 -0.39 0.00 -3.00 0.00 0.00 55.06 53.45 1a5t s HIS 103 Cb -0.10 -3.46 -0.16 0.00 -4.00 0.00 0.00 32.58 24.86 1a5t s HIS 103 CO 0.36 -1.33 1.56 0.00 -1.00 0.00 0.00 174.74 174.33 1a5t n ALA 104 N 2.59 -0.67 -0.30 -1.38 0.00 -1.26 -4.85 120.51 114.63 1a5t n ALA 104 Ca 0.05 0.45 0.13 0.00 0.00 0.00 0.00 53.44 54.07 1a5t n ALA 104 Cb 0.44 -2.14 0.30 0.00 0.00 0.00 0.00 19.45 18.05 1a5t n ALA 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1a5t h ARG 105 N 5.93 0.30 -0.47 0.00 3.08 -1.90 0.96 114.38 122.29 1a5t h ARG 105 Ca -0.47 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.56 1a5t h ARG 105 Cb 1.33 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.31 1a5t h ARG 105 CO 0.88 0.20 0.00 1.28 -1.07 0.00 0.00 179.97 181.26 1a5t n LEU 106 N -5.12 2.50 -1.22 3.04 4.32 -1.26 -4.93 117.00 114.33 1a5t n LEU 106 Ca 0.22 -1.25 -0.15 0.00 -0.02 0.00 0.00 56.01 54.81 1a5t n LEU 106 Cb 0.66 -0.32 -0.05 0.00 -1.62 0.00 0.00 43.42 42.09 1a5t n LEU 106 CO 0.10 0.60 -0.15 0.61 -1.22 0.00 0.00 177.39 177.34 1a5t n GLY 107 N 1.19 1.18 0.00 -0.72 0.00 0.33 -4.95 105.19 102.23 1a5t n GLY 107 Ca 0.15 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1a5t n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a5t n GLY 108 N -1.16 2.60 3.93 -0.02 0.00 -1.26 -4.98 105.19 104.30 1a5t n GLY 108 Ca -0.15 -0.15 -0.25 0.00 0.00 0.00 0.00 46.02 45.47 1a5t n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a5t s ALA 109 N -2.00 3.35 0.00 4.61 0.00 -1.26 -4.74 121.76 121.72 1a5t s ALA 109 Ca 0.00 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.11 1a5t s ALA 109 Cb 0.00 -2.51 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 1a5t s ALA 109 CO 0.00 -0.96 -0.10 0.15 0.00 0.00 0.00 175.76 174.86 1a5t s LYS 110 N -5.03 0.77 -0.03 0.00 1.02 0.29 -4.89 119.74 111.86 1a5t s LYS 110 Ca 0.56 -0.42 0.03 0.00 0.02 0.00 0.00 55.97 56.16 1a5t s LYS 110 Cb -0.11 -0.73 0.00 0.00 -0.52 0.00 0.00 37.83 36.48 1a5t s LYS 110 CO 0.44 0.20 -0.11 0.08 -0.92 0.00 0.00 175.35 175.04 1a5t s VAL 111 N -0.38 0.92 -0.11 3.17 1.01 -0.71 -0.17 120.40 124.13 1a5t s VAL 111 Ca 0.02 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.61 1a5t s VAL 111 Cb -0.05 -0.82 0.01 0.00 0.00 0.00 0.00 36.38 35.52 1a5t s VAL 111 CO -0.00 0.29 -0.19 -0.69 0.00 0.00 0.00 175.10 174.51 1a5t s VAL 112 N 0.26 1.74 -0.29 2.92 1.01 0.45 -0.75 120.40 125.73 1a5t s VAL 112 Ca -0.05 -0.80 -0.00 0.00 0.00 0.00 0.00 61.98 61.13 1a5t s VAL 112 Cb -0.10 -1.55 0.06 0.00 0.00 0.00 0.00 36.38 34.78 1a5t s VAL 112 CO 0.01 0.49 -0.03 0.86 0.00 0.00 0.00 175.10 176.43 1a5t s TRP 113 N 0.78 3.29 -0.55 5.22 -0.00 -0.37 -0.25 118.94 127.06 1a5t s TRP 113 Ca -0.10 -2.04 -0.20 0.00 -0.00 0.00 0.00 56.10 53.76 1a5t s TRP 113 Cb -0.16 -2.11 0.07 0.00 -0.00 0.00 0.00 33.47 31.28 1a5t s TRP 113 CO 0.01 -0.83 0.72 0.08 -0.00 0.00 0.00 176.95 176.93 1a5t s VAL 114 N 1.20 4.74 0.41 5.86 1.01 0.13 -0.78 120.40 132.96 1a5t s VAL 114 Ca -0.06 -0.52 0.17 0.00 0.00 0.00 0.00 61.98 61.57 1a5t s VAL 114 Cb -0.20 -4.42 0.38 0.00 0.00 0.00 0.00 36.38 32.14 1a5t s VAL 114 CO -0.02 -1.00 1.83 0.74 0.00 0.00 0.00 175.10 176.64 1a5t h THR 115 N 5.91 0.65 -1.08 3.92 2.02 -1.49 -2.41 112.91 120.43 1a5t h THR 115 Ca -0.28 -0.15 -0.04 0.00 0.77 0.00 0.00 66.41 66.72 1a5t h THR 115 Cb 1.09 0.18 -0.21 0.00 -1.74 0.00 0.00 68.15 67.47 1a5t h THR 115 CO 1.04 0.08 -0.43 -0.62 0.37 0.00 0.00 175.52 175.96 1a5t s ASP 116 N -5.53 -1.37 0.52 4.18 -1.08 -1.24 -4.42 116.67 107.72 1a5t s ASP 116 Ca -0.08 -0.33 0.31 0.00 -0.52 0.00 0.00 52.55 51.92 1a5t s ASP 116 Cb 0.23 1.90 1.68 0.00 -1.46 0.00 0.00 42.92 45.28 1a5t s ASP 116 CO 0.79 -0.25 1.93 0.00 0.52 0.00 0.00 175.17 178.17 1a5t h ALA 117 N 7.54 1.09 -0.23 3.66 0.00 -1.57 -1.34 119.26 128.42 1a5t h ALA 117 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1a5t h ALA 117 Cb 1.18 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1a5t h ALA 117 CO 0.14 -0.09 -0.49 0.00 0.00 0.00 0.00 179.25 178.80 1a5t h ALA 118 N 1.77 0.71 0.00 0.00 0.00 -1.86 -2.98 119.26 116.90 1a5t h ALA 118 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1a5t h ALA 118 Cb 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1a5t h ALA 118 CO 0.00 0.67 0.00 1.28 0.00 0.00 0.00 179.25 181.20 1a5t n LEU 119 N -3.99 0.00 -4.77 0.00 4.77 -0.50 -4.80 117.00 107.72 1a5t n LEU 119 Ca -0.03 0.50 -0.40 0.00 -0.03 0.00 0.00 56.01 56.06 1a5t n LEU 119 Cb 0.58 -0.50 0.02 0.00 -2.33 0.00 0.00 43.42 41.19 1a5t n LEU 119 CO 0.47 -0.24 1.08 -0.76 -1.33 0.00 0.00 177.39 176.60 1a5t s LEU 120 N -3.01 4.09 0.67 2.23 1.43 -1.13 -0.02 118.68 122.95 1a5t s LEU 120 Ca 0.07 2.94 -0.11 0.00 -1.03 0.00 0.00 54.13 56.00 1a5t s LEU 120 Cb 0.10 -3.95 -0.01 0.00 0.03 0.00 0.00 46.19 42.36 1a5t s LEU 120 CO 0.28 -1.23 1.06 -0.89 0.23 0.00 0.00 176.35 175.80 1a5t s THR 121 N -1.20 4.12 0.52 5.49 2.01 -0.42 -4.74 115.64 121.41 1a5t s THR 121 Ca 0.62 0.69 0.18 0.00 0.31 0.00 0.00 61.69 63.49 1a5t s THR 121 Cb -0.44 -3.60 0.27 0.00 0.01 0.00 0.00 72.50 68.74 1a5t s THR 121 CO 0.57 -0.90 2.14 -0.78 -0.69 0.00 0.00 174.62 174.96 1a5t h ASP 122 N -0.56 0.00 0.73 3.53 3.58 -1.94 0.83 116.42 122.60 1a5t h ASP 122 Ca -0.44 0.00 -0.26 0.00 0.42 0.00 0.00 57.03 56.75 1a5t h ASP 122 Cb 1.22 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.24 1a5t h ASP 122 CO 0.61 0.03 -1.32 0.00 -2.88 0.00 0.00 179.24 175.68 1a5t h ALA 123 N 1.97 0.45 -0.08 -0.78 0.00 -1.94 -2.81 119.26 116.07 1a5t h ALA 123 Ca -0.00 -1.11 -0.03 0.00 0.00 0.00 0.00 54.91 53.77 1a5t h ALA 123 Cb 0.05 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1a5t h ALA 123 CO 0.00 1.32 -0.07 0.00 0.00 0.00 0.00 179.25 180.50 1a5t h ALA 124 N 0.88 0.12 -0.60 0.00 0.00 -1.65 0.12 119.26 118.14 1a5t h ALA 124 Ca -0.14 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1a5t h ALA 124 Cb 1.90 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.63 1a5t h ALA 124 CO 0.12 -0.08 0.30 0.00 0.00 0.00 0.00 179.25 179.60 1a5t h ALA 125 N 0.58 0.77 -0.38 0.00 0.00 -1.00 0.21 119.26 119.44 1a5t h ALA 125 Ca 0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1a5t h ALA 125 Cb 0.56 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1a5t h ALA 125 CO 0.02 0.32 0.18 -0.91 0.00 0.00 0.00 179.25 178.86 1a5t h ASN 126 N 0.81 0.47 0.31 0.00 2.35 -1.35 0.36 115.58 118.53 1a5t h ASN 126 Ca 0.21 -0.04 -0.24 0.00 -0.55 0.00 0.00 56.30 55.69 1a5t h ASN 126 Cb 0.09 -0.12 0.01 0.00 0.05 0.00 0.00 38.32 38.35 1a5t h ASN 126 CO -0.03 0.40 -0.98 0.00 -1.65 0.00 0.00 177.43 175.18 1a5t h ALA 127 N 1.67 0.31 -0.23 -0.83 0.00 -0.30 -3.06 119.26 116.83 1a5t h ALA 127 Ca 0.14 -0.72 -0.02 0.00 0.00 0.00 0.00 54.91 54.30 1a5t h ALA 127 Cb 0.06 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1a5t h ALA 127 CO -0.02 0.81 0.05 1.25 0.00 0.00 0.00 179.25 181.34 1a5t h LEU 128 N 0.24 0.35 -0.64 0.00 5.85 -0.34 -2.82 115.31 117.95 1a5t h LEU 128 Ca -0.09 -0.23 0.13 0.00 0.84 0.00 0.00 57.88 58.52 1a5t h LEU 128 Cb 1.62 -0.09 -0.12 0.00 0.37 0.00 0.00 40.66 42.44 1a5t h LEU 128 CO 0.17 0.49 -0.16 0.25 -0.34 0.00 0.00 178.44 178.86 1a5t h LEU 129 N 0.19 -0.59 -1.51 2.25 5.85 -0.96 0.19 115.31 120.73 1a5t h LEU 129 Ca 0.07 0.19 0.10 0.00 0.84 0.00 0.00 57.88 59.08 1a5t h LEU 129 Cb 0.28 0.40 -0.04 0.00 0.37 0.00 0.00 40.66 41.66 1a5t h LEU 129 CO 0.00 -0.21 0.45 0.11 -0.34 0.00 0.00 178.44 178.45 1a5t h LYS 130 N 0.00 0.53 -0.02 1.25 1.79 -1.40 0.31 116.57 119.03 1a5t h LYS 130 Ca 0.31 -0.03 -0.19 0.00 -2.18 0.00 0.00 60.65 58.56 1a5t h LYS 130 Cb 0.48 -0.12 0.01 0.00 -1.58 0.00 0.00 32.23 31.02 1a5t h LYS 130 CO -0.66 0.35 -0.74 1.15 -1.08 0.00 0.00 179.45 178.47 1a5t h THR 131 N 0.55 1.36 -0.44 -0.16 