#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a6o s LEU 2 N 0.00 3.26 0.34 3.17 1.02 -1.26 -4.86 118.68 120.34 3a6o s LEU 2 Ca 0.00 -0.40 0.03 0.00 0.02 0.00 0.00 54.13 53.78 3a6o s LEU 2 Cb 0.00 -2.55 0.60 0.00 0.02 0.00 0.00 46.19 44.26 3a6o s LEU 2 CO 0.00 -2.12 1.91 -0.07 0.02 0.00 0.00 176.35 176.09 3a6o h LEU 3 N 14.97 0.59 -1.12 1.79 3.38 -2.03 -1.60 115.31 131.29 3a6o h LEU 3 Ca -0.12 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.76 3a6o h LEU 3 Cb 1.07 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.67 3a6o h LEU 3 CO 1.27 0.57 0.26 -0.33 0.09 0.00 0.00 178.44 180.30 3a6o h GLU 4 N 0.63 0.00 -0.01 1.13 3.07 -2.03 -0.42 114.58 116.95 3a6o h GLU 4 Ca 0.15 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.01 3a6o h GLU 4 Cb 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.11 3a6o h GLU 4 CO -0.01 0.00 -0.53 0.00 -1.40 0.00 0.00 179.01 177.08 3a6o n ALA 5 N -1.64 3.64 -2.68 3.43 0.00 -0.61 -4.97 120.51 117.67 3a6o n ALA 5 Ca -0.01 -0.57 -0.42 0.00 0.00 0.00 0.00 53.44 52.43 3a6o n ALA 5 Cb 0.28 -0.67 -0.03 0.00 0.00 0.00 0.00 19.45 19.04 3a6o n ALA 5 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3a6o s ILE 6 N -2.33 4.78 0.00 0.00 1.01 -0.17 -3.94 121.20 120.55 3a6o s ILE 6 Ca 0.13 2.03 0.01 0.00 0.00 0.00 0.00 60.65 62.83 3a6o s ILE 6 Cb 0.15 -4.31 -0.01 0.00 0.01 0.00 0.00 42.46 38.31 3a6o s ILE 6 CO 0.56 -0.01 -0.04 0.12 0.00 0.00 0.00 174.94 175.56 3a6o s PHE 7 N 2.15 0.34 0.08 3.97 5.36 0.17 -4.97 117.98 125.07 3a6o s PHE 7 Ca 0.48 -0.12 -0.24 0.00 -0.96 0.00 0.00 56.93 56.08 3a6o s PHE 7 Cb -0.18 -0.22 0.06 0.00 -0.34 0.00 0.00 43.02 42.35 3a6o s PHE 7 CO 0.16 -0.02 0.59 -1.58 -1.46 0.00 0.00 175.22 172.91 3a6o s HIS 8 N -0.28 -0.52 -0.11 10.12 5.65 -1.26 -1.13 115.29 127.76 3a6o s HIS 8 Ca -0.01 0.54 -0.11 0.00 0.25 0.00 0.00 55.06 55.73 3a6o s HIS 8 Cb -0.03 0.45 0.03 0.00 -1.18 0.00 0.00 32.58 31.86 3a6o s HIS 8 CO -0.00 -0.73 0.31 -1.83 -0.65 0.00 0.00 174.74 171.84 3a6o s GLU 9 N -2.81 0.39 -0.20 2.88 -1.05 -1.26 -5.06 118.70 111.58 3a6o s GLU 9 Ca -0.03 0.37 -0.06 0.00 -0.15 0.00 0.00 54.97 55.10 3a6o s GLU 9 Cb -0.01 0.19 -0.17 0.00 -0.44 0.00 0.00 34.13 33.70 3a6o s GLU 9 CO -0.05 -0.06 3.37 0.00 0.95 0.00 0.00 175.26 179.48 3a6o n ALA 10 N 2.76 6.46 -3.73 -0.84 0.00 -1.26 -3.75 120.51 120.15 3a6o n ALA 10 Ca -0.14 -2.24 0.09 0.00 0.00 0.00 0.00 53.44 51.15 3a6o n ALA 10 Cb 0.58 -2.33 0.01 0.00 0.00 0.00 0.00 19.45 17.71 3a6o n ALA 10 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 3a6o n LYS 11 N 2.13 0.41 0.00 0.00 2.85 -1.24 -4.81 118.16 117.50 3a6o n LYS 11 Ca 0.46 -1.01 0.00 0.00 -1.05 0.00 0.00 58.31 56.71 3a6o n LYS 11 Cb 0.79 1.42 0.00 0.00 -0.65 0.00 0.00 35.03 36.59 3a6o n LYS 11 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3a6o n GLY 12 N -0.62 3.89 0.05 2.58 0.00 -1.25 -2.42 105.19 107.41 3a6o n GLY 12 Ca -0.00 0.09 0.11 0.00 0.00 0.00 0.00 46.02 46.22 3a6o n GLY 12 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3a6o n SER 13 N 6.81 0.61 0.15 1.61 7.64 -1.26 -4.15 113.62 125.03 3a6o n SER 13 Ca 0.00 -0.05 0.12 0.00 1.01 0.00 0.00 58.87 59.94 3a6o n SER 13 Cb 0.00 0.79 0.08 0.00 -1.01 0.00 0.00 64.21 64.06 3a6o n SER 13 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 3a6o h TYR 14 N 0.00 0.00 -2.04 1.43 0.05 -1.69 -3.44 116.97 111.28 3a6o h TYR 14 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3a6o h TYR 14 Cb 0.81 0.00 -0.23 0.00 1.01 0.00 0.00 36.73 38.32 3a6o h TYR 14 CO 0.00 0.00 -0.26 0.00 -1.05 0.00 0.00 178.16 176.85 3a6o s ALA 15 N -3.29 -1.69 0.06 3.88 0.00 -1.05 -1.22 121.76 118.45 3a6o s ALA 15 Ca 0.03 1.88 -0.26 0.00 0.00 0.00 0.00 51.96 53.60 3a6o s ALA 15 Cb 0.08 -1.67 0.08 0.00 0.00 0.00 0.00 23.12 21.61 3a6o s ALA 15 CO 0.74 -0.95 0.68 1.52 0.00 0.00 0.00 175.76 177.74 3a6o s TYR 16 N 2.77 -0.55 0.24 0.00 -0.85 -0.35 -3.68 117.35 114.94 3a6o s TYR 16 Ca 0.00 0.57 -0.22 0.00 -0.52 0.00 0.00 57.07 56.91 3a6o s TYR 16 Cb -0.13 0.51 -0.09 0.00 0.38 0.00 0.00 41.96 42.63 3a6o s TYR 16 CO -0.17 -0.72 0.79 -1.25 -1.52 0.00 0.00 175.55 172.68 3a6o s PRO 17 N -2.77 4.38 -0.04 -3.49 0.05 -1.26 0.82 135.00 132.68 3a6o s PRO 17 Ca -0.02 1.03 0.12 0.00 0.05 0.00 0.00 61.00 62.17 3a6o s PRO 17 Cb -0.01 -2.90 -0.17 0.00 0.05 0.00 0.00 34.50 31.47 3a6o s PRO 17 CO -0.05 0.38 0.21 0.44 0.05 0.00 0.00 177.00 178.03 3a6o n ILE 18 N 0.77 0.20 -2.28 0.56 -5.35 -0.81 -4.44 119.36 108.00 3a6o n ILE 18 Ca -0.01 -0.33 0.00 0.00 -0.27 0.00 0.00 62.75 62.14 3a6o n ILE 18 Cb 0.51 -0.02 0.00 0.00 -1.74 0.00 0.00 39.64 38.39 3a6o n ILE 18 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3a6o n SER 19 N -2.05 0.00 -0.07 7.28 3.41 -1.23 -4.97 113.62 115.99 3a6o n SER 19 Ca -0.06 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.67 3a6o n SER 19 Cb 0.46 0.00 0.26 0.00 -0.26 0.00 0.00 64.21 64.67 3a6o n SER 19 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3a6o n GLU 20 N 0.00 0.24 0.00 4.33 2.13 -1.26 -4.06 120.64 122.01 3a6o n GLU 20 Ca 0.00 -0.14 0.00 0.00 0.66 0.00 0.00 57.16 57.68 3a6o n GLU 20 Cb 0.00 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.21 3a6o n GLU 20 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 3a6o n THR 21 N -1.26 0.46 -4.28 6.31 -2.24 -1.26 -4.71 114.28 107.30 3a6o n THR 21 Ca 0.07 -0.49 -0.20 0.00 -2.27 0.00 0.00 64.05 61.16 3a6o n THR 21 Cb 0.34 0.82 -0.16 0.00 -2.10 0.00 0.00 70.33 69.24 3a6o n THR 21 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3a6o s GLN 22 N -0.46 0.90 -0.12 -0.78 -0.21 -1.26 0.75 119.66 118.48 3a6o s GLN 22 Ca 0.00 -0.21 -0.02 0.00 0.02 0.00 0.00 55.36 55.15 3a6o s GLN 22 Cb 0.00 -0.85 -0.03 0.00 1.00 0.00 0.00 33.01 33.13 3a6o s GLN 22 CO 0.00 0.02 -0.06 -1.17 -2.12 0.00 0.00 175.29 171.96 3a6o s LEU 23 N 0.51 3.14 -0.05 2.90 2.96 -0.31 -1.93 118.68 125.90 3a6o s LEU 23 Ca -0.08 -0.12 -0.19 0.00 -0.22 0.00 0.00 54.13 53.52 3a6o s LEU 23 Cb -0.11 -1.72 -0.05 0.00 0.50 0.00 0.00 46.19 44.81 3a6o s LEU 23 CO 0.01 0.24 0.54 -0.60 -1.32 0.00 0.00 176.35 175.21 3a6o s ARG 24 N -0.05 4.29 0.09 1.98 6.06 0.24 0.40 118.95 131.96 3a6o s ARG 24 Ca 0.00 0.61 0.05 0.00 -2.50 0.00 0.00 55.73 53.89 3a6o s ARG 24 Cb -0.13 -3.37 -0.03 0.00 0.06 0.00 0.00 34.95 31.48 3a6o s ARG 24 CO 0.03 0.31 -0.13 0.14 -2.50 0.00 0.00 175.30 173.16 3a6o s VAL 25 N 0.05 1.10 0.01 7.11 -7.23 0.19 -1.22 120.40 120.42 3a6o s VAL 25 Ca 0.29 -1.53 0.00 0.00 -1.81 0.00 0.00 61.98 58.93 3a6o s VAL 25 Cb -0.17 -1.29 -0.01 0.00 0.56 0.00 0.00 36.38 35.47 3a6o s VAL 25 CO 0.14 -0.40 -0.03 -0.13 -0.31 0.00 0.00 175.10 174.38 3a6o s ARG 26 N -2.36 0.24 0.01 4.82 0.52 -0.35 -1.32 118.95 120.50 3a6o s ARG 26 Ca 0.03 -0.40 0.03 0.00 -0.52 0.00 0.00 55.73 54.87 3a6o s ARG 26 Cb -0.06 -0.00 -0.01 0.00 0.52 0.00 0.00 34.95 35.39 3a6o s ARG 26 CO 0.02 -0.01 -0.09 -1.17 0.02 0.00 0.00 175.30 174.07 3a6o s LEU 27 N -0.91 2.10 0.08 2.53 0.20 0.29 -4.70 118.68 118.27 3a6o s LEU 27 Ca -0.09 -0.29 0.09 0.00 0.69 0.00 0.00 54.13 54.53 3a6o s LEU 27 Cb -0.06 -0.37 -0.03 0.00 -0.43 0.00 0.00 46.19 45.30 3a6o s LEU 27 CO -0.00 0.01 -0.24 0.00 -0.29 0.00 0.00 176.35 175.82 3a6o s ARG 28 N -0.69 1.70 -0.01 1.98 1.70 -0.29 0.01 118.95 123.35 3a6o s ARG 28 Ca -0.00 -1.18 -0.07 0.00 -0.47 0.00 0.00 55.73 54.00 3a6o s ARG 28 Cb -0.05 -2.00 0.00 0.00 -0.57 0.00 0.00 34.95 32.33 3a6o s ARG 28 CO 0.00 0.49 0.15 0.00 -1.08 0.00 0.00 175.30 174.86 3a6o s ALA 29 N -0.96 -0.35 0.05 7.88 0.00 -0.79 0.44 121.76 128.02 3a6o s ALA 29 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 51.96 51.74 3a6o s ALA 29 Cb -0.10 0.03 -0.19 0.00 0.00 0.00 0.00 23.12 22.86 3a6o s ALA 29 CO 0.05 -0.18 0.90 1.17 0.00 0.00 0.00 175.76 177.70 3a6o n LYS 30 N 1.78 0.00 -1.64 0.00 4.81 -1.26 -1.24 118.16 120.61 3a6o n LYS 30 Ca -0.21 0.00 -0.51 0.00 -0.87 0.00 0.00 58.31 56.73 3a6o n LYS 30 Cb 0.56 -1.33 -0.05 0.00 0.02 0.00 0.00 35.03 34.23 3a6o n LYS 30 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 3a6o n LYS 31 N 1.33 1.57 0.00 1.64 4.81 0.64 -1.28 118.16 126.86 3a6o n LYS 31 Ca 0.19 0.57 0.00 0.00 -0.87 0.00 0.00 58.31 58.20 3a6o n LYS 31 Cb 0.12 -2.28 0.00 0.00 0.02 0.00 0.00 35.03 32.89 3a6o n LYS 31 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3a6o n GLY 32 N 3.28 2.96 0.33 3.14 0.00 -1.26 -4.91 105.19 108.72 3a6o n GLY 32 Ca 0.20 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.16 3a6o n GLY 32 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3a6o h ASP 33 N 0.00 1.06 -2.90 1.61 5.19 -1.53 -3.44 116.42 116.42 3a6o h ASP 33 Ca 0.00 -0.15 -0.60 0.00 -0.62 0.00 0.00 57.03 55.67 3a6o h ASP 33 Cb 0.00 -0.27 -0.09 0.00 0.18 0.00 0.00 39.33 39.15 3a6o h ASP 33 CO 0.00 0.91 -0.60 -0.69 -3.12 0.00 0.00 179.24 175.74 3a6o s VAL 34 N -5.66 4.28 0.00 -1.35 1.01 -1.26 -4.13 120.40 113.29 3a6o s VAL 34 Ca -0.13 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 60.77 3a6o s VAL 34 Cb 0.16 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.39 3a6o s VAL 34 CO 0.83 -0.04 0.00 0.52 0.00 0.00 0.00 175.10 176.41 3a6o n VAL 35 N -0.06 0.00 -3.66 2.92 0.31 -0.22 -4.91 118.33 112.72 3a6o n VAL 35 Ca -0.09 -0.03 -0.11 0.00 -0.01 0.00 0.00 64.34 64.10 3a6o n VAL 35 Cb 0.54 0.49 -0.11 0.00 -0.91 0.00 0.00 33.84 33.85 3a6o n VAL 35 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 3a6o s ARG 36 N -0.20 0.24 -0.18 5.55 3.52 -1.08 -5.00 118.95 121.80 3a6o s ARG 36 Ca 0.00 0.89 0.01 0.00 -0.13 0.00 0.00 55.73 56.50 3a6o s ARG 36 Cb 0.00 0.15 0.03 0.00 -1.56 0.00 0.00 34.95 33.57 3a6o s ARG 36 CO 0.00 -0.27 -0.14 0.00 -0.81 0.00 0.00 175.30 174.09 3a6o s GLU 38 N 1.39 1.66 -0.24 0.00 2.12 0.15 -0.47 118.70 123.31 3a6o s GLU 38 Ca 0.02 -0.70 -0.10 0.00 0.36 0.00 0.00 54.97 54.56 3a6o s GLU 38 Cb -0.15 -1.57 -0.04 0.00 0.26 0.00 0.00 34.13 32.63 3a6o s GLU 38 CO -0.10 0.39 0.13 0.08 -0.54 0.00 0.00 175.26 175.23 3a6o s VAL 39 N -0.37 5.07 -0.34 3.70 1.01 0.68 0.40 120.40 130.55 3a6o s VAL 39 Ca 0.05 0.08 -0.09 0.00 0.00 0.00 0.00 61.98 62.02 3a6o s VAL 39 Cb -0.08 -3.37 0.02 0.00 0.00 0.00 0.00 36.38 32.95 3a6o s VAL 39 CO -0.00 0.34 0.16 -0.76 0.00 0.00 0.00 175.10 174.84 3a6o s LEU 40 N 1.20 4.41 0.28 3.92 1.02 -0.08 -1.90 118.68 127.52 3a6o s LEU 40 Ca 0.06 -0.88 0.03 0.00 0.02 0.00 0.00 54.13 53.36 3a6o s LEU 40 Cb -0.14 -1.97 -0.04 0.00 0.02 0.00 0.00 46.19 44.05 3a6o s LEU 40 CO 0.05 -0.31 0.16 -0.72 0.02 0.00 0.00 176.35 175.55 3a6o s TYR 41 N 1.53 1.53 0.05 0.29 -0.85 0.13 -2.66 117.35 117.37 3a6o s TYR 41 Ca 0.02 -1.37 -0.28 0.00 -0.52 0.00 0.00 57.07 54.92 3a6o s TYR 41 Cb -0.18 -0.80 0.09 0.00 0.38 0.00 0.00 41.96 41.45 3a6o s TYR 41 CO 0.05 -0.55 1.04 0.00 -1.52 0.00 0.00 175.55 174.58 3a6o s ALA 42 N -3.71 -1.86 0.54 9.51 0.00 -0.51 0.11 121.76 125.84 3a6o s ALA 42 Ca 0.37 0.58 -0.22 0.00 0.00 0.00 0.00 51.96 52.69 3a6o s ALA 42 Cb 0.05 0.46 -0.05 0.00 0.00 0.00 0.00 23.12 23.59 3a6o s ALA 42 CO 0.17 -0.93 1.36 0.34 0.00 0.00 0.00 175.76 176.70 3a6o s ASP 43 N -2.78 5.29 0.38 0.00 2.15 -1.26 -1.47 116.67 118.98 3a6o s ASP 43 Ca 0.11 2.78 0.10 0.00 0.43 0.00 0.00 52.55 55.97 3a6o s ASP 43 Cb 0.00 -2.64 0.86 0.00 -0.30 0.00 0.00 42.92 40.84 3a6o s ASP 43 CO -0.02 -1.56 1.91 0.03 -0.17 0.00 0.00 175.17 175.37 3a6o h ARG 44 N 1.50 0.62 -0.50 4.34 3.08 -1.78 -1.23 114.38 120.41 3a6o h ARG 44 Ca -0.51 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.50 3a6o h ARG 44 Cb 1.30 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.21 3a6o h ARG 44 CO 0.57 0.41 0.00 0.66 -1.07 0.00 0.00 179.97 180.54 3a6o n TYR 45 N -4.51 0.68 -1.63 3.04 4.02 -1.26 -4.96 117.16 112.54 3a6o n TYR 45 Ca 0.14 -0.33 -0.40 0.00 -0.01 0.00 0.00 57.90 57.30 3a6o n TYR 45 Cb 0.40 -0.02 0.02 0.00 -0.02 0.00 0.00 39.34 39.73 3a6o n TYR 45 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3a6o n ALA 46 N 0.90 0.44 -1.77 -0.72 0.00 -0.47 -4.95 120.51 113.95 3a6o n ALA 46 Ca 0.16 0.19 -0.38 0.00 0.00 0.00 0.00 53.44 53.42 3a6o n ALA 46 Cb 0.43 -2.13 -0.02 0.00 0.00 0.00 0.00 19.45 17.72 3a6o n ALA 46 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3a6o s SER 47 N -0.80 6.57 0.00 0.00 0.15 -1.26 -4.89 113.70 113.47 3a6o s SER 47 Ca 0.65 2.27 0.01 0.00 0.70 0.00 0.00 55.95 59.58 3a6o s SER 47 Cb -0.51 -2.61 0.03 0.00 -1.71 0.00 0.00 66.02 61.21 3a6o s SER 47 CO 0.55 -0.64 0.85 -0.81 1.20 0.00 0.00 173.24 174.40 3a6o n PRO 48 N 0.04 0.01 -0.00 5.44 -0.04 -1.26 -0.48 135.00 138.70 3a6o n PRO 48 Ca 0.04 0.33 0.01 0.00 -0.04 0.00 0.00 63.50 63.84 3a6o n PRO 48 Cb 0.47 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.32 3a6o n PRO 48 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3a6o n GLU 49 N -1.33 0.64 -2.30 0.54 4.71 -1.26 -4.93 120.64 116.71 3a6o n GLU 49 Ca 0.00 0.07 -0.35 0.00 -0.01 0.00 0.00 57.16 56.87 3a6o n GLU 49 Cb 0.00 -1.68 -0.00 0.00 -1.01 0.00 0.00 31.44 28.75 3a6o n GLU 49 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 3a6o s GLU 50 N -2.97 3.48 0.46 3.49 2.02 0.37 -4.99 118.70 120.56 3a6o s GLU 50 Ca -0.06 1.60 -0.23 0.00 0.02 0.00 0.00 54.97 56.30 3a6o s GLU 50 Cb 0.09 -2.08 -0.07 0.00 0.10 0.00 0.00 34.13 32.17 3a6o s GLU 50 CO 0.84 -0.74 1.23 -1.21 0.02 0.00 0.00 175.26 175.40 3a6o s GLU 51 N -3.18 3.68 0.72 1.61 0.41 -1.26 -4.96 118.70 115.72 3a6o s GLU 51 Ca 0.71 1.95 -0.14 0.00 -0.41 0.00 0.00 54.97 57.08 3a6o s GLU 51 Cb -0.24 -2.46 0.03 0.00 -1.78 0.00 0.00 34.13 29.69 3a6o s GLU 51 CO 0.27 -0.67 1.13 -0.51 -0.49 0.00 0.00 175.26 175.00 3a6o s LEU 52 N -2.99 3.25 0.35 1.80 1.43 -1.26 -4.97 118.68 116.29 3a6o s LEU 52 Ca 0.64 2.06 -0.08 0.00 -1.03 0.00 0.00 54.13 55.72 3a6o s LEU 52 Cb -0.33 -4.56 -0.06 0.00 0.03 0.00 0.00 46.19 41.28 3a6o s LEU 52 CO 0.40 -1.99 0.67 0.00 0.23 0.00 0.00 176.35 175.66 3a6o s ALA 53 N -2.40 3.48 0.05 4.21 0.00 0.31 -4.85 121.76 122.57 3a6o s ALA 53 Ca 0.67 -0.37 0.07 0.00 0.00 0.00 0.00 51.96 52.33 3a6o s ALA 53 Cb -0.22 -2.51 -0.03 0.00 0.00 0.00 0.00 23.12 20.36 3a6o s ALA 53 CO 0.47 0.12 -0.15 -1.01 0.00 0.00 0.00 175.76 175.18 3a6o s HIS 54 N -2.23 2.63 -0.20 0.00 0.09 -1.26 0.18 115.29 114.50 3a6o s HIS 54 Ca 0.48 -0.21 -0.07 0.00 -0.00 0.00 0.00 55.06 55.26 3a6o s HIS 54 Cb -0.10 -1.47 0.09 0.00 -0.00 0.00 0.00 32.58 31.09 3a6o s HIS 54 CO 0.30 0.30 0.41 0.00 -0.00 0.00 0.00 174.74 175.76 3a6o s ALA 55 N -0.98 -1.14 -0.15 -1.40 0.00 -0.80 -4.97 121.76 112.32 3a6o s ALA 55 Ca 0.16 1.47 -0.13 0.00 0.00 0.00 0.00 51.96 53.46 3a6o s ALA 55 Cb -0.11 -1.33 -0.05 0.00 0.00 0.00 0.00 23.12 21.63 3a6o s ALA 55 CO 0.07 -0.77 0.27 -1.17 0.00 0.00 0.00 175.76 174.15 3a6o s LEU 56 N 2.61 4.27 -0.38 0.00 2.96 -1.26 -0.23 118.68 126.64 3a6o s LEU 56 Ca -0.01 0.50 -0.18 0.00 -0.22 0.00 0.00 54.13 54.22 3a6o s LEU 56 Cb -0.12 -2.33 0.01 0.00 0.50 0.00 0.00 46.19 44.25 3a6o s LEU 56 CO -0.13 0.15 0.50 0.00 -1.32 0.00 0.00 176.35 175.56 3a6o s ALA 57 N 0.23 3.44 0.65 5.97 0.00 0.38 -4.83 121.76 127.60 3a6o s ALA 57 Ca 0.16 -1.18 -0.13 0.00 0.00 0.00 0.00 51.96 50.81 3a6o s ALA 57 Cb -0.13 -3.06 -0.01 0.00 0.00 0.00 0.00 23.12 19.93 3a6o s ALA 57 CO 0.04 -1.39 1.06 0.20 0.00 0.00 0.00 175.76 175.67 3a6o s GLY 58 N 1.81 1.86 -0.28 0.00 0.00 0.04 -4.40 107.32 106.35 3a6o s GLY 58 Ca 0.17 0.22 -0.29 0.00 0.00 0.00 0.00 44.72 44.82 3a6o s GLY 58 CO 0.14 0.53 1.53 1.25 0.00 0.00 0.00 173.10 176.56 3a6o s LYS 59 N -4.63 3.73 0.00 2.90 2.20 -1.26 0.27 119.74 122.95 3a6o s LYS 59 Ca 0.60 1.43 0.24 0.00 -0.36 0.00 0.00 55.97 57.89 3a6o s LYS 59 Cb -0.15 -4.02 0.34 0.00 -1.51 0.00 0.00 37.83 32.50 3a6o s LYS 59 CO 0.47 -1.36 1.31 0.00 -0.36 0.00 0.00 175.35 175.41 3a6o n ALA 60 N 8.53 3.28 0.00 3.13 0.00 0.13 -4.94 120.51 130.64 3a6o n ALA 60 Ca 0.18 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 53.07 3a6o n ALA 60 Cb 0.46 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.97 3a6o n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a6o n GLY 61 N 1.37 0.74 3.09 0.00 0.00 -1.16 -4.90 105.19 104.35 3a6o n GLY 61 Ca 0.11 -0.99 -0.12 0.00 0.00 0.00 0.00 46.02 45.02 3a6o n GLY 61 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3a6o s SER 62 N 0.00 -0.11 0.00 1.61 0.01 -1.26 -0.62 113.70 113.32 3a6o s SER 62 Ca 0.00 0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.41 3a6o s SER 62 Cb 0.00 0.32 0.00 0.00 0.21 0.00 0.00 66.02 66.55 3a6o s SER 62 CO 0.00 -0.20 0.00 -0.90 0.41 0.00 0.00 173.24 172.55 3a6o n ASP 63 N 2.33 0.00 -0.09 2.44 3.85 -0.45 -4.63 116.55 119.99 3a6o n ASP 63 Ca -0.17 0.00 -0.10 0.00 -0.71 0.00 0.00 54.79 53.81 3a6o n ASP 63 Cb 0.57 0.00 -0.03 0.00 -1.35 0.00 0.00 41.12 40.32 3a6o n ASP 63 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 3a6o h GLU 64 N 0.00 0.43 0.00 0.11 4.57 -1.92 -3.38 114.58 114.39 3a6o h GLU 64 Ca 0.00 -0.07 -0.15 0.00 -1.18 0.00 0.00 59.36 57.96 3a6o h GLU 64 Cb 0.00 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 3a6o h GLU 64 CO 0.00 0.43 -1.63 0.54 -1.18 0.00 0.00 179.01 177.18 3a6o n ARG 65 N -4.76 2.22 -4.37 1.92 1.74 -1.26 -4.97 116.66 107.18 3a6o n ARG 65 Ca -0.02 -0.01 -0.25 0.00 -0.77 0.00 0.00 57.85 56.80 3a6o n ARG 65 Cb 0.12 -1.24 -0.09 0.00 -1.02 0.00 0.00 32.46 30.23 3a6o n ARG 65 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3a6o s PHE 66 N -2.28 2.50 0.06 -1.55 0.40 -1.26 -0.26 117.98 115.58 3a6o s PHE 66 Ca -0.05 -0.27 0.03 0.00 -0.60 0.00 0.00 56.93 56.04 3a6o s PHE 66 Cb 0.03 -1.14 -0.04 0.00 0.51 0.00 0.00 43.02 42.39 3a6o s PHE 66 CO 0.39 0.62 0.05 -0.51 0.70 0.00 0.00 175.22 176.47 3a6o s ASP 67 N -3.34 5.39 -0.04 1.36 -0.00 -0.37 -1.34 116.67 118.33 3a6o s ASP 67 Ca 0.28 -0.02 0.06 0.00 -0.00 0.00 0.00 52.55 52.88 3a6o s ASP 67 Cb -0.07 -1.43 -0.01 0.00 -0.00 0.00 0.00 42.92 41.42 3a6o s ASP 67 CO 0.16 0.21 -0.23 -0.31 -0.00 0.00 0.00 175.17 175.00 3a6o s TYR 68 N -1.30 2.15 0.02 4.23 1.51 0.21 -1.89 117.35 122.27 3a6o s TYR 68 Ca 0.26 -0.56 0.09 0.00 -1.01 0.00 0.00 57.07 55.84 3a6o s TYR 68 Cb -0.12 -1.41 -0.02 0.00 -0.11 0.00 0.00 41.96 40.30 3a6o s TYR 68 CO 0.18 -0.15 -0.25 -0.06 -1.11 0.00 0.00 175.55 174.16 3a6o s PHE 69 N -0.24 2.26 -0.02 2.71 0.08 0.10 -0.70 117.98 122.17 3a6o s PHE 69 Ca 0.00 -0.42 0.00 0.00 