2.02 -0.69 -3.25 112.91 112.31 1a5t h THR 131 Ca 0.31 -2.10 -0.03 0.00 0.77 0.00 0.00 66.41 65.37 1a5t h THR 131 Cb 0.50 2.45 -0.02 0.00 -1.74 0.00 0.00 68.15 69.33 1a5t h THR 131 CO -0.10 0.63 0.16 -0.07 0.37 0.00 0.00 175.52 176.50 1a5t h LEU 132 N 0.12 0.58 -0.05 2.58 3.38 0.16 -1.65 115.31 120.42 1a5t h LEU 132 Ca -0.09 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1a5t h LEU 132 Cb 1.42 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.03 1a5t h LEU 132 CO 0.15 0.54 0.00 -0.62 0.09 0.00 0.00 178.44 178.59 1a5t n GLU 133 N -4.35 0.03 -3.04 1.13 1.02 0.83 -3.62 120.64 112.63 1a5t n GLU 133 Ca 0.03 0.17 -0.17 0.00 -0.02 0.00 0.00 57.16 57.17 1a5t n GLU 133 Cb 0.16 -1.54 -0.01 0.00 -0.02 0.00 0.00 31.44 30.03 1a5t n GLU 133 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1a5t n GLU 134 N -1.59 0.84 -1.68 3.49 -0.58 -0.73 -5.10 120.64 115.30 1a5t n GLU 134 Ca 0.05 -2.81 -0.46 0.00 -0.42 0.00 0.00 57.16 53.52 1a5t n GLU 134 Cb 0.24 -1.38 -0.04 0.00 -0.57 0.00 0.00 31.44 29.70 1a5t n GLU 134 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 1a5t n PRO 135 N 0.97 2.38 -1.91 3.49 -0.04 -0.70 -4.81 135.00 134.39 1a5t n PRO 135 Ca 0.18 0.87 -0.37 0.00 -0.04 0.00 0.00 63.50 64.13 1a5t n PRO 135 Cb 0.61 -2.72 0.03 0.00 -0.04 0.00 0.00 33.50 31.39 1a5t n PRO 135 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 1a5t s PRO 136 N 3.01 3.14 0.31 0.54 0.02 -1.26 -4.90 135.00 135.87 1a5t s PRO 136 Ca 0.86 2.05 -0.28 0.00 0.02 0.00 0.00 61.00 63.65 1a5t s PRO 136 Cb -0.61 -2.17 -0.13 0.00 0.02 0.00 0.00 34.50 31.61 1a5t s PRO 136 CO 0.44 -1.13 1.13 0.00 -0.33 0.00 0.00 177.00 177.10 1a5t n ALA 137 N -1.16 0.41 -3.75 -1.55 0.00 -1.26 -2.83 120.51 110.38 1a5t n ALA 137 Ca 0.11 0.38 -0.29 0.00 0.00 0.00 0.00 53.44 53.64 1a5t n ALA 137 Cb 0.47 -2.12 0.01 0.00 0.00 0.00 0.00 19.45 17.81 1a5t n ALA 137 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1a5t n GLU 138 N 0.65 -4.69 -4.96 0.00 -0.58 -1.26 -4.85 120.64 104.95 1a5t n GLU 138 Ca 0.07 0.57 -0.32 0.00 -0.42 0.00 0.00 57.16 57.06 1a5t n GLU 138 Cb 0.34 -5.40 -0.15 0.00 -0.57 0.00 0.00 31.44 25.66 1a5t n GLU 138 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1a5t s THR 139 N -3.19 2.71 -0.17 2.62 2.01 -1.13 -0.55 115.64 117.93 1a5t s THR 139 Ca 0.59 -0.81 0.01 0.00 0.31 0.00 0.00 61.69 61.79 1a5t s THR 139 Cb -0.30 -2.08 0.02 0.00 0.01 0.00 0.00 72.50 70.15 1a5t s THR 139 CO 0.72 0.55 -0.20 0.26 -0.69 0.00 0.00 174.62 175.26 1a5t s TRP 140 N 0.05 2.76 -0.05 4.92 0.52 0.76 -4.78 118.94 123.12 1a5t s TRP 140 Ca -0.07 -1.57 -0.03 0.00 0.02 0.00 0.00 56.10 54.45 1a5t s TRP 140 Cb -0.15 -1.90 -0.04 0.00 -1.15 0.00 0.00 33.47 30.23 1a5t s TRP 140 CO 0.05 -0.76 0.10 -0.06 0.02 0.00 0.00 176.95 176.30 1a5t s PHE 141 N 1.19 3.40 -0.15 -1.98 0.40 0.12 -0.41 117.98 120.55 1a5t s PHE 141 Ca 0.03 0.33 -0.02 0.00 -0.60 0.00 0.00 56.93 56.66 1a5t s PHE 141 Cb -0.14 -1.82 0.05 0.00 0.51 0.00 0.00 43.02 41.62 1a5t s PHE 141 CO -0.10 0.61 -0.00 -0.06 0.70 0.00 0.00 175.22 176.36 1a5t s PHE 142 N -1.12 1.16 -0.09 0.36 0.08 0.65 -1.56 117.98 117.48 1a5t s PHE 142 Ca 0.20 -0.76 0.03 0.00 0.12 0.00 0.00 56.93 56.51 1a5t s PHE 142 Cb -0.12 -1.07 -0.02 0.00 -0.57 0.00 0.00 43.02 41.25 1a5t s PHE 142 CO 0.10 -0.54 -0.17 -0.51 -0.10 0.00 0.00 175.22 174.00 1a5t s LEU 143 N 1.81 2.54 0.07 -0.37 1.02 0.10 0.17 118.68 124.02 1a5t s LEU 143 Ca 0.01 -0.34 0.09 0.00 0.02 0.00 0.00 54.13 53.91 1a5t s LEU 143 Cb -0.15 -1.53 -0.03 0.00 0.02 0.00 0.00 46.19 44.50 1a5t s LEU 143 CO -0.07 0.24 -0.25 0.00 0.02 0.00 0.00 176.35 176.29 1a5t s ALA 144 N -0.12 2.12 0.10 4.21 0.00 -0.91 -0.27 121.76 126.90 1a5t s ALA 144 Ca -0.02 -1.27 -0.14 0.00 0.00 0.00 0.00 51.96 50.53 1a5t s ALA 144 Cb -0.14 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.61 1a5t s ALA 144 CO 0.04 0.48 0.32 0.95 0.00 0.00 0.00 175.76 177.56 1a5t s THR 145 N -0.91 0.09 -0.13 0.00 -4.23 -0.42 -1.94 115.64 108.10 1a5t s THR 145 Ca 0.11 -0.77 -0.10 0.00 -1.18 0.00 0.00 61.69 59.74 1a5t s THR 145 Cb -0.10 -1.19 -0.25 0.00 1.34 0.00 0.00 72.50 72.30 1a5t s THR 145 CO 0.03 -0.43 0.37 -0.09 -0.54 0.00 0.00 174.62 173.97 1a5t h ARG 146 N 2.61 0.23 -3.59 3.99 2.43 -1.87 -1.15 114.38 117.02 1a5t h ARG 146 Ca -0.34 -0.39 -0.58 0.00 -0.81 0.00 0.00 59.98 57.86 1a5t h ARG 146 Cb 1.23 0.15 -0.40 0.00 -0.42 0.00 0.00 29.97 30.53 1a5t h ARG 146 CO 0.50 1.19 -0.76 -1.21 -1.51 0.00 0.00 179.97 178.18 1a5t s GLU 147 N -2.52 0.74 0.20 0.20 2.02 -1.26 -4.50 118.70 113.57 1a5t s GLU 147 Ca -0.23 -1.07 0.15 0.00 0.02 0.00 0.00 54.97 53.84 1a5t s GLU 147 Cb 0.06 -2.02 0.76 0.00 0.10 0.00 0.00 34.13 33.03 1a5t s GLU 147 CO 0.75 -0.97 1.45 -0.35 0.02 0.00 0.00 175.26 176.15 1a5t n PRO 148 N 4.84 0.09 0.22 0.39 -0.04 -1.26 -1.30 135.00 137.94 1a5t n PRO 148 Ca -0.02 0.55 0.08 0.00 -0.04 0.00 0.00 63.50 64.07 1a5t n PRO 148 Cb 0.42 -1.78 0.48 0.00 -0.04 0.00 0.00 33.50 32.58 1a5t n PRO 148 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1a5t h GLU 149 N 0.00 0.00 -0.62 0.54 3.07 -2.01 -2.84 114.58 112.72 1a5t h GLU 149 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1a5t h GLU 149 Cb 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 1a5t h GLU 149 CO 0.00 0.27 0.00 0.54 -1.40 0.00 0.00 179.01 178.42 1a5t n ARG 150 N -3.62 1.98 -4.15 2.33 1.74 -0.42 -4.89 116.66 109.63 1a5t n ARG 150 Ca -0.01 -0.95 -0.23 0.00 -0.77 0.00 0.00 57.85 55.90 1a5t n ARG 150 Cb 0.40 -1.53 -0.05 0.00 -1.02 0.00 0.00 32.46 30.26 1a5t n ARG 150 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1a5t s LEU 151 N -0.93 3.68 -0.05 0.55 1.43 -1.07 -4.76 118.68 117.53 1a5t s LEU 151 Ca 0.17 -0.32 -0.33 0.00 -1.03 0.00 0.00 54.13 52.63 1a5t s LEU 151 Cb 0.11 -2.22 -0.11 0.00 0.03 0.00 0.00 46.19 44.00 1a5t s LEU 151 CO 0.07 -0.01 1.92 -0.11 0.23 0.00 0.00 176.35 178.45 1a5t n LEU 152 N -0.98 3.70 -0.28 1.79 7.94 -1.26 -4.81 117.00 123.09 1a5t n LEU 152 Ca -0.08 0.94 0.08 0.00 -1.11 0.00 0.00 56.01 55.84 1a5t n LEU 152 Cb 0.58 -1.42 0.22 0.00 0.53 0.00 0.00 43.42 43.33 1a5t n LEU 152 CO 0.42 0.03 1.04 0.00 -1.11 0.00 0.00 177.39 177.77 1a5t h ALA 153 N 9.76 1.20 0.00 1.96 0.00 -1.93 -0.17 119.26 130.09 1a5t h ALA 153 Ca -0.49 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 1a5t h ALA 153 Cb 1.26 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1a5t h ALA 153 CO 0.95 -0.22 -0.17 1.79 0.00 0.00 0.00 179.25 181.59 1a5t h THR 154 N 0.46 0.82 -0.03 0.00 1.35 -2.01 -2.90 112.91 110.60 1a5t h THR 154 Ca 0.46 -0.67 -0.01 0.00 -0.55 0.00 0.00 66.41 65.65 1a5t h THR 154 Cb 0.74 1.39 -0.00 0.00 -1.73 0.00 0.00 68.15 68.56 1a5t h THR 154 CO -0.43 0.17 -0.02 0.25 -0.25 0.00 0.00 175.52 175.24 1a5t h LEU 155 N 0.00 0.06 -0.96 3.87 6.46 -1.39 -3.29 115.31 120.07 1a5t h LEU 155 Ca -0.00 -0.43 0.15 0.00 -0.12 0.00 0.00 57.88 57.48 1a5t h LEU 155 Cb 0.38 -0.02 -0.09 0.00 -0.73 0.00 0.00 40.66 40.20 1a5t h LEU 155 CO 0.02 0.48 0.57 0.03 -0.62 0.00 0.00 178.44 178.92 1a5t h ARG 156 N -0.35 0.80 0.00 1.25 3.08 -1.29 -2.56 114.38 115.30 1a5t h ARG 156 Ca 0.01 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1a5t h ARG 156 Cb 0.46 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1a5t h ARG 156 CO 0.00 0.53 0.00 -1.13 -1.07 0.00 0.00 179.97 178.30 1a5t n SER 157 N -4.73 0.00 -0.97 7.04 3.41 -1.20 -2.98 113.62 114.18 1a5t n SER 157 Ca 0.20 0.30 0.12 0.00 -0.26 0.00 0.00 58.87 59.23 1a5t n SER 157 Cb 0.44 -0.41 0.11 0.00 -0.26 0.00 0.00 64.21 64.09 1a5t n SER 157 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1a5t n ARG 158 N -1.41 2.32 -4.37 4.33 3.00 -0.96 -4.97 116.66 114.60 1a5t n ARG 158 Ca 0.06 -1.96 -0.27 0.00 -0.01 0.00 0.00 57.85 55.68 1a5t n ARG 158 