0.12 0.00 0.00 56.93 56.64 3a6o s PHE 69 Cb -0.12 -1.39 0.02 0.00 -0.57 0.00 0.00 43.02 40.96 3a6o s PHE 69 CO 0.02 0.06 -0.00 -2.00 -0.10 0.00 0.00 175.22 173.19 3a6o s GLU 70 N -0.97 0.23 0.05 0.44 2.12 0.14 -0.55 118.70 120.16 3a6o s GLU 70 Ca 0.11 0.04 -0.02 0.00 0.36 0.00 0.00 54.97 55.45 3a6o s GLU 70 Cb -0.10 -0.36 -0.03 0.00 0.26 0.00 0.00 34.13 33.90 3a6o s GLU 70 CO 0.01 -0.08 0.02 0.00 -0.54 0.00 0.00 175.26 174.66 3a6o s ALA 71 N 0.70 0.29 -0.24 6.30 0.00 -0.44 -0.78 121.76 127.59 3a6o s ALA 71 Ca -0.07 -0.97 -0.02 0.00 0.00 0.00 0.00 51.96 50.90 3a6o s ALA 71 Cb -0.10 0.28 0.02 0.00 0.00 0.00 0.00 23.12 23.32 3a6o s ALA 71 CO -0.01 -0.36 -0.06 -1.17 0.00 0.00 0.00 175.76 174.16 3a6o s LEU 72 N -2.64 3.11 -0.17 0.00 2.96 -1.26 -0.64 118.68 120.05 3a6o s LEU 72 Ca 0.02 -0.76 -0.15 0.00 -0.22 0.00 0.00 54.13 53.03 3a6o s LEU 72 Cb 0.04 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 45.01 3a6o s LEU 72 CO -0.08 -0.10 0.36 -0.76 -1.32 0.00 0.00 176.35 174.44 3a6o s LEU 73 N 1.36 4.21 -0.47 -0.68 1.02 0.16 -4.91 118.68 119.38 3a6o s LEU 73 Ca 0.02 0.56 -0.21 0.00 0.02 0.00 0.00 54.13 54.51 3a6o s LEU 73 Cb -0.16 -2.47 0.03 0.00 0.02 0.00 0.00 46.19 43.61 3a6o s LEU 73 CO -0.04 0.02 0.69 -1.61 0.02 0.00 0.00 176.35 175.42 3a6o s GLU 74 N 0.80 3.26 -0.62 1.70 0.41 -1.26 -1.17 118.70 121.82 3a6o s GLU 74 Ca 0.19 -0.47 0.05 0.00 -0.41 0.00 0.00 54.97 54.33 3a6o s GLU 74 Cb -0.14 -4.00 0.19 0.00 -1.78 0.00 0.00 34.13 28.40 3a6o s GLU 74 CO 0.06 -1.13 0.52 0.00 -0.49 0.00 0.00 175.26 174.22 3a6o h SER 76 N 5.11 0.10 1.20 0.00 0.02 -1.94 0.97 113.55 119.02 3a6o h SER 76 Ca 0.18 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 3a6o h SER 76 Cb 0.77 0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.51 3a6o h SER 76 CO 0.66 -0.05 0.00 0.71 -1.14 0.00 0.00 176.83 177.01 3a6o h THR 77 N 0.30 0.00 -0.08 -2.27 1.35 -1.93 -3.47 112.91 106.81 3a6o h THR 77 Ca 0.48 -0.51 -0.04 0.00 -0.55 0.00 0.00 66.41 65.79 3a6o h THR 77 Cb 0.88 1.43 -0.01 0.00 -1.73 0.00 0.00 68.15 68.71 3a6o h THR 77 CO -0.54 0.00 -0.03 0.29 -0.25 0.00 0.00 175.52 174.98 3a6o n LYS 78 N -2.68 -0.78 -3.74 4.72 5.02 0.34 -4.97 118.16 116.07 3a6o n LYS 78 Ca 0.03 0.33 -0.24 0.00 -2.02 0.00 0.00 58.31 56.40 3a6o n LYS 78 Cb 0.35 -3.99 -0.17 0.00 -0.02 0.00 0.00 35.03 31.19 3a6o n LYS 78 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3a6o s ARG 79 N -1.21 0.53 0.09 1.97 0.52 -1.26 -1.88 118.95 117.71 3a6o s ARG 79 Ca 0.00 -0.02 0.09 0.00 -0.52 0.00 0.00 55.73 55.28 3a6o s ARG 79 Cb 0.00 -1.28 -0.04 0.00 0.52 0.00 0.00 34.95 34.15 3a6o s ARG 79 CO 0.00 -0.41 -0.19 0.54 0.02 0.00 0.00 175.30 175.25 3a6o s VAL 80 N 1.97 2.75 0.08 3.52 0.11 -0.89 -2.83 120.40 125.12 3a6o s VAL 80 Ca 0.03 -1.42 0.06 0.00 -2.93 0.00 0.00 61.98 57.73 3a6o s VAL 80 Cb -0.14 -2.22 -0.03 0.00 -1.53 0.00 0.00 36.38 32.46 3a6o s VAL 80 CO -0.06 0.18 -0.17 -1.59 -3.33 0.00 0.00 175.10 170.13 3a6o s LYS 81 N -1.88 0.95 0.29 1.54 -2.85 -0.54 -1.42 119.74 115.83 3a6o s LYS 81 Ca 0.16 -1.04 -0.18 0.00 -1.00 0.00 0.00 55.97 53.91 3a6o s LYS 81 Cb -0.10 -1.06 0.02 0.00 -2.06 0.00 0.00 37.83 34.63 3a6o s LYS 81 CO 0.08 0.24 0.69 1.52 0.10 0.00 0.00 175.35 177.98 3a6o s TYR 82 N -1.22 -0.02 -0.08 1.78 -0.85 -0.16 -1.43 117.35 115.36 3a6o s TYR 82 Ca 0.01 -0.45 -0.10 0.00 -0.52 0.00 0.00 57.07 56.01 3a6o s TYR 82 Cb -0.10 0.63 0.02 0.00 0.38 0.00 0.00 41.96 42.89 3a6o s TYR 82 CO 0.03 -1.25 0.27 0.14 -1.52 0.00 0.00 175.55 173.23 3a6o s VAL 83 N -3.67 0.02 -0.02 -3.49 -7.23 -1.09 -0.47 120.40 104.45 3a6o s VAL 83 Ca 0.14 -0.15 -0.09 0.00 -1.81 0.00 0.00 61.98 60.08 3a6o s VAL 83 Cb -0.05 -0.44 -0.05 0.00 0.56 0.00 0.00 36.38 36.40 3a6o s VAL 83 CO 0.08 -0.08 0.28 -0.36 -0.31 0.00 0.00 175.10 174.72 3a6o s PHE 84 N -0.25 3.62 -0.26 2.82 0.40 -0.15 -0.90 117.98 123.26 3a6o s PHE 84 Ca -0.04 0.69 -0.03 0.00 -0.60 0.00 0.00 56.93 56.95 3a6o s PHE 84 Cb -0.03 -2.07 0.02 0.00 0.51 0.00 0.00 43.02 41.45 3a6o s PHE 84 CO 0.01 0.64 -0.03 -1.17 0.70 0.00 0.00 175.22 175.37 3a6o s LEU 85 N -1.44 3.31 -0.07 -0.37 0.20 0.16 -0.03 118.68 120.44 3a6o s LEU 85 Ca 0.24 -0.80 0.00 0.00 0.69 0.00 0.00 54.13 54.26 3a6o s LEU 85 Cb -0.14 -1.72 -0.03 0.00 -0.43 0.00 0.00 46.19 43.88 3a6o s LEU 85 CO 0.13 -0.13 -0.05 -0.76 -0.29 0.00 0.00 176.35 175.25 3a6o s LEU 86 N 1.37 3.29 -0.10 -0.68 1.43 0.15 0.29 118.68 124.44 3a6o s LEU 86 Ca 0.01 0.02 0.02 0.00 -1.03 0.00 0.00 54.13 53.15 3a6o s LEU 86 Cb -0.17 -1.73 0.01 0.00 0.03 0.00 0.00 46.19 44.33 3a6o s LEU 86 CO -0.03 0.36 -0.15 -0.89 0.23 0.00 0.00 176.35 175.88 3a6o s THR 87 N -0.84 1.42 0.77 5.49 2.01 0.75 -0.22 115.64 125.02 3a6o s THR 87 Ca 0.13 -0.61 -0.07 0.00 0.31 0.00 0.00 61.69 61.46 3a6o s THR 87 Cb -0.11 -1.29 0.12 0.00 0.01 0.00 0.00 72.50 71.23 3a6o s THR 87 CO 0.02 0.42 1.08 -0.83 -0.69 0.00 0.00 174.62 174.62 3a6o s GLY 88 N 0.89 1.75 0.17 4.40 0.00 0.14 -1.05 107.32 113.61 3a6o s GLY 88 Ca -0.09 -1.31 -0.11 0.00 0.00 0.00 0.00 44.72 43.21 3a6o s GLY 88 CO 0.00 -0.75 1.66 -0.56 0.00 0.00 0.00 173.10 173.45 3a6o h PRO 89 N -0.82 0.94 0.00 2.90 0.14 -1.85 -0.11 132.00 133.20 3a6o h PRO 89 Ca -0.41 -0.25 0.00 0.00 0.14 0.00 0.00 66.00 65.48 3a6o h PRO 89 Cb 1.28 -0.11 0.00 0.00 0.14 0.00 0.00 31.00 32.30 3a6o h PRO 89 CO 0.47 0.89 0.00 1.04 0.14 0.00 0.00 178.00 180.54 3a6o n GLN 90 N -4.34 0.54 -0.94 0.86 1.13 -1.26 -4.89 117.38 108.49 3a6o n GLN 90 Ca 0.03 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.09 3a6o n GLN 90 Cb 0.26 -1.19 0.00 0.00 0.11 0.00 0.00 30.24 29.43 3a6o n GLN 90 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3a6o n GLY 91 N 0.06 0.56 3.63 1.08 0.00 -0.05 -5.04 105.19 105.43 3a6o n GLY 91 Ca 0.05 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.62 3a6o n GLY 91 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3a6o n GLU 92 N -2.88 1.67 -4.91 1.61 0.00 -1.26 -4.73 120.64 110.14 3a6o n GLU 92 Ca 0.00 0.59 -0.28 0.00 0.00 0.00 0.00 57.16 57.47 3a6o n GLU 92 Cb 0.00 -2.12 -0.17 0.00 0.00 0.00 0.00 31.44 29.16 3a6o n GLU 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3a6o s ALA 93 N -0.56 1.71 -0.01 -1.84 0.00 -1.26 -0.69 121.76 119.11 3a6o s ALA 93 Ca 0.64 -0.72 -0.05 0.00 0.00 0.00 0.00 51.96 51.84 3a6o s ALA 93 Cb -0.69 -0.65 0.00 0.00 0.00 0.00 0.00 23.12 21.78 3a6o s ALA 93 CO 0.55 0.23 0.10 0.54 0.00 0.00 0.00 175.76 177.19 3a6o s VAL 94 N 0.35 0.06 -0.21 0.00 0.11 0.70 -4.75 120.40 116.66 3a6o s VAL 94 Ca -0.13 -0.48 -0.15 0.00 -2.93 0.00 0.00 61.98 58.29 3a6o s VAL 94 Cb -0.16 -0.31 -0.04 0.00 -1.53 0.00 0.00 36.38 34.35 3a6o s VAL 94 CO 0.05 -0.26 0.39 -0.31 -3.33 0.00 0.00 175.10 171.64 3a6o s TYR 95 N -0.87 3.35 -0.25 1.54 1.51 -0.58 -0.68 117.35 121.37 3a6o s TYR 95 Ca -0.10 0.57 -0.03 0.00 -1.01 0.00 0.00 57.07 56.50 3a6o s TYR 95 Cb -0.06 -2.52 0.02 0.00 -0.11 0.00 0.00 41.96 39.29 3a6o s TYR 95 CO 0.01 -0.04 -0.03 0.12 -1.11 0.00 0.00 175.55 174.50 3a6o s PHE 96 N 1.42 3.06 0.28 2.71 5.99 0.96 -2.30 117.98 130.10 3a6o s PHE 96 Ca 0.18 -1.31 0.06 0.00 0.00 0.00 0.00 56.93 55.86 3a6o s PHE 96 Cb -0.15 -2.11 -0.02 0.00 0.00 0.00 0.00 43.02 40.74 3a6o s PHE 96 CO 0.08 -0.66 0.22 0.41 -0.00 0.00 0.00 175.22 175.27 3a6o n GLY 97 N 4.74 3.13 0.39 13.12 0.00 -0.55 -0.98 105.19 125.05 3a6o n GLY 97 Ca -0.16 -1.88 0.18 0.00 0.00 0.00 0.00 46.02 44.16 3a6o n GLY 97 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3a6o h GLU 98 N 0.00 0.37 0.00 1.61 4.81 -1.71 -1.96 114.58 117.70 3a6o h GLU 98 Ca -0.20 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 58.97 3a6o h GLU 98 Cb 1.00 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 3a6o h GLU 98 CO 0.30 0.25 -0.21 1.15 -0.73 0.00 0.00 179.01 179.76 3a6o h THR 99 N 0.38 0.32 0.00 0.32 2.02 -1.47 -3.49 112.91 110.99 3a6o h THR 99 Ca 0.42 -1.45 0.00 0.00 0.77 0.00 0.00 66.41 66.15 3a6o h THR 99 Cb 1.06 2.15 0.00 0.00 -1.74 0.00 0.00 68.15 69.62 3a6o h THR 99 CO -0.14 0.18 0.00 0.61 0.37 0.00 0.00 175.52 176.54 3a6o n GLY 100 N 1.15 0.82 3.92 2.16 0.00 -0.74 -4.93 105.19 107.57 3a6o n GLY 100 Ca 0.03 -1.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.01 3a6o n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3a6o s PHE 101 N -3.34 3.49 -0.27 1.61 0.40 -1.26 -1.48 117.98 117.12 3a6o s PHE 101 Ca 0.00 0.39 -0.29 0.00 -0.60 0.00 0.00 56.93 56.43 3a6o s PHE 101 Cb 0.00 -1.88 0.19 0.00 0.51 0.00 0.00 43.02 41.84 3a6o s PHE 101 CO 0.00 0.44 1.32 0.45 0.70 0.00 0.00 175.22 178.13 3a6o s SER 102 N -2.82 -0.08 0.12 1.36 0.15 -0.97 -4.68 113.70 106.79 3a6o s SER 102 Ca 0.39 0.09 0.22 0.00 0.70 0.00 0.00 55.95 57.34 3a6o s SER 102 Cb -0.12 0.07 0.88 0.00 -1.71 0.00 0.00 66.02 65.14 3a6o s SER 102 CO 0.27 -0.07 1.68 0.00 1.20 0.00 0.00 173.24 176.33 3a6o n ALA 103 N 0.61 1.88 -2.61 5.45 0.00 -1.26 -1.53 120.51 123.04 3a6o n ALA 103 Ca -0.02 -0.01 -0.43 0.00 0.00 0.00 0.00 53.44 52.98 3a6o n ALA 103 Cb 0.59 -1.37 -0.09 0.00 0.00 0.00 0.00 19.45 18.58 3a6o n ALA 103 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3a6o s GLU 104 N -3.12 2.96 0.00 0.00 2.02 -1.26 -4.82 118.70 114.48 3a6o s GLU 104 Ca 0.08 -1.13 0.00 0.00 0.02 0.00 0.00 54.97 53.94 3a6o s GLU 104 Cb 0.12 -4.01 0.00 0.00 0.10 0.00 0.00 34.13 30.33 3a6o s GLU 104 CO 0.41 -0.84 0.26 -2.13 0.02 0.00 0.00 175.26 172.98 3a6o n ARG 105 N 5.16 0.00 -0.11 1.61 0.63 -1.26 -0.25 116.66 122.43 3a6o n ARG 105 Ca -0.11 0.26 0.02 0.00 -0.92 0.00 0.00 57.85 57.10 3a6o n ARG 105 Cb 0.46 -0.44 0.05 0.00 0.45 0.00 0.00 32.46 32.98 3a6o n ARG 105 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3a6o n SER 106 N -1.48 -0.10 0.11 6.15 2.88 -1.26 -1.68 113.62 118.23 3a6o n SER 106 Ca 0.00 0.55 0.12 0.00 -1.33 0.00 0.00 58.87 58.21 3a6o n SER 106 Cb 0.00 -0.17 0.46 0.00 -0.75 0.00 0.00 64.21 63.74 3a6o n SER 106 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3a6o n LYS 107 N -4.48 0.20 0.17 -1.46 5.02 0.65 -2.47 118.16 115.80 3a6o n LYS 107 Ca 0.05 0.32 0.06 0.00 -2.02 0.00 0.00 58.31 56.72 3a6o n LYS 107 Cb 0.17 -1.81 0.08 0.00 -0.02 0.00 0.00 35.03 33.46 3a6o n LYS 107 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3a6o h ALA 108 N 2.41 0.81 -1.35 7.82 0.00 -1.30 -3.41 119.26 124.24 3a6o h ALA 108 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3a6o h ALA 108 Cb 0.51 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3a6o h ALA 108 CO 0.00 0.37 0.00 0.41 0.00 0.00 0.00 179.25 180.03 3a6o n GLY 109 N 1.18 -0.75 2.86 0.00 0.00 -1.03 -1.28 105.19 106.17 3a6o n GLY 109 Ca 0.03 -1.05 -0.17 0.00 0.00 0.00 0.00 46.02 44.83 3a6o n GLY 109 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3a6o s VAL 110 N 0.00 0.31 0.63 1.61 -7.23 -1.26 -4.25 120.40 110.20 3a6o s VAL 110 Ca 0.00 -0.02 -0.16 0.00 -1.81 0.00 0.00 61.98 59.98 3a6o s VAL 110 Cb 0.00 -0.36 -0.02 0.00 0.56 0.00 0.00 36.38 36.57 3a6o s VAL 110 CO 0.00 0.16 1.12 -0.36 -0.31 0.00 0.00 175.10 175.71 3a6o s PHE 111 N 0.77 2.61 -0.05 2.82 0.40 0.38 -4.24 117.98 120.67 3a6o s PHE 111 Ca -0.09 1.55 0.02 0.00 -0.60 0.00 0.00 56.93 57.82 3a6o s PHE 111 Cb -0.12 -3.22 0.01 0.00 0.51 0.00 0.00 43.02 40.21 3a6o s PHE 111 CO -0.01 -1.69 -0.11 -0.65 0.70 0.00 0.00 175.22 173.46 3a6o s GLN 112 N -3.84 1.46 -0.66 0.44 -0.21 -1.26 -0.99 119.66 114.59 3a6o s GLN 112 Ca 0.69 -0.37 -0.09 0.00 0.02 0.00 0.00 55.36 55.62 3a6o s GLN 112 Cb -0.22 -1.25 0.17 0.00 1.00 0.00 0.00 33.01 32.71 3a6o s GLN 112 CO 0.37 0.04 0.54 -0.47 -2.12 0.00 0.00 175.29 173.66 3a6o s TYR 113 N 0.57 3.54 0.25 0.91 5.04 -0.50 -4.87 117.35 122.29 3a6o s TYR 113 Ca -0.12 -2.21 -0.03 0.00 -2.44 0.00 0.00 57.07 52.27 3a6o s TYR 113 Cb -0.14 -3.52 0.49 0.00 0.35 0.00 0.00 41.96 39.14 3a6o s TYR 113 CO 0.03 -0.94 1.72 0.00 -1.34 0.00 0.00 175.55 175.02 3a6o h ALA 114 N 7.68 1.08 -1.59 3.97 0.00 -1.92 -2.36 119.26 126.12 3a6o h ALA 114 Ca -0.02 0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.10 3a6o h ALA 114 Cb 1.02 0.12 -0.26 0.00 0.00 0.00 0.00 17.79 18.66 3a6o h ALA 114 CO 0.77 -0.24 0.39 -0.47 0.00 0.00 0.00 179.25 179.69 3a6o s TYR 115 N -6.01 -0.57 -0.24 0.00 5.04 -1.26 -4.53 117.35 109.78 3a6o s TYR 115 Ca -0.12 1.22 -0.20 0.00 -2.44 0.00 0.00 57.07 55.53 3a6o s TYR 115 Cb 0.21 0.37 -0.02 0.00 0.35 0.00 0.00 41.96 42.87 3a6o s TYR 115 CO 0.76 -0.28 0.60 0.42 -1.34 0.00 0.00 175.55 175.71 3a6o s ILE 116 N 0.92 5.02 -0.19 3.14 1.01 -0.79 -5.03 121.20 125.28 3a6o s ILE 116 Ca -0.04 1.07 -0.06 0.00 0.00 0.00 0.00 60.65 61.62 3a6o s ILE 116 Cb -0.04 -3.91 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 3a6o s ILE 116 CO -0.12 0.06 0.03 -1.00 0.00 0.00 0.00 174.94 173.91 3a6o s HIS 117 N 2.33 3.13 0.36 3.97 3.76 -1.26 -4.98 115.29 122.60 3a6o s HIS 117 Ca 0.25 -0.20 0.19 0.00 -0.15 0.00 0.00 55.06 55.15 3a6o s HIS 117 Cb -0.16 -2.08 1.27 0.00 1.11 0.00 0.00 32.58 32.72 3a6o s HIS 117 CO 0.09 -0.06 1.58 0.54 -0.85 0.00 0.00 174.74 176.04 3a6o n ARG 118 N 3.94 -0.06 0.00 1.40 1.74 -1.26 0.14 116.66 122.55 3a6o n ARG 118 Ca -0.17 1.39 0.12 0.00 -0.77 0.00 0.00 57.85 58.43 3a6o n ARG 118 Cb 0.52 -2.47 0.57 0.00 -1.02 0.00 0.00 32.46 30.07 3a6o n ARG 118 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3a6o n SER 119 N -5.29 0.00 -1.12 0.55 3.41 -1.26 -2.58 113.62 107.34 3a6o n SER 119 Ca 0.36 0.38 0.11 0.00 -0.26 0.00 0.00 58.87 59.45 3a6o n SER 119 Cb 1.22 -0.45 0.23 0.00 -0.26 0.00 0.00 64.21 64.95 3a6o n SER 119 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3a6o n GLU 120 N -1.45 2.53 -2.68 4.33 1.02 0.37 -4.90 120.64 119.85 3a6o n GLU 120 Ca 0.08 -2.33 -0.43 0.00 -0.02 0.00 0.00 57.16 54.46 3a6o n GLU 120 Cb 0.28 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.20 3a6o n GLU 120 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3a6o s VAL 121 N -1.22 4.71 0.04 2.62 1.01 -1.06 -4.85 120.40 121.64 3a6o s VAL 121 Ca 0.39 2.01 -0.30 0.00 0.00 0.00 0.00 61.98 64.07 3a6o s VAL 121 Cb 0.22 -4.30 -0.09 0.00 0.00 0.00 0.00 36.38 32.21 3a6o s VAL 121 CO 0.29 -0.14 1.86 0.12 0.00 0.00 0.00 175.10 177.23 3a6o s PHE 122 N 2.98 1.67 -0.02 5.22 5.99 -1.26 -4.96 117.98 127.60 3a6o s PHE 122 Ca 0.44 -0.19 0.01 0.00 0.00 0.00 0.00 56.93 57.19 3a6o s PHE 122 Cb -0.16 -4.15 0.01 0.00 0.00 0.00 0.00 43.02 38.73 3a6o s PHE 122 CO 0.08 -4.99 -0.02 0.95 -0.00 0.00 0.00 175.22 171.24 3a6o s THR 123 N 3.88 0.25 0.32 0.12 -4.23 -1.26 -4.96 115.64 109.76 3a6o s THR 123 Ca 0.83 -0.03 0.10 0.00 -1.18 0.00 0.00 61.69 61.41 3a6o s THR 123 Cb -0.41 -0.28 -0.06 0.00 1.34 0.00 0.00 72.50 73.09 3a6o s THR 123 CO 0.38 0.12 -0.11 0.42 -0.54 0.00 0.00 174.62 174.89 3a6o s THR 124 N 0.54 2.44 0.53 3.99 -4.23 -1.26 -5.03 115.64 112.63 3a6o s THR 124 Ca -0.06 -2.23 -0.20 0.00 -1.18 0.00 0.00 61.69 58.02 3a6o s THR 124 Cb -0.09 -2.56 -0.06 0.00 1.34 0.00 0.00 72.50 71.14 3a6o s THR 124 CO -0.01 -0.28 1.16 -2.84 -0.54 0.00 0.00 174.62 172.11 3a6o s PRO 125 N -3.59 3.41 0.08 3.99 0.02 -1.26 -4.93 135.00 132.71 3a6o s PRO 125 Ca 0.32 1.72 -0.15 0.00 0.02 0.00 0.00 61.00 62.91 3a6o s PRO 125 Cb -0.01 -2.12 -0.16 0.00 0.02 0.00 0.00 34.50 32.22 3a6o s PRO 125 CO 0.17 -0.83 1.28 0.93 -0.33 0.00 0.00 177.00 178.22 3a6o h GLU 126 N 1.42 0.69 -0.88 5.54 4.39 -1.94 -3.11 114.58 120.69 3a6o h GLU 126 Ca -0.50 -0.55 0.10 0.00 0.34 0.00 0.00 59.36 58.74 3a6o h GLU 126 Cb 1.26 0.11 -0.06 0.00 -0.10 0.00 0.00 28.75 29.96 3a6o h GLU 126 CO 0.58 1.17 0.57 0.11 -1.16 0.00 0.00 179.01 180.27 3a6o h TRP 127 N 0.38 0.93 -0.31 4.33 5.08 -1.95 -1.70 115.95 122.71 3a6o h TRP 127 Ca -0.04 0.03 0.05 0.00 1.08 0.00 0.00 58.89 60.00 3a6o h TRP 127 Cb 1.29 -0.30 -0.02 0.00 -3.00 0.00 0.00 29.16 27.13 3a6o h TRP 127 CO 0.10 0.43 0.21 0.00 -1.28 0.00 0.00 178.44 177.90 3a6o h ALA 128 N 1.56 2.04 -0.98 0.11 0.00 -1.93 -2.36 119.26 117.70 3a6o h ALA 128 Ca 0.41 -0.01 0.19 0.00 0.00 0.00 0.00 54.91 55.50 3a6o h ALA 128 Cb 0.42 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.07 3a6o h ALA 128 CO -0.17 -0.10 0.61 0.87 0.00 0.00 0.00 179.25 180.46 3a6o h LYS 129 N 0.20 0.65 -0.37 0.00 1.57 -1.37 -3.07 116.57 114.19 3a6o h LYS 129 Ca 0.14 -0.04 -0.28 0.00 -1.87 0.00 0.00 60.65 58.60 3a6o h LYS 129 Cb 0.30 -0.15 -0.31 0.00 0.08 0.00 0.00 32.23 32.14 3a6o h LYS 129 CO -0.02 0.43 -0.86 -0.85 -0.57 0.00 0.00 179.45 177.58 3a6o n GLU 130 N -4.68 2.05 -3.06 3.15 0.28 -0.90 -4.70 120.64 112.78 3a6o n GLU 130 Ca 0.22 -3.43 -0.23 0.00 -0.16 0.00 0.00 57.16 53.56 3a6o n GLU 130 Cb 0.60 -1.57 0.01 0.00 1.43 0.00 0.00 31.44 31.91 3a6o n GLU 130 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3a6o s ALA 131 N -2.95 3.78 -0.06 -1.84 0.00 -1.13 -4.99 121.76 114.57 3a6o s ALA 131 Ca 0.39 -1.06 0.03 0.00 0.00 0.00 0.00 51.96 51.32 3a6o s ALA 131 Cb 0.37 -2.11 0.01 0.00 0.00 0.00 0.00 23.12 21.39 3a6o s ALA 131 CO -0.04 -0.31 -0.15 0.08 0.00 0.00 0.00 175.76 175.34 3a6o s VAL 132 N -2.50 1.28 0.01 0.00 1.01 -1.26 -4.39 120.40 114.54 3a6o s VAL 132 Ca 0.47 -0.59 0.05 0.00 0.00 0.00 0.00 61.98 61.91 3a6o s VAL 132 Cb -0.10 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 3a6o s VAL 132 CO 0.37 0.38 -0.12 -0.63 0.00 0.00 0.00 175.10 175.10 3a6o s ILE 133 N 0.36 3.21 -0.19 2.22 1.09 -0.14 -1.78 121.20 125.97 3a6o s ILE 133 Ca -0.10 -0.94 0.00 0.00 -1.10 0.00 0.00 60.65 58.52 3a6o s ILE 133 Cb -0.14 -2.36 0.02 0.00 -1.06 0.00 0.00 42.46 38.92 3a6o s ILE 133 CO 0.03 0.40 -0.17 -0.47 -0.10 0.00 0.00 174.94 174.64 3a6o s TYR 134 N -0.93 2.83 -0.22 3.97 5.04 -0.86 -0.86 117.35 126.31 3a6o s TYR 134 Ca 0.15 -1.53 -0.20 0.00 -2.44 0.00 0.00 57.07 53.06 3a6o s TYR 134 Cb -0.11 -1.96 -0.02 0.00 0.35 0.00 0.00 41.96 40.22 3a6o s TYR 134 CO 0.06 -0.76 0.61 -1.14 -1.34 0.00 0.00 175.55 172.98 3a6o s GLN 135 N 1.32 4.16 -0.20 4.97 0.74 0.64 -0.46 119.66 130.84 3a6o s GLN 135 Ca 0.05 0.55 -0.06 0.00 0.05 0.00 0.00 55.36 55.95 3a6o s GLN 135 Cb -0.13 -3.61 -0.03 0.00 1.10 0.00 0.00 33.01 30.34 3a6o s GLN 135 CO -0.11 -0.31 0.02 0.42 -0.55 0.00 0.00 175.29 174.77 3a6o s ILE 136 N 2.15 4.25 -0.68 -2.34 -1.09 0.11 -1.82 121.20 121.78 3a6o s ILE 136 Ca 0.27 -0.21 -0.13 0.00 -2.23 0.00 0.00 60.65 58.34 3a6o s ILE 136 Cb -0.16 -2.92 0.18 0.00 -1.58 0.00 0.00 42.46 37.98 3a6o s ILE 136 CO 0.09 0.43 0.61 0.12 -1.23 0.00 0.00 174.94 174.96 3a6o s PHE 137 N 0.83 3.54 0.19 3.97 5.36 -1.26 -1.66 117.98 128.94 3a6o s PHE 137 Ca 0.02 -1.83 -0.13 0.00 -0.96 0.00 0.00 56.93 54.03 3a6o s PHE 137 Cb -0.14 -3.72 0.20 0.00 -0.34 0.00 0.00 43.02 39.01 3a6o s PHE 137 CO 0.02 -0.99 1.69 -1.35 -1.46 0.00 0.00 175.22 173.13 3a6o h PRO 138 N 8.13 0.13 -0.76 10.12 0.11 -1.90 -1.06 132.00 146.78 3a6o h PRO 138 Ca -0.07 -0.01 0.22 0.00 0.11 0.00 0.00 66.00 66.26 3a6o h PRO 138 Cb 1.05 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 3a6o h PRO 138 CO 0.85 0.09 0.81 1.49 -0.21 0.00 0.00 178.00 181.03 3a6o h GLU 139 N 0.13 0.00 0.00 1.05 4.22 -1.83 -2.22 114.58 115.94 3a6o h GLU 139 Ca 0.26 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.67 3a6o h GLU 139 Cb 0.38 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 3a6o h GLU 139 CO -0.41 0.00 -0.47 0.54 -2.18 0.00 0.00 179.01 176.49 3a6o n ARG 140 N -3.55 1.23 -0.12 1.92 1.74 -0.40 -0.54 116.66 116.93 3a6o n ARG 140 Ca 0.16 -2.86 -0.23 0.00 -0.77 0.00 0.00 57.85 54.15 3a6o n ARG 140 Cb 1.07 -1.32 -0.08 0.00 -1.02 0.00 0.00 32.46 31.11 3a6o n ARG 140 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3a6o n PHE 141 N -0.91 0.21 -3.62 -1.55 -0.00 -0.83 -2.07 117.46 108.68 3a6o n PHE 141 Ca 0.16 0.09 -0.01 0.00 -0.00 0.00 0.00 57.45 57.68 3a6o n PHE 141 Cb 0.74 -0.89 -0.04 0.00 -0.00 0.00 0.00 39.48 39.29 3a6o n PHE 141 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3a6o s ALA 142 N -2.59 -1.97 -0.99 3.13 0.00 -1.26 -4.42 121.76 113.67 3a6o s ALA 142 Ca -0.34 2.23 -0.23 0.00 0.00 0.00 0.00 51.96 53.62 3a6o s ALA 142 Cb 0.10 -1.76 0.04 0.00 0.00 0.00 0.00 23.12 21.50 3a6o s ALA 142 CO 0.48 -0.94 1.50 1.21 0.00 0.00 0.00 175.76 178.00 3a6o s ASN 143 N 2.87 6.32 0.00 0.00 3.84 -1.26 -0.62 114.94 126.09 3a6o s ASN 143 Ca -0.04 -1.29 0.22 0.00 0.21 0.00 0.00 52.86 51.96 3a6o s ASN 143 Cb -0.12 -2.57 -0.17 0.00 -0.55 0.00 0.00 41.25 37.84 3a6o s ASN 143 CO -0.19 -1.67 0.83 0.61 -2.79 0.00 0.00 177.10 173.90 3a6o n GLY 144 N 6.78 -1.06 2.75 1.21 0.00 -1.26 -4.63 105.19 108.98 3a6o n GLY 144 Ca 0.32 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 3a6o n GLY 144 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3a6o s ASP 145 N -3.62 3.95 0.46 1.61 -1.08 -1.26 -4.74 116.67 111.99 3a6o s ASP 145 Ca 0.03 -2.03 0.12 0.00 -0.52 0.00 0.00 52.55 50.15 3a6o s ASP 145 Cb 0.15 -0.98 1.03 0.00 -1.46 0.00 0.00 42.92 41.66 3a6o s ASP 145 CO 0.86 -0.36 2.06 -0.65 0.52 0.00 0.00 175.17 177.60 3a6o h PRO 146 N 7.56 0.20 0.00 4.34 0.11 -1.90 -3.16 132.00 139.16 3a6o h PRO 146 Ca -0.08 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.01 3a6o h PRO 146 Cb 0.98 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.05 3a6o h PRO 146 CO 0.48 0.19 0.00 0.66 -0.21 0.00 0.00 178.00 179.12 3a6o h SER 147 N 0.20 0.00 -0.58 -2.05 4.64 -1.99 -2.77 113.55 110.99 3a6o h SER 147 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3a6o h SER 147 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 3a6o h SER 147 CO -0.00 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.50 3a6o n ASN 148 N -2.66 4.28 -4.76 4.97 0.23 -1.19 -5.00 115.26 111.13 3a6o n ASN 148 Ca 0.00 -2.35 -0.41 0.00 -0.53 0.00 0.00 54.58 51.29 3a6o n ASN 148 Cb 0.21 -0.51 -0.03 0.00 -2.08 0.00 0.00 39.78 37.38 3a6o n ASN 148 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 3a6o s ASP 149 N -1.04 6.84 0.81 0.53 -0.00 -1.05 -4.41 116.67 118.35 3a6o s ASP 149 Ca 0.46 2.56 -0.11 0.00 -0.00 0.00 0.00 52.55 55.46 3a6o s ASP 149 Cb 0.29 -2.63 0.08 0.00 -0.00 0.00 0.00 42.92 40.65 3a6o s ASP 149 CO 0.23 -0.52 1.11 -2.84 -0.00 0.00 0.00 175.17 173.15 3a6o s PRO 150 N -1.06 1.93 0.12 8.23 0.02 -1.26 -4.96 135.00 138.03 3a6o s PRO 150 Ca 0.52 1.29 -0.31 0.00 0.02 0.00 0.00 61.00 62.53 3a6o s PRO 150 Cb -0.38 -1.85 -0.10 0.00 0.02 0.00 0.00 34.50 32.19 3a6o s PRO 150 CO 0.46 -1.91 1.73 -2.14 -0.33 0.00 0.00 177.00 174.81 3a6o s PRO 151 N -4.78 4.16 0.00 5.54 0.02 -1.26 -2.98 135.00 135.70 3a6o s PRO 151 Ca 0.63 2.48 0.00 0.00 0.02 0.00 0.00 61.00 64.13 3a6o s PRO 151 Cb -0.19 -3.49 0.00 0.00 0.02 0.00 0.00 34.50 30.84 3a6o s PRO 151 CO 0.56 -0.77 0.00 0.41 -0.33 0.00 0.00 177.00 176.87 3a6o n GLY 152 N 4.07 0.64 3.67 0.52 0.00 -1.26 -4.94 105.19 107.88 3a6o n GLY 152 Ca 0.16 -0.51 -0.54 0.00 0.00 0.00 0.00 46.02 45.13 3a6o n GLY 152 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3a6o n THR 153 N -2.62 0.38 -1.15 2.61 -1.04 -1.16 -4.67 114.28 106.62 3a6o n THR 153 Ca 0.00 -0.10 -0.25 0.00 -2.04 0.00 0.00 64.05 61.66 3a6o n THR 153 Cb 0.00 -1.47 0.20 0.00 -1.82 0.00 0.00 70.33 67.24 3a6o n THR 153 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3a6o n GLU 154 N 6.17 -2.39 -3.91 -2.82 1.02 -0.54 -4.98 120.64 113.18 3a6o n GLU 154 Ca 0.28 -1.52 -0.34 0.00 -0.02 0.00 0.00 57.16 55.55 3a6o n GLU 154 Cb 0.19 -1.31 -0.05 0.00 -0.02 0.00 0.00 31.44 30.24 3a6o n GLU 154 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3a6o s GLN 155 N -5.15 3.42 -1.15 3.49 -0.21 -1.26 -4.75 119.66 114.05 3a6o s GLN 155 Ca 0.60 -0.29 -0.17 0.00 0.02 0.00 0.00 55.36 55.53 3a6o s GLN 155 Cb -0.05 -3.11 0.13 0.00 1.00 0.00 0.00 33.01 30.98 3a6o s GLN 155 CO 0.45 0.70 1.43 -0.46 -2.12 0.00 0.00 175.29 175.29 3a6o s TRP 156 N -1.25 3.18 0.12 0.91 -0.11 -1.26 -4.80 118.94 115.72 3a6o s TRP 156 Ca 0.24 -1.75 0.07 0.00 1.22 0.00 0.00 56.10 55.88 3a6o s TRP 156 Cb -0.12 -4.44 -0.04 0.00 -1.50 0.00 0.00 33.47 27.37 3a6o s TRP 156 CO 0.15 -1.55 -0.16 0.00 -4.62 0.00 0.00 176.95 170.77 3a6o s ALA 157 N 2.69 1.57 0.00 5.86 0.00 -1.26 -5.03 121.76 125.59 3a6o s ALA 157 Ca 0.43 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 51.13 3a6o s ALA 157 Cb -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 22.98 3a6o s ALA 157 CO -0.01 0.18 0.25 1.17 0.00 0.00 0.00 175.76 177.35 3a6o n LYS 158 N 0.71 0.00 0.00 0.00 0.00 -1.26 -2.20 118.16 115.41 3a6o n LYS 158 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.14 3a6o n LYS 158 Cb 0.56 -1.59 0.00 0.00 0.00 0.00 0.00 35.03 34.00 3a6o n LYS 158 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 3a6o n ASP 159 N -0.70 0.00 -4.77 3.14 5.68 -1.26 -5.01 116.55 113.64 3a6o n ASP 159 Ca 0.00 0.00 -0.41 0.00 -0.50 0.00 0.00 54.79 53.88 3a6o n ASP 159 Cb 0.25 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.22 3a6o n ASP 159 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3a6o s ALA 160 N 0.00 3.55 -0.48 2.12 0.00 -0.94 -5.06 121.76 120.95 3a6o s ALA 160 Ca 0.00 1.36 -0.05 0.00 0.00 0.00 0.00 51.96 53.27 3a6o s ALA 160 Cb 0.00 -3.53 0.13 0.00 0.00 0.00 0.00 23.12 19.71 3a6o s ALA 160 CO 0.00 -0.77 0.31 1.03 0.00 0.00 0.00 175.76 176.33 3a6o s ARG 161 N -1.56 2.30 0.50 0.00 1.81 -1.26 -4.80 118.95 115.95 3a6o s ARG 161 Ca 0.52 -1.94 -0.23 0.00 -1.72 0.00 0.00 55.73 52.36 3a6o s ARG 161 Cb -0.42 -3.75 -0.07 0.00 -0.45 0.00 0.00 34.95 30.26 3a6o s ARG 161 CO 0.53 -1.14 1.22 -2.30 -0.68 0.00 0.00 175.30 172.94 3a6o n PRO 162 N 4.49 1.59 -3.61 3.54 -0.02 -1.26 -5.02 135.00 134.71 3a6o n PRO 162 Ca -0.02 0.58 -0.20 0.00 -2.02 0.00 0.00 63.50 61.84 3a6o n PRO 162 Cb 0.41 -2.38 -0.02 0.00 -0.02 0.00 0.00 33.50 31.48 3a6o n PRO 162 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3a6o s ARG 163 N -2.55 2.88 0.58 -0.52 0.52 -1.26 -4.57 118.95 114.03 3a6o s ARG 163 Ca 0.68 -1.19 0.33 0.00 -0.52 0.00 0.00 55.73 55.03 3a6o s ARG 163 Cb -0.46 -2.63 1.40 0.00 0.52 0.00 0.00 34.95 33.78 3a6o s ARG 163 CO 0.52 0.04 1.70 0.45 0.02 0.00 0.00 175.30 178.04 3a6o h HIS 164 N 1.05 0.00 -0.19 -0.53 3.86 -1.95 -2.72 115.15 114.67 3a6o h HIS 164 Ca -0.45 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.76 3a6o h HIS 164 Cb 1.26 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.73 3a6o h HIS 164 CO 0.48 0.00 0.00 -0.40 0.86 0.00 0.00 177.93 178.87 3a6o n ASP 165 N -3.78 3.00 -4.77 2.45 5.75 -1.26 -4.87 116.55 113.07 3a6o n ASP 165 Ca 0.21 -2.57 -0.32 0.00 -0.01 0.00 0.00 54.79 52.09 3a6o n ASP 165 Cb 1.18 -0.34 0.07 0.00 -1.03 0.00 0.00 41.12 41.00 3a6o n ASP 165 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 3a6o s SER 166 N -1.70 4.76 -0.02 -1.12 0.01 -1.03 -4.89 113.70 109.71 3a6o s SER 166 Ca 0.28 1.89 0.01 0.00 1.31 0.00 0.00 55.95 59.44 3a6o s SER 166 Cb 0.21 -2.53 0.01 0.00 0.21 0.00 0.00 66.02 63.92 3a6o s SER 166 CO 0.08 -1.86 -0.05 -0.36 0.41 0.00 0.00 173.24 171.46 3a6o s PHE 167 N -2.67 0.60 -0.62 2.43 0.40 -1.26 -4.65 117.98 112.20 3a6o s PHE 167 Ca 0.63 -0.13 0.07 0.00 -0.60 0.00 0.00 56.93 56.90 3a6o s PHE 167 Cb -0.18 -0.47 -0.00 0.00 0.51 0.00 0.00 43.02 42.87 3a6o s PHE 167 CO 0.50 -0.09 0.51 0.66 0.70 0.00 0.00 175.22 177.51 3a6o n TYR 168 N 3.47 0.00 -0.55 0.36 4.01 -1.26 -1.47 117.16 121.71 3a6o n TYR 168 Ca -0.19 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 3a6o n TYR 168 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.57 3a6o n TYR 168 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3a6o n GLY 169 N 0.75 0.72 3.74 2.72 0.00 -1.25 -4.77 105.19 107.10 3a6o n GLY 169 Ca 0.03 -0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 3a6o n GLY 169 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a6o n GLY 170 N -2.55 0.82 3.13 -0.02 0.00 0.30 -4.23 105.19 102.63 3a6o n GLY 170 Ca 0.00 0.15 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 3a6o n GLY 170 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3a6o n ASP 171 N -0.26 -1.43 0.01 1.61 5.68 0.21 -4.26 116.55 118.12 3a6o n ASP 171 Ca 0.07 -2.65 -0.02 0.00 -0.50 0.00 0.00 54.79 51.69 3a6o n ASP 171 Cb 0.42 2.57 0.26 0.00 -1.14 0.00 0.00 41.12 43.22 3a6o n ASP 171 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 3a6o h LEU 172 N 0.00 0.47 -1.06 -2.12 3.38 -1.75 -2.73 115.31 111.48 3a6o h LEU 172 Ca -0.26 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.53 3a6o h LEU 172 Cb 1.08 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 3a6o h LEU 172 CO 0.35 0.63 -0.01 0.50 0.09 0.00 0.00 178.44 180.00 3a6o h LYS 173 N 0.45 0.65 -0.66 1.13 1.63 -1.89 -1.83 116.57 116.06 3a6o h LYS 173 Ca 0.08 -0.16 -0.03 0.00 -0.85 0.00 0.00 60.65 59.69 3a6o h LYS 173 Cb 0.50 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 32.01 3a6o h LYS 173 CO 0.03 0.68 0.28 0.78 -3.45 0.00 0.00 179.45 177.77 3a6o h GLY 174 N 0.92 1.01 0.94 5.01 0.00 -1.61 0.09 103.07 109.43 3a6o h GLY 174 Ca 0.13 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 3a6o h GLY 174 CO 0.02 0.48 0.14 -2.08 0.00 0.00 0.00 176.54 175.10 3a6o h VAL 175 N 0.94 1.20 -0.71 4.60 2.07 -1.18 -1.20 116.25 121.97 3a6o h VAL 175 Ca 0.22 -0.62 0.08 0.00 0.82 0.00 0.00 66.70 67.20 3a6o h VAL 175 Cb 0.15 0.90 -0.06 0.00 -1.52 0.00 0.00 31.29 30.75 3a6o h VAL 175 CO -0.02 0.22 0.37 0.40 0.02 0.00 0.00 177.57 178.56 3a6o h ILE 176 N 0.46 0.91 -0.18 4.57 2.04 -0.77 -0.47 117.51 124.07 3a6o h ILE 176 Ca 0.12 -0.23 -0.14 0.00 1.00 0.00 0.00 64.86 65.62 3a6o h ILE 176 Cb 0.21 0.19 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 3a6o h ILE 176 CO -0.01 0.12 -0.49 0.44 0.00 0.00 0.00 178.15 178.21 3a6o h ASP 177 N 0.66 0.53 -0.07 1.72 3.32 -0.88 -2.95 116.42 118.75 3a6o h ASP 177 Ca 0.33 -0.26 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3a6o h ASP 177 Cb 0.29 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3a6o h ASP 177 CO -0.23 0.93 0.00 0.54 -1.72 0.00 0.00 179.24 178.76 3a6o n ARG 178 N -3.98 1.54 -0.30 3.56 5.12 -0.46 -4.35 116.66 117.79 3a6o n ARG 178 Ca -0.02 -0.79 0.14 0.00 -1.93 0.00 0.00 57.85 55.24 3a6o n ARG 178 Cb 0.56 -1.43 0.38 0.00 -1.16 0.00 0.00 32.46 30.82 3a6o n ARG 178 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 3a6o h LEU 179 N 1.76 0.65 -1.14 0.55 3.38 -0.95 -0.98 115.31 118.58 3a6o h LEU 179 Ca 0.00 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 3a6o h LEU 179 Cb 0.38 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 3a6o h LEU 179 CO 0.00 0.28 0.24 -0.65 0.09 0.00 0.00 178.44 178.41 3a6o h PRO 180 N 0.67 0.85 0.74 1.13 0.11 -1.83 0.14 132.00 133.80 3a6o h PRO 180 Ca 0.50 -0.13 -0.03 0.00 0.11 0.00 0.00 66.00 66.45 3a6o h PRO 180 Cb 0.88 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.83 3a6o h PRO 180 CO -0.26 0.69 -0.45 -0.92 -0.21 0.00 0.00 178.00 176.85 3a6o h TYR 181 N 0.84 -1.21 -0.86 0.65 3.20 -1.51 -0.57 116.97 117.51 3a6o h TYR 181 Ca 0.20 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.23 3a6o h TYR 181 Cb 0.15 0.43 -0.16 0.00 1.54 0.00 0.00 36.73 38.69 3a6o h TYR 181 CO 0.01 -0.68 -0.24 -0.07 -1.64 0.00 0.00 178.16 175.54 3a6o h LEU 182 N -1.12 -0.89 -0.13 2.82 -0.00 -1.19 -1.38 115.31 113.43 3a6o h LEU 182 Ca -0.10 0.26 -0.01 0.00 -0.00 0.00 0.00 57.88 58.04 3a6o h LEU 182 Cb 0.90 0.56 -0.01 0.00 -0.00 0.00 0.00 40.66 42.12 3a6o h LEU 182 CO 0.10 -0.29 0.05 -0.08 -0.00 0.00 0.00 178.44 178.22 3a6o h GLU 183 N -0.01 0.19 -0.97 1.13 4.81 -0.49 -1.32 114.58 117.92 3a6o h GLU 183 Ca 0.40 -0.03 0.24 0.00 -0.13 0.00 0.00 59.36 59.83 3a6o h GLU 183 Cb 0.63 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.90 3a6o h GLU 183 CO -0.89 0.29 0.65 1.49 -0.73 0.00 0.00 179.01 179.81 3a6o h GLU 184 N 0.06 0.31 -0.21 1.92 4.81 -0.66 0.46 114.58 121.26 3a6o h GLU 184 Ca 0.04 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.13 3a6o h GLU 184 Cb 0.16 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 3a6o h GLU 184 CO -0.00 0.20 -0.38 1.25 -0.73 0.00 0.00 179.01 179.35 3a6o h LEU 185 N 0.32 0.50 0.00 1.64 5.85 -0.14 -3.48 115.31 120.01 3a6o h LEU 185 Ca 0.51 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 59.02 3a6o h LEU 185 Cb 1.43 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.32 3a6o h LEU 185 CO -0.18 0.84 0.00 0.61 -0.34 0.00 0.00 178.44 179.37 3a6o n GLY 186 N -0.10 1.15 3.77 3.75 0.00 0.15 -4.45 105.19 109.46 3a6o n GLY 186 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 3a6o n GLY 186 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3a6o s VAL 187 N -2.00 3.20 0.00 1.61 -7.23 -1.21 -4.88 120.40 109.89 3a6o s VAL 187 Ca 0.00 0.61 0.00 0.00 -1.81 0.00 0.00 61.98 60.78 3a6o s VAL 187 Cb 0.00 -3.15 0.00 0.00 0.56 0.00 0.00 36.38 33.79 3a6o s VAL 187 CO 0.00 -0.30 0.10 0.35 -0.31 0.00 0.00 175.10 174.94 3a6o n THR 188 N -2.11 0.00 -3.95 5.32 -2.24 -0.74 -4.71 114.28 105.85 3a6o n THR 188 Ca 0.11 -0.38 -0.08 0.00 -2.27 0.00 0.00 64.05 61.43 3a6o n THR 188 Cb 0.52 1.06 -0.09 0.00 -2.10 0.00 0.00 70.33 69.72 3a6o n THR 188 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3a6o s ALA 189 N -0.56 0.06 -0.10 6.98 0.00 -1.07 -0.31 121.76 126.76 3a6o s ALA 189 Ca 0.00 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.19 3a6o s ALA 189 Cb 0.00 0.35 -0.01 0.00 0.00 0.00 0.00 23.12 23.46 3a6o s ALA 189 CO 0.00 -0.41 -0.18 -0.51 0.00 0.00 0.00 175.76 174.65 3a6o s LEU 190 N -2.68 2.42 -0.45 0.00 1.43 0.34 -2.03 118.68 117.71 3a6o s LEU 190 Ca 0.03 -0.41 -0.13 0.00 -1.03 0.00 0.00 54.13 52.59 3a6o s LEU 190 Cb 0.04 -1.50 0.08 0.00 0.03 0.00 0.00 46.19 44.83 3a6o s LEU 190 CO -0.09 0.20 0.34 -0.47 0.23 0.00 0.00 176.35 176.56 3a6o s TYR 191 N 0.14 3.28 -0.17 0.29 5.04 0.39 -0.09 117.35 126.23 3a6o s TYR 191 Ca -0.10 -1.17 -0.24 0.00 -2.44 0.00 0.00 57.07 53.13 3a6o s TYR 191 Cb -0.16 -3.09 -0.02 0.00 0.35 0.00 0.00 41.96 39.04 3a6o s TYR 191 CO 0.06 -0.82 0.75 -0.06 -1.34 0.00 0.00 175.55 174.14 3a6o s PHE 192 N 1.56 3.42 1.03 4.97 0.08 -0.80 -0.71 117.98 127.54 3a6o s PHE 192 Ca 0.04 1.15 -0.23 0.00 0.12 0.00 0.00 56.93 58.00 3a6o s PHE 192 Cb -0.24 -2.92 -0.10 0.00 -0.57 0.00 0.00 43.02 39.20 3a6o s PHE 192 CO 0.05 -0.18 -0.92 2.41 -0.10 0.00 0.00 175.22 176.48 3a6o n THR 193 N 4.61 0.00 -1.72 0.64 -1.04 -0.67 -3.23 114.28 112.87 3a6o n THR 193 Ca 0.02 -0.16 -0.41 0.00 -2.04 0.00 0.00 64.05 61.46 3a6o n THR 193 Cb 0.49 -0.20 0.01 0.00 -1.82 0.00 0.00 70.33 68.81 3a6o n THR 193 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3a6o n PRO 194 N 1.00 2.07 -0.49 -2.82 -0.02 -1.26 -4.47 135.00 129.01 3a6o n PRO 194 Ca -0.01 0.74 0.03 0.00 -2.02 0.00 0.00 63.50 62.24 3a6o n PRO 194 Cb 0.68 -2.47 0.05 0.00 -0.02 0.00 0.00 33.50 31.75 3a6o n PRO 194 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3a6o n ILE 195 N -0.14 0.63 -3.64 4.25 -5.35 -1.26 -4.75 119.36 109.11 3a6o n ILE 195 Ca 0.06 -0.90 -0.20 0.00 -0.27 0.00 0.00 62.75 61.44 3a6o n ILE 195 Cb 0.40 0.31 -0.01 0.00 -1.74 0.00 0.00 39.64 38.60 3a6o n ILE 195 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 3a6o s PHE 196 N -0.96 3.20 -0.04 4.28 2.99 -1.26 -2.57 117.98 123.61 3a6o s PHE 196 Ca 0.14 -0.16 -0.33 0.00 0.00 0.00 0.00 56.93 56.58 3a6o s PHE 196 Cb 0.14 -1.85 -0.11 0.00 0.00 0.00 0.00 43.02 41.19 3a6o s PHE 196 CO -0.01 0.14 1.88 0.00 -0.00 0.00 0.00 175.22 177.23 3a6o n ALA 197 N -1.55 1.09 -3.33 5.36 0.00 -0.67 -4.33 120.51 117.07 3a6o n ALA 197 Ca -0.03 0.28 -0.15 0.00 0.00 0.00 0.00 53.44 53.54 3a6o n ALA 197 Cb 0.58 -2.53 -0.07 0.00 0.00 0.00 0.00 19.45 17.43 3a6o n ALA 197 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3a6o s SER 198 N 3.94 -0.41 -1.27 0.00 0.15 -1.26 -0.84 113.70 114.00 3a6o s SER 198 Ca 0.91 0.29 -0.07 0.00 0.70 0.00 0.00 55.95 57.78 3a6o s SER 198 Cb -0.63 0.44 0.16 0.00 -1.71 0.00 0.00 66.02 64.28 3a6o s SER 198 CO 0.49 -0.59 2.08 -0.81 1.20 0.00 0.00 173.24 175.60 3a6o n PRO 199 N 0.84 4.23 -3.83 5.44 -0.04 -1.26 -4.88 135.00 135.50 3a6o n PRO 199 Ca -0.20 -3.63 -0.06 0.00 -0.04 0.00 0.00 63.50 59.57 3a6o n PRO 199 Cb 0.58 -2.74 -0.01 0.00 -0.04 0.00 0.00 33.50 31.30 3a6o n PRO 199 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3a6o s SER 200 N 0.31 -0.17 0.09 3.54 1.04 -1.26 -5.00 113.70 112.25 3a6o s SER 200 Ca 0.45 -0.66 0.26 0.00 0.48 0.00 0.00 55.95 56.48 3a6o s SER 200 Cb 0.14 0.68 0.99 0.00 0.10 0.00 0.00 66.02 67.93 3a6o s SER 200 CO -0.04 -1.28 1.80 0.00 0.98 0.00 0.00 173.24 174.69 3a6o n HIS 201 N -0.49 0.39 -0.04 5.02 1.44 -1.26 -3.73 115.22 116.55 3a6o n HIS 201 Ca -0.05 0.12 -0.00 0.00 -2.01 0.00 0.00 57.72 55.78 3a6o n HIS 201 Cb 0.60 -0.70 -0.10 0.00 0.12 0.00 0.00 29.99 29.91 3a6o n HIS 201 CO 0.00 