Cb 0.19 -1.46 -0.11 0.00 0.00 0.00 0.00 32.46 31.09 1a5t n ARG 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1a5t s ARG 160 N -2.78 4.09 0.04 0.00 3.52 -0.08 -4.86 118.95 118.87 1a5t s ARG 160 Ca 0.23 0.29 -0.26 0.00 -0.13 0.00 0.00 55.73 55.86 1a5t s ARG 160 Cb -0.08 -3.63 -0.05 0.00 -1.56 0.00 0.00 34.95 29.63 1a5t s ARG 160 CO 0.12 -0.28 0.81 -1.17 -0.81 0.00 0.00 175.30 173.97 1a5t s LEU 161 N 2.06 4.43 -0.18 -0.88 2.96 -1.26 -0.37 118.68 125.45 1a5t s LEU 161 Ca 0.21 1.49 -0.00 0.00 -0.22 0.00 0.00 54.13 55.60 1a5t s LEU 161 Cb -0.16 -3.30 0.05 0.00 0.50 0.00 0.00 46.19 43.28 1a5t s LEU 161 CO 0.09 -0.04 -0.05 -2.28 -1.32 0.00 0.00 176.35 172.75 1a5t s HIS 162 N 0.17 1.80 -0.30 5.38 5.65 0.12 -4.93 115.29 123.19 1a5t s HIS 162 Ca 0.41 -1.22 -0.22 0.00 0.25 0.00 0.00 55.06 54.29 1a5t s HIS 162 Cb -0.21 -1.35 -0.01 0.00 -1.18 0.00 0.00 32.58 29.84 1a5t s HIS 162 CO 0.24 -0.65 0.70 -0.47 -0.65 0.00 0.00 174.74 173.90 1a5t s TYR 163 N 1.60 3.21 -0.97 3.88 5.04 -1.26 -0.63 117.35 128.21 1a5t s TYR 163 Ca -0.01 0.69 -0.21 0.00 -2.44 0.00 0.00 57.07 55.11 1a5t s TYR 163 Cb -0.16 -3.08 0.10 0.00 0.35 0.00 0.00 41.96 39.16 1a5t s TYR 163 CO -0.07 -0.51 1.27 -1.17 -1.34 0.00 0.00 175.55 173.73 1a5t s LEU 164 N 2.76 4.37 0.29 6.97 2.96 0.29 -4.93 118.68 131.38 1a5t s LEU 164 Ca 0.28 -1.79 -0.29 0.00 -0.22 0.00 0.00 54.13 52.11 1a5t s LEU 164 Cb -0.15 -2.47 -0.09 0.00 0.50 0.00 0.00 46.19 43.98 1a5t s LEU 164 CO 0.12 -1.26 1.05 0.00 -1.32 0.00 0.00 176.35 174.94 1a5t s ALA 165 N 3.69 3.34 0.65 5.97 0.00 -1.26 -4.70 121.76 129.44 1a5t s ALA 165 Ca 0.39 0.79 -0.18 0.00 0.00 0.00 0.00 51.96 52.95 1a5t s ALA 165 Cb -0.03 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 19.80 1a5t s ALA 165 CO -0.10 -0.06 1.28 -2.30 0.00 0.00 0.00 175.76 174.58 1a5t n PRO 166 N 1.07 1.11 -1.55 0.00 -0.02 -1.26 -4.99 135.00 129.36 1a5t n PRO 166 Ca -0.00 0.44 -0.29 0.00 -2.02 0.00 0.00 63.50 61.62 1a5t n PRO 166 Cb 0.46 -2.51 0.17 0.00 -0.02 0.00 0.00 33.50 31.60 1a5t n PRO 166 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1a5t s PRO 167 N -3.33 0.46 0.42 0.52 0.04 -1.26 -4.95 135.00 126.90 1a5t s PRO 167 Ca 0.82 -0.00 -0.26 0.00 0.04 0.00 0.00 61.00 61.60 1a5t s PRO 167 Cb -0.38 -1.79 -0.10 0.00 0.04 0.00 0.00 34.50 32.28 1a5t s PRO 167 CO 0.41 -2.60 1.35 -2.30 0.04 0.00 0.00 177.00 173.90 1a5t n PRO 168 N -3.99 2.13 -0.22 0.56 -0.02 -1.26 -4.78 135.00 127.42 1a5t n PRO 168 Ca 0.11 0.76 0.03 0.00 -2.02 0.00 0.00 63.50 62.37 1a5t n PRO 168 Cb 0.59 -2.50 0.13 0.00 -0.02 0.00 0.00 33.50 31.71 1a5t n PRO 168 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1a5t h GLU 169 N 2.27 0.21 -0.51 -0.52 4.81 -1.95 -0.01 114.58 118.88 1a5t h GLU 169 Ca -0.49 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.72 1a5t h GLU 169 Cb 1.28 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.59 1a5t h GLU 169 CO 0.61 0.14 0.29 0.37 -0.73 0.00 0.00 179.01 179.69 1a5t h GLN 170 N 0.21 0.70 -0.25 1.92 4.15 -2.00 0.74 115.11 120.58 1a5t h GLN 170 Ca 0.36 -0.06 -0.15 0.00 0.77 0.00 0.00 58.65 59.57 1a5t h GLN 170 Cb 0.58 -0.15 -0.00 0.00 0.21 0.00 0.00 27.48 28.12 1a5t h GLN 170 CO -0.49 0.51 -0.42 -0.92 -1.93 0.00 0.00 178.83 175.58 1a5t h TYR 171 N 0.71 0.91 -0.62 3.99 5.03 -1.41 -2.86 116.97 122.72 1a5t h TYR 171 Ca 0.18 -0.31 -0.09 0.00 2.58 0.00 0.00 58.73 61.09 1a5t h TYR 171 Cb 0.00 -0.17 -0.02 0.00 1.55 0.00 0.00 36.73 38.08 1a5t h TYR 171 CO 0.00 1.10 0.05 0.00 -1.32 0.00 0.00 178.16 177.99 1a5t h ALA 172 N 0.65 0.91 -0.38 1.82 0.00 0.02 -0.90 119.26 121.39 1a5t h ALA 172 Ca 0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1a5t h ALA 172 Cb 1.02 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1a5t h ALA 172 CO 0.10 0.66 0.20 0.28 0.00 0.00 0.00 179.25 180.48 1a5t h VAL 173 N 0.97 1.16 -0.37 0.00 2.07 -0.88 -1.54 116.25 117.67 1a5t h VAL 173 Ca 0.18 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 1a5t h VAL 173 Cb 0.49 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1a5t h VAL 173 CO 0.02 0.16 0.13 0.74 0.02 0.00 0.00 177.57 178.65 1a5t h THR 174 N 0.48 1.20 -0.35 2.57 2.02 -1.31 0.24 112.91 117.77 1a5t h THR 174 Ca 0.13 -0.63 0.05 0.00 0.77 0.00 0.00 66.41 66.73 1a5t h THR 174 Cb 0.08 0.93 -0.05 0.00 -1.74 0.00 0.00 68.15 67.37 1a5t h THR 174 CO -0.02 0.22 0.07 -0.25 0.37 0.00 0.00 175.52 175.91 1a5t h TRP 175 N 0.45 0.12 -0.69 3.16 2.91 -0.98 -1.98 115.95 118.94 1a5t h TRP 175 Ca 0.12 0.02 -0.03 0.00 1.13 0.00 0.00 58.89 60.14 1a5t h TRP 175 Cb 0.22 -0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 28.84 1a5t h TRP 175 CO 0.00 0.02 0.33 -0.07 -1.03 0.00 0.00 178.44 177.69 1a5t h LEU 176 N 0.19 0.90 -2.36 0.65 3.38 -0.98 -1.75 115.31 115.33 1a5t h LEU 176 Ca 0.17 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.03 1a5t h LEU 176 Cb 0.19 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 1a5t h LEU 176 CO -0.22 0.78 0.17 0.77 0.09 0.00 0.00 178.44 180.03 1a5t h SER 177 N 0.96 0.00 1.23 -0.43 4.64 0.24 0.51 113.55 120.70 1a5t h SER 177 Ca 0.24 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.44 1a5t h SER 177 Cb 0.12 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.19 1a5t h SER 177 CO -0.03 0.00 -0.81 0.03 -0.87 0.00 0.00 176.83 175.15 1a5t h ARG 178 N 0.00 0.00 0.01 4.77 -0.00 -1.01 -3.34 114.38 114.81 1a5t h ARG 178 Ca 0.05 0.00 -0.28 0.00 -0.50 0.00 0.00 59.98 59.25 1a5t h ARG 178 Cb 0.39 0.00 -0.04 0.00 0.00 0.00 0.00 29.97 30.31 1a5t h ARG 178 CO -0.00 0.38 -1.57 0.93 0.00 0.00 0.00 179.97 179.72 1a5t h GLU 179 N 0.00 0.03 -4.19 0.04 4.39 -0.83 -3.48 114.58 110.55 1a5t h GLU 179 Ca -0.05 -0.05 -0.13 0.00 0.34 0.00 0.00 59.36 59.46 1a5t h GLU 179 Cb 1.41 0.02 -0.14 0.00 -0.10 0.00 0.00 28.75 29.93 1a5t h GLU 179 CO 0.05 0.68 -0.57 0.14 -1.16 0.00 0.00 179.01 178.15 1a5t s VAL 180 N -2.62 0.15 -0.53 3.13 -7.23 -0.44 -5.11 120.40 107.75 1a5t s VAL 180 Ca -0.05 -1.69 -0.09 0.00 -1.81 0.00 0.00 61.98 58.34 1a5t s VAL 180 Cb 0.08 -1.72 0.13 0.00 0.56 0.00 0.00 36.38 35.44 1a5t s VAL 180 CO 0.82 -0.66 0.41 -0.89 -0.31 0.00 0.00 175.10 174.47 1a5t s THR 181 N -3.96 4.37 0.12 5.32 2.01 -1.26 -4.43 115.64 117.81 1a5t s THR 181 Ca 0.14 -1.95 -0.08 0.00 0.31 0.00 0.00 61.69 60.11 1a5t s THR 181 Cb 0.07 -3.85 -0.01 0.00 0.01 0.00 0.00 72.50 68.72 1a5t s THR 181 CO -0.05 -0.82 0.22 -0.04 -0.69 0.00 0.00 174.62 173.24 1a5t s MET 182 N 1.12 0.97 0.31 4.92 -1.94 -1.26 -5.13 119.30 118.29 1a5t s MET 182 Ca 0.08 -1.08 -0.29 0.00 -1.71 0.00 0.00 55.69 52.69 1a5t s MET 182 Cb -0.24 0.35 -0.11 0.00 2.01 0.00 0.00 34.83 36.84 1a5t s MET 182 CO -0.02 -0.33 1.47 0.45 -0.01 0.00 0.00 175.02 176.59 1a5t s SER 183 N -2.92 6.51 0.24 3.03 0.15 -1.26 -4.89 113.70 114.56 1a5t s SER 183 Ca 0.11 2.86 0.20 0.00 0.70 0.00 0.00 55.95 59.81 1a5t s SER 183 Cb 0.04 -2.64 0.93 0.00 -1.71 0.00 0.00 66.02 62.64 1a5t s SER 183 CO -0.06 -0.78 1.60 0.00 1.20 0.00 0.00 173.24 175.20 1a5t n GLN 184 N 1.52 0.14 0.09 5.44 6.02 -1.26 -1.82 117.38 127.51 1a5t n GLN 184 Ca 0.04 0.50 -0.16 0.00 -0.01 0.00 0.00 57.00 57.37 1a5t n GLN 184 Cb 0.39 -1.84 -0.10 0.00 1.02 0.00 0.00 30.24 29.71 1a5t n GLN 184 CO 0.00 0.00 0.00 0.38 -1.01 0.00 0.00 177.06 176.43 1a5t h ASP 185 N 0.00 0.55 -0.70 1.08 2.03 -1.94 -1.68 116.42 115.77 1a5t h ASP 185 Ca 0.00 -0.52 -0.07 0.00 -0.73 0.00 0.00 57.03 55.71 1a5t h ASP 185 Cb 0.18 -0.17 -0.03 0.00 -0.83 0.00 0.00 39.33 38.48 1a5t h ASP 185 CO 0.00 1.36 0.16 0.00 -1.03 0.00 0.00 179.24 179.72 1a5t h ALA 186 N 0.58 0.95 0.33 4.15 0.00 -1.73 0.45 119.26 124.00 1a5t h ALA 186 Ca -0.13 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1a5t h ALA 186 Cb 1.82 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.34 