0.00 0.00 -2.39 -2.81 0.00 0.00 176.34 171.14 3a6o n HIS 202 N -1.82 0.00 -2.70 -1.40 -0.00 -1.26 -4.64 115.22 103.39 3a6o n HIS 202 Ca 0.06 0.00 -0.22 0.00 -0.00 0.00 0.00 57.72 57.56 3a6o n HIS 202 Cb 0.34 -0.47 0.01 0.00 -0.00 0.00 0.00 29.99 29.87 3a6o n HIS 202 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 3a6o n LYS 203 N -2.23 -3.23 0.00 -1.40 4.76 -1.24 -4.23 118.16 110.59 3a6o n LYS 203 Ca -0.12 0.95 0.14 0.00 -2.87 0.00 0.00 58.31 56.41 3a6o n LYS 203 Cb 0.65 -5.72 0.54 0.00 -1.84 0.00 0.00 35.03 28.66 3a6o n LYS 203 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 3a6o n TYR 204 N -4.24 0.00 -3.73 2.13 4.01 -1.26 -4.34 117.16 109.73 3a6o n TYR 204 Ca -0.18 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.22 3a6o n TYR 204 Cb 0.65 -0.03 -0.09 0.00 -0.31 0.00 0.00 39.34 39.57 3a6o n TYR 204 CO 0.00 0.00 0.00 0.16 -0.46 0.00 0.00 176.86 176.56 3a6o s ASP 205 N -2.12 5.54 0.12 7.72 -4.77 -1.26 -4.67 116.67 117.23 3a6o s ASP 205 Ca 0.36 -3.62 -0.31 0.00 -3.30 0.00 0.00 52.55 45.67 3a6o s ASP 205 Cb 0.21 -1.82 -0.09 0.00 -1.09 0.00 0.00 42.92 40.13 3a6o s ASP 205 CO 0.38 -0.18 1.52 -0.89 0.70 0.00 0.00 175.17 176.70 3a6o s THR 206 N -1.18 2.95 -0.07 2.11 2.01 -1.26 -4.34 115.64 115.87 3a6o s THR 206 Ca 0.25 0.63 -0.12 0.00 0.31 0.00 0.00 61.69 62.76 3a6o s THR 206 Cb -0.09 -3.41 -0.30 0.00 0.01 0.00 0.00 72.50 68.72 3a6o s THR 206 CO -0.12 0.04 0.62 0.00 -0.69 0.00 0.00 174.62 174.47 3a6o h ALA 207 N 7.11 0.17 -2.14 7.40 0.00 -1.28 -0.82 119.26 129.70 3a6o h ALA 207 Ca -0.42 -1.13 -0.26 0.00 0.00 0.00 0.00 54.91 53.10 3a6o h ALA 207 Cb 1.20 0.47 -0.32 0.00 0.00 0.00 0.00 17.79 19.14 3a6o h ALA 207 CO 0.90 0.97 -0.58 0.34 0.00 0.00 0.00 179.25 180.88 3a6o s ASP 208 N -7.21 1.03 0.57 0.00 -1.08 -0.97 -4.02 116.67 105.00 3a6o s ASP 208 Ca -0.17 -0.26 0.32 0.00 -0.52 0.00 0.00 52.55 51.91 3a6o s ASP 208 Cb 0.05 0.71 1.74 0.00 -1.46 0.00 0.00 42.92 43.97 3a6o s ASP 208 CO 0.82 -0.34 2.17 1.88 0.52 0.00 0.00 175.17 180.23 3a6o h TYR 209 N 8.24 0.00 -0.88 -5.34 -1.99 -1.91 -2.85 116.97 112.25 3a6o h TYR 209 Ca -0.16 0.00 -0.51 0.00 2.00 0.00 0.00 58.73 60.06 3a6o h TYR 209 Cb 1.13 0.00 -0.28 0.00 2.00 0.00 0.00 36.73 39.58 3a6o h TYR 209 CO 0.19 0.05 0.52 1.28 -0.00 0.00 0.00 178.16 180.20 3a6o n LEU 210 N -3.53 6.50 -3.74 3.88 4.77 -1.26 -4.92 117.00 118.71 3a6o n LEU 210 Ca -0.02 -3.90 -0.13 0.00 -0.03 0.00 0.00 56.01 51.93 3a6o n LEU 210 Cb 0.17 -0.82 -0.10 0.00 -2.33 0.00 0.00 43.42 40.34 3a6o n LEU 210 CO 0.27 1.27 0.05 0.00 -1.33 0.00 0.00 177.39 177.65 3a6o s ALA 211 N -3.46 -0.94 0.22 -1.18 0.00 -1.08 -5.08 121.76 110.24 3a6o s ALA 211 Ca 0.57 1.08 -0.32 0.00 0.00 0.00 0.00 51.96 53.30 3a6o s ALA 211 Cb 0.47 -0.63 -0.12 0.00 0.00 0.00 0.00 23.12 22.84 3a6o s ALA 211 CO 0.05 -0.18 1.71 -0.89 0.00 0.00 0.00 175.76 176.45 3a6o n ILE 212 N 2.91 0.16 -1.66 0.00 2.08 -1.26 -1.67 119.36 119.91 3a6o n ILE 212 Ca -0.13 -0.04 -0.47 0.00 0.56 0.00 0.00 62.75 62.67 3a6o n ILE 212 Cb 0.57 -1.98 -0.04 0.00 -0.75 0.00 0.00 39.64 37.44 3a6o n ILE 212 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 3a6o n ASP 213 N 3.69 2.97 -0.29 4.38 -0.08 -1.06 -4.48 116.55 121.67 3a6o n ASP 213 Ca 0.15 1.07 0.22 0.00 -1.51 0.00 0.00 54.79 54.72 3a6o n ASP 213 Cb 0.35 -1.39 0.52 0.00 2.34 0.00 0.00 41.12 42.94 3a6o n ASP 213 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3a6o h PRO 214 N 6.26 0.37 -0.02 -0.67 0.11 -1.93 0.34 132.00 136.46 3a6o h PRO 214 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3a6o h PRO 214 Cb 1.27 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3a6o h PRO 214 CO 0.89 0.25 0.00 0.00 -0.21 0.00 0.00 178.00 178.92 3a6o n GLN 215 N -4.56 1.27 -0.07 1.05 10.64 -1.26 -3.15 117.38 121.31 3a6o n GLN 215 Ca 0.23 -0.40 -0.04 0.00 -1.83 0.00 0.00 57.00 54.96 3a6o n GLN 215 Cb 0.82 -1.45 -0.14 0.00 -0.86 0.00 0.00 30.24 28.61 3a6o n GLN 215 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 3a6o n PHE 216 N -0.48 0.00 0.00 2.61 3.72 0.11 -4.66 117.46 118.75 3a6o n PHE 216 Ca 0.20 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.60 3a6o n PHE 216 Cb 0.20 -0.74 0.00 0.00 -0.94 0.00 0.00 39.48 38.00 3a6o n PHE 216 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3a6o n GLY 217 N 1.81 0.10 3.43 1.37 0.00 -0.37 -2.37 105.19 109.16 3a6o n GLY 217 Ca -0.22 -1.11 -0.14 0.00 0.00 0.00 0.00 46.02 44.55 3a6o n GLY 217 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3a6o s ASP 218 N -4.00 0.81 0.19 1.61 1.47 -1.26 -3.79 116.67 111.70 3a6o s ASP 218 Ca 0.00 -1.45 -0.09 0.00 1.18 0.00 0.00 52.55 52.19 3a6o s ASP 218 Cb 0.00 0.60 0.09 0.00 -0.34 0.00 0.00 42.92 43.27 3a6o s ASP 218 CO 0.00 -1.17 1.69 0.25 0.68 0.00 0.00 175.17 176.62 3a6o h LEU 219 N 2.20 1.04 -0.86 2.11 5.85 -1.98 -2.17 115.31 121.50 3a6o h LEU 219 Ca -0.28 -0.25 0.08 0.00 0.84 0.00 0.00 57.88 58.27 3a6o h LEU 219 Cb 1.24 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.93 3a6o h LEU 219 CO 0.40 1.03 0.52 -0.65 -0.34 0.00 0.00 178.44 179.40 3a6o h PRO 220 N 1.02 0.88 -0.74 5.25 0.11 -2.00 -1.29 132.00 135.23 3a6o h PRO 220 Ca 0.21 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 66.28 3a6o h PRO 220 Cb 0.42 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 31.29 3a6o h PRO 220 CO 0.01 0.58 0.48 1.15 -0.21 0.00 0.00 178.00 180.01 3a6o h THR 221 N 0.90 1.16 -0.66 -1.15 2.02 -1.82 -1.59 112.91 111.78 3a6o h THR 221 Ca 0.40 -0.33 0.04 0.00 0.77 0.00 0.00 66.41 67.29 3a6o h THR 221 Cb 0.28 0.11 -0.05 0.00 -1.74 0.00 0.00 68.15 66.75 3a6o h THR 221 CO -0.21 0.18 0.38 0.15 0.37 0.00 0.00 175.52 176.39 3a6o h PHE 222 N 0.97 0.71 -0.08 3.16 3.57 -0.81 0.75 116.94 125.21 3a6o h PHE 222 Ca 0.28 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.74 3a6o h PHE 222 Cb -0.07 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.44 3a6o h PHE 222 CO -0.03 0.37 -0.25 0.00 -2.23 0.00 0.00 178.31 176.17 3a6o h ARG 223 N 0.73 0.13 -0.29 1.11 2.47 -0.71 0.16 114.38 117.98 3a6o h ARG 223 Ca 0.28 -0.04 -0.17 0.00 -1.26 0.00 0.00 59.98 58.79 3a6o h ARG 223 Cb 0.11 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.41 3a6o h ARG 223 CO -0.15 0.38 -0.50 -0.09 0.56 0.00 0.00 179.97 180.17 3a6o h ARG 224 N 0.12 0.81 0.19 0.04 9.65 -0.63 -0.91 114.38 123.65 3a6o h ARG 224 Ca 0.02 -0.49 -0.01 0.00 -1.10 0.00 0.00 59.98 58.40 3a6o h ARG 224 Cb 0.52 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.14 3a6o h ARG 224 CO 0.04 1.12 -0.09 1.25 2.80 0.00 0.00 179.97 185.08 3a6o h LEU 225 N 0.63 -0.21 -0.55 3.80 5.85 0.11 0.41 115.31 125.35 3a6o h LEU 225 Ca 0.03 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.70 3a6o h LEU 225 Cb 1.09 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 42.12 3a6o h LEU 225 CO 0.11 -0.01 0.24 0.58 -0.34 0.00 0.00 178.44 179.01 3a6o h VAL 226 N -0.41 0.86 -0.22 1.05 2.07 -0.59 -0.27 116.25 118.73 3a6o h VAL 226 Ca -0.03 -0.15 -0.20 0.00 0.82 0.00 0.00 66.70 67.14 3a6o h VAL 226 Cb 0.32 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 3a6o h VAL 226 CO 0.04 0.08 -0.66 0.44 0.02 0.00 0.00 177.57 177.49 3a6o h ASP 227 N 0.44 0.95 -0.16 0.57 3.32 -0.99 0.67 116.42 121.22 3a6o h ASP 227 Ca 0.26 -0.56 -0.02 0.00 0.02 0.00 0.00 57.03 56.73 3a6o h ASP 227 Cb 0.25 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 3a6o h ASP 227 CO -0.23 1.36 0.06 -0.33 -1.72 0.00 0.00 179.24 178.38 3a6o h GLU 228 N 0.60 0.30 0.02 3.56 4.39 -0.43 0.12 114.58 123.16 3a6o h GLU 228 Ca -0.02 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.65 3a6o h GLU 228 Cb 1.28 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 3a6o h GLU 228 CO 0.14 0.28 -0.01 0.00 -1.16 0.00 0.00 179.01 178.26 3a6o h ALA 229 N 1.77 -0.03 -0.83 3.43 0.00 -0.85 -3.26 119.26 119.49 3a6o h ALA 229 Ca 0.08 -0.36 0.20 0.00 0.00 0.00 0.00 54.91 54.82 3a6o h ALA 229 Cb 0.11 0.01 -0.12 0.00 0.00 0.00 0.00 17.79 17.79 3a6o h ALA 229 CO -0.00 -0.11 0.25 0.45 0.00 0.00 0.00 179.25 179.83 3a6o h HIS 230 N -0.85 0.40 0.00 0.00 3.86 -0.38 0.57 115.15 118.75 3a6o h HIS 230 Ca -0.00 0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 3a6o h HIS 230 Cb 0.73 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.16 3a6o h HIS 230 CO 0.19 -0.12 0.00 2.89 0.86 0.00 0.00 177.93 181.75 3a6o n ARG 231 N -5.15 0.37 -0.49 2.45 1.85 0.38 -1.85 116.66 114.22 3a6o n ARG 231 Ca 0.19 0.07 0.05 0.00 -1.00 0.00 0.00 57.85 57.16 3a6o n ARG 231 Cb 0.58 -1.50 0.21 0.00 -1.05 0.00 0.00 32.46 30.70 3a6o n ARG 231 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 3a6o n ARG 232 N -1.16 2.05 -3.46 2.89 1.74 0.08 -4.96 116.66 113.84 3a6o n ARG 232 Ca 0.10 -2.94 -0.24 0.00 -0.77 0.00 0.00 57.85 54.00 3a6o n ARG 232 Cb 0.10 -1.73 0.06 0.00 -1.02 0.00 0.00 32.46 29.87 3a6o n ARG 232 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3a6o n GLY 233 N -0.99 -0.53 3.09 -0.13 0.00 -0.77 -4.91 105.19 100.94 3a6o n GLY 233 Ca 0.24 0.21 -0.32 0.00 0.00 0.00 0.00 46.02 46.15 3a6o n GLY 233 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a6o s ILE 234 N -3.26 1.90 0.88 -0.61 1.01 -0.52 -4.46 121.20 116.14 3a6o s ILE 234 Ca 0.51 -0.85 -0.13 0.00 0.00 0.00 0.00 60.65 60.17 3a6o s ILE 234 Cb -0.23 -1.74 0.13 0.00 0.01 0.00 0.00 42.46 40.63 3a6o s ILE 234 CO 0.63 0.50 1.20 -0.54 0.00 0.00 0.00 174.94 176.73 3a6o s LYS 235 N 1.35 1.36 -0.13 2.79 1.02 0.58 -2.81 119.74 123.91 3a6o s LYS 235 Ca 0.05 0.01 -0.00 0.00 0.02 0.00 0.00 55.97 56.05 3a6o s LYS 235 Cb -0.13 -1.89 0.02 0.00 -0.52 0.00 0.00 37.83 35.31 3a6o s LYS 235 CO -0.12 -1.99 -0.10 0.42 -0.92 0.00 0.00 175.35 172.63 3a6o s ILE 236 N -3.57 1.28 -0.09 2.17 -1.09 -1.26 -0.50 121.20 118.13 3a6o s ILE 236 Ca 0.66 -0.46 0.01 0.00 -2.23 0.00 0.00 60.65 58.63 3a6o s ILE 236 Cb -0.10 -1.25 -0.02 0.00 -1.58 0.00 0.00 42.46 39.51 3a6o s ILE 236 CO 0.51 0.39 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.86 3a6o s ILE 237 N 1.61 3.12 0.33 2.92 -1.09 0.87 0.88 121.20 129.84 3a6o s ILE 237 Ca 0.05 -0.67 0.08 0.00 -2.23 0.00 0.00 60.65 57.88 3a6o s ILE 237 Cb -0.13 -2.27 -0.04 0.00 -1.58 0.00 0.00 42.46 38.44 3a6o s ILE 237 CO -0.09 0.56 0.11 -0.76 -1.23 0.00 0.00 174.94 173.52 3a6o s LEU 238 N -0.20 3.23 -0.33 2.97 1.43 -0.10 -1.90 118.68 123.79 3a6o s LEU 238 Ca 0.00 -0.77 -0.11 0.00 -1.03 0.00 0.00 54.13 52.23 3a6o s LEU 238 Cb -0.13 -1.71 -0.01 0.00 0.03 0.00 0.00 46.19 44.37 3a6o s LEU 238 CO 0.03 -0.24 0.20 -0.62 0.23 0.00 0.00 176.35 175.95 3a6o s ASP 239 N -3.81 5.84 -0.32 2.29 -1.08 -1.20 -0.23 116.67 118.16 3a6o s ASP 239 Ca 0.36 -0.48 -0.14 0.00 -0.52 0.00 0.00 52.55 51.77 3a6o s ASP 239 Cb -0.03 -2.08 -0.02 0.00 -1.46 0.00 0.00 42.92 39.33 3a6o s ASP 239 CO 0.22 -0.22 0.33 0.00 0.52 0.00 0.00 175.17 176.01 3a6o s ALA 240 N 1.67 3.51 -0.94 3.66 0.00 0.12 -4.70 121.76 125.09 3a6o s ALA 240 Ca 0.05 -1.15 -0.11 0.00 0.00 0.00 0.00 51.96 50.75 3a6o s ALA 240 Cb -0.17 -2.74 0.24 0.00 0.00 0.00 0.00 23.12 20.45 3a6o s ALA 240 CO 0.09 -0.92 0.89 0.08 0.00 0.00 0.00 175.76 175.89 3a6o s VAL 241 N 1.95 5.65 -0.68 0.00 1.01 -1.26 -1.72 120.40 125.35 3a6o s VAL 241 Ca 0.11 -2.92 0.16 0.00 0.00 0.00 0.00 61.98 59.33 3a6o s VAL 241 Cb -0.16 -4.46 -0.19 0.00 0.00 0.00 0.00 36.38 31.57 3a6o s VAL 241 CO 0.11 -1.09 0.65 0.49 0.00 0.00 0.00 175.10 175.27 3a6o n PHE 242 N 3.39 0.00 0.02 5.22 3.72 -1.26 -4.44 117.46 124.11 3a6o n PHE 242 Ca 0.18 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.54 3a6o n PHE 242 Cb 0.43 -0.05 0.19 0.00 -0.94 0.00 0.00 39.48 39.12 3a6o n PHE 242 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 3a6o h ASN 243 N 0.00 0.47 -5.01 4.37 -1.24 -1.87 -3.44 115.58 108.87 3a6o h ASN 243 Ca 0.00 -0.17 -0.11 0.00 0.71 0.00 0.00 56.30 56.73 3a6o h ASN 243 Cb 0.43 -0.13 -0.19 0.00 0.73 0.00 0.00 38.32 39.16 3a6o h ASN 243 CO 0.00 0.74 -0.27 -1.38 -1.29 0.00 0.00 177.43 175.24 3a6o s HIS 244 N -4.43 -0.16 0.61 0.67 -3.43 -1.26 -1.29 115.29 105.99 3a6o s HIS 244 Ca -0.07 0.19 0.03 0.00 -0.80 0.00 0.00 55.06 54.42 3a6o s HIS 244 Cb 0.14 0.10 0.08 0.00 -1.43 0.00 0.00 32.58 31.46 3a6o s HIS 244 CO 0.79 -0.42 0.84 0.00 -2.00 0.00 0.00 174.74 173.95 3a6o s ALA 245 N -1.64 4.10 0.40 -1.38 0.00 -0.35 -4.80 121.76 118.09 3a6o s ALA 245 Ca -0.11 -1.74 -0.09 0.00 0.00 0.00 0.00 51.96 50.02 3a6o s ALA 245 Cb -0.04 -1.84 -0.06 0.00 0.00 0.00 0.00 23.12 21.18 3a6o s ALA 245 CO 0.02 -1.00 0.74 0.20 0.00 0.00 0.00 175.76 175.72 3a6o s GLY 246 N -4.60 1.88 0.00 0.00 0.00 -0.31 -3.01 107.32 101.28 3a6o s GLY 246 Ca 0.62 -0.29 0.00 0.00 0.00 0.00 0.00 44.72 45.05 3a6o s GLY 246 CO 0.40 -0.12 0.60 2.09 0.00 0.00 0.00 173.10 176.08 3a6o n ASP 247 N -1.35 0.00 -1.03 1.64 5.75 -0.12 -0.75 116.55 120.69 3a6o n ASP 247 Ca 0.02 0.12 0.09 0.00 -0.01 0.00 0.00 54.79 55.01 3a6o n ASP 247 Cb 0.54 -0.12 0.23 0.00 -1.03 0.00 0.00 41.12 40.74 3a6o n ASP 247 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3a6o n GLN 248 N -1.10 2.61 -2.02 0.11 1.13 -1.26 -4.44 117.38 112.41 3a6o n GLN 248 Ca 0.00 -2.30 -0.41 0.00 -1.94 0.00 0.00 57.00 52.35 3a6o n GLN 248 Cb 0.01 -1.44 -0.02 0.00 0.11 0.00 0.00 30.24 28.90 3a6o n GLN 248 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 3a6o s PHE 249 N -1.08 2.96 0.20 1.08 5.36 0.07 -4.72 117.98 121.85 3a6o s PHE 249 Ca 0.36 1.23 -0.21 0.00 -0.96 0.00 0.00 56.93 57.36 3a6o s PHE 249 Cb 0.20 -3.79 0.15 0.00 -0.34 0.00 0.00 43.02 39.23 3a6o s PHE 249 CO 0.26 -2.34 1.57 0.27 -1.46 0.00 0.00 175.22 173.52 3a6o h PHE 250 N 3.90 -1.07 -0.06 10.12 -5.15 -1.91 -0.12 116.94 122.65 3a6o h PHE 250 Ca -0.48 0.09 0.02 0.00 -0.20 0.00 0.00 57.97 57.39 3a6o h PHE 250 Cb 1.23 0.58 -0.00 0.00 0.22 0.00 0.00 35.95 37.97 3a6o h PHE 250 CO 0.57 -0.40 0.04 0.00 -2.00 0.00 0.00 178.31 176.53 3a6o h ALA 251 N 1.06 2.04 0.00 12.09 0.00 -1.96 -0.17 119.26 132.32 3a6o h ALA 251 Ca 0.26 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 55.00 3a6o h ALA 251 Cb 0.57 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3a6o h ALA 251 CO -0.80 -0.07 -1.04 0.35 0.00 0.00 0.00 179.25 177.69 3a6o h PHE 252 N 0.00 0.00 -0.29 0.00 3.57 -1.41 -2.33 116.94 116.49 3a6o h PHE 252 Ca 0.03 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.38 3a6o h PHE 252 Cb 0.12 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.85 3a6o h PHE 252 CO 0.00 0.72 -0.40 0.00 -2.23 0.00 0.00 178.31 176.40 3a6o h ARG 253 N 0.00 0.78 -0.62 1.11 3.08 -0.01 0.19 114.38 118.91 3a6o h ARG 253 Ca -0.09 -0.45 0.13 0.00 0.07 0.00 0.00 59.98 59.64 3a6o h ARG 253 Cb 1.62 0.04 -0.10 0.00 0.08 0.00 0.00 29.97 31.60 3a6o h ARG 253 CO 0.08 1.08 -0.00 0.22 -1.07 0.00 0.00 179.97 180.27 3a6o h ASP 254 N 0.53 -0.28 -0.09 7.04 3.58 -1.14 0.68 116.42 126.74 3a6o h ASP 254 Ca 0.03 0.15 -0.01 0.00 0.42 0.00 0.00 57.03 57.62 3a6o h ASP 254 Cb 0.99 0.27 -0.00 0.00 1.72 0.00 0.00 39.33 42.31 3a6o h ASP 254 CO 0.09 -0.12 0.01 0.58 -2.88 0.00 0.00 179.24 176.93 3a6o h VAL 255 N 0.11 1.22 -0.47 2.25 2.07 -0.69 0.64 116.25 121.39 3a6o h VAL 255 Ca 0.32 -0.69 0.14 0.00 0.82 0.00 0.00 66.70 67.29 3a6o h VAL 255 Cb 0.52 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 3a6o h VAL 255 CO -0.53 0.20 0.35 -0.07 0.02 0.00 0.00 177.57 177.54 3a6o h LEU 256 N -0.10 0.00 0.00 2.57 3.38 0.08 -2.03 115.31 119.21 3a6o h LEU 256 Ca 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3a6o h LEU 256 Cb 0.30 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 3a6o h LEU 256 CO 0.00 0.00 -0.48 -0.61 0.09 0.00 0.00 178.44 177.45 3a6o h GLN 257 N 0.00 0.00 -0.30 1.13 5.75 0.17 -3.39 115.11 118.47 3a6o h GLN 257 Ca 0.22 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.72 3a6o h GLN 257 Cb 0.93 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.48 3a6o h GLN 257 CO -0.00 0.07 0.00 1.63 -2.65 0.00 0.00 178.83 177.88 3a6o n LYS 258 N -4.63 1.67 0.00 1.69 5.02 0.21 -5.00 118.16 117.13 3a6o n LYS 258 Ca -0.08 -1.01 0.00 0.00 -2.02 0.00 0.00 58.31 55.20 3a6o n LYS 258 Cb 0.25 -1.24 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 3a6o n LYS 258 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3a6o n GLY 259 N 0.92 1.79 0.70 0.72 0.00 -0.77 -1.51 105.19 107.05 3a6o n GLY 259 Ca 0.09 0.20 0.09 0.00 0.00 0.00 0.00 46.02 46.40 3a6o n GLY 259 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3a6o n GLU 260 N 11.36 1.90 0.23 1.61 0.28 -1.26 -2.04 120.64 132.72 3a6o n GLU 260 Ca 0.00 -1.37 0.15 0.00 -0.16 0.00 0.00 57.16 55.77 3a6o n GLU 260 Cb 0.00 -1.36 0.48 0.00 1.43 0.00 0.00 31.44 31.99 3a6o n GLU 260 CO 0.00 0.00 0.00 1.96 -0.16 0.00 0.00 177.13 178.93 3a6o h GLN 261 N 2.47 0.00 -6.61 3.44 1.08 -1.67 -3.47 115.11 110.35 3a6o h GLN 261 Ca 0.00 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.67 3a6o h GLN 261 Cb 0.55 0.00 0.06 0.00 -0.05 0.00 0.00 27.48 28.04 3a6o h GLN 261 CO 0.00 0.00 0.99 0.43 -0.95 0.00 0.00 178.83 179.30 3a6o n SER 262 N -2.95 3.87 0.23 1.46 7.64 -0.87 -4.84 113.62 118.16 3a6o n SER 262 Ca 0.02 1.05 0.13 0.00 1.01 0.00 0.00 58.87 61.09 3a6o n SER 262 Cb 0.38 -1.55 0.72 0.00 -1.01 0.00 0.00 64.21 62.75 3a6o n SER 262 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 3a6o h ARG 263 N 6.89 0.00 -0.38 1.43 2.47 -1.91 -2.80 114.38 120.08 3a6o h ARG 263 Ca -0.44 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.28 3a6o h ARG 263 Cb 1.21 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.53 3a6o h ARG 263 CO 0.95 0.00 0.00 0.66 0.56 0.00 0.00 179.97 182.14 3a6o n TYR 264 N -2.49 1.13 -0.17 3.04 4.02 -1.26 -4.67 117.16 116.76 3a6o n TYR 264 Ca -0.02 -0.76 -0.10 0.00 -0.01 0.00 0.00 57.90 57.01 3a6o n TYR 264 Cb 0.15 -0.29 0.00 0.00 -0.02 0.00 0.00 39.34 39.18 3a6o n TYR 264 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 3a6o h LYS 265 N 2.51 0.87 -0.42 -0.72 2.10 -1.82 -2.89 116.57 116.19 3a6o h LYS 265 Ca 0.00 -0.29 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 3a6o h LYS 265 Cb 1.43 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.68 3a6o h LYS 265 CO 0.24 0.92 0.00 -0.25 -2.00 0.00 0.00 179.45 178.36 3a6o n ASP 266 N -4.32 0.42 0.07 7.07 10.43 -1.26 -2.18 116.55 126.79 3a6o n ASP 266 Ca 0.01 -1.99 0.12 0.00 2.57 0.00 0.00 54.79 55.50 3a6o n ASP 266 Cb 0.33 -0.21 0.14 0.00 1.84 0.00 0.00 41.12 43.22 3a6o n ASP 266 CO 0.00 0.00 0.00 -0.50 -1.07 0.00 0.00 177.20 175.63 3a6o h TRP 267 N 0.00 0.00 -4.01 1.24 4.06 -1.86 -3.45 115.95 111.94 3a6o h TRP 267 Ca 0.00 0.00 -0.25 0.00 2.06 0.00 0.00 58.89 60.70 3a6o h TRP 267 Cb 0.21 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.32 3a6o h TRP 267 CO 0.00 0.00 -0.19 1.19 -3.56 0.00 0.00 178.44 175.88 3a6o n PHE 268 N -2.23 0.21 -3.64 0.49 3.01 -0.92 -0.18 117.46 114.20 3a6o n PHE 268 Ca 0.03 -1.06 -0.31 0.00 1.01 0.00 0.00 57.45 57.12 3a6o n PHE 268 Cb 0.46 -0.05 -0.09 0.00 -0.01 0.00 0.00 39.48 39.79 3a6o n PHE 268 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 3a6o n PHE 269 N -0.43 3.56 -2.90 1.38 3.72 -1.26 -4.79 117.46 116.75 3a6o n PHE 269 Ca -0.05 -4.11 -0.43 0.00 -0.05 0.00 0.00 57.45 52.81 3a6o n PHE 269 Cb 0.26 -0.78 -0.05 0.00 -0.94 0.00 0.00 39.48 37.97 3a6o n PHE 269 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3a6o s ILE 270 N -1.84 4.60 0.32 4.37 1.09 -1.26 -2.07 121.20 126.40 3a6o s ILE 270 Ca 0.30 0.71 0.07 0.00 -1.10 0.00 0.00 60.65 60.64 3a6o s ILE 270 Cb 0.01 -4.34 0.07 0.00 -1.06 0.00 0.00 42.46 37.15 3a6o s ILE 270 CO -0.09 -0.68 1.76 -0.08 -0.10 0.00 0.00 174.94 175.74 3a6o h GLU 271 N 8.86 0.25 -1.11 2.79 4.81 -1.03 -3.48 114.58 125.67 3a6o h GLU 271 Ca -0.24 -0.10 0.28 0.00 -0.13 0.00 0.00 59.36 59.17 3a6o h GLU 271 Cb 1.08 -0.01 -0.23 0.00 0.63 0.00 0.00 28.75 30.22 3a6o h GLU 271 CO 0.98 0.55 0.94 0.16 -0.73 0.00 0.00 179.01 180.91 3a6o s ASP 272 N -6.87 -0.04 0.13 1.04 1.47 -1.24 -5.07 116.67 106.09 3a6o s ASP 272 Ca -0.05 0.02 -0.05 0.00 1.18 0.00 0.00 52.55 53.65 3a6o s ASP 272 Cb 0.14 0.04 -0.06 0.00 -0.34 0.00 0.00 42.92 42.70 3a6o s ASP 272 CO 0.76 -0.06 0.37 -0.36 0.68 0.00 0.00 175.17 176.56 3a6o s PHE 273 N -1.63 3.49 0.56 2.11 0.08 -1.26 -4.38 117.98 116.94 3a6o s PHE 273 Ca 0.10 0.57 -0.19 0.00 0.12 0.00 0.00 56.93 57.52 3a6o s PHE 273 Cb -0.01 -2.01 -0.05 0.00 -0.57 0.00 0.00 43.02 40.38 3a6o s PHE 273 CO -0.05 0.45 1.17 -1.25 -0.10 0.00 0.00 175.22 175.44 3a6o s PRO 274 N -2.56 3.20 -0.54 0.24 0.04 -1.26 -5.10 135.00 129.02 3a6o s PRO 274 Ca 0.40 1.73 -0.25 0.00 0.04 0.00 0.00 61.00 62.92 3a6o s PRO 274 Cb -0.12 -2.00 0.04 0.00 0.04 0.00 0.00 34.50 32.45 3a6o s PRO 274 CO 0.24 -1.00 1.00 0.08 0.04 0.00 0.00 177.00 177.36 3a6o s VAL 275 N -1.66 4.31 0.00 -0.36 1.01 -1.26 -4.53 120.40 117.91 3a6o s VAL 275 Ca 0.74 0.55 0.00 0.00 0.00 0.00 0.00 61.98 63.27 3a6o s VAL 275 Cb -0.28 -4.57 0.00 0.00 0.00 0.00 0.00 36.38 31.54 3a6o s VAL 275 CO 0.31 -1.11 0.00 -0.24 0.00 0.00 0.00 175.10 174.06 3a6o n SER 276 N 7.65 0.00 -2.78 3.32 2.88 -1.26 -4.79 113.62 118.63 3a6o n SER 276 Ca 0.05 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.19 3a6o n SER 276 Cb 0.48 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.87 3a6o n SER 276 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 3a6o n LYS 277 N 0.00 0.00 0.00 -1.46 0.00 -1.24 -4.68 118.16 110.78 3a6o n LYS 277 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 3a6o n LYS 277 Cb 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 35.03 34.09 3a6o n LYS 277 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 3a6o n THR 278 N 3.47 0.00 -0.21 3.15 -1.04 -1.26 0.15 114.28 118.54 3a6o n THR 278 Ca 0.29 0.42 0.31 0.00 -2.04 0.00 0.00 64.05 63.03 3a6o n THR 278 Cb -0.03 -1.35 0.69 0.00 -1.82 0.00 0.00 70.33 67.82 3a6o n THR 278 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3a6o h SER 279 N 0.00 0.00 -3.75 8.00 0.02 -1.97 -1.97 113.55 113.88 3a6o h SER 279 Ca 0.00 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 60.29 3a6o h SER 279 Cb 0.00 0.00 -0.38 0.00 0.14 0.00 0.00 62.40 62.16 3a6o h SER 279 CO 0.00 0.00 -0.42 -0.60 -1.14 0.00 0.00 176.83 174.67 3a6o s ARG 280 N -4.74 2.56 0.45 3.45 6.06 -1.25 -5.01 118.95 120.47 3a6o s ARG 280 Ca -0.04 -2.95 -0.25 0.00 -2.50 0.00 0.00 55.73 49.99 3a6o s ARG 280 Cb 0.19 -3.60 -0.08 0.00 0.06 0.00 0.00 34.95 31.52 3a6o s ARG 280 CO 0.67 -1.21 1.36 0.95 -2.50 0.00 0.00 175.30 174.58 3a6o s THR 281 N -0.79 2.29 -0.29 4.11 -4.23 0.41 -3.64 115.64 113.50 3a6o s THR 281 Ca 0.21 0.25 0.08 0.00 -1.18 0.00 0.00 61.69 61.06 3a6o s THR 281 Cb -0.14 -3.14 0.47 0.00 1.34 0.00 0.00 72.50 71.02 3a6o s THR 281 CO -0.08 0.03 1.38 -0.46 -0.54 0.00 0.00 174.62 174.95 3a6o n ASN 282 N -0.26 2.98 -3.85 3.99 6.94 -1.26 -4.92 115.26 118.88 3a6o n ASN 282 Ca 0.06 -3.82 -0.11 0.00 -0.02 0.00 0.00 54.58 50.69 3a6o n ASN 282 Cb 0.43 -0.57 -0.09 0.00 -2.36 0.00 0.00 39.78 37.19 3a6o n ASN 282 CO 0.00 0.00 0.00 -0.72 -1.03 0.00 0.00 177.26 175.51 3a6o s TYR 283 N -3.35 0.06 0.11 -2.53 -0.85 -1.26 -0.31 117.35 109.22 3a6o s TYR 283 Ca 0.45 -0.25 -0.20 0.00 -0.52 0.00 0.00 57.07 56.54 3a6o s TYR 283 Cb 0.40 -0.04 -0.07 0.00 0.38 0.00 0.00 41.96 42.64 3a6o s TYR 283 CO -0.02 -0.40 0.62 -2.00 -1.52 0.00 0.00 175.55 172.23 3a6o s GLU 284 N -2.34 4.27 0.19 -3.49 2.12 -0.88 -4.95 118.70 113.61 3a6o s GLU 284 Ca -0.07 0.82 0.06 0.00 0.36 0.00 0.00 54.97 56.14 3a6o s GLU 284 Cb -0.02 -3.20 -0.05 0.00 0.26 0.00 0.00 34.13 31.12 3a6o s GLU 284 CO -0.03 0.60 -0.12 0.95 -0.54 0.00 0.00 175.26 176.13 3a6o s THR 285 N -1.17 1.47 0.44 -1.70 -4.23 -1.26 -0.70 115.64 108.48 3a6o s THR 285 Ca 0.32 -2.14 -0.22 0.00 -1.18 0.00 0.00 61.69 58.47 3a6o s THR 285 Cb -0.20 -2.00 -0.12 0.00 1.34 0.00 0.00 72.50 71.52 3a6o s THR 285 CO 0.21 -0.63 0.47 0.33 -0.54 0.00 0.00 174.62 174.46 3a6o n PHE 286 N -0.32 -0.77 -1.13 3.99 -0.00 -0.17 -4.63 117.46 114.43 3a6o n PHE 286 Ca -0.09 0.58 0.00 0.00 -0.00 0.00 0.00 57.45 57.94 3a6o n PHE 286 Cb 0.61 -1.95 0.00 0.00 -0.00 0.00 0.00 39.48 38.13 3a6o n PHE 286 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3a6o n ALA 287 N -1.01 0.00 -3.77 3.13 0.00 -1.26 -4.21 120.51 113.39 3a6o n ALA 287 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.26 3a6o n ALA 287 Cb 0.41 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.69 3a6o n ALA 287 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3a6o s VAL 288 N 0.00 1.61 -0.88 0.00 1.01 -1.26 -4.89 120.40 115.98 3a6o s VAL 288 Ca 0.00 -0.69 -0.05 0.00 0.00 0.00 0.00 61.98 61.24 3a6o s VAL 288 Cb 0.00 -1.47 -0.02 0.00 0.00 0.00 0.00 36.38 34.89 3a6o s VAL 288 CO 0.00 0.46 0.75 0.00 0.00 0.00 0.00 175.10 176.32 3a6o n GLN 289 N 4.36 -1.54 -3.71 2.72 1.13 -1.26 -4.96 117.38 114.11 3a6o n GLN 289 Ca -0.19 1.10 -0.29 0.00 -1.94 0.00 0.00 57.00 55.69 3a6o n GLN 289 Cb 0.51 -5.09 -0.13 0.00 0.11 0.00 0.00 30.24 25.64 3a6o n GLN 289 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3a6o s VAL 290 N -3.16 1.51 0.46 5.09 1.01 -1.26 -5.00 120.40 119.06 3a6o s VAL 290 Ca 0.18 -2.77 0.19 0.00 0.00 0.00 0.00 61.98 59.58 3a6o s VAL 290 Cb -0.04 -2.05 0.23 0.00 0.00 0.00 0.00 36.38 34.52 3a6o s VAL 290 CO 0.78 -0.93 2.05 -0.65 0.00 0.00 0.00 175.10 176.36 3a6o h PRO 291 N 6.49 0.00 0.00 2.72 0.11 -1.93 0.21 132.00 139.61 3a6o h PRO 291 Ca 0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 3a6o h PRO 291 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 3a6o h PRO 291 CO 0.51 0.13 0.00 0.00 -0.21 0.00 0.00 178.00 178.43 3a6o n ALA 292 N -2.44 1.88 -3.17 -0.75 0.00 -1.26 -4.23 120.51 110.54 3a6o n ALA 292 Ca -0.02 -0.07 -0.25 0.00 0.00 0.00 0.00 53.44 53.10 3a6o n ALA 292 Cb 0.21 -1.30 -0.05 0.00 0.00 0.00 0.00 19.45 18.31 3a6o n ALA 292 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3a6o n MET 293 N -1.43 2.17 -1.93 0.00 2.81 0.74 -0.95 117.12 118.53 3a6o n MET 293 Ca 0.06 -4.24 -0.40 0.00 -1.81 0.00 0.00 57.70 51.30 3a6o n MET 293 Cb 0.19 -1.97 -0.00 0.00 -0.71 0.00 0.00 33.22 30.73 3a6o n MET 293 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 3a6o s PRO 294 N -2.61 4.07 0.18 0.03 0.04 -1.16 -1.00 135.00 134.55 3a6o s PRO 294 Ca 0.42 2.38 -0.30 0.00 0.04 0.00 0.00 61.00 63.54 3a6o s PRO 294 Cb 0.24 -2.90 -0.09 0.00 0.04 0.00 0.00 34.50 31.79 3a6o s PRO 294 CO -0.09 -0.49 1.34 0.21 0.04 0.00 0.00 177.00 178.01 3a6o s LYS 295 N -2.11 4.36 0.15 4.56 2.20 0.12 -1.21 119.74 127.81 3a6o s LYS 295 Ca 0.54 2.07 -0.30 0.00 -0.36 0.00 0.00 55.97 57.92 3a6o s LYS 295 Cb -0.43 -3.20 -0.07 0.00 -1.51 0.00 0.00 37.83 32.63 3a6o s LYS 295 CO 0.57 -0.31 0.98 -0.51 -0.36 0.00 0.00 175.35 175.72 3a6o s LEU 296 N 0.15 4.53 -1.30 5.43 1.43 -0.41 -4.12 118.68 124.38 3a6o s LEU 296 Ca 0.59 1.87 -0.15 0.00 -1.03 0.00 0.00 54.13 55.41 3a6o s LEU 296 Cb -0.37 -3.60 0.11 0.00 0.03 0.00 0.00 46.19 42.37 3a6o s LEU 296 CO 0.37 -0.05 1.76 -1.14 0.23 0.00 0.00 176.35 177.52 3a6o n ARG 297 N 2.47 3.26 -0.11 1.70 0.63 0.74 -4.80 116.66 120.54 3a6o n ARG 297 Ca 0.02 -3.37 0.15 0.00 -0.92 0.00 0.00 57.85 53.73 3a6o n ARG 297 Cb 0.48 -3.23 0.54 0.00 0.45 0.00 0.00 32.46 30.70 3a6o n ARG 297 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 3a6o h THR 298 N 4.71 0.81 -0.47 5.15 1.35 -1.90 0.75 112.91 123.31 3a6o h THR 298 Ca 0.42 -0.12 0.14 0.00 -0.55 0.00 0.00 66.41 66.30 3a6o h THR 298 Cb 0.79 0.44 -0.02 0.00 -1.73 0.00 0.00 68.15 67.63 3a6o h THR 298 CO 1.50 0.06 0.38 -0.33 -0.25 0.00 0.00 175.52 176.88 3a6o h GLU 299 N 0.34 0.00 -6.25 4.72 5.08 -1.98 -3.38 114.58 113.11 3a6o h GLU 299 Ca 0.32 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 58.12 3a6o h GLU 299 Cb 0.80 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.04 3a6o h GLU 299 CO -0.09 0.00 1.20 1.21 -1.00 0.00 0.00 179.01 180.33 3a6o s ASN 300 N -5.97 6.29 0.45 1.42 3.84 0.26 -4.90 114.94 116.33 3a6o s ASN 300 Ca -0.05 1.93 0.15 0.00 0.21 0.00 0.00 52.86 55.10 3a6o s ASN 300 Cb 0.18 -2.53 1.08 0.00 -0.55 0.00 0.00 41.25 39.43 3a6o s ASN 300 CO 0.67 -1.28 1.97 1.55 -2.79 0.00 0.00 177.10 177.22 3a6o h PRO 301 N 11.20 0.35 -0.59 0.43 0.13 -1.85 0.18 132.00 141.83 3a6o h PRO 301 Ca -0.38 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.73 3a6o h PRO 301 Cb 1.18 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 3a6o h PRO 301 CO 0.98 0.23 0.37 0.93 -0.23 0.00 0.00 178.00 180.27 3a6o h GLU 302 N 0.36 0.80 -0.48 0.86 5.08 -1.93 0.27 114.58 119.54 3a6o h GLU 302 Ca 0.29 -0.07 -0.06 0.00 -1.00 0.00 0.00 59.36 58.52 3a6o h GLU 302 Cb 0.64 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 3a6o h GLU 302 CO -0.07 0.56 0.04 0.28 -1.00 0.00 0.00 179.01 178.81 3a6o h VAL 303 N 0.80 1.23 -0.08 3.13 2.07 -1.01 -1.54 116.25 120.85 3a6o h VAL 303 Ca 0.21 -0.92 -0.09 0.00 0.82 0.00 0.00 66.70 66.72 3a6o h VAL 303 Cb -0.04 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 3a6o h VAL 303 CO -0.04 0.33 -0.30 0.50 0.02 0.00 0.00 177.57 178.08 3a6o h LYS 304 N 0.73 0.35 -0.61 1.57 3.64 -0.66 -2.37 116.57 119.21 3a6o h LYS 304 Ca 0.15 -0.26 0.03 0.00 -1.27 0.00 0.00 60.65 59.30 3a6o h LYS 304 Cb 0.39 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.23 3a6o h LYS 304 CO 0.01 0.90 0.40 1.49 -2.27 0.00 0.00 179.45 179.98 3a6o h GLU 305 N -0.13 0.70 0.04 1.90 4.57 -0.25 0.23 114.58 121.64 3a6o h GLU 305 Ca -0.01 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.12 3a6o h GLU 305 Cb 0.94 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.37 3a6o h GLU 305 CO 0.06 0.46 -0.02 -0.92 -1.18 0.00 0.00 179.01 177.41 3a6o h TYR 306 N 0.72 -0.05 -0.62 0.92 5.03 -1.05 0.66 116.97 122.58 3a6o h TYR 306 Ca 0.24 -0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.50 3a6o h TYR 306 Cb 0.08 0.02 -0.03 0.00 1.55 0.00 0.00 36.73 38.35 3a6o h TYR 306 CO -0.00 0.27 0.17 -0.07 -1.32 0.00 0.00 178.16 177.21 3a6o h LEU 307 N -0.37 0.89 -0.87 2.82 3.38 -1.18 0.96 115.31 120.93 3a6o h LEU 307 Ca -0.01 -0.16 0.12 0.00 0.09 0.00 0.00 57.88 57.92 3a6o h LEU 307 Cb 0.34 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 40.78 3a6o h LEU 307 CO 0.01 0.84 0.50 -0.26 0.09 0.00 0.00 178.44 179.62 3a6o h PHE 308 N 0.91 0.90 -0.79 1.13 0.05 -0.86 -0.88 116.94 117.40 3a6o h PHE 308 Ca 0.20 0.03 -0.04 0.00 3.82 0.00 0.00 57.97 61.99 3a6o h PHE 308 Cb 0.29 -0.27 -0.04 0.00 2.00 0.00 0.00 35.95 37.93 3a6o h PHE 308 CO 0.02 0.32 0.35 -0.44 -0.18 0.00 0.00 178.31 178.38 3a6o h ASP 309 N 0.79 1.07 -0.79 2.17 3.45 0.15 -1.34 116.42 121.92 3a6o h ASP 309 Ca 0.44 -0.15 0.11 0.00 0.43 0.00 0.00 57.03 57.85 3a6o h ASP 309 Cb 0.48 -0.27 -0.08 0.00 -0.56 0.00 0.00 39.33 38.90 3a6o h ASP 309 CO -0.29 0.92 0.42 0.58 -1.57 0.00 0.00 179.24 179.31 3a6o h VAL 310 N 1.14 0.84 -0.08 -1.35 2.07 -0.74 -2.18 116.25 115.95 3a6o h VAL 310 Ca 0.27 -0.24 -0.15 0.00 0.82 0.00 0.00 66.70 67.40 3a6o h VAL 310 Cb 0.17 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 3a6o h VAL 310 CO -0.03 0.13 -0.62 0.00 0.02 0.00 0.00 177.57 177.07 3a6o h ALA 311 N 1.47 0.79 -0.26 1.67 0.00 -0.40 -2.06 119.26 120.48 3a6o h ALA 311 Ca 0.40 -0.55 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 3a6o h ALA 311 Cb 0.44 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3a6o h ALA 311 CO -0.28 0.73 -0.43 0.00 0.00 0.00 0.00 179.25 179.27 3a6o h ARG 312 N 0.21 0.64 0.89 0.00 3.08 -1.00 -2.31 114.38 115.89 3a6o h ARG 312 Ca -0.01 -0.34 -0.04 0.00 0.07 0.00 0.00 59.98 59.66 3a6o h ARG 312 Cb 1.14 0.01 0.01 0.00 0.08 0.00 0.00 29.97 31.21 3a6o h ARG 312 CO 0.10 0.94 -0.43 0.35 -1.07 0.00 0.00 179.97 179.86 3a6o h PHE 313 N 0.52 -1.10 0.00 3.04 3.04 -0.75 -0.22 116.94 121.46 3a6o h PHE 313 Ca 0.04 -0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.95 3a6o h PHE 313 Cb 0.95 0.37 -0.00 0.00 2.56 0.00 0.00 35.95 39.83 3a6o h PHE 313 CO 0.04 -0.69 -0.04 -1.49 -2.02 0.00 0.00 178.31 174.11 3a6o h TRP 314 N -1.25 0.00 0.00 0.41 4.06 -1.47 0.56 115.95 118.26 3a6o h TRP 314 Ca -0.12 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.82 3a6o h TRP 314 Cb 0.91 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.07 3a6o h TRP 314 CO 0.02 0.04 -0.02 0.52 -3.56 0.00 0.00 178.44 175.44 3a6o h MET 315 N 0.00 0.00 0.00 0.49 2.86 -0.84 -2.27 114.93 115.17 3a6o h MET 315 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3a6o h MET 315 Cb 0.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.84 3a6o h MET 315 CO 0.01 0.02 0.00 0.39 1.06 0.00 0.00 176.91 178.39 3a6o n GLU 316 N -3.11 0.13 -0.00 1.72 1.02 0.18 -2.33 120.64 118.26 3a6o n GLU 316 Ca 0.04 0.20 0.15 0.00 -0.02 0.00 0.00 57.16 57.53 3a6o n GLU 316 Cb 0.53 -1.68 0.77 0.00 -0.02 0.00 0.00 31.44 31.04 3a6o n GLU 316 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3a6o n GLN 317 N -1.91 1.25 -0.62 3.49 1.13 -0.86 -4.94 117.38 114.93 3a6o n GLN 317 Ca 0.05 -0.37 0.00 0.00 -1.94 0.00 0.00 57.00 54.74 3a6o n GLN 317 Cb 0.32 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.19 3a6o n GLN 317 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3a6o n GLY 318 N 1.06 0.67 3.27 1.08 0.00 -0.98 -4.94 105.19 105.34 3a6o n GLY 318 Ca 0.22 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 3a6o n GLY 318 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3a6o n ILE 319 N -2.62 0.00 -0.16 -0.61 -5.35 -1.25 -4.94 119.36 104.43 3a6o n ILE 319 Ca 0.00 -0.17 0.00 0.00 -0.27 0.00 0.00 62.75 62.31 3a6o n ILE 319 Cb 0.00 -0.93 0.00 0.00 -1.74 0.00 0.00 39.64 36.97 3a6o n ILE 319 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3a6o n ASP 320 N -4.99 0.93 0.00 7.28 8.00 0.26 -4.93 116.55 123.09 3a6o n ASP 320 Ca 0.09 -1.08 0.00 0.00 0.71 0.00 0.00 54.79 54.51 3a6o n ASP 320 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 3a6o n ASP 320 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3a6o n GLY 321 N -0.04 -0.48 3.12 0.44 0.00 -1.12 -0.98 105.19 106.13 3a6o n GLY 321 Ca 0.00 -1.33 -0.14 0.00 0.00 0.00 0.00 46.02 44.55 3a6o n GLY 321 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3a6o s TRP 322 N -2.90 0.88 -0.10 1.61 0.52 0.41 -0.92 118.94 118.43 3a6o s TRP 322 Ca 0.00 -0.57 0.03 0.00 0.02 0.00 0.00 56.10 55.58 3a6o s TRP 322 Cb 0.00 -0.51 0.01 0.00 -1.15 0.00 0.00 33.47 31.82 3a6o s TRP 322 CO 0.00 -0.05 -0.19 0.50 0.02 0.00 0.00 176.95 177.23 3a6o s ARG 323 N -2.11 2.59 -0.42 4.98 3.00 0.68 -1.28 118.95 126.40 3a6o s ARG 323 Ca -0.03 -0.71 -0.10 0.00 -1.00 0.00 0.00 55.73 53.89 3a6o s ARG 323 Cb -0.07 -2.05 0.07 0.00 0.00 0.00 0.00 34.95 32.90 3a6o s ARG 323 CO 0.00 0.06 0.26 -0.51 0.00 0.00 0.00 175.30 175.12 3a6o s LEU 324 N 0.63 5.12 0.34 -0.88 1.43 0.16 0.13 118.68 125.61 3a6o s LEU 324 Ca -0.13 -1.39 -0.27 0.00 -1.03 0.00 0.00 54.13 51.30 3a6o s LEU 324 Cb -0.16 -2.01 -0.09 0.00 0.03 0.00 0.00 46.19 43.95 3a6o s LEU 324 CO 0.04 -0.52 1.12 -0.62 0.23 0.00 0.00 176.35 176.60 3a6o s ASP 325 N 2.07 6.94 -1.31 2.29 -1.08 -0.70 -1.26 116.67 123.62 3a6o s ASP 325 Ca 0.03 2.27 -0.01 0.00 -0.52 0.00 0.00 52.55 54.32 3a6o s ASP 325 Cb -0.22 -2.62 0.00 0.00 -1.46 0.00 0.00 42.92 38.62 3a6o s ASP 325 CO 0.03 -0.37 0.03 0.52 0.52 0.00 0.00 175.17 175.90 3a6o n VAL 326 N 0.62 -0.91 0.21 1.11 0.31 -1.25 -4.36 118.33 114.06 3a6o n VAL 326 Ca 0.02 -0.43 0.04 0.00 -0.01 0.00 0.00 64.34 63.96 3a6o n VAL 326 Cb 0.46 -0.90 0.44 0.00 -0.91 0.00 0.00 33.84 32.93 3a6o n VAL 326 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3a6o h ALA 327 N 1.01 1.49 0.00 3.52 0.00 -1.35 -2.08 119.26 121.85 3a6o h ALA 327 Ca -0.56 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.09 3a6o h ALA 327 Cb 1.