1a5t h ALA 186 CO 0.20 0.67 -0.16 -0.07 0.00 0.00 0.00 179.25 179.89 1a5t h LEU 187 N 1.07 -0.38 -1.20 0.00 3.38 -1.50 0.11 115.31 116.79 1a5t h LEU 187 Ca 0.22 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.13 1a5t h LEU 187 Cb 0.39 0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 1a5t h LEU 187 CO 0.01 -0.10 0.56 0.25 0.09 0.00 0.00 178.44 179.25 1a5t h LEU 188 N -0.67 0.86 0.19 1.67 5.85 -1.12 0.16 115.31 122.26 1a5t h LEU 188 Ca -0.05 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1a5t h LEU 188 Cb 0.47 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1a5t h LEU 188 CO 0.07 0.57 -0.09 0.00 -0.34 0.00 0.00 178.44 178.65 1a5t h ALA 189 N 1.53 -0.26 -0.65 1.25 0.00 0.26 0.19 119.26 121.58 1a5t h ALA 189 Ca 0.36 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 55.22 1a5t h ALA 189 Cb 0.17 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1a5t h ALA 189 CO -0.13 -0.55 0.33 0.00 0.00 0.00 0.00 179.25 178.90 1a5t h ALA 190 N 0.33 0.87 -0.25 0.00 0.00 -0.42 0.23 119.26 120.02 1a5t h ALA 190 Ca -0.03 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1a5t h ALA 190 Cb 0.34 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1a5t h ALA 190 CO 0.04 -0.03 0.16 1.25 0.00 0.00 0.00 179.25 180.67 1a5t h LEU 191 N 0.60 0.29 -1.01 0.00 5.85 -0.37 -0.38 115.31 120.28 1a5t h LEU 191 Ca 0.31 -0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.92 1a5t h LEU 191 Cb 0.26 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1a5t h LEU 191 CO -0.22 0.23 -0.06 0.03 -0.34 0.00 0.00 178.44 178.08 1a5t h ARG 192 N 0.32 0.64 0.00 1.25 3.08 0.61 -0.71 114.38 119.57 1a5t h ARG 192 Ca 0.09 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 59.92 1a5t h ARG 192 Cb -0.01 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1a5t h ARG 192 CO -0.02 0.70 -0.19 -0.07 -1.07 0.00 0.00 179.97 179.32 1a5t h LEU 193 N 0.59 0.00 -1.40 3.04 3.38 -0.15 -1.89 115.31 118.89 1a5t h LEU 193 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1a5t h LEU 193 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1a5t h LEU 193 CO 0.02 0.19 0.00 -1.20 0.09 0.00 0.00 178.44 177.55 1a5t n SER 194 N -4.26 2.09 -1.47 -0.43 7.64 -0.19 -4.94 113.62 112.06 1a5t n SER 194 Ca -0.02 -1.80 -0.15 0.00 1.01 0.00 0.00 58.87 57.91 1a5t n SER 194 Cb 0.25 -0.15 -0.03 0.00 -1.01 0.00 0.00 64.21 63.28 1a5t n SER 194 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1a5t n ALA 195 N 0.61 -0.36 -0.30 -0.43 0.00 -0.71 -2.68 120.51 116.64 1a5t n ALA 195 Ca 0.17 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1a5t n ALA 195 Cb 0.39 -1.65 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1a5t n ALA 195 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a5t n GLY 196 N -1.08 0.67 3.58 0.00 0.00 -0.38 -4.93 105.19 103.05 1a5t n GLY 196 Ca -0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 1a5t n GLY 196 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1a5t s SER 197 N -2.98 6.52 0.35 1.61 0.15 -1.09 -4.53 113.70 113.73 1a5t s SER 197 Ca 0.00 0.19 0.10 0.00 0.70 0.00 0.00 55.95 56.94 1a5t s SER 197 Cb 0.00 -2.51 0.65 0.00 -1.71 0.00 0.00 66.02 62.45 1a5t s SER 197 CO 0.00 -1.26 1.80 -0.65 1.20 0.00 0.00 173.24 174.34 1a5t h PRO 198 N 9.28 0.11 -0.19 5.44 0.11 -1.91 -1.73 132.00 143.10 1a5t h PRO 198 Ca -0.24 -0.04 -0.09 0.00 0.11 0.00 0.00 66.00 65.74 1a5t h PRO 198 Cb 1.06 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1a5t h PRO 198 CO 1.11 0.44 -0.22 0.78 -0.21 0.00 0.00 178.00 179.90 1a5t h GLY 199 N 1.09 0.53 1.73 -0.55 0.00 -1.48 -2.33 103.07 102.06 1a5t h GLY 199 Ca 0.01 -0.56 -0.07 0.00 0.00 0.00 0.00 47.33 46.71 1a5t h GLY 199 CO 0.05 0.51 -0.19 0.00 0.00 0.00 0.00 176.54 176.90 1a5t h ALA 200 N 0.63 1.32 -0.06 3.60 0.00 -1.61 -1.28 119.26 121.86 1a5t h ALA 200 Ca 0.03 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 1a5t h ALA 200 Cb 0.78 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1a5t h ALA 200 CO 0.05 0.46 -0.28 0.00 0.00 0.00 0.00 179.25 179.48 1a5t h ALA 201 N 1.50 1.42 0.09 0.00 0.00 -1.27 -2.49 119.26 118.52 1a5t h ALA 201 Ca 0.05 -0.28 -0.26 0.00 0.00 0.00 0.00 54.91 54.41 1a5t h ALA 201 Cb 0.52 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.25 1a5t h ALA 201 CO 0.03 0.42 -1.15 1.25 0.00 0.00 0.00 179.25 179.80 1a5t h LEU 202 N 0.10 0.53 -1.82 0.00 7.12 -0.80 -3.27 115.31 117.17 1a5t h LEU 202 Ca 0.02 -0.51 -0.00 0.00 0.13 0.00 0.00 57.88 57.52 1a5t h LEU 202 Cb 0.55 -0.17 -0.01 0.00 -0.53 0.00 0.00 40.66 40.50 1a5t h LEU 202 CO 0.04 1.35 0.06 0.00 -0.13 0.00 0.00 178.44 179.76 1a5t h ALA 203 N 0.59 1.86 -0.36 1.25 0.00 -0.80 -1.72 119.26 120.08 1a5t h ALA 203 Ca -0.13 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1a5t h ALA 203 Cb 1.84 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.55 1a5t h ALA 203 CO 0.20 0.12 0.03 -0.07 0.00 0.00 0.00 179.25 179.53 1a5t h LEU 204 N 0.18 0.51 0.00 0.00 3.38 -1.56 -1.81 115.31 116.01 1a5t h LEU 204 Ca 0.05 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1a5t h LEU 204 Cb 0.02 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1a5t h LEU 204 CO -0.01 0.55 -0.05 0.49 0.09 0.00 0.00 178.44 179.52 1a5t n PHE 205 N -4.30 0.53 -3.15 1.13 3.72 -0.66 -0.53 117.46 114.20 1a5t n PHE 205 Ca 0.02 0.16 -0.45 0.00 -0.05 0.00 0.00 57.45 57.12 1a5t n PHE 205 Cb 0.23 -0.74 -0.03 0.00 -0.94 0.00 0.00 39.48 38.00 1a5t n PHE 205 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1a5t s GLN 206 N -3.06 3.46 0.91 -1.08 -0.21 -0.68 -4.83 119.66 114.17 1a5t s GLN 206 Ca 0.12 -1.97 0.00 0.00 0.02 0.00 0.00 55.36 53.53 1a5t s GLN 206 Cb 0.15 -4.55 0.00 0.00 1.00 0.00 0.00 33.01 29.61 1a5t s GLN 206 CO 0.58 -1.50 0.00 0.41 -2.12 0.00 0.00 175.29 172.66 1a5t n GLY 207 N 4.79 -1.78 0.00 3.09 0.00 -1.26 -4.54 105.19 105.49 1a5t n GLY 207 Ca 0.11 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.49 1a5t n GLY 207 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1a5t n ASP 208 N 0.23 0.00 -0.18 1.61 2.03 -1.26 -3.12 116.55 115.85 1a5t n ASP 208 Ca 0.00 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.22 1a5t n ASP 208 Cb 0.00 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.33 1a5t n ASP 208 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 1a5t h ASN 209 N 0.00 -1.36 -0.91 1.67 4.21 -1.80 0.02 115.58 117.41 1a5t h ASN 209 Ca 0.00 0.19 0.04 0.00 1.21 0.00 0.00 56.30 57.74 1a5t h ASN 209 Cb 0.00 0.58 -0.05 0.00 -1.12 0.00 0.00 38.32 37.73 1a5t h ASN 209 CO 0.00 -0.22 0.60 -0.25 -1.29 0.00 0.00 177.43 176.27 1a5t h TRP 210 N -0.15 1.10 -0.24 1.19 -0.00 -0.75 -1.22 115.95 115.88 1a5t h TRP 210 Ca 0.08 0.03 -0.14 0.00 -0.00 0.00 0.00 58.89 58.85 1a5t h TRP 210 Cb 0.35 -0.37 -0.01 0.00 -0.00 0.00 0.00 29.16 29.13 1a5t h TRP 210 CO -0.83 0.63 -0.42 1.96 -0.00 0.00 0.00 178.44 179.78 1a5t h GLN 211 N 1.13 0.59 -0.90 2.65 1.08 -1.65 -2.31 115.11 115.70 1a5t h GLN 211 Ca 0.36 -0.31 -0.01 0.00 -1.45 0.00 0.00 58.65 57.24 1a5t h GLN 211 Cb 0.03 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.43 1a5t h GLN 211 CO -0.11 0.90 0.51 0.00 -0.95 0.00 0.00 178.83 179.18 1a5t h ALA 212 N 1.06 1.21 -0.44 3.87 0.00 0.09 -0.68 119.26 124.37 1a5t h ALA 212 Ca 0.04 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1a5t h ALA 212 Cb 0.93 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1a5t h ALA 212 CO 0.08 0.65 -0.05 -0.09 0.00 0.00 0.00 179.25 179.85 1a5t h ARG 213 N 1.25 0.82 -0.69 0.00 2.43 -0.96 -1.84 114.38 115.38 1a5t h ARG 213 Ca 0.32 -0.29 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1a5t h ARG 213 Cb -0.01 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.45 1a5t h ARG 213 CO -0.06 0.90 0.35 1.49 -1.51 0.00 0.00 179.97 