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3a6o h ALA 327 CO 0.60 0.35 0.00 0.27 0.00 0.00 0.00 179.25 180.47 3a6o n ASN 328 N -4.13 0.00 -0.38 0.00 6.94 -1.26 -2.30 115.26 114.13 3a6o n ASN 328 Ca -0.02 -1.34 0.04 0.00 -0.02 0.00 0.00 54.58 53.24 3a6o n ASN 328 Cb 0.33 0.00 0.08 0.00 -2.36 0.00 0.00 39.78 37.83 3a6o n ASN 328 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3a6o n GLU 329 N -0.73 2.19 -4.26 -3.83 1.02 -0.78 -4.95 120.64 109.29 3a6o n GLU 329 Ca 0.10 -1.62 -0.32 0.00 -0.02 0.00 0.00 57.16 55.29 3a6o n GLU 329 Cb 0.04 -1.16 -0.09 0.00 -0.02 0.00 0.00 31.44 30.22 3a6o n GLU 329 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3a6o s VAL 330 N -0.90 4.20 0.93 2.62 -7.23 -0.97 -5.03 120.40 114.02 3a6o s VAL 330 Ca 0.13 -0.60 -0.10 0.00 -1.81 0.00 0.00 61.98 59.60 3a6o s VAL 330 Cb 0.07 -2.88 0.15 0.00 0.56 0.00 0.00 36.38 34.28 3a6o s VAL 330 CO 0.10 0.36 1.14 1.51 -0.31 0.00 0.00 175.10 177.90 3a6o s ASP 331 N -1.61 2.82 0.16 4.85 -4.77 -1.26 -4.88 116.67 111.98 3a6o s ASP 331 Ca 0.20 2.16 -0.03 0.00 -3.30 0.00 0.00 52.55 51.58 3a6o s ASP 331 Cb -0.12 -2.56 0.01 0.00 -1.09 0.00 0.00 42.92 39.17 3a6o s ASP 331 CO 0.11 -3.16 1.40 0.45 0.70 0.00 0.00 175.17 174.67 3a6o h HIS 332 N -1.91 0.64 -0.42 2.11 3.86 -1.99 -2.97 115.15 114.47 3a6o h HIS 332 Ca -0.44 -0.29 0.00 0.00 -1.16 0.00 0.00 60.37 58.48 3a6o h HIS 332 Cb 1.27 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 29.62 3a6o h HIS 332 CO 0.49 1.06 0.26 0.00 0.86 0.00 0.00 177.93 180.61 3a6o h ALA 333 N 0.86 0.53 -0.48 2.45 0.00 -1.99 0.33 119.26 120.96 3a6o h ALA 333 Ca -0.04 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 54.92 3a6o h ALA 333 Cb 1.34 -0.17 -0.09 0.00 0.00 0.00 0.00 17.79 18.86 3a6o h ALA 333 CO 0.13 0.01 -0.15 0.35 0.00 0.00 0.00 179.25 179.59 3a6o h PHE 334 N 0.56 -0.36 -0.37 0.00 3.04 -1.89 -0.67 116.94 117.25 3a6o h PHE 334 Ca 0.15 0.05 -0.13 0.00 3.98 0.00 0.00 57.97 62.02 3a6o h PHE 334 Cb -0.03 0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.70 3a6o h PHE 334 CO -0.04 -0.24 -0.30 -1.49 -2.02 0.00 0.00 178.31 174.22 3a6o h TRP 335 N -0.04 0.93 -0.81 0.41 -0.00 -0.95 0.47 115.95 115.94 3a6o h TRP 335 Ca 0.23 -0.24 -0.04 0.00 -0.00 0.00 0.00 58.89 58.84 3a6o h TRP 335 Cb 0.40 -0.21 -0.04 0.00 -0.00 0.00 0.00 29.16 29.31 3a6o h TRP 335 CO -0.44 0.99 0.36 0.00 -0.00 0.00 0.00 178.44 179.36 3a6o h ARG 336 N 0.68 1.19 -0.03 0.49 3.08 -0.13 -1.16 114.38 118.50 3a6o h ARG 336 Ca 0.08 -0.19 -0.24 0.00 0.07 0.00 0.00 59.98 59.69 3a6o h ARG 336 Cb 0.83 -0.21 0.01 0.00 0.08 0.00 0.00 29.97 30.69 3a6o h ARG 336 CO 0.07 0.93 -0.95 0.93 -1.07 0.00 0.00 179.97 179.89 3a6o h GLU 337 N 1.17 0.63 -0.14 0.04 5.08 -0.51 -1.45 114.58 119.40 3a6o h GLU 337 Ca 0.28 -0.63 0.05 0.00 -1.00 0.00 0.00 59.36 58.05 3a6o h GLU 337 Cb 0.16 0.17 -0.06 0.00 0.50 0.00 0.00 28.75 29.51 3a6o h GLU 337 CO -0.03 1.24 -0.28 0.35 -1.00 0.00 0.00 179.01 179.29 3a6o h PHE 338 N 0.37 -0.75 -0.87 4.33 3.57 -0.01 0.23 116.94 123.81 3a6o h PHE 338 Ca -0.10 0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.59 3a6o h PHE 338 Cb 1.59 0.35 -0.10 0.00 2.79 0.00 0.00 35.95 40.58 3a6o h PHE 338 CO 0.08 -0.36 0.45 -0.09 -2.23 0.00 0.00 178.31 176.17 3a6o h ARG 339 N -0.34 0.61 -0.06 1.11 2.43 -1.15 0.14 114.38 117.12 3a6o h ARG 339 Ca 0.10 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 3a6o h ARG 339 Cb 0.50 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.91 3a6o h ARG 339 CO -0.33 0.40 0.02 0.00 -1.51 0.00 0.00 179.97 178.55 3a6o h ARG 340 N 0.63 0.09 0.81 0.20 3.08 0.05 0.13 114.38 119.38 3a6o h ARG 340 Ca 0.48 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.47 3a6o h ARG 340 Cb 0.70 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.74 3a6o h ARG 340 CO -0.37 0.28 -0.39 1.25 -1.07 0.00 0.00 179.97 179.66 3a6o h LEU 341 N -0.11 -0.92 -0.67 3.04 6.46 -0.23 -0.99 115.31 121.88 3a6o h LEU 341 Ca 0.02 0.03 0.12 0.00 -0.12 0.00 0.00 57.88 57.93 3a6o h LEU 341 Cb 0.22 0.24 -0.12 0.00 -0.73 0.00 0.00 40.66 40.27 3a6o h LEU 341 CO -0.00 -0.62 -0.34 0.58 -0.62 0.00 0.00 178.44 177.44 3a6o h VAL 342 N -1.17 0.14 -0.04 1.05 2.07 -0.71 -0.32 116.25 117.27 3a6o h VAL 342 Ca -0.11 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.36 3a6o h VAL 342 Cb 0.83 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 3a6o h VAL 342 CO 0.18 0.00 -0.20 0.11 0.02 0.00 0.00 177.57 177.68 3a6o h LYS 343 N -0.13 0.07 -0.36 1.57 1.79 -0.72 0.05 116.57 118.85 3a6o h LYS 343 Ca 0.26 -0.02 -0.13 0.00 -2.18 0.00 0.00 60.65 58.58 3a6o h LYS 343 Cb 0.56 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.19 3a6o h LYS 343 CO -0.74 0.27 -0.30 0.66 -1.08 0.00 0.00 179.45 178.26 3a6o h SER 344 N 0.07 0.80 0.93 0.86 4.64 0.23 -2.63 113.55 118.44 3a6o h SER 344 Ca 0.01 -0.32 -0.18 0.00 -0.47 0.00 0.00 61.79 60.83 3a6o h SER 344 Cb 0.40 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.24 3a6o h SER 344 CO 0.03 1.05 -0.85 -0.07 -0.87 0.00 0.00 176.83 176.11 3a6o h LEU 345 N 0.65 0.00 -6.04 5.97 4.07 -0.17 -3.43 115.31 116.36 3a6o h LEU 345 Ca 0.07 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.02 3a6o h LEU 345 Cb 0.84 0.00 -0.22 0.00 1.08 0.00 0.00 40.66 42.36 3a6o h LEU 345 CO 0.07 0.85 -0.41 0.21 -1.08 0.00 0.00 178.44 178.08 3a6o s ASN 346 N -6.72 -1.34 0.58 -0.43 3.04 -0.09 -5.03 114.94 104.95 3a6o s ASN 346 Ca 0.01 -0.03 0.29 0.00 0.04 0.00 0.00 52.86 53.17 3a6o s ASN 346 Cb 0.11 1.90 1.47 0.00 -1.54 0.00 0.00 41.25 43.18 3a6o s ASN 346 CO 0.80 -0.29 1.89 -0.65 -3.04 0.00 0.00 177.10 175.81 3a6o h PRO 347 N 7.88 0.00 -0.02 0.43 0.11 -1.70 0.18 132.00 138.89 3a6o h PRO 347 Ca -0.01 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3a6o h PRO 347 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3a6o h PRO 347 CO 0.16 0.00 -0.09 -0.25 -0.21 0.00 0.00 178.00 177.61 3a6o n ASP 348 N -3.76 1.83 -4.68 -2.05 8.00 -1.26 -4.69 116.55 109.94 3a6o n ASP 348 Ca 0.09 -1.52 -0.44 0.00 0.71 0.00 0.00 54.79 53.63 3a6o n ASP 348 Cb 0.70 0.06 -0.04 0.00 -0.02 0.00 0.00 41.12 41.82 3a6o n ASP 348 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3a6o n ALA 349 N 0.30 1.59 -2.19 2.24 0.00 0.64 -4.84 120.51 118.27 3a6o n ALA 349 Ca 0.16 0.29 -0.31 0.00 0.00 0.00 0.00 53.44 53.58 3a6o n ALA 349 Cb 0.42 -2.57 -0.05 0.00 0.00 0.00 0.00 19.45 17.26 3a6o n ALA 349 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3a6o s LEU 350 N 3.36 3.98 -0.11 0.00 2.96 -0.15 -4.89 118.68 123.83 3a6o s LEU 350 Ca 0.86 1.18 -0.02 0.00 -0.22 0.00 0.00 54.13 55.94 3a6o s LEU 350 Cb -0.55 -4.01 0.04 0.00 0.50 0.00 0.00 46.19 42.17 3a6o s LEU 350 CO 0.42 -0.27 -0.00 -0.63 -1.32 0.00 0.00 176.35 174.55 3a6o s ILE 351 N -2.13 0.54 -0.07 6.68 1.01 -1.26 -0.45 121.20 125.52 3a6o s ILE 351 Ca 0.52 -0.15 0.02 0.00 0.00 0.00 0.00 60.65 61.04 3a6o s ILE 351 Cb -0.10 -0.77 0.02 0.00 0.01 0.00 0.00 42.46 41.61 3a6o s ILE 351 CO 0.23 0.14 -0.10 -0.69 0.00 0.00 0.00 174.94 174.53 3a6o s VAL 352 N 1.89 0.99 0.10 2.92 1.01 -0.41 -0.71 120.40 126.20 3a6o s VAL 352 Ca 0.03 -0.37 0.01 0.00 0.00 0.00 0.00 61.98 61.66 3a6o s VAL 352 Cb -0.14 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 3a6o s VAL 352 CO -0.06 0.33 0.24 -0.83 0.00 0.00 0.00 175.10 174.78 3a6o s GLY 353 N 0.91 1.95 -0.78 4.51 0.00 -0.38 0.36 107.32 113.88 3a6o s GLY 353 Ca -0.10 -0.94 -0.10 0.00 0.00 0.00 0.00 44.72 43.57 3a6o s GLY 353 CO 0.01 -0.93 0.68 1.85 0.00 0.00 0.00 173.10 174.71 3a6o s GLU 354 N -2.86 3.30 -0.04 2.90 2.12 -0.39 -1.76 118.70 121.97 3a6o s GLU 354 Ca 0.35 -2.54 0.03 0.00 0.36 0.00 0.00 54.97 53.17 3a6o s GLU 354 Cb -0.12 -4.21 0.00 0.00 0.26 0.00 0.00 34.13 30.06 3a6o s GLU 354 CO 0.28 -1.25 -0.13 0.42 -0.54 0.00 0.00 175.26 174.04 3a6o s ILE 355 N -0.01 1.11 -0.14 -3.70 1.01 -1.26 -2.89 121.20 115.32 3a6o s ILE 355 Ca 0.18 -0.53 0.17 0.00 0.00 0.00 0.00 60.65 60.47 3a6o s ILE 355 Cb -0.13 -0.98 -0.24 0.00 0.01 0.00 0.00 42.46 41.12 3a6o s ILE 355 CO -0.07 0.33 0.32 0.79 0.00 0.00 0.00 174.94 176.31 3a6o n TRP 356 N 3.30 0.34 -1.35 3.97 7.02 -1.26 -4.52 117.44 124.94 3a6o n TRP 356 Ca -0.19 0.12 0.00 0.00 -1.02 0.00 0.00 57.50 56.41 3a6o n TRP 356 Cb 0.53 -1.01 0.00 0.00 -2.42 0.00 0.00 31.31 28.41 3a6o n TRP 356 CO 0.00 0.00 0.00 -2.39 -2.02 0.00 0.00 177.69 173.28 3a6o n HIS 357 N -2.79 -1.18 -1.77 -5.99 1.44 -1.26 -4.19 115.22 99.48 3a6o n HIS 357 Ca -0.24 0.00 -0.39 0.00 -2.01 0.00 0.00 57.72 55.07 3a6o n HIS 357 Cb 1.05 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 31.13 3a6o n HIS 357 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 3a6o s ASP 358 N -1.00 5.10 -0.08 4.39 3.68 -1.26 -4.81 116.67 122.69 3a6o s ASP 358 Ca 0.00 1.10 0.04 0.00 2.13 0.00 0.00 52.55 55.82 3a6o s ASP 358 Cb 0.00 -2.51 0.23 0.00 -1.45 0.00 0.00 42.92 39.19 3a6o s ASP 358 CO 0.00 -2.37 0.92 0.00 0.13 0.00 0.00 175.17 173.85 3a6o n ALA 359 N 13.30 2.97 -0.03 3.66 0.00 -1.26 -4.53 120.51 134.62 3a6o n ALA 359 Ca 0.29 -0.60 0.20 0.00 0.00 0.00 0.00 53.44 53.33 3a6o n ALA 359 Cb 0.51 -1.05 0.67 0.00 0.00 0.00 0.00 19.45 19.57 3a6o n ALA 359 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3a6o h SER 360 N 1.05 0.06 0.63 0.00 4.64 -1.88 -1.72 113.55 116.33 3a6o h SER 360 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3a6o h SER 360 Cb 1.01 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 3a6o h SER 360 CO 0.17 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.77 3a6o n GLY 361 N -1.63 -1.32 0.57 -0.77 0.00 -1.26 -2.09 105.19 98.70 3a6o n GLY 361 Ca 0.11 -0.14 0.05 0.00 0.00 0.00 0.00 46.02 46.04 3a6o n GLY 361 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3a6o n TRP 362 N -1.32 0.32 -2.50 1.61 8.01 -0.66 -4.70 117.44 118.20 3a6o n TRP 362 Ca 0.13 -0.35 -0.23 0.00 -1.31 0.00 0.00 57.50 55.74 3a6o n TRP 362 Cb 0.26 -0.02 0.01 0.00 -2.01 0.00 0.00 31.31 29.54 3a6o n TRP 362 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 3a6o n LEU 363 N 0.53 4.09 -0.00 -0.99 4.77 -0.89 -2.55 117.00 121.96 3a6o n LEU 363 Ca 0.10 -4.91 0.07 0.00 -0.03 0.00 0.00 56.01 51.24 3a6o n LEU 363 Cb 0.38 -0.29 -0.10 0.00 -2.33 0.00 0.00 43.42 41.08 3a6o n LEU 363 CO 0.07 2.10 -0.46 0.23 -1.33 0.00 0.00 177.39 178.01 3a6o n MET 364 N -0.41 1.10 0.00 3.23 2.81 -1.26 -4.37 117.12 118.22 3a6o n MET 364 Ca 0.33 -0.09 0.00 0.00 -1.81 0.00 0.00 57.70 56.14 3a6o n MET 364 Cb 0.70 -1.28 0.00 0.00 -0.71 0.00 0.00 33.22 31.93 3a6o n MET 364 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3a6o n GLY 365 N 1.57 0.29 0.14 3.03 0.00 -1.26 -4.70 105.19 104.25 3a6o n GLY 365 Ca -0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.02 3a6o n GLY 365 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3a6o n ASP 366 N 0.00 2.18 0.00 1.61 5.68 -1.26 -4.80 116.55 119.96 3a6o n ASP 366 Ca 0.00 -1.99 0.00 0.00 -0.50 0.00 0.00 54.79 52.30 3a6o n ASP 366 Cb 0.00 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 39.93 3a6o n ASP 366 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3a6o n GLN 367 N -0.28 0.00 -2.74 0.11 6.02 -1.26 -4.10 117.38 115.13 3a6o n GLN 367 Ca 0.02 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 56.65 3a6o n GLN 367 Cb 0.28 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.48 3a6o n GLN 367 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3a6o s PHE 368 N 1.30 3.57 0.12 1.08 2.99 -1.06 -4.75 117.98 121.23 3a6o s PHE 368 Ca 0.00 1.74 0.16 0.00 0.00 0.00 0.00 56.93 58.83 3a6o s PHE 368 Cb 0.00 -2.96 0.46 0.00 0.00 0.00 0.00 43.02 40.53 3a6o s PHE 368 CO 0.00 0.01 1.63 -0.44 -0.00 0.00 0.00 175.22 176.43 3a6o h ASP 369 N 2.92 0.00 -5.46 1.36 3.32 -1.22 -3.43 116.42 113.91 3a6o h ASP 369 Ca -0.47 0.00 0.21 0.00 0.02 0.00 0.00 57.03 56.79 3a6o h ASP 369 Cb 1.19 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.66 3a6o h ASP 369 CO 0.64 0.47 0.59 -0.55 -1.72 0.00 0.00 179.24 178.68 3a6o s SER 370 N -6.51 -0.11 0.21 6.45 0.15 -0.80 -4.68 113.70 108.40 3a6o s SER 370 Ca 0.01 -0.39 0.01 0.00 0.70 0.00 0.00 55.95 56.28 3a6o s SER 370 Cb 0.10 0.41 -0.05 0.00 -1.71 0.00 0.00 66.02 64.78 3a6o s SER 370 CO 0.72 -0.77 0.05 0.68 1.20 0.00 0.00 173.24 175.12 3a6o s VAL 371 N -2.85 0.56 -0.34 4.45 -7.23 -1.26 -1.25 120.40 112.48 3a6o s VAL 371 Ca 0.15 -1.99 -0.29 0.00 -1.81 0.00 0.00 61.98 58.04 3a6o s VAL 371 Cb -0.00 -2.35 -0.00 0.00 0.56 0.00 0.00 36.38 34.58 3a6o s VAL 371 CO 0.01 -0.25 1.44 -0.04 -0.31 0.00 0.00 175.10 175.96 3a6o s MET 372 N -3.99 3.70 -1.38 4.82 -1.94 -0.72 -1.29 119.30 118.49 3a6o s MET 372 Ca 0.31 1.20 -0.15 0.00 -1.71 0.00 0.00 55.69 55.33 3a6o s MET 372 Cb 0.07 -3.99 0.06 0.00 2.01 0.00 0.00 34.83 32.98 3a6o s MET 372 CO 0.08 -1.40 2.01 -1.71 -0.01 0.00 0.00 175.02 173.99 3a6o n ASN 373 N 8.49 4.37 0.23 3.03 2.85 0.44 -4.62 115.26 130.04 3a6o n ASN 373 Ca 0.17 -2.89 0.15 0.00 -0.11 0.00 0.00 54.58 51.90 3a6o n ASN 373 Cb 0.47 -1.68 0.80 0.00 1.24 0.00 0.00 39.78 40.60 3a6o n ASN 373 CO 0.00 0.00 0.00 1.88 -2.11 0.00 0.00 177.26 177.03 3a6o h TYR 374 N 6.62 0.00 0.79 1.20 -1.99 -1.82 -2.02 116.97 119.76 3a6o h TYR 374 Ca 0.51 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 61.20 3a6o h TYR 374 Cb 0.73 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.47 3a6o h TYR 374 CO 1.43 0.00 -0.44 -0.07 -0.00 0.00 0.00 178.16 179.08 3a6o h LEU 375 N 0.00 -1.09 -0.87 3.88 -0.00 -1.85 -0.81 115.31 114.58 3a6o h LEU 375 Ca 0.05 0.05 0.17 0.00 -0.00 0.00 0.00 57.88 58.16 3a6o h LEU 375 Cb 0.27 0.30 -0.16 0.00 -0.00 0.00 0.00 40.66 41.07 3a6o h LEU 375 CO -0.00 -0.71 -0.22 0.33 -0.00 0.00 0.00 178.44 177.84 3a6o n PHE 376 N -5.59 0.31 -0.27 1.13 -0.00 -0.80 -0.14 117.46 112.09 3a6o n PHE 376 Ca -0.15 1.06 -0.05 0.00 -0.00 0.00 0.00 57.45 58.32 3a6o n PHE 376 Cb 0.47 -1.00 0.10 0.00 -0.00 0.00 0.00 39.48 39.05 3a6o n PHE 376 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.76 176.67 3a6o h ARG 377 N 0.00 1.13 -0.05 -4.13 2.43 -0.87 -2.18 114.38 110.72 3a6o h ARG 377 Ca 0.41 -0.19 0.03 0.00 -0.81 0.00 0.00 59.98 59.43 3a6o h ARG 377 Cb 0.63 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.95 3a6o h ARG 377 CO -0.90 0.90 -0.19 0.93 -1.51 0.00 0.00 179.97 179.21 3a6o h GLU 378 N 1.11 -0.27 -0.81 0.20 5.08 0.87 0.57 114.58 121.33 3a6o h GLU 378 Ca 0.26 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.67 3a6o h GLU 378 Cb 0.18 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 3a6o h GLU 378 CO -0.02 -0.18 0.54 0.77 -1.00 0.00 0.00 179.01 179.11 3a6o h SER 379 N -0.28 0.88 -0.39 1.42 0.02 -1.32 0.13 113.55 114.02 3a6o h SER 379 Ca 0.07 -0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 60.90 3a6o h SER 379 Cb 0.38 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 3a6o h SER 379 CO -0.21 0.61 -0.17 0.58 -1.14 0.00 0.00 176.83 176.51 3a6o h VAL 380 N 1.03 1.28 0.30 2.27 2.07 -0.72 -2.38 116.25 120.10 3a6o h VAL 380 Ca 0.32 -1.29 -0.01 0.00 0.82 0.00 0.00 66.70 66.53 3a6o h VAL 380 Cb 0.00 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 3a6o h VAL 380 CO -0.09 0.43 -0.14 0.40 0.02 0.00 0.00 177.57 178.19 3a6o h ILE 381 N 0.60 0.72 0.00 4.57 1.08 -0.33 0.29 117.51 124.45 3a6o h ILE 381 Ca 0.09 -0.13 0.00 0.00 -0.39 0.00 0.00 64.86 64.43 3a6o h ILE 381 Cb 0.71 0.79 0.00 0.00 -3.07 0.00 0.00 36.82 35.26 3a6o h ILE 381 CO 0.05 0.03 0.00 -2.11 -0.69 0.00 0.00 178.15 175.43 3a6o n ARG 382 N -5.24 0.46 -0.11 2.37 1.85 0.39 -0.78 116.66 115.60 3a6o n ARG 382 Ca -0.10 0.03 -0.24 0.00 -1.00 0.00 0.00 57.85 56.55 3a6o n ARG 382 Cb 0.20 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 30.03 3a6o n ARG 382 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 3a6o n PHE 383 N -1.23 0.00 -0.02 2.89 7.35 -0.90 -1.20 117.46 124.35 3a6o n PHE 383 Ca 0.14 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 56.89 3a6o n PHE 383 Cb 0.18 -0.78 -0.16 0.00 0.35 0.00 0.00 39.48 39.07 3a6o n PHE 383 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 3a6o n PHE 384 N -3.98 0.05 0.00 -5.13 3.01 0.06 -4.12 117.46 107.35 3a6o n PHE 384 Ca -0.43 0.02 0.00 0.00 1.01 0.00 0.00 57.45 58.04 3a6o n PHE 384 Cb 0.81 -0.62 0.00 0.00 -0.01 0.00 0.00 39.48 39.65 3a6o n PHE 384 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3a6o n ALA 385 N -2.36 0.00 0.14 4.37 0.00 -0.81 -4.69 120.51 117.17 3a6o n ALA 385 Ca -0.10 -0.10 0.02 0.00 0.00 0.00 0.00 53.44 53.26 3a6o n ALA 385 Cb 0.69 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.16 3a6o n ALA 385 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3a6o h THR 386 N 0.00 0.92 -0.05 0.00 1.35 -1.13 -3.43 112.91 110.57 3a6o h THR 386 Ca 0.00 -2.28 -0.02 0.00 -0.55 0.00 0.00 66.41 63.56 3a6o h THR 386 Cb 0.00 2.44 -0.01 0.00 -1.73 0.00 0.00 68.15 68.85 3a6o h THR 386 CO 0.00 0.52 -0.02 0.61 -0.25 0.00 0.00 175.52 176.38 3a6o n GLY 387 N 1.20 0.36 0.46 5.82 0.00 -0.99 -4.90 105.19 107.15 3a6o n GLY 387 Ca 0.02 -0.06 0.28 0.00 0.00 0.00 0.00 46.02 46.26 3a6o n GLY 387 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3a6o h GLU 388 N 0.47 0.18 -6.53 1.61 5.08 -1.46 -3.42 114.58 110.50 3a6o h GLU 388 Ca -0.02 -0.01 -0.64 0.00 -1.00 0.00 0.00 59.36 57.69 3a6o h GLU 388 Cb 0.49 -0.04 -0.16 0.00 0.50 0.00 0.00 28.75 29.54 3a6o h GLU 388 CO 0.03 0.12 -0.78 0.96 -1.00 0.00 0.00 179.01 178.34 3a6o s ILE 389 N -5.20 2.75 0.30 3.13 -4.36 -0.77 -5.04 121.20 112.02 3a6o s ILE 389 Ca -0.07 -1.86 0.04 0.00 -0.26 0.00 0.00 60.65 58.50 3a6o s ILE 389 Cb 0.24 -2.34 0.05 0.00 1.25 0.00 0.00 42.46 41.66 3a6o s ILE 389 CO 0.80 -0.12 0.42 0.00 0.24 0.00 0.00 174.94 176.28 3a6o n HIS 390 N 0.15 -2.73 0.26 1.37 1.44 -1.26 -4.65 115.22 109.80 3a6o n HIS 390 Ca -0.12 -1.02 0.14 0.00 -2.01 0.00 0.00 57.72 54.71 3a6o n HIS 390 Cb 0.56 -0.29 0.71 0.00 0.12 0.00 0.00 29.99 31.09 3a6o n HIS 390 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3a6o h ALA 391 N 0.17 1.13 0.04 1.59 0.00 -1.82 -1.90 119.26 118.46 3a6o h ALA 391 Ca -0.14 -0.10 -0.33 0.00 0.00 0.00 0.00 54.91 54.34 3a6o h ALA 391 Cb 0.62 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 3a6o h ALA 391 CO 0.19 0.14 -1.91 0.39 0.00 0.00 0.00 179.25 178.06 3a6o n GLU 392 N -3.41 0.68 -0.26 0.00 1.02 -1.26 -2.52 120.64 114.89 3a6o n GLU 392 Ca -0.01 0.25 -0.06 0.00 -0.02 0.00 0.00 57.16 57.32 3a6o n GLU 392 Cb 0.28 -1.73 0.05 0.00 -0.02 0.00 0.00 31.44 30.02 3a6o n GLU 392 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 3a6o h ARG 393 N 0.02 1.05 -0.31 3.49 2.43 -1.89 -2.47 114.38 116.70 3a6o h ARG 393 Ca -0.37 -0.18 0.07 0.00 -0.81 0.00 0.00 59.98 58.69 3a6o h ARG 393 Cb 2.04 -0.18 -0.08 0.00 -0.42 0.00 0.00 29.97 31.33 3a6o h ARG 393 CO 0.07 0.85 -0.28 0.35 -1.51 0.00 0.00 179.97 179.45 3a6o h PHE 394 N 1.01 -0.77 -1.00 2.20 -0.00 -1.41 0.40 116.94 117.37 3a6o h PHE 394 Ca 0.24 0.05 0.15 0.00 -0.00 0.00 0.00 57.97 58.41 3a6o h PHE 394 Cb 0.17 0.39 -0.09 0.00 -0.00 0.00 0.00 35.95 36.42 3a6o h PHE 394 CO 0.01 -0.35 0.62 0.22 -0.00 0.00 0.00 178.31 178.81 3a6o h ASP 395 N -0.26 0.86 -0.43 0.41 -0.00 -1.42 0.26 116.42 115.84 3a6o h ASP 395 Ca 0.16 0.07 -0.14 0.00 -0.00 0.00 0.00 57.03 57.11 3a6o h ASP 395 Cb 0.51 -0.10 -0.01 0.00 -0.00 0.00 0.00 39.33 39.73 3a6o h ASP 395 CO -0.46 0.40 -0.28 0.00 -0.00 0.00 0.00 179.24 178.89 3a6o h ALA 396 N 1.59 0.62 -0.02 -0.78 0.00 -0.61 -2.01 119.26 118.04 3a6o h ALA 396 Ca 0.53 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3a6o h ALA 396 Cb 0.67 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3a6o h ALA 396 CO -0.32 0.65 -0.00 0.93 0.00 0.00 0.00 179.25 180.51 3a6o h GLU 397 N 0.79 0.04 -0.48 0.00 5.08 0.52 0.16 114.58 120.70 3a6o h GLU 397 Ca 0.09 -0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.53 3a6o h GLU 397 Cb 0.87 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.02 3a6o h GLU 397 CO 0.08 0.36 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.28 3a6o h LEU 398 N -0.28 -0.41 -0.15 1.33 4.07 -0.51 -1.86 115.31 117.50 3a6o h LEU 398 Ca 0.01 0.14 -0.10 0.00 0.08 0.00 0.00 57.88 58.00 3a6o h LEU 398 Cb 0.35 0.28 0.00 0.00 1.08 0.00 0.00 40.66 42.37 3a6o h LEU 398 CO 0.00 -0.15 -0.32 0.74 -1.08 0.00 0.00 178.44 177.64 3a6o h THR 399 N 0.01 1.36 -0.41 0.22 2.02 -1.15 0.37 112.91 115.34 3a6o h THR 399 Ca 0.23 -1.58 -0.01 0.00 0.77 0.00 0.00 66.41 65.82 3a6o h THR 399 Cb 0.35 2.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.75 3a6o h THR 399 CO -0.48 0.47 0.22 -0.09 0.37 0.00 0.00 175.52 176.02 3a6o h ARG 400 N 0.09 0.57 -0.46 6.66 2.43 -0.67 -1.97 114.38 121.02 3a6o h ARG 400 Ca 0.00 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3a6o h ARG 400 Cb 0.92 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 30.33 3a6o h ARG 400 CO 0.07 0.46 0.30 0.00 -1.51 0.00 0.00 179.97 179.29 3a6o h ALA 401 N 1.07 0.58 -0.98 2.80 0.00 -1.14 -2.55 119.26 119.05 3a6o h ALA 401 Ca 0.14 -0.03 0.27 0.00 0.00 0.00 0.00 54.91 55.30 3a6o h ALA 401 Cb 0.06 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 3a6o h ALA 401 CO -0.02 0.01 0.69 -0.09 0.00 0.00 0.00 179.25 179.84 3a6o h ARG 402 N 0.60 0.12 -0.02 0.00 2.43 -0.46 -2.11 114.38 114.94 3a6o h ARG 402 Ca 0.17 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 3a6o h ARG 402 Cb -0.05 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 3a6o h ARG 402 CO -0.05 0.08 0.00 -1.33 -1.51 0.00 0.00 179.97 177.16 3a6o n MET 403 N -4.34 1.80 0.08 0.20 2.81 -0.78 -4.19 117.12 112.70 3a6o n MET 403 Ca 0.21 -1.16 -0.10 0.00 -1.81 0.00 0.00 57.70 54.85 3a6o n MET 403 Cb 0.97 -1.48 -0.05 0.00 -0.71 0.00 0.00 33.22 31.96 3a6o n MET 403 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 3a6o h LEU 404 N 2.82 0.25 -9.33 4.03 5.85 -1.37 -3.46 115.31 114.10 3a6o h LEU 404 Ca 0.00 -0.22 -0.54 0.00 0.84 0.00 0.00 57.88 57.96 3a6o h LEU 404 Cb 0.60 -0.08 -0.14 0.00 0.37 0.00 0.00 40.66 41.41 3a6o h LEU 404 CO 0.00 1.07 -0.64 -0.31 -0.34 0.00 0.00 178.44 178.22 3a6o s TYR 405 N -3.03 2.16 0.60 1.25 4.12 -1.26 -4.74 117.35 116.45 3a6o s TYR 405 Ca -0.02 -0.72 -0.18 0.00 0.02 0.00 0.00 57.07 56.16 3a6o s TYR 405 Cb 0.10 -1.35 -0.03 0.00 -1.52 0.00 0.00 41.96 39.15 3a6o s TYR 405 CO 0.84 0.31 1.20 -2.14 0.02 0.00 0.00 175.55 175.78 3a6o s PRO 406 N -3.74 2.92 0.26 -1.71 0.02 -1.26 -4.75 135.00 126.74 3a6o s PRO 406 Ca 0.33 1.79 -0.01 0.00 0.02 0.00 0.00 61.00 63.13 3a6o s PRO 406 Cb 0.06 -1.93 0.51 0.00 0.02 0.00 0.00 34.50 33.16 3a6o s PRO 406 CO 0.15 -1.23 1.78 1.05 -0.33 0.00 0.00 177.00 178.42 3a6o h GLU 407 N 0.78 0.70 -0.96 5.54 4.11 -1.95 -1.16 114.58 121.64 3a6o h GLU 407 Ca -0.50 -0.04 0.16 0.00 0.07 0.00 0.00 59.36 59.05 3a6o h GLU 407 Cb 1.29 -0.16 -0.08 0.00 0.50 0.00 0.00 28.75 30.30 3a6o h GLU 407 CO 0.55 0.46 0.61 1.96 0.07 0.00 0.00 179.01 182.65 3a6o h GLN 408 N 0.72 0.74 0.62 1.06 7.50 -1.92 -0.01 115.11 123.82 3a6o h GLN 408 Ca 0.45 -0.04 -0.03 0.00 0.50 0.00 0.00 58.65 59.53 3a6o h GLN 408 Cb 0.57 -0.17 0.01 0.00 0.05 0.00 0.00 27.48 27.94 3a6o h GLN 408 CO -0.32 0.49 -0.30 0.00 -1.50 0.00 0.00 178.83 177.20 3a6o h ALA 409 N 1.60 -0.83 -0.17 3.87 0.00 -1.50 -3.34 119.26 118.89 3a6o h ALA 409 Ca 0.50 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.26 3a6o h ALA 409 Cb 0.76 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3a6o h ALA 409 CO -0.27 -0.82 0.14 0.00 0.00 0.00 0.00 179.25 178.30 3a6o h ALA 410 N -0.99 2.00 -0.90 0.00 0.00 -0.57 -1.53 119.26 117.26 3a6o h ALA 410 Ca -0.08 -0.01 0.16 0.00 0.00 0.00 0.00 54.91 54.98 3a6o h ALA 410 Cb 0.68 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 3a6o h ALA 410 CO 0.14 -0.23 0.58 0.37 0.00 0.00 0.00 179.25 180.12 3a6o h GLN 411 N 0.00 0.62 0.00 0.00 5.75 -1.20 -3.27 115.11 117.00 3a6o h GLN 411 Ca 0.08 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.53 3a6o h GLN 411 Cb 0.36 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.75 3a6o h GLN 411 CO -0.00 0.41 -0.25 0.41 -2.65 0.00 0.00 178.83 176.75 3a6o n GLY 412 N -1.44 3.84 3.66 2.39 0.00 -0.62 -3.14 105.19 109.88 3a6o n GLY 412 Ca 0.18 -0.93 -0.45 0.00 0.00 0.00 0.00 46.02 44.83 3a6o n GLY 412 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3a6o n LEU 413 N -0.99 2.85 -4.57 0.99 4.32 -0.95 -4.45 117.00 114.19 3a6o n LEU 413 Ca 0.13 1.16 -0.42 0.00 -0.02 0.00 0.00 56.01 56.86 3a6o n LEU 413 Cb 0.69 -1.40 -0.03 0.00 -1.62 0.00 0.00 43.42 41.07 3a6o n LEU 413 CO -0.00 -0.70 1.17 0.26 -1.22 0.00 0.00 177.39 176.90 3a6o s TRP 414 N -0.41 2.39 -0.50 -1.77 0.52 -0.41 0.15 118.94 118.90 3a6o s TRP 414 Ca 0.65 0.30 -0.19 0.00 0.02 0.00 0.00 56.10 56.87 3a6o s TRP 414 Cb -0.66 -4.51 0.05 0.00 -1.15 0.00 0.00 33.47 27.20 3a6o s TRP 414 CO 0.54 -1.86 0.63 -0.80 0.02 0.00 0.00 176.95 175.48 3a6o s ASN 415 N 3.73 6.23 0.46 2.95 0.01 0.18 -0.42 114.94 128.08 3a6o s ASN 415 Ca 0.44 -0.86 0.07 0.00 -0.71 0.00 0.00 52.86 51.80 3a6o s ASN 415 Cb -0.09 -2.30 0.00 0.00 0.41 0.00 0.00 41.25 39.28 3a6o s ASN 415 CO 0.22 -0.89 0.43 -1.48 -1.51 0.00 0.00 177.10 173.87 3a6o s LEU 416 N 2.68 3.22 -0.04 0.60 2.34 -1.26 -2.33 118.68 123.87 3a6o s LEU 416 Ca 0.16 -0.86 0.14 0.00 0.06 0.00 0.00 54.13 53.63 3a6o s LEU 416 Cb -0.19 -1.83 -0.21 0.00 -0.56 0.00 0.00 46.19 43.40 3a6o s LEU 416 CO 0.13 -0.82 0.26 0.18 -1.06 0.00 0.00 176.35 175.03 3a6o n LEU 417 N -1.67 0.00 -3.61 1.48 4.77 -1.26 -4.07 117.00 112.64 3a6o n LEU 417 Ca 0.04 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.03 3a6o n LEU 417 Cb 0.62 0.07 -0.01 0.00 -2.33 0.00 0.00 43.42 41.78 3a6o n LEU 417 CO 0.41 0.07 1.09 1.51 -1.33 0.00 0.00 177.39 179.14 3a6o s ASP 418 N -3.89 -0.05 0.00 -1.43 1.47 -1.26 -4.59 116.67 106.91 3a6o s ASP 418 Ca -0.06 -0.10 0.00 0.00 1.18 0.00 0.00 52.55 53.58 3a6o s ASP 418 Cb 0.08 0.13 0.00 0.00 -0.34 0.00 0.00 42.92 42.79 3a6o s ASP 418 CO 0.59 -0.23 0.00 -1.54 0.68 0.00 0.00 175.17 174.67 3a6o n SER 419 N -0.44 0.00 0.00 2.11 3.41 -1.26 -4.82 113.62 112.62 3a6o n SER 419 Ca -0.08 -0.36 0.07 0.00 -0.26 0.00 0.00 58.87 58.24 3a6o n SER 419 Cb 0.62 0.00 0.34 0.00 -0.26 0.00 0.00 64.21 64.91 3a6o n SER 419 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3a6o n HIS 420 N 0.00 0.00 -1.16 7.33 1.44 -1.26 -2.74 115.22 118.83 3a6o n HIS 420 Ca 0.00 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.73 3a6o n HIS 420 Cb 0.00 -0.35 0.24 0.00 0.12 0.00 0.00 29.99 30.00 3a6o n HIS 420 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 3a6o n ASP 421 N -1.35 3.53 -3.76 4.39 8.00 -1.26 -4.39 116.55 121.71 3a6o n ASP 421 Ca 0.06 -3.31 -0.10 0.00 0.71 0.00 0.00 54.79 52.14 3a6o n ASP 421 Cb 0.13 -0.61 -0.06 0.00 -0.02 0.00 0.00 41.12 40.55 3a6o n ASP 421 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3a6o s THR 422 N -3.01 0.10 0.98 -3.53 2.01 -1.11 -4.69 115.64 106.39 3a6o s THR 422 Ca 0.45 -0.85 -0.12 0.00 0.31 0.00 0.00 61.69 61.49 3a6o s THR 422 Cb 0.38 -1.16 0.18 0.00 0.01 0.00 0.00 72.50 71.91 3a6o s THR 422 CO 0.06 -0.47 1.08 -1.83 -0.69 0.00 0.00 174.62 172.78 3a6o s GLU 423 N -3.43 0.57 0.35 4.92 -1.05 -1.26 -3.94 118.70 114.86 3a6o s GLU 423 Ca 0.01 0.77 -0.18 0.00 -0.15 0.00 0.00 54.97 55.42 3a6o s GLU 423 Cb 0.02 -1.73 -0.10 0.00 -0.44 0.00 0.00 34.13 31.88 3a6o s GLU 423 CO -0.09 -2.70 0.81 1.03 0.95 0.00 0.00 175.26 175.26 3a6o s ARG 424 N -4.84 4.11 0.26 -4.83 1.81 0.44 -4.54 118.95 111.36 3a6o s ARG 424 Ca 0.65 0.84 -0.04 0.00 -1.72 0.00 0.00 55.73 55.46 3a6o s ARG 424 Cb -0.20 -2.41 0.31 0.00 -0.45 0.00 0.00 34.95 32.21 3a6o s ARG 424 CO 0.59 0.13 1.87 0.35 -0.68 0.00 0.00 175.30 177.55 3a6o h PHE 425 N 2.28 1.10 -1.00 -0.53 3.57 -1.89 -1.07 116.94 119.40 3a6o h PHE 425 Ca -0.48 -0.03 0.21 0.00 3.53 0.00 0.00 57.97 61.20 3a6o h PHE 425 Cb 1.18 -0.35 -0.11 0.00 2.79 0.00 0.00 35.95 39.46 3a6o h PHE 425 CO 0.62 0.78 0.60 1.25 -2.23 0.00 0.00 178.31 179.33 3a6o h LEU 426 N 1.12 0.74 -0.02 0.59 6.46 -1.94 -2.23 115.31 120.03 3a6o h LEU 426 Ca 0.28 0.11 -0.00 0.00 -0.12 0.00 0.00 57.88 58.15 3a6o h LEU 426 Cb 0.06 -0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 39.97 3a6o h LEU 426 CO -0.04 0.21 0.01 0.74 -0.62 0.00 0.00 178.44 178.74 3a6o h THR 427 N 0.69 1.16 -0.77 1.05 2.02 -1.49 0.36 112.91 115.93 3a6o h THR 427 Ca 0.60 -0.46 0.22 0.00 0.77 0.00 0.00 66.41 67.54 3a6o h THR 427 Cb 1.01 1.43 -0.03 0.00 -1.74 0.00 0.00 68.15 68.82 3a6o h THR 427 CO -0.42 0.12 0.64 0.28 0.37 0.00 0.00 175.52 176.51 3a6o h SER 428 N -0.15 0.00 -0.39 4.18 0.02 -1.03 0.47 113.55 116.64 3a6o h SER 428 Ca 0.01 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 3a6o h SER 428 Cb 0.19 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.68 3a6o h SER 428 CO -0.00 0.00 0.12 0.00 -1.14 0.00 0.00 176.83 175.81 3a6o n GLY 430 N 0.09 -0.12 3.12 0.00 0.00 0.16 0.35 105.19 108.79 3a6o n GLY 430 Ca 0.21 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.35 3a6o n GLY 430 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a6o n GLY 431 N -1.96 0.46 3.59 -0.02 0.00 0.12 -4.93 105.19 102.45 3a6o n GLY 431 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 3a6o n GLY 431 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3a6o s ASN 432 N -2.36 6.29 0.19 1.61 3.84 0.16 -4.87 114.94 119.78 3a6o s ASN 432 Ca 0.00 0.60 -0.09 0.00 0.21 0.00 0.00 52.86 53.58 3a6o s ASN 432 Cb 0.00 -2.54 0.09 0.00 -0.55 0.00 0.00 41.25 38.24 3a6o s ASN 432 CO 0.00 -1.52 1.67 -0.08 -2.79 0.00 0.00 177.10 174.39 3a6o h GLU 433 N 10.71 1.10 -0.47 0.43 4.81 -1.91 -2.78 114.58 126.47 3a6o h GLU 433 Ca -0.27 -0.31 -0.00 0.00 -0.13 0.00 0.00 59.36 58.65 3a6o h GLU 433 Cb 1.10 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.33 3a6o h GLU 433 CO 1.12 1.03 0.30 0.00 -0.73 0.00 0.00 179.01 180.73 3a6o h ALA 434 N 1.03 0.60 0.00 2.92 0.00 -1.97 -0.28 119.26 121.57 3a6o h ALA 434 Ca 0.19 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 3a6o h ALA 434 Cb 0.48 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3a6o h ALA 434 CO 0.02 0.08 -0.18 0.87 0.00 0.00 0.00 179.25 180.04 3a6o h LYS 435 N 0.64 0.00 0.35 0.00 1.57 -1.88 -3.04 116.57 114.21 3a6o h LYS 435 Ca 0.17 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.93 3a6o h LYS 435 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.29 3a6o h LYS 435 CO -0.03 0.18 -0.17 0.35 -0.57 0.00 0.00 179.45 179.21 3a6o h PHE 436 N 0.00 -0.43 -0.66 -1.35 3.57 -0.80 -2.60 116.94 114.67 3a6o h PHE 436 Ca -0.00 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 61.68 3a6o h PHE 436 Cb 0.34 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.20 3a6o h PHE 436 CO 0.00 -0.10 0.48 0.00 -2.23 0.00 0.00 178.31 176.46 3a6o h ARG 437 N -0.92 0.00 -0.09 1.11 3.08 -1.33 0.19 114.38 116.43 3a6o h ARG 437 Ca -0.05 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.83 3a6o h ARG 437 Cb 0.53 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.59 3a6o h ARG 437 CO 0.08 0.00 -0.61 1.25 -1.07 0.00 0.00 179.97 179.62 3a6o h LEU 438 N 0.00 0.70 -1.47 3.04 5.85 -1.46 -0.80 115.31 121.16 3a6o h LEU 438 Ca 0.31 -0.66 0.02 0.00 0.84 0.00 0.00 57.88 58.39 3a6o h LEU 438 Cb 1.28 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.07 3a6o h LEU 438 CO -0.00 1.25 0.37 0.00 -0.34 0.00 0.00 178.44 179.72 3a6o h ALA 439 N 0.46 1.65 -0.08 1.25 0.00 -0.80 0.30 119.26 122.03 3a6o h ALA 439 Ca -0.05 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 3a6o h ALA 439 Cb 1.26 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 3a6o h ALA 439 CO 0.13 0.31 -0.72 0.28 0.00 0.00 0.00 179.25 179.25 3a6o h VAL 440 N 0.72 1.37 -0.40 0.00 2.07 -0.41 -1.12 116.25 118.48 3a6o h VAL 440 Ca 0.21 -2.11 -0.07 0.00 0.82 0.00 0.00 66.70 65.55 3a6o h VAL 440 Cb -0.02 2.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 3a6o h VAL 440 CO -0.05 0.64 -0.02 0.25 0.02 0.00 0.00 177.57 178.41 3a6o h LEU 441 N 0.29 0.70 -0.39 2.57 6.46 -0.53 0.51 115.31 124.92 3a6o h LEU 441 Ca -0.03 -0.32 0.03 0.00 -0.12 0.00 0.00 57.88 57.45 3a6o h LEU 441 Cb 1.29 -0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 41.00 3a6o h LEU 441 CO 0.12 0.85 0.18 0.15 -0.62 0.00 0.00 178.44 179.12 3a6o h PHE 442 N 0.53 0.33 -0.52 1.25 3.04 -0.79 -2.13 116.94 118.65 3a6o h PHE 442 Ca 0.11 0.02 -0.06 0.00 3.98 0.00 0.00 57.97 62.01 3a6o h PHE 442 Cb 0.50 -0.09 -0.02 0.00 2.56 0.00 0.00 35.95 38.90 3a6o h PHE 442 CO 0.04 0.16 0.06 0.37 -2.02 0.00 0.00 178.31 176.92 3a6o h GLN 443 N 0.37 0.83 -0.00 1.11 4.15 -0.31 0.16 115.11 121.42 3a6o h GLN 443 Ca 0.17 -0.20 0.00 0.00 0.77 0.00 0.00 58.65 59.39 3a6o h GLN 443 Cb 0.09 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.68 3a6o h GLN 443 CO -0.13 0.79 -0.06 -1.33 -1.93 0.00 0.00 178.83 176.17 3a6o n MET 444 N -4.24 0.45 -0.00 1.69 2.81 0.09 -3.80 117.12 114.12 3a6o n MET 444 Ca 0.03 -0.08 0.01 0.00 -1.81 0.00 0.00 57.70 55.85 3a6o n MET 444 Cb 0.27 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.27 3a6o n MET 444 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3a6o n THR 445 N -1.21 0.00 -1.69 2.03 -2.24 -0.37 -4.74 114.28 106.06 3a6o n THR 445 Ca 0.13 -0.11 -0.29 0.00 -2.27 0.00 0.00 64.05 61.51 3a6o n THR 445 Cb 0.27 0.55 0.10 0.00 -2.10 0.00 0.00 70.33 69.15 3a6o n THR 445 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3a6o s TYR 446 N -1.97 2.81 0.17 4.78 5.04 0.44 -4.93 117.35 123.70 3a6o s TYR 446 Ca -0.00 0.91 -0.31 0.00 -2.44 0.00 0.00 57.07 55.23 3a6o s TYR 446 Cb 0.01 -3.32 -0.10 0.00 0.35 0.00 0.00 41.96 38.91 3a6o s TYR 446 CO 0.07 -1.92 1.50 -1.17 -1.34 0.00 0.00 175.55 172.70 3a6o s LEU 447 N -5.76 4.37 0.00 6.97 2.96 -1.26 -4.84 118.68 121.12 3a6o s LEU 447 Ca 0.62 2.57 0.00 0.00 -0.22 0.00 0.00 54.13 57.10 3a6o s LEU 447 Cb -0.13 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.96 3a6o s LEU 447 CO 0.52 -0.76 0.00 0.61 -1.32 0.00 0.00 176.35 175.40 3a6o n GLY 448 N 3.34 0.31 3.27 7.98 0.00 -1.19 -4.91 105.19 114.00 3a6o n GLY 448 Ca 0.12 -2.31 -0.36 0.00 0.00 0.00 0.00 46.02 43.47 3a6o n GLY 448 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a6o s THR 449 N -0.45 3.54 0.18 2.61 2.01 0.12 -4.84 115.64 118.81 3a6o s THR 449 Ca 0.00 -0.98 -0.31 0.00 0.31 0.00 0.00 61.69 60.71 3a6o s THR 449 Cb 0.00 -2.90 -0.10 0.00 0.01 0.00 0.00 72.50 69.51 3a6o s THR 449 CO 0.00 0.01 1.55 -2.16 -0.69 0.00 0.00 174.62 173.33 3a6o s PRO 450 N 1.40 4.22 -0.27 4.92 0.04 -1.26 0.49 135.00 144.54 3a6o s PRO 450 Ca -0.00 2.37 -0.05 0.00 0.04 0.00 0.00 61.00 63.36 3a6o s PRO 450 Cb -0.18 -3.14 0.01 0.00 0.04 0.00 0.00 34.50 31.23 3a6o s PRO 450 CO 0.01 -0.58 0.02 -1.17 0.04 0.00 0.00 177.00 175.31 3a6o s LEU 451 N 0.82 3.49 0.07 -3.56 2.96 -0.98 -0.96 118.68 120.52 3a6o s LEU 451 Ca 0.68 -0.72 -0.22 0.00 -0.22 0.00 0.00 54.13 53.65 3a6o s LEU 451 Cb -0.44 -1.79 -0.06 0.00 0.50 0.00 0.00 46.19 44.40 3a6o s LEU 451 CO 0.34 -0.14 0.65 -0.63 -1.32 0.00 0.00 176.35 175.24 3a6o s ILE 452 N 1.44 4.70 -0.22 6.68 1.01 -0.04 -4.32 121.20 130.44 3a6o s ILE 452 Ca 0.02 1.39 -0.07 0.00 0.00 0.00 0.00 60.65 61.98 3a6o s ILE 452 Cb -0.17 -3.99 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 3a6o s ILE 452 CO -0.01 0.49 0.07 -0.47 0.00 0.00 0.00 174.94 175.02 3a6o s TYR 453 N -0.75 3.14 0.10 3.97 5.04 -1.26 -0.26 117.35 127.34 3a6o s TYR 453 Ca 0.32 -0.20 -0.34 0.00 -2.44 0.00 0.00 57.07 54.41 3a6o s TYR 453 Cb -0.20 -2.18 -0.18 0.00 0.35 0.00 0.00 41.96 39.75 3a6o s TYR 453 CO 0.21 -0.15 0.86 2.48 -1.34 0.00 0.00 175.55 177.61 3a6o n TYR 454 N 4.37 0.26 0.00 4.97 0.18 -0.76 -1.08 117.16 125.10 3a6o n TYR 454 Ca -0.16 0.97 0.00 0.00 1.88 0.00 0.00 57.90 60.59 3a6o n TYR 454 Cb 0.52 -2.06 0.00 0.00 -0.38 0.00 0.00 39.34 37.42 3a6o n TYR 454 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3a6o n GLY 455 N 1.77 3.05 0.29 -7.48 0.00 -1.26 -4.90 105.19 96.66 3a6o n GLY 455 Ca 0.19 -0.46 0.07 0.00 0.00 0.00 0.00 46.02 45.82 3a6o n GLY 455 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3a6o h ASP 456 N 0.01 0.22 0.59 1.61 5.19 -1.40 -0.82 116.42 121.82 3a6o h ASP 456 Ca 0.00 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3a6o h ASP 456 Cb 0.00 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 39.46 3a6o h ASP 456 CO 0.00 0.16 0.00 1.05 -3.12 0.00 0.00 179.24 177.33 3a6o h GLU 457 N 0.26 0.00 0.00 3.56 9.09 -1.91 -2.47 114.58 123.11 3a6o h GLU 457 Ca 0.09 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.50 3a6o h GLU 457 Cb 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.15 3a6o h GLU 457 CO -0.02 0.00 -0.07 0.44 0.05 0.00 0.00 179.01 179.41 3a6o n ILE 458 N -2.43 0.97 0.00 -1.06 -6.64 -0.35 -3.00 119.36 106.85 3a6o n ILE 458 Ca 0.01 -1.08 0.00 0.00 -1.77 0.00 0.00 62.75 59.90 3a6o n ILE 458 Cb 0.19 0.35 0.00 0.00 -1.44 0.00 0.00 39.64 38.75 3a6o n ILE 458 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 3a6o n GLY 459 N -0.64 0.67 3.72 3.28 0.00 -0.93 -1.60 105.19 109.70 3a6o n GLY 459 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3a6o n GLY 459 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3a6o n MET 460 N -1.39 2.34 -2.30 1.61 2.81 -1.10 -5.02 117.12 114.08 3a6o n MET 460 Ca 0.00 0.83 -0.09 0.00 -1.81 0.00 0.00 57.70 56.62 3a6o n MET 460 Cb 0.00 -2.49 0.00 0.00 -0.71 0.00 0.00 33.22 30.03 3a6o n MET 460 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3a6o n ALA 461 N 0.86 0.32 0.00 3.04 0.00 -1.26 -4.70 120.51 118.77 3a6o n ALA 461 Ca 0.05 