181.15 1a5t h GLU 214 N 0.66 0.99 -0.75 0.20 4.57 -0.91 0.37 114.58 119.71 1a5t h GLU 214 Ca 0.12 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 1a5t h GLU 214 Cb 0.57 -0.18 -0.04 0.00 -0.16 0.00 0.00 28.75 28.94 1a5t h GLU 214 CO 0.03 0.77 0.46 1.15 -1.18 0.00 0.00 179.01 180.24 1a5t h THR 215 N 0.96 1.21 -0.36 0.32 2.02 -1.03 0.46 112.91 116.50 1a5t h THR 215 Ca 0.24 -0.46 -0.03 0.00 0.77 0.00 0.00 66.41 66.93 1a5t h THR 215 Cb 0.09 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 66.65 1a5t h THR 215 CO -0.03 0.22 0.12 0.25 0.37 0.00 0.00 175.52 176.45 1a5t h LEU 216 N 1.03 0.51 -0.75 2.58 6.46 -0.61 0.14 115.31 124.67 1a5t h LEU 216 Ca 0.27 -0.19 -0.01 0.00 -0.12 0.00 0.00 57.88 57.83 1a5t h LEU 216 Cb -0.04 -0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 39.72 1a5t h LEU 216 CO -0.05 0.57 0.44 0.00 -0.62 0.00 0.00 178.44 178.78 1a5t h GLN 218 N 1.03 0.95 -0.40 0.00 5.75 0.16 -1.46 115.11 121.14 1a5t h GLN 218 Ca 0.27 -0.36 -0.06 0.00 -0.15 0.00 0.00 58.65 58.35 1a5t h GLN 218 Cb -0.02 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.46 1a5t h GLN 218 CO -0.05 1.03 -0.01 0.00 -2.65 0.00 0.00 178.83 177.15 1a5t h ALA 219 N 0.89 1.25 -0.40 3.38 0.00 -0.17 -2.67 119.26 121.55 1a5t h ALA 219 Ca 0.12 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 1a5t h ALA 219 Cb 0.68 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1a5t h ALA 219 CO 0.05 0.50 -0.35 -0.07 0.00 0.00 0.00 179.25 179.38 1a5t h LEU 220 N 0.60 0.97 -1.90 0.00 3.38 -0.27 -2.38 115.31 115.71 1a5t h LEU 220 Ca 0.12 -0.43 0.07 0.00 0.09 0.00 0.00 57.88 57.73 1a5t h LEU 220 Cb 0.39 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1a5t h LEU 220 CO 0.01 1.22 0.43 0.00 0.09 0.00 0.00 178.44 180.19 1a5t h ALA 221 N 0.83 1.79 0.02 1.53 0.00 -0.92 -1.71 119.26 120.80 1a5t h ALA 221 Ca 0.07 -0.01 -0.39 0.00 0.00 0.00 0.00 54.91 54.58 1a5t h ALA 221 Cb 0.93 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 1a5t h ALA 221 CO 0.09 -0.55 -2.26 0.98 0.00 0.00 0.00 179.25 177.51 1a5t n TYR 222 N -3.30 0.35 -0.28 0.00 9.36 -1.12 -4.46 117.16 117.71 1a5t n TYR 222 Ca 0.03 0.10 -0.03 0.00 3.32 0.00 0.00 57.90 61.33 1a5t n TYR 222 Cb 0.55 -1.04 0.14 0.00 -0.63 0.00 0.00 39.34 38.35 1a5t n TYR 222 CO 0.00 0.00 0.00 0.77 0.22 0.00 0.00 176.86 177.85 1a5t h SER 223 N -0.47 1.03 0.78 2.98 0.02 -0.88 -2.13 113.55 114.88 1a5t h SER 223 Ca -0.57 -0.09 -0.04 0.00 -0.84 0.00 0.00 61.79 60.26 1a5t h SER 223 Cb 1.74 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 64.02 1a5t h SER 223 CO -0.19 0.83 -0.41 0.58 -1.14 0.00 0.00 176.83 176.50 1a5t h VAL 224 N 1.16 0.17 0.00 2.27 2.07 -1.58 0.58 116.25 120.92 1a5t h VAL 224 Ca 0.29 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.74 1a5t h VAL 224 Cb 0.03 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 29.96 1a5t h VAL 224 CO -0.05 0.00 -0.35 1.55 0.02 0.00 0.00 177.57 178.74 1a5t h PRO 225 N -1.09 0.00 0.00 1.57 0.13 -1.78 -3.24 132.00 127.59 1a5t h PRO 225 Ca -0.10 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.97 1a5t h PRO 225 Cb 0.85 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 1a5t h PRO 225 CO 0.15 0.35 -1.14 -1.13 -0.23 0.00 0.00 178.00 176.01 1a5t n SER 226 N -3.60 0.85 0.00 1.44 3.41 -0.80 -4.93 113.62 109.99 1a5t n SER 226 Ca -0.01 0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 1a5t n SER 226 Cb 0.47 0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.79 1a5t n SER 226 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1a5t n GLY 227 N 1.25 0.95 3.46 5.00 0.00 0.20 -4.96 105.19 111.08 1a5t n GLY 227 Ca -0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.55 1a5t n GLY 227 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1a5t s ASP 228 N -2.91 6.56 0.11 1.61 -1.08 -1.17 -4.83 116.67 114.96 1a5t s ASP 228 Ca 0.00 -1.88 0.19 0.00 -0.52 0.00 0.00 52.55 50.34 1a5t s ASP 228 Cb 0.00 -2.41 -0.09 0.00 -1.46 0.00 0.00 42.92 38.97 1a5t s ASP 228 CO 0.00 -1.13 0.91 0.79 0.52 0.00 0.00 175.17 176.25 1a5t n TRP 229 N 6.80 0.99 0.28 -5.34 7.02 -1.26 -3.88 117.44 122.05 1a5t n TRP 229 Ca 0.20 0.31 0.15 0.00 -1.02 0.00 0.00 57.50 57.14 1a5t n TRP 229 Cb 0.49 -1.05 0.79 0.00 -2.42 0.00 0.00 31.31 29.12 1a5t n TRP 229 CO 0.00 0.00 0.00 -0.92 -2.02 0.00 0.00 177.69 174.75 1a5t h TYR 230 N 0.00 0.00 0.00 -5.99 3.20 -1.88 -1.68 116.97 110.62 1a5t h TYR 230 Ca -0.10 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.77 1a5t h TYR 230 Cb 1.37 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.64 1a5t h TYR 230 CO 0.00 0.08 0.00 -1.13 -1.64 0.00 0.00 178.16 175.47 1a5t n SER 231 N -3.53 0.17 0.02 -2.11 3.41 -1.25 -1.98 113.62 108.35 1a5t n SER 231 Ca -0.02 0.56 0.12 0.00 -0.26 0.00 0.00 58.87 59.27 1a5t n SER 231 Cb 0.21 -0.59 0.52 0.00 -0.26 0.00 0.00 64.21 64.10 1a5t n SER 231 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1a5t n LEU 232 N -1.71 0.14 -0.25 1.04 4.77 -0.63 -4.16 117.00 116.20 1a5t n LEU 232 Ca 0.01 0.52 0.06 0.00 -0.03 0.00 0.00 56.01 56.57 1a5t n LEU 232 Cb 0.10 -0.48 0.18 0.00 -2.33 0.00 0.00 43.42 40.89 1a5t n LEU 232 CO 0.09 -0.10 0.88 0.25 -1.33 0.00 0.00 177.39 177.18 1a5t h LEU 233 N 0.00 -0.15 -0.05 2.23 5.85 -1.61 -2.33 115.31 119.25 1a5t h LEU 233 Ca 0.00 0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.92 1a5t h LEU 233 Cb 0.47 0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 1a5t h LEU 233 CO 0.00 -0.11 -0.15 0.00 -0.34 0.00 0.00 178.44 177.84 1a5t h ALA 234 N 1.66 -0.13 0.00 1.25 0.00 -1.86 0.51 119.26 120.70 1a5t h ALA 234 Ca 0.42 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.36 1a5t h ALA 234 Cb 0.75 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1a5t h ALA 234 CO -0.59 -0.62 -0.01 0.00 0.00 0.00 0.00 179.25 178.03 1a5t h ALA 235 N 0.77 1.02 0.00 0.00 0.00 -1.72 -3.26 119.26 116.06 1a5t h ALA 235 Ca 0.07 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.78 1a5t h ALA 235 Cb 0.31 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1a5t h ALA 235 CO -0.18 0.01 -1.72 1.28 0.00 0.00 0.00 179.25 178.63 1a5t n LEU 236 N -3.12 0.12 -4.55 0.00 4.77 -0.79 -4.86 117.00 108.58 1a5t n LEU 236 Ca -0.02 -0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.58 1a5t n LEU 236 Cb 0.17 0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 1a5t n LEU 236 CO 0.23 0.28 1.38 0.21 -1.33 0.00 0.00 177.39 178.16 1a5t s ASN 237 N -4.34 5.82 -0.02 -1.43 2.47 0.17 -4.30 114.94 113.31 1a5t s ASN 237 Ca -0.06 -0.44 -0.30 0.00 0.42 0.00 0.00 52.86 52.48 1a5t s ASN 237 Cb 0.03 -2.55 0.11 0.00 -1.45 0.00 0.00 41.25 37.39 1a5t s ASN 237 CO 0.43 -2.07 1.07 -2.28 -3.72 0.00 0.00 177.10 170.53 1a5t s HIS 238 N 7.20 -0.17 0.22 0.43 2.46 -1.26 -4.89 115.29 119.28 1a5t s HIS 238 Ca 0.52 0.03 -0.08 0.00 0.47 0.00 0.00 55.06 55.99 1a5t s HIS 238 Cb -0.08 0.56 0.36 0.00 -0.13 0.00 0.00 32.58 33.29 1a5t s HIS 238 CO 0.10 -0.47 1.71 1.49 -2.47 0.00 0.00 174.74 175.10 1a5t h GLU 239 N 2.00 0.29 -1.68 2.88 4.57 -2.02 -2.19 114.58 118.44 1a5t h GLU 239 Ca -0.21 -0.02 -0.21 0.00 -1.18 0.00 0.00 59.36 57.74 1a5t h GLU 239 Cb 1.21 -0.07 -0.09 0.00 -0.16 0.00 0.00 28.75 29.64 1a5t h GLU 239 CO 0.27 0.19 0.28 1.04 -1.18 0.00 0.00 179.01 179.61 1a5t n GLN 240 N -5.10 1.53 -0.20 1.92 1.13 -1.26 -4.51 117.38 110.88 1a5t n GLN 240 Ca 0.11 -1.04 -0.09 0.00 -1.94 0.00 0.00 57.00 54.05 1a5t n GLN 240 Cb 0.36 -1.41 0.02 0.00 0.11 0.00 0.00 30.24 29.33 1a5t n GLN 240 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1a5t h ALA 241 N 1.32 0.77 -0.90 -1.58 0.00 -1.58 -2.36 119.26 114.93 1a5t h ALA 241 Ca 0.19 -0.26 0.16 0.00 0.00 0.00 0.00 54.91 55.01 1a5t h ALA 241 Cb 0.95 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 18.45 1a5t h ALA 241 CO 0.50 0.53 0.58 -1.35 0.00 0.00 0.00 179.25 179.51 1a5t h PRO 242 N 0.86 0.60 0.02 0.00 0.11 -1.87 0.37 132.00 132.09 1a5t h PRO 242 Ca 0.18 -0.04 -0.24 0.00 0.11 0.00 0.00 66.00 66.01 1a5t h PRO 242 Cb 0.43 -0.14 0.02 0.00 0.11 0.00 0.00 31.00 31.42 1a5t h PRO 242 CO 0.01 0.40 -0.94 0.00 -0.21 0.00 0.00 178.00 177.26 1a5t h ALA 243 N 1.61 0.09 -0.32 -0.75 0.00 -1.90 -2.42 119.26 115.56 1a5t h ALA 243 Ca 0.47 -0.67 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1a5t h ALA 243 Cb 0.86 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1a5t h ALA 243 CO -0.22 0.58 0.10 0.00 0.00 0.00 0.00 179.25 179.72 1a5t h ARG 244 N 0.22 0.46 -0.03 0.00 3.08 -0.73 -1.10 114.38 116.29 1a5t h ARG 244 Ca -0.12 -0.06 -0.15 0.00 0.07 0.00 0.00 59.98 59.71 1a5t h ARG 244 Cb 1.62 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 31.57 1a5t h ARG 244 CO 0.18 0.41 -0.68 -0.07 -1.07 0.00 0.00 179.97 178.74 1a5t h LEU 245 N 0.46 0.15 -0.24 3.04 3.38 -0.27 -2.78 115.31 119.04 1a5t h LEU 245 Ca 0.11 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1a5t h LEU 245 Cb 0.14 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1a5t h LEU 245 CO -0.01 0.78 0.11 -0.74 0.09 0.00 0.00 178.44 178.68 1a5t h HIS 246 N 0.09 0.35 -0.23 1.13 2.76 -0.72 0.18 115.15 118.70 1a5t h HIS 246 Ca -0.01 -0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.19 1a5t h HIS 246 Cb 1.21 -0.11 -0.06 0.00 1.55 0.00 0.00 27.41 30.00 1a5t h HIS 246 CO 0.01 0.35 -0.16 -1.49 -1.30 0.00 0.00 177.93 175.35 1a5t h TRP 247 N 0.25 -0.40 0.01 5.26 6.55 -1.14 0.42 115.95 126.90 1a5t h TRP 247 Ca 0.08 0.03 0.03 0.00 0.95 0.00 0.00 58.89 59.98 1a5t h TRP 247 Cb 0.14 0.21 -0.05 0.00 -0.86 0.00 0.00 29.16 28.60 1a5t h TRP 247 CO -0.02 -0.23 -0.30 1.25 -1.05 0.00 0.00 178.44 178.09 1a5t h LEU 248 N -0.15 -0.89 -1.04 -4.49 5.85 -1.24 -0.98 115.31 112.36 1a5t h LEU 248 Ca 0.13 0.12 0.16 0.00 0.84 0.00 0.00 57.88 59.13 1a5t h LEU 248 Cb 0.35 0.36 -0.09 0.00 0.37 0.00 0.00 40.66 41.64 1a5t h LEU 248 CO -0.32 -0.37 0.62 0.00 -0.34 0.00 0.00 178.44 178.03 1a5t h ALA 249 N 0.30 1.64 -0.66 1.25 0.00 -0.27 -0.17 119.26 121.34 1a5t h ALA 249 Ca 0.06 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1a5t h ALA 249 Cb 0.54 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1a5t h ALA 249 CO -0.25 0.06 0.19 1.15 0.00 0.00 0.00 179.25 180.40 1a5t h THR 250 N 0.85 1.25 -0.19 0.00 2.02 0.29 0.16 112.91 117.29 1a5t h THR 250 Ca 0.53 -0.86 -0.12 0.00 0.77 0.00 0.00 66.41 66.73 1a5t h THR 250 Cb 0.72 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1a5t h THR 250 CO -0.31 0.33 -0.36 -0.07 0.37 0.00 0.00 175.52 175.48 1a5t h LEU 251 N 0.98 0.64 -0.53 2.58 3.38 0.15 -1.37 115.31 121.13 1a5t h LEU 251 Ca 0.21 -0.55 0.03 0.00 0.09 0.00 0.00 57.88 57.67 1a5t h LEU 251 Cb 0.30 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1a5t h LEU 251 CO -0.01 1.06 0.31 -0.07 0.09 0.00 0.00 178.44 179.83 1a5t h LEU 252 N 0.24 0.50 -1.23 1.67 3.38 -1.14 0.16 115.31 118.89 1a5t h LEU 252 Ca 0.01 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 1a5t h LEU 252 Cb 0.95 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 1a5t h LEU 252 CO 0.08 0.35 -0.27 -0.03 0.09 0.00 0.00 178.44 178.66 1a5t h MET 253 N 0.62 0.18 -0.15 1.13 4.05 -0.91 -0.06 114.93 119.79 1a5t h MET 253 Ca 0.22 -0.06 -0.20 0.00 -0.28 0.00 0.00 59.70 59.38 1a5t h MET 253 Cb 0.04 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 30.82 1a5t h MET 253 CO -0.10 0.45 -0.70 -0.44 0.23 0.00 0.00 176.91 176.35 1a5t h ASP 254 N 0.16 0.76 0.13 1.39 3.32 -0.36 -3.02 116.42 118.80 1a5t h ASP 254 Ca 0.03 -0.47 -0.06 0.00 0.02 0.00 0.00 57.03 56.54 1a5t h ASP 254 Cb 0.58 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1a5t h ASP 254 CO 0.04 1.24 -0.23 0.00 -1.72 0.00 0.00 179.24 178.57 1a5t h ALA 255 N 0.75 1.43 0.00 3.45 0.00 -0.03 -2.27 119.26 122.59 1a5t h ALA 255 Ca -0.03 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1a5t h ALA 255 Cb 1.30 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1a5t h ALA 255 CO 0.14 0.40 0.00 1.28 0.00 0.00 0.00 179.25 181.07 1a5t n LEU 256 N -4.20 0.00 -2.15 0.00 4.77 -0.10 -3.60 117.00 111.72 1a5t n LEU 256 Ca -0.01 0.33 -0.27 0.00 -0.03 0.00 0.00 56.01 56.03 1a5t n LEU 256 Cb 0.33 -0.33 0.07 0.00 -2.33 0.00 0.00 43.42 41.16 1a5t n LEU 256 CO 0.39 -0.07 1.34 0.29 -1.33 0.00 0.00 177.39 178.01 1a5t n LYS 257 N -1.33 2.32 0.00 3.23 5.02 -0.85 -5.08 118.16 121.46 1a5t n LYS 257 Ca 0.10 -2.61 0.00 0.00 -2.02 0.00 0.00 58.31 53.78 1a5t n LYS 257 Cb 0.21 -2.02 0.00 0.00 -0.02 0.00 0.00 35.03 33.20 1a5t n LYS 257 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1a5t n ARG 258 N -0.49 0.00 -3.25 1.97 1.74 -1.24 -5.09 116.66 110.30 1a5t n ARG 258 Ca 0.50 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 57.61 1a5t n ARG 258 Cb 0.72 -1.54 -0.04 0.00 -1.02 0.00 0.00 32.46 30.59 1a5t n ARG 258 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1a5t s VAL 265 N -0.01 -0.23 -0.12 1.55 1.01 -1.26 -5.13 120.40 116.21 1a5t s VAL 265 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 61.98 61.85 1a5t s VAL 265 Cb 0.00 -1.00 -0.26 0.00 0.00 0.00 0.00 36.38 35.12 1a5t s VAL 265 CO 0.00 0.00 0.44 0.71 0.00 0.00 0.00 175.10 176.25 1a5t h THR 266 N 5.23 0.85 -0.81 3.92 1.35 -1.95 -3.39 112.91 118.10 1a5t h THR 266 Ca -0.14 -2.35 -0.73 0.00 -0.55 0.00 0.00 66.41 62.64 1a5t h THR 266 Cb 1.13 2.56 -0.09 0.00 -1.73 0.00 0.00 68.15 70.03 1a5t h THR 266 CO 0.04 0.74 2.74 0.59 -0.25 0.00 0.00 175.52 179.37 1a5t n ASN 267 N -3.80 6.96 0.14 5.36 3.02 -1.26 -4.32 115.26 121.35 1a5t n ASN 267 Ca -0.29 -2.97 0.11 0.00 -0.03 0.00 0.00 54.58 51.40 1a5t n ASN 267 Cb 0.94 -1.47 0.52 0.00 -0.61 0.00 0.00 39.78 39.15 1a5t n ASN 267 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1a5t n VAL 268 N 2.96 0.97 0.74 2.41 0.24 -1.26 -2.40 118.33 121.99 1a5t n VAL 268 Ca 0.59 0.47 0.12 0.00 -2.04 0.00 0.00 64.34 63.48 1a5t n VAL 268 Cb 0.29 -1.43 0.20 0.00 -1.47 0.00 0.00 33.84 31.43 1a5t n VAL 268 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1a5t n ASP 269 N -2.21 0.59 -2.87 -1.34 5.75 -1.26 -4.34 116.55 110.87 1a5t n ASP 269 Ca 0.00 -0.04 -0.21 0.00 -0.01 0.00 0.00 54.79 54.54 1a5t n ASP 269 Cb 0.13 0.23 -0.02 0.00 -1.03 0.00 0.00 41.12 40.44 1a5t n ASP 269 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 1a5t n VAL 270 N -1.85 1.52 0.33 2.12 0.24 -1.01 -4.88 118.33 114.80 1a5t n VAL 270 Ca 0.04 -4.64 0.22 0.00 -2.04 0.00 0.00 64.34 57.91 1a5t n VAL 270 Cb 0.40 -0.60 1.15 0.00 -1.47 0.00 0.00 33.84 33.31 1a5t n VAL 270 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1a5t h PRO 271 N 2.91 0.00 0.19 7.34 0.13 -1.76 -2.42 132.00 138.40 1a5t h PRO 271 Ca 0.11 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.23 1a5t h PRO 271 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1a5t h PRO 271 CO 0.66 0.00 -0.09 0.78 -0.23 0.00 0.00 178.00 179.12 1a5t h GLY 272 N 0.19 -0.27 1.80 1.56 0.00 -1.94 -0.73 103.07 103.69 1a5t h GLY 272 Ca -0.00 0.10 -0.11 0.00 0.00 0.00 0.00 47.33 47.32 1a5t h GLY 272 CO 0.00 -0.10 -0.41 -2.00 0.00 0.00 0.00 176.54 174.03 1a5t h LEU 273 N -0.44 0.23 -0.41 3.11 5.85 -1.86 -1.03 115.31 120.76 1a5t h LEU 273 Ca -0.03 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.56 1a5t h LEU 273 Cb 0.34 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1a5t h LEU 273 CO 0.04 0.63 0.10 0.58 -0.34 0.00 0.00 178.44 179.45 1a5t h VAL 274 N 0.19 1.23 0.14 1.05 2.07 -1.39 -0.72 116.25 118.81 1a5t h VAL 274 Ca 0.02 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 1a5t h VAL 274 Cb 0.81 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 1a5t h VAL 274 CO 0.06 0.28 -0.07 0.00 0.02 0.00 0.00 177.57 177.87 1a5t h ALA 275 N 0.95 -0.18 -0.89 1.67 0.00 -0.68 -0.22 119.26 119.91 1a5t h ALA 275 Ca 0.13 -0.04 0.13 0.00 0.00 0.00 0.00 54.91 55.13 1a5t h ALA 275 Cb 0.32 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.11 1a5t h ALA 275 CO 0.00 -0.60 0.57 1.49 0.00 0.00 0.00 179.25 180.72 1a5t h GLU 276 N -0.19 0.73 -0.06 0.00 4.81 -1.08 0.30 114.58 119.10 1a5t h GLU 276 Ca -0.02 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 1a5t h GLU 276 Cb 0.14 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.36 1a5t h GLU 276 CO 0.03 0.48 -0.03 -0.07 -0.73 0.00 0.00 179.01 178.69 1a5t h LEU 277 N 0.75 0.13 -1.59 1.64 3.38 -0.43 -1.76 115.31 117.43 1a5t h LEU 277 Ca 0.44 -0.43 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1a5t h LEU 277 Cb 0.63 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1a5t h LEU 277 CO -0.20 0.53 -0.18 0.00 0.09 0.00 0.00 178.44 178.68 1a5t h ALA 278 N 0.60 1.19 0.13 1.53 0.00 -0.25 -1.60 119.26 120.86 1a5t h ALA 278 Ca 0.01 -0.16 -0.24 0.00 0.00 0.00 0.00 54.91 54.51 1a5t h ALA 278 Cb 0.49 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.26 1a5t h ALA 278 CO 0.01 0.22 -1.19 -0.97 0.00 0.00 0.00 179.25 177.33 1a5t h ASN 279 N 0.00 0.44 1.15 0.00 -0.00 -0.40 -3.39 115.58 113.38 1a5t h ASN 279 Ca -0.00 -0.89 0.00 0.00 -0.00 0.00 0.00 56.30 55.41 1a5t h ASN 279 Cb 0.51 -0.14 0.00 0.00 -0.00 0.00 0.00 38.32 38.68 1a5t h ASN 279 CO 0.02 1.54 -0.77 0.45 -0.00 0.00 0.00 177.43 178.67 1a5t h HIS 280 N -0.31 0.00 -3.49 0.67 3.86 -1.30 -3.46 115.15 111.13 1a5t h HIS 280 Ca -0.24 0.00 -0.66 0.00 -1.16 0.00 0.00 60.37 58.31 1a5t h HIS 280 Cb 1.73 0.00 -0.26 0.00 1.06 0.00 0.00 27.41 29.94 1a5t h HIS 280 CO 0.15 0.00 -0.77 -0.51 0.86 0.00 0.00 177.93 177.66 1a5t s LEU 281 N -5.33 2.70 0.59 2.43 1.02 -0.61 -5.09 118.68 114.39 1a5t s LEU 281 Ca 0.02 -0.31 -0.17 0.00 0.02 0.00 0.00 54.13 53.69 1a5t s LEU 281 Cb 0.09 -1.59 -0.03 0.00 0.02 0.00 0.00 46.19 44.68 1a5t s LEU 281 CO 0.76 0.21 1.12 -0.94 0.02 0.00 0.00 176.35 177.51 1a5t s SER 282 N 0.10 5.48 0.45 2.29 1.04 -1.26 -4.68 113.70 117.12 1a5t s SER 282 Ca -0.06 2.08 0.16 0.00 0.48 0.00 0.00 55.95 58.61 1a5t s SER 282 Cb -0.15 -2.57 1.10 0.00 0.10 0.00 0.00 66.02 64.51 1a5t s SER 282 CO 0.05 -1.38 1.98 -0.65 0.98 0.00 0.00 173.24 174.22 1a5t h PRO 283 N 0.69 0.32 -0.33 4.02 0.11 -1.97 -0.08 132.00 134.76 1a5t h PRO 283 Ca -0.49 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.52 1a5t h PRO 283 Cb 1.25 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1a5t h PRO 283 CO 0.56 0.21 -0.14 0.66 -0.21 0.00 0.00 178.00 179.08 1a5t h SER 284 N 0.33 0.57 0.37 -2.05 4.64 -2.00 -1.48 113.55 113.93 1a5t h SER 284 Ca 0.27 -0.16 -0.32 0.00 -0.47 0.00 0.00 61.79 61.11 1a5t h SER 284 Cb 0.63 -0.15 0.03 0.00 -0.31 0.00 0.00 62.40 62.59 1a5t h SER 284 CO -0.07 0.73 -1.43 0.03 -0.87 0.00 0.00 176.83 175.23 1a5t h ARG 285 N 0.53 0.46 -0.74 4.77 3.08 -1.57 -2.39 114.38 118.53 1a5t h ARG 285 Ca 0.09 -0.78 0.05 0.00 0.07 0.00 0.00 59.98 59.42 1a5t h ARG 285 Cb 0.55 0.29 -0.05 0.00 0.08 0.00 0.00 29.97 30.83 1a5t h ARG 285 CO 0.03 1.37 0.44 -0.07 -1.07 0.00 0.00 179.97 180.68 1a5t h LEU 286 N 0.12 0.69 -0.50 3.04 3.38 -0.92 0.15 115.31 121.28 1a5t h LEU 286 Ca -0.23 0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.66 1a5t h LEU 286 Cb 2.11 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 42.72 1a5t h LEU 286 CO 0.25 0.45 -0.10 -0.61 0.09 0.00 0.00 178.44 178.53 1a5t h GLN 287 N 0.83 0.95 -0.50 1.13 5.75 -1.31 0.17 115.11 122.13 1a5t h GLN 287 Ca 0.32 -0.35 -0.10 0.00 -0.15 0.00 0.00 58.65 58.37 1a5t h GLN 287 Cb 0.14 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 1a5t h GLN 287 CO -0.16 1.02 -0.07 0.00 -2.65 0.00 0.00 178.83 176.97 1a5t h ALA 288 N 0.90 0.68 -0.38 3.38 0.00 -0.93 -0.13 119.26 122.79 1a5t h ALA 288 Ca 0.13 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1a5t h ALA 288 Cb 0.65 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1a5t h ALA 288 CO 0.05 0.55 -0.10 0.82 0.00 0.00 0.00 179.25 180.57 1a5t h ILE 289 N 0.79 1.28 -0.53 0.00 2.04 -0.59 -2.52 117.51 117.97 1a5t h ILE 289 Ca 0.13 -1.18 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 1a5t h ILE 289 Cb 0.61 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 1a5t h ILE 289 CO 0.04 0.39 0.30 0.25 0.00 0.00 0.00 178.15 179.13 1a5t h LEU 290 N 0.53 0.65 -0.71 1.44 5.85 -0.49 -1.10 115.31 121.48 1a5t h LEU 290 Ca 0.09 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 1a5t h LEU 290 Cb 0.61 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1a5t h LEU 290 CO 0.04 0.55 0.36 1.23 -0.34 0.00 0.00 178.44 180.28 1a5t h GLY 291 N 0.71 1.08 0.72 3.75 0.00 -0.96 -1.98 103.07 106.39 1a5t h GLY 291 Ca 0.19 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 1a5t h GLY 291 CO -0.03 0.49 -0.00 -1.80 0.00 0.00 0.00 176.54 175.20 1a5t h ASP 292 N 0.98 0.10 -0.63 0.19 1.82 -1.27 -1.77 116.42 115.84 1a5t h ASP 292 Ca 0.25 -0.31 0.09 0.00 -0.39 0.00 0.00 57.03 56.66 1a5t h ASP 292 Cb 0.08 -0.03 -0.07 0.00 0.68 0.00 0.00 39.33 39.99 1a5t h ASP 292 CO -0.04 0.38 0.27 0.58 -1.61 0.00 0.00 179.24 178.83 1a5t h VAL 293 N -0.20 0.81 -0.40 2.25 2.07 -1.11 -0.90 116.25 118.77 1a5t h VAL 293 Ca 0.02 -0.16 -0.10 0.00 0.82 0.00 0.00 66.70 67.27 1a5t h VAL 293 Cb 0.34 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1a5t h VAL 293 CO 0.00 0.09 -0.17 0.00 0.02 0.00 0.00 177.57 177.51 1a5t h HIS 295 N 0.67 0.75 0.02 0.00 6.17 -0.72 -2.33 115.15 119.71 1a5t h HIS 295 Ca 0.10 -0.20 -0.21 0.00 0.71 0.00 0.00 60.37 60.78 1a5t h HIS 295 Cb 0.65 -0.17 -0.01 0.00 2.52 0.00 0.00 27.41 30.41 1a5t h HIS 295 CO 0.03 0.90 -0.93 0.82 0.71 0.00 0.00 177.93 179.46 1a5t h ILE 296 N 0.54 1.50 -0.16 6.26 5.03 -1.06 -1.54 117.51 128.07 1a5t h ILE 296 Ca 0.06 -2.69 0.02 0.00 -0.12 0.00 0.00 64.86 62.13 1a5t h ILE 296 Cb 0.85 2.53 -0.02 0.00 -3.03 0.00 0.00 36.82 37.14 1a5t h ILE 296 CO 0.07 0.78 0.01 -0.09 -0.68 0.00 0.00 178.15 178.25 1a5t h ARG 297 N 0.11 0.07 -0.57 2.37 2.43 -0.79 -0.21 114.38 117.79 1a5t h ARG 297 Ca -0.05 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 1a5t h ARG 297 Cb 1.57 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 31.08 1a5t h ARG 297 CO 0.14 0.04 0.28 0.93 -1.51 0.00 0.00 179.97 179.85 1a5t h GLU 298 N 0.07 0.81 -0.76 0.20 4.39 -1.37 -2.34 114.58 115.58 1a5t h GLU 298 Ca 0.07 -0.12 0.06 0.00 0.34 0.00 0.00 59.36 59.71 1a5t h GLU 298 Cb 0.08 -0.15 -0.05 0.00 -0.10 0.00 0.00 28.75 28.54 1a5t h GLU 298 CO -0.12 0.66 0.50 1.96 -1.16 0.00 0.00 179.01 180.86 1a5t h GLN 299 N 0.77 0.82 0.00 2.33 4.20 -0.74 0.12 115.11 122.61 1a5t h GLN 299 Ca 0.20 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.81 1a5t h GLN 299 Cb 0.11 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1a5t h GLN 299 CO -0.03 0.54 -0.21 -0.07 -0.67 0.00 0.00 178.83 178.40 1a5t h LEU 300 N 0.84 0.00 0.00 1.46 3.38 -0.65 -3.04 115.31 117.31 1a5t h LEU 300 Ca 0.32 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.10 1a5t h LEU 300 Cb 0.20 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 1a5t h LEU 300 CO -0.11 0.21 -2.00 0.23 0.09 0.00 0.00 178.44 176.86 1a5t n MET 301 N -3.29 0.66 0.03 1.13 2.81 -0.69 -2.39 117.12 115.38 1a5t n MET 301 Ca 0.01 -0.02 -0.19 0.00 -1.81 0.00 0.00 57.70 55.69 1a5t n MET 301 Cb 0.47 -1.59 -0.12 0.00 -0.71 0.00 0.00 33.22 31.26 1a5t n MET 301 CO 0.00 0.00 0.00 0.77 1.51 0.00 0.00 175.97 178.25 1a5t h SER 302 N 0.00 0.60 -0.28 7.83 0.02 -0.84 -3.41 113.55 117.47 1a5t h SER 302 Ca -0.26 -0.82 -0.27 0.00 -0.84 0.00 0.00 61.79 59.60 1a5t h SER 302 Cb 1.65 -0.19 -0.19 0.00 0.14 0.00 0.00 62.40 63.82 1a5t h SER 302 CO 0.02 1.35 -0.54 0.52 -1.14 0.00 0.00 176.83 177.04 1a5t n VAL 303 N -4.10 -0.01 0.00 2.27 0.31 -1.15 -5.06 118.33 110.59 1a5t n VAL 303 Ca -0.12 -1.93 0.00 0.00 -0.01 0.00 0.00 64.34 62.28 1a5t n VAL 303 Cb 0.77 1.22 0.00 0.00 -0.91 0.00 0.00 33.84 34.93 1a5t n VAL 303 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1a5t n THR 304 N 0.27 0.00 -0.35 2.52 -1.04 -1.01 -4.25 114.28 110.43 1a5t n THR 304 Ca 0.08 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.97 1a5t n THR 304 Cb 0.71 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.18 1a5t n THR 304 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1a5t n GLY 305 N 0.00 -0.09 0.00 3.41 0.00 -1.25 -4.46 105.19 102.80 1a5t n GLY 305 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.30 1a5t n GLY 305 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1a5t n ILE 306 N 1.77 0.00 -3.82 -0.61 -5.35 -1.26 -0.21 119.36 109.88 1a5t n ILE 306 Ca 0.15 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.34 1a5t n ILE 306 Cb 0.00 0.00 -0.11 0.00 -1.74 0.00 0.00 39.64 37.80 1a5t n ILE 306 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1a5t n ASN 307 N -2.18 3.36 -0.35 7.28 5.15 -1.26 -4.96 115.26 122.31 1a5t n ASN 307 Ca 0.00 -3.21 -0.02 0.00 -0.60 0.00 0.00 54.58 50.76 1a5t n ASN 307 Cb 0.00 -0.83 0.14 0.00 -0.53 0.00 0.00 39.78 38.56 1a5t n ASN 307 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 1a5t h ARG 308 N 5.47 1.26 -0.08 1.20 1.12 -0.87 -2.96 114.38 119.53 1a5t h ARG 308 Ca 0.16 -0.08 0.01 0.00 -1.11 0.00 0.00 59.98 58.96 1a5t h ARG 308 Cb 0.76 -0.28 -0.00 0.00 -0.01 0.00 0.00 29.97 30.43 1a5t h ARG 308 CO 0.76 0.84 0.05 1.49 -3.11 0.00 0.00 179.97 180.00 1a5t h GLU 309 N 1.30 0.05 0.03 0.20 4.81 -1.93 -1.55 114.58 117.50 1a5t h GLU 309 Ca 0.35 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.58 1a5t h GLU 309 Cb -0.15 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.22 1a5t h GLU 309 CO -0.08 0.03 -0.02 1.25 -0.73 0.00 0.00 179.01 179.47 1a5t h LEU 310 N 0.05 -0.04 -0.46 1.64 6.46 -1.90 -0.24 115.31 120.82 1a5t h LEU 310 Ca 0.03 -0.47 0.09 0.00 -0.12 0.00 0.00 57.88 57.42 1a5t h LEU 310 Cb 0.08 0.01 -0.10 0.00 -0.73 0.00 0.00 40.66 39.92 1a5t h LEU 310 CO -0.00 0.46 -0.22 -0.07 -0.62 0.00 0.00 178.44 177.99 1a5t h LEU 311 N -0.55 -0.74 -0.28 2.25 3.38 -1.41 -0.41 115.31 117.55 1a5t h LEU 311 Ca -0.00 0.17 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 1a5t h LEU 311 Cb 0.50 0.40 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1a5t h LEU 311 CO 0.01 -0.24 0.06 0.40 0.09 0.00 0.00 178.44 178.75 1a5t h ILE 312 N -0.12 1.22 -0.90 1.22 2.04 -1.26 -1.80 117.51 117.92 1a5t h ILE 312 Ca 0.22 -0.75 0.01 0.00 1.00 0.00 0.00 64.86 65.34 1a5t h ILE 312 Cb 0.46 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 37.66 1a5t h ILE 312 CO -0.53 0.24 0.60 0.71 0.00 0.00 0.00 178.15 179.17 1a5t h THR 313 N 0.29 1.23 -0.20 -0.27 1.35 -0.45 0.23 112.91 115.08 1a5t h THR 313 Ca 0.09 -0.42 -0.10 0.00 -0.55 0.00 0.00 66.41 65.44 1a5t h THR 313 Cb 0.31 -0.09 -0.01 0.00 -1.73 0.00 0.00 68.15 66.62 1a5t h THR 313 CO 0.00 0.22 -0.29 0.44 -0.25 0.00 0.00 175.52 175.65 1a5t h ASP 314 N 1.21 0.40 0.01 5.36 3.32 -0.97 -1.21 116.42 124.55 1a5t h ASP 314 Ca 0.33 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 1a5t h ASP 314 Cb -0.14 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.30 1a5t h ASP 314 CO -0.07 0.68 -0.01 0.25 -1.72 0.00 0.00 179.24 178.37 1a5t h LEU 315 N 0.35 -0.01 -1.40 1.55 6.46 -0.33 0.47 115.31 122.40 1a5t h LEU 315 Ca 0.05 -0.20 -0.02 0.00 -0.12 0.00 0.00 57.88 57.59 1a5t h LEU 315 Cb 0.69 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.60 1a5t h LEU 315 CO 0.05 0.20 0.18 -0.07 -0.62 0.00 0.00 178.44 178.18 1a5t h LEU 316 N -0.22 0.53 -0.24 2.25 3.38 -0.54 -1.51 115.31 118.95 1a5t h LEU 316 Ca -0.00 -0.05 -0.18 0.00 0.09 0.00 0.00 57.88 57.74 1a5t h LEU 316 Cb 0.22 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1a5t h LEU 316 CO 0.00 0.47 -0.87 -0.07 0.09 0.00 0.00 178.44 178.07 1a5t h LEU 317 N 0.59 0.00 -0.40 1.67 3.38 -1.05 -2.33 115.31 117.17 1a5t h LEU 317 Ca 0.15 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.98 1a5t h LEU 317 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1a5t h LEU 317 CO -0.02 0.87 -0.27 0.03 0.09 0.00 0.00 178.44 179.13 1a5t h ARG 318 N 0.00 0.89 -0.69 1.13 3.08 -0.40 -2.02 114.38 116.36 1a5t h ARG 318 Ca -0.01 -0.43 0.07 0.00 0.07 0.00 0.00 59.98 59.68 1a5t h ARG 318 Cb 1.55 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 31.53 1a5t h ARG 318 CO 0.11 1.08 0.38 0.82 -1.07 0.00 0.00 179.97 181.29 1a5t h ILE 319 N 0.71 0.95 -0.14 2.04 2.04 -1.20 0.66 117.51 122.57 1a5t h ILE 319 Ca 0.08 -0.24 -0.10 0.00 1.00 0.00 0.00 64.86 65.61 1a5t h ILE 319 Cb 0.85 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1a5t h ILE 319 CO 0.07 0.13 -0.34 -0.33 0.00 0.00 0.00 178.15 177.68 1a5t h GLU 320 N 0.69 0.29 -0.37 2.37 5.08 -1.33 -2.04 114.58 119.27 1a5t h GLU 320 Ca 0.32 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.50 1a5t h GLU 320 Cb 0.22 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1a5t h GLU 320 CO -0.20 0.60 -0.01 1.25 -1.00 0.00 0.00 179.01 179.65 1a5t h HIS 321 N 0.25 0.62 -0.61 4.33 2.76 -0.17 -2.92 115.15 119.41 1a5t h HIS 321 Ca 0.03 -0.07 -0.03 0.00 -2.20 0.00 0.00 60.37 58.10 1a5t h HIS 321 Cb 0.72 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.48 1a5t h HIS 321 CO 0.01 0.60 0.27 1.88 -1.30 0.00 0.00 177.93 179.40 1a5t h TYR 322 N 0.56 0.87 0.00 5.26 0.05 -0.42 -3.00 116.97 120.30 1a5t h TYR 322 Ca 0.12 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.86 1a5t h TYR 322 Cb 0.37 -0.27 0.00 0.00 1.01 0.00 0.00 36.73 37.84 1a5t h TYR 322 CO 0.01 0.66 0.00 -0.07 -1.05 0.00 0.00 178.16 177.71 1a5t h LEU 323 N 0.87 0.00 -9.63 3.88 3.38 -1.32 -3.45 115.31 109.04 1a5t h LEU 323 Ca 0.21 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.66 1a5t h LEU 323 Cb 0.13 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.89 1a5t h LEU 323 CO -0.02 0.00 0.52 -1.10 0.09 0.00 0.00 178.44 177.92 1a5t s GLN 324 N -3.47 4.53 0.33 1.13 -1.52 -1.13 -5.00 119.66 114.52 1a5t s GLN 324 Ca 0.01 1.78 -0.29 0.00 -1.95 0.00 0.00 55.36 54.91 1a5t s GLN 324 Cb 0.08 -3.28 -0.11 0.00 -0.22 0.00 0.00 33.01 29.48 1a5t s GLN 324 CO 0.32 -0.04 1.53 -2.14 -0.25 0.00 0.00 175.29 174.72 1a5t s PRO 325 N -0.06 4.12 0.00 2.91 0.02 -1.26 -2.76 135.00 137.97 1a5t s PRO 325 Ca 0.52 2.56 0.00 0.00 0.02 0.00 0.00 61.00 64.10 1a5t s PRO 325 Cb -0.30 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.22 1a5t s PRO 325 CO 0.34 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 176.85 1a5t n GLY 326 N 1.34 1.10 3.73 0.52 0.00 -1.26 -5.04 105.19 105.57 1a5t n GLY 326 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1a5t n GLY 326 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a5t s VAL 327 N -3.08 4.77 -0.17 1.61 1.01 -1.11 -5.03 120.40 118.40 1a5t s VAL 327 Ca 0.00 1.76 -0.28 0.00 0.00 0.00 0.00 61.98 63.46 1a5t s VAL 327 Cb 0.00 -4.18 -0.00 0.00 0.00 0.00 0.00 36.38 32.20 1a5t s VAL 327 CO 0.00 0.29 0.98 0.68 0.00 0.00 0.00 175.10 177.05 1a5t s VAL 328 N 0.33 4.76 -0.04 2.92 -7.23 -1.26 -4.99 120.40 114.88 1a5t s VAL 328 Ca 0.43 1.94 0.21 0.00 -1.81 0.00 0.00 61.98 62.75 1a5t s VAL 328 Cb -0.21 -4.27 0.20 0.00 0.56 0.00 0.00 36.38 32.67 1a5t s VAL 328 CO 0.24 -0.07 1.68 -0.07 -0.31 0.00 0.00 175.10 176.58 1a5t h LEU 329 N 8.71 0.00 0.00 1.32 3.38 -1.95 -3.50 115.31 123.26 1a5t h LEU 329 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1a5t h LEU 329 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1a5t h LEU 329 CO 0.90 0.27 0.00 -2.65 0.09 0.00 0.00 178.44 177.05