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 52.69 3a6o n ALA 461 Cb 0.36 0.32 0.00 0.00 0.00 0.00 0.00 19.45 20.13 3a6o n ALA 461 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a6o n GLY 462 N 2.57 4.57 1.43 0.00 0.00 -1.26 -4.83 105.19 107.66 3a6o n GLY 462 Ca -0.00 -0.64 -0.13 0.00 0.00 0.00 0.00 46.02 45.25 3a6o n GLY 462 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a6o n ALA 463 N -1.56 -1.68 -1.34 4.61 0.00 -1.26 -0.42 120.51 118.86 3a6o n ALA 463 Ca 0.00 -0.67 -0.29 0.00 0.00 0.00 0.00 53.44 52.47 3a6o n ALA 463 Cb 0.00 -0.05 0.13 0.00 0.00 0.00 0.00 19.45 19.53 3a6o n ALA 463 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3a6o s THR 464 N -1.72 2.52 -0.21 0.00 -1.32 -1.26 -0.86 115.64 112.79 3a6o s THR 464 Ca 0.29 0.17 -0.25 0.00 -1.21 0.00 0.00 61.69 60.69 3a6o s THR 464 Cb -0.04 -2.76 -0.11 0.00 -1.51 0.00 0.00 72.50 68.08 3a6o s THR 464 CO 0.23 -0.22 0.82 -0.67 -2.21 0.00 0.00 174.62 172.58 3a6o n ASP 465 N -3.82 0.51 -1.20 8.08 2.03 -1.25 -1.50 116.55 119.40 3a6o n ASP 465 Ca 0.06 0.66 0.11 0.00 0.52 0.00 0.00 54.79 56.14 3a6o n ASP 465 Cb 0.57 -0.50 0.28 0.00 -0.72 0.00 0.00 41.12 40.75 3a6o n ASP 465 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 3a6o n PRO 466 N 1.91 2.71 0.19 -0.67 -0.04 -1.26 -4.90 135.00 132.93 3a6o n PRO 466 Ca 0.16 -2.50 0.07 0.00 -0.04 0.00 0.00 63.50 61.19 3a6o n PRO 466 Cb -0.01 -1.51 0.21 0.00 -0.04 0.00 0.00 33.50 32.15 3a6o n PRO 466 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 3a6o h ASP 467 N 3.89 0.00 0.44 3.54 -0.00 -1.43 -2.85 116.42 120.02 3a6o h ASP 467 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 3a6o h ASP 467 Cb 0.94 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.27 3a6o h ASP 467 CO 0.00 0.28 0.00 0.00 -0.00 0.00 0.00 179.24 179.52 3a6o n ARG 469 N -1.26 3.04 -1.33 0.00 1.74 -1.07 -4.89 116.66 112.89 3a6o n ARG 469 Ca 0.13 -3.85 -0.31 0.00 -0.77 0.00 0.00 57.85 53.05 3a6o n ARG 469 Cb 0.20 -2.27 0.09 0.00 -1.02 0.00 0.00 32.46 29.46 3a6o n ARG 469 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3a6o s ARG 470 N -3.82 2.26 0.40 5.56 0.52 -1.22 -4.85 118.95 117.79 3a6o s ARG 470 Ca 0.53 1.06 -0.26 0.00 -0.52 0.00 0.00 55.73 56.53 3a6o s ARG 470 Cb 0.44 -1.91 -0.09 0.00 0.52 0.00 0.00 34.95 33.91 3a6o s ARG 470 CO -0.23 -1.61 1.31 -1.25 0.02 0.00 0.00 175.30 173.54 3a6o s PRO 471 N -4.95 4.01 0.14 3.54 0.04 -1.26 -4.89 135.00 131.63 3a6o s PRO 471 Ca 0.61 2.17 -0.31 0.00 0.04 0.00 0.00 61.00 63.51 3a6o s PRO 471 Cb -0.16 -2.80 -0.10 0.00 0.04 0.00 0.00 34.50 31.48 3a6o s PRO 471 CO 0.56 -0.46 1.61 1.41 0.04 0.00 0.00 177.00 180.16 3a6o s MET 472 N -2.19 4.20 -0.12 4.56 -2.45 -0.88 -4.92 119.30 117.51 3a6o s MET 472 Ca 0.56 2.38 -0.29 0.00 -1.25 0.00 0.00 55.69 57.08 3a6o s MET 472 Cb -0.38 -3.29 -0.03 0.00 1.25 0.00 0.00 34.83 32.38 3a6o s MET 472 CO 0.50 -0.66 1.33 0.42 1.05 0.00 0.00 175.02 177.66 3a6o s ILE 473 N 1.60 4.11 -0.21 10.11 -1.09 -1.26 -4.90 121.20 129.57 3a6o s ILE 473 Ca 0.72 1.37 0.06 0.00 -2.23 0.00 0.00 60.65 60.57 3a6o s ILE 473 Cb -0.43 -3.88 -0.08 0.00 -1.58 0.00 0.00 42.46 36.49 3a6o s ILE 473 CO 0.32 -0.09 0.23 0.79 -1.23 0.00 0.00 174.94 174.96 3a6o n TRP 474 N 6.38 0.00 -2.24 3.97 7.02 -1.26 -4.92 117.44 126.40 3a6o n TRP 474 Ca 0.14 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 56.19 3a6o n TRP 474 Cb 0.45 -0.05 -0.02 0.00 -2.42 0.00 0.00 31.31 29.26 3a6o n TRP 474 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 3a6o s GLU 475 N -1.89 3.87 0.16 -0.99 2.02 -1.26 -4.91 118.70 115.69 3a6o s GLU 475 Ca 0.01 1.53 -0.17 0.00 0.02 0.00 0.00 54.97 56.36 3a6o s GLU 475 Cb 0.05 -3.96 0.10 0.00 0.10 0.00 0.00 34.13 30.41 3a6o s GLU 475 CO 0.27 -1.19 1.17 -1.91 0.02 0.00 0.00 175.26 173.62 3a6o n GLU 476 N 7.47 -0.23 -0.24 1.61 2.13 -1.26 0.13 120.64 130.24 3a6o n GLU 476 Ca 0.17 1.16 0.05 0.00 0.66 0.00 0.00 57.16 59.19 3a6o n GLU 476 Cb 0.46 -1.71 0.17 0.00 0.27 0.00 0.00 31.44 30.63 3a6o n GLU 476 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 3a6o h LYS 477 N 0.00 0.30 0.00 5.31 6.56 -2.02 -0.76 116.57 125.97 3a6o h LYS 477 Ca 0.21 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.78 3a6o h LYS 477 Cb 0.40 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 31.99 3a6o h LYS 477 CO -0.74 0.20 0.00 0.39 -2.06 0.00 0.00 179.45 177.24 3a6o n GLU 478 N -5.11 0.74 -4.87 3.15 -0.58 0.12 -4.84 120.64 109.25 3a6o n GLU 478 Ca 0.13 0.00 -0.31 0.00 -0.42 0.00 0.00 57.16 56.56 3a6o n GLU 478 Cb 0.42 -1.32 -0.14 0.00 -0.57 0.00 0.00 31.44 29.84 3a6o n GLU 478 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 3a6o s GLN 479 N -2.00 2.13 -1.24 3.49 -0.21 -0.29 -4.95 119.66 116.60 3a6o s GLN 479 Ca 0.22 -0.93 -0.20 0.00 0.02 0.00 0.00 55.36 54.48 3a6o s GLN 479 Cb 0.10 -2.17 0.01 0.00 1.00 0.00 0.00 33.01 31.95 3a6o s GLN 479 CO 0.17 0.56 1.80 1.21 -2.12 0.00 0.00 175.29 176.91 3a6o s ASN 480 N -1.10 6.19 0.50 5.90 3.84 -0.63 -4.76 114.94 124.88 3a6o s ASN 480 Ca 0.13 -2.11 0.22 0.00 0.21 0.00 0.00 52.86 51.31 3a6o s ASN 480 Cb -0.10 -2.58 1.29 0.00 -0.55 0.00 0.00 41.25 39.30 3a6o s ASN 480 CO 0.03 -1.86 2.05 0.03 -2.79 0.00 0.00 177.10 174.56 3a6o h ARG 481 N 8.46 0.00 -0.61 0.43 2.47 -1.87 -1.71 114.38 121.55 3a6o h ARG 481 Ca 0.35 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 59.05 3a6o h ARG 481 Cb 0.90 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.19 3a6o h ARG 481 CO 1.38 0.14 0.28 0.78 0.56 0.00 0.00 179.97 183.10 3a6o h GLY 482 N 0.62 0.96 2.00 0.04 0.00 -1.94 0.33 103.07 105.08 3a6o h GLY 482 Ca -0.00 -0.49 -0.04 0.00 0.00 0.00 0.00 47.33 46.80 3a6o h GLY 482 CO 0.02 0.46 -0.21 -2.00 0.00 0.00 0.00 176.54 174.81 3a6o h LEU 483 N 0.84 0.00 0.06 3.11 6.46 -1.59 -2.63 115.31 121.55 3a6o h LEU 483 Ca 0.21 0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.87 3a6o h LEU 483 Cb 0.14 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.08 3a6o h LEU 483 CO -0.02 0.21 -0.41 0.15 -0.62 0.00 0.00 178.44 177.74 3a6o h PHE 484 N 0.00 0.31 0.00 1.25 3.04 -0.58 -1.69 116.94 119.26 3a6o h PHE 484 Ca -0.00 -0.21 -0.00 0.00 3.98 0.00 0.00 57.97 61.74 3a6o h PHE 484 Cb 0.74 -0.02 -0.00 0.00 2.56 0.00 0.00 35.95 39.23 3a6o h PHE 484 CO 0.00 1.12 -0.02 0.93 -2.02 0.00 0.00 178.31 178.31 3a6o h GLU 485 N -0.59 0.00 0.55 1.11 4.39 -1.00 0.68 114.58 119.72 3a6o h GLU 485 Ca -0.07 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.61 3a6o h GLU 485 Cb 1.27 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.93 3a6o h GLU 485 CO 0.08 0.02 -0.27 0.35 -1.16 0.00 0.00 179.01 178.03 3a6o h PHE 486 N 0.00 -0.69 -0.59 4.33 -0.00 -1.21 -0.50 116.94 118.29 3a6o h PHE 486 Ca -0.00 -0.02 0.11 0.00 -0.00 0.00 0.00 57.97 58.07 3a6o h PHE 486 Cb 0.05 0.23 -0.12 0.00 -0.00 0.00 0.00 35.95 36.12 3a6o h PHE 486 CO 0.00 -0.37 -0.24 1.88 -0.00 0.00 0.00 178.31 179.58 3a6o h TYR 487 N -1.10 -0.61 -0.82 0.41 -1.99 -0.93 -0.72 116.97 111.21 3a6o h TYR 487 Ca -0.08 0.06 0.11 0.00 2.00 0.00 0.00 58.73 60.83 3a6o h TYR 487 Cb 0.63 0.36 -0.08 0.00 2.00 0.00 0.00 36.73 39.64 3a6o h TYR 487 CO 0.01 -0.33 0.45 0.87 -0.00 0.00 0.00 178.16 179.16 3a6o h LYS 488 N -0.09 0.69 -0.07 4.88 1.57 -0.79 0.23 116.57 122.99 3a6o h LYS 488 Ca 0.26 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.96 3a6o h LYS 488 Cb 0.51 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.66 3a6o h LYS 488 CO -0.65 0.46 -0.14 1.49 -0.57 0.00 0.00 179.45 180.04 3a6o h GLU 489 N 0.71 0.21 -0.82 3.15 4.81 0.05 -2.42 114.58 120.27 3a6o h GLU 489 Ca 0.42 -0.14 0.16 0.00 -0.13 0.00 0.00 59.36 59.67 3a6o h GLU 489 Cb 0.47 0.02 -0.10 0.00 0.63 0.00 0.00 28.75 29.77 3a6o h GLU 489 CO -0.29 0.73 0.36 -0.07 -0.73 0.00 0.00 179.01 179.00 3a6o h LEU 490 N -0.28 0.36 -1.06 1.64 3.38 -0.82 -2.28 115.31 116.24 3a6o h LEU 490 Ca 0.00 0.11 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 3a6o h LEU 490 Cb 0.72 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 3a6o h LEU 490 CO 0.03 0.12 -0.01 0.40 0.09 0.00 0.00 178.44 179.06 3a6o h ILE 491 N 0.49 1.22 -0.14 1.22 2.04 -0.39 -2.03 117.51 119.92 3a6o h ILE 491 Ca 0.46 -0.92 -0.16 0.00 1.00 0.00 0.00 64.86 65.25 3a6o h ILE 491 Cb 0.73 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 3a6o h ILE 491 CO -0.42 0.32 -0.58 0.03 0.00 0.00 0.00 178.15 177.50 3a6o h ARG 492 N 0.61 0.44 -0.01 2.37 3.08 -1.16 -2.45 114.38 117.25 3a6o h ARG 492 Ca 0.12 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 59.88 3a6o h ARG 492 Cb 0.40 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 3a6o h ARG 492 CO 0.02 0.89 0.01 -0.07 -1.07 0.00 0.00 179.97 179.75 3a6o h LEU 493 N 0.33 0.02 -1.12 3.04 3.38 -1.15 0.30 115.31 120.12 3a6o h LEU 493 Ca -0.00 -0.18 0.33 0.00 0.09 0.00 0.00 57.88 58.12 3a6o h LEU 493 Cb 1.11 -0.01 -0.14 0.00 0.09 0.00 0.00 40.66 41.72 3a6o h LEU 493 CO 0.10 0.19 0.63 -0.09 0.09 0.00 0.00 178.44 179.37 3a6o h ARG 494 N -0.15 0.30 0.05 1.13 2.43 -1.38 -0.84 114.38 115.92 3a6o h ARG 494 Ca 0.00 -0.02 -0.15 0.00 -0.81 0.00 0.00 59.98 59.00 3a6o h ARG 494 Cb 0.18 -0.07 0.01 0.00 -0.42 0.00 0.00 29.97 29.68 3a6o h ARG 494 CO -0.00 0.20 -0.63 0.45 -1.51 0.00 0.00 179.97 178.47 3a6o h HIS 495 N 0.31 0.54 -0.01 2.20 3.86 -0.70 -3.34 115.15 118.00 3a6o h HIS 495 Ca 0.73 -0.33 -0.05 0.00 -1.16 0.00 0.00 60.37 59.56 3a6o h HIS 495 Cb 1.78 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 30.19 3a6o h HIS 495 CO -0.01 1.18 -0.24 0.00 0.86 0.00 0.00 177.93 179.73 3a6o h ARG 496 N -0.25 0.01 -4.43 2.45 3.08 -0.47 -3.42 114.38 111.34 3a6o h ARG 496 Ca -0.09 -0.00 -0.72 0.00 0.07 0.00 0.00 59.98 59.24 3a6o h ARG 496 Cb 1.40 -0.00 -0.28 0.00 0.08 0.00 0.00 29.97 31.16 3a6o h ARG 496 CO 0.12 0.25 -0.46 -0.51 -1.07 0.00 0.00 179.97 178.30 3a6o s LEU 497 N -8.51 5.22 0.31 3.04 1.43 -0.37 -4.93 118.68 114.86 3a6o s LEU 497 Ca -0.04 -1.55 0.00 0.00 -1.03 0.00 0.00 54.13 51.52 3a6o s LEU 497 Cb 0.15 -1.99 0.49 0.00 0.03 0.00 0.00 46.19 44.87 3a6o s LEU 497 CO 0.71 -0.55 1.90 0.00 0.23 0.00 0.00 176.35 178.63 3a6o h ALA 498 N 8.41 1.34 -0.93 4.21 0.00 -1.83 -1.59 119.26 128.86 3a6o h ALA 498 Ca -0.23 -0.14 0.22 0.00 0.00 0.00 0.00 54.91 54.76 3a6o h ALA 498 Cb 1.08 -0.23 -0.12 0.00 0.00 0.00 0.00 17.79 18.52 3a6o h ALA 498 CO 0.77 0.50 0.48 1.03 0.00 0.00 0.00 179.25 182.03 3a6o h SER 499 N 0.82 0.50 0.64 0.00 0.87 -1.91 0.77 113.55 115.24 3a6o h SER 499 Ca 0.20 0.14 -0.13 0.00 -1.23 0.00 0.00 61.79 60.77 3a6o h SER 499 Cb 0.14 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.16 3a6o h SER 499 CO -0.02 0.07 -0.61 -0.07 -0.53 0.00 0.00 176.83 175.67 3a6o h LEU 500 N 0.51 0.00 0.02 2.23 3.38 -1.59 0.59 115.31 120.44 3a6o h LEU 500 Ca 0.58 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 58.22 3a6o h LEU 500 Cb 1.06 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.76 3a6o h LEU 500 CO -0.48 0.61 -2.02 0.35 0.09 0.00 0.00 178.44 176.98 3a6o n THR 501 N -3.78 1.56 0.00 0.22 -2.24 -0.72 -4.70 114.28 104.62 3a6o n THR 501 Ca -0.01 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 3a6o n THR 501 Cb 0.61 -0.98 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 3a6o n THR 501 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3a6o n ARG 502 N -3.03 5.53 -1.83 -0.78 1.74 0.26 -4.59 116.66 113.96 3a6o n ARG 502 Ca -0.26 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.52 3a6o n ARG 502 Cb 1.08 -0.46 0.15 0.00 -1.02 0.00 0.00 32.46 32.21 3a6o n ARG 502 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3a6o s GLY 503 N -0.90 1.68 0.33 -0.13 0.00 0.21 -4.86 107.32 103.65 3a6o s GLY 503 Ca 0.00 -0.91 -0.05 0.00 0.00 0.00 0.00 44.72 43.76 3a6o s GLY 503 CO 0.00 -0.26 0.45 1.16 0.00 0.00 0.00 173.10 174.45 3a6o n ASN 504 N -3.65 0.13 -4.04 1.64 2.04 -0.49 -4.76 115.26 106.14 3a6o n ASN 504 Ca 0.11 -1.22 -0.19 0.00 -0.44 0.00 0.00 54.58 52.84 3a6o n ASN 504 Cb 0.60 -0.34 -0.15 0.00 -2.53 0.00 0.00 39.78 37.37 3a6o n ASN 504 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 3a6o s VAL 505 N -1.81 0.79 -0.00 3.53 1.01 -1.26 -3.04 120.40 119.62 3a6o s VAL 505 Ca 0.26 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.83 3a6o s VAL 505 Cb -0.01 -0.67 -0.01 0.00 0.00 0.00 0.00 36.38 35.70 3a6o s VAL 505 CO 0.18 0.22 -0.07 -0.13 0.00 0.00 0.00 175.10 175.30 3a6o s ARG 506 N -0.26 0.57 0.31 2.72 1.81 -0.57 -4.96 118.95 118.58 3a6o s ARG 506 Ca 0.04 -0.27 -0.30 0.00 -1.72 0.00 0.00 55.73 53.48 3a6o s ARG 506 Cb -0.04 -0.55 -0.11 0.00 -0.45 0.00 0.00 34.95 33.80 3a6o s ARG 506 CO -0.00 0.15 1.58 0.43 -0.68 0.00 0.00 175.30 176.78 3a6o n SER 507 N 2.85 3.88 -0.05 0.23 7.64 -1.26 -0.31 113.62 126.59 3a6o n SER 507 Ca -0.13 1.16 -0.07 0.00 1.01 0.00 0.00 58.87 60.84 3a6o n SER 507 Cb 0.57 -1.60 -0.05 0.00 -1.01 0.00 0.00 64.21 62.12 3a6o n SER 507 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 3a6o n TRP 508 N 1.80 0.00 -3.71 1.43 -0.00 0.39 -4.81 117.44 112.55 3a6o n TRP 508 Ca 0.07 0.00 -0.14 0.00 -0.00 0.00 0.00 57.50 57.43 3a6o n TRP 508 Cb 0.37 -0.43 -0.09 0.00 -0.00 0.00 0.00 31.31 31.17 3a6o n TRP 508 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 177.69 176.11 3a6o s HIS 509 N -2.22 -0.37 -0.26 5.87 2.46 -1.10 -4.82 115.29 114.86 3a6o s HIS 509 Ca -0.13 0.73 -0.02 0.00 0.47 0.00 0.00 55.06 56.11 3a6o s HIS 509 Cb 0.04 0.17 0.15 0.00 -0.13 0.00 0.00 32.58 32.81 3a6o s HIS 509 CO 0.28 -0.38 0.42 0.00 -2.47 0.00 0.00 174.74 172.60 3a6o s ALA 510 N -0.78 -1.34 -0.35 1.58 0.00 -1.26 -1.11 121.76 118.51 3a6o s ALA 510 Ca -0.09 1.03 0.02 0.00 0.00 0.00 0.00 51.96 52.92 3a6o s ALA 510 Cb -0.04 -1.81 0.10 0.00 0.00 0.00 0.00 23.12 21.38 3a6o s ALA 510 CO 0.04 -1.32 0.09 0.34 0.00 0.00 0.00 175.76 174.91 3a6o s ASP 511 N 2.61 4.38 0.60 0.00 3.68 -0.98 -4.80 116.67 122.16 3a6o s ASP 511 Ca 0.14 -2.04 0.29 0.00 2.13 0.00 0.00 52.55 53.06 3a6o s ASP 511 Cb -0.15 -1.30 1.15 0.00 -1.45 0.00 0.00 42.92 41.18 3a6o s ASP 511 CO -0.18 -0.38 1.52 0.07 0.13 0.00 0.00 175.17 176.33 3a6o h LYS 512 N 7.67 0.00 0.00 4.34 2.10 -1.89 0.18 116.57 128.97 3a6o h LYS 512 Ca -0.08 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 3a6o h LYS 512 Cb 1.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.33 3a6o h LYS 512 CO 0.51 0.00 -0.01 0.37 -2.00 0.00 0.00 179.45 178.32 3a6o h GLN 513 N 0.00 0.00 0.00 0.07 5.75 -1.96 -3.34 115.11 115.63 3a6o h GLN 513 Ca 0.42 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.92 3a6o h GLN 513 Cb 2.39 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 30.94 3a6o h GLN 513 CO -0.00 0.00 -0.01 0.00 -2.65 0.00 0.00 178.83 176.16 3a6o h ALA 514 N -1.58 1.27 -5.15 3.38 0.00 -1.95 -3.46 119.26 111.76 3a6o h ALA 514 Ca 0.00 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.56 3a6o h ALA 514 Cb 0.01 -0.00 0.12 0.00 0.00 0.00 0.00 17.79 17.92 3a6o h ALA 514 CO 0.00 0.01 -0.58 -1.71 0.00 0.00 0.00 179.25 176.97 3a6o n ASN 515 N -3.49 -5.70 -4.27 0.00 4.05 0.63 -4.61 115.26 101.87 3a6o n ASN 515 Ca -0.03 -0.46 -0.38 0.00 0.45 0.00 0.00 54.58 54.16 3a6o n ASN 515 Cb 0.10 -4.38 -0.12 0.00 1.23 0.00 0.00 39.78 36.60 3a6o n ASN 515 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 177.26 173.99 3a6o s LEU 516 N -6.39 4.56 -0.10 1.20 0.20 -1.23 -2.64 118.68 114.28 3a6o s LEU 516 Ca 0.50 -1.27 -0.02 0.00 0.69 0.00 0.00 54.13 54.03 3a6o s LEU 516 Cb -0.22 -1.89 -0.03 0.00 -0.43 0.00 0.00 46.19 43.62 3a6o s LEU 516 CO 0.62 -0.39 -0.04 -0.47 -0.29 0.00 0.00 176.35 175.79 3a6o s TYR 517 N 1.39 3.04 0.06 5.38 6.14 -0.42 -2.32 117.35 130.61 3a6o s TYR 517 Ca 0.00 -0.03 0.03 0.00 0.64 0.00 0.00 57.07 57.71 3a6o s TYR 517 Cb -0.20 -1.82 -0.03 0.00 0.42 0.00 0.00 41.96 40.33 3a6o s TYR 517 CO 0.02 0.25 -0.11 0.00 0.64 0.00 0.00 175.55 176.36 3a6o s ALA 518 N -0.43 0.84 0.20 3.97 0.00 -0.26 0.12 121.76 126.20 3a6o s ALA 518 Ca 0.07 -0.88 -0.07 0.00 0.00 0.00 0.00 51.96 51.08 3a6o s ALA 518 Cb -0.12 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 3a6o s ALA 518 CO 0.02 0.06 0.27 -0.59 0.00 0.00 0.00 175.76 175.52 3a6o s PHE 519 N -1.38 0.67 -0.09 0.00 -0.71 -0.82 -0.46 117.98 115.19 3a6o s PHE 519 Ca -0.06 -0.99 -0.01 0.00 -1.04 0.00 0.00 56.93 54.83 3a6o s PHE 519 Cb -0.10 -0.18 0.03 0.00 -1.21 0.00 0.00 43.02 41.56 3a6o s PHE 519 CO 0.01 -0.76 -0.03 0.08 -1.34 0.00 0.00 175.22 173.18 3a6o s VAL 520 N -4.05 0.63 -0.02 -2.49 1.01 0.57 -0.98 120.40 115.08 3a6o s VAL 520 Ca 0.26 -0.05 -0.22 0.00 0.00 0.00 0.00 61.98 61.98 3a6o s VAL 520 Cb 0.04 -0.73 -0.05 0.00 0.00 0.00 0.00 36.38 35.64 3a6o s VAL 520 CO 0.07 0.30 0.63 -0.13 0.00 0.00 0.00 175.10 175.97 3a6o s ARG 521 N 1.80 4.37 -0.03 2.72 1.81 -0.45 -1.51 118.95 127.65 3a6o s ARG 521 Ca 0.04 0.79 0.00 0.00 -1.72 0.00 0.00 55.73 54.84 3a6o s ARG 521 Cb -0.12 -3.37 0.03 0.00 -0.45 0.00 0.00 34.95 31.03 3a6o s ARG 521 CO -0.06 0.29 -0.00 0.99 -0.68 0.00 0.00 175.30 175.84 3a6o s THR 522 N 0.06 0.21 -0.04 0.02 2.01 -1.17 -0.92 115.64 115.82 3a6o s THR 522 Ca 0.33 0.08 0.02 0.00 0.31 0.00 0.00 61.69 62.43 3a6o s THR 522 Cb -0.18 -0.31 0.01 0.00 0.01 0.00 0.00 72.50 72.03 3a6o s THR 522 CO 0.18 0.16 -0.09 0.54 -0.69 0.00 0.00 174.62 174.71 3a6o s VAL 523 N 1.10 0.83 0.00 3.82 0.11 -0.86 -1.39 120.40 124.02 3a6o s VAL 523 Ca -0.09 -0.36 0.00 0.00 -2.93 0.00 0.00 61.98 58.60 3a6o s VAL 523 Cb -0.13 -0.76 0.00 0.00 -1.53 0.00 0.00 36.38 33.96 3a6o s VAL 523 CO -0.02 0.27 0.00 1.67 -3.33 0.00 0.00 175.10 173.69 3a6o n GLN 524 N 3.48 0.00 0.00 1.54 -0.06 -1.26 -0.97 117.38 120.11 3a6o n GLN 524 Ca -0.20 0.00 0.12 0.00 -2.00 0.00 0.00 57.00 54.92 3a6o n GLN 524 Cb 0.53 0.00 0.25 0.00 -4.06 0.00 0.00 30.24 26.97 3a6o n GLN 524 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 3a6o n ASP 525 N 4.76 1.36 -4.69 1.69 10.43 -1.26 -4.91 116.55 123.93 3a6o n ASP 525 Ca 0.00 -1.11 -0.42 0.00 2.57 0.00 0.00 54.79 55.83 3a6o n ASP 525 Cb 0.00 0.25 -0.03 0.00 1.84 0.00 0.00 41.12 43.18 3a6o n ASP 525 CO 0.00 0.00 0.00 -1.58 -1.07 0.00 0.00 177.20 174.55 3a6o s GLN 526 N -2.49 4.33 -0.14 -1.24 0.74 -0.14 -4.75 119.66 115.97 3a6o s GLN 526 Ca 0.23 1.88 0.02 0.00 0.05 0.00 0.00 55.36 57.53 3a6o s GLN 526 Cb 0.19 -3.50 0.00 0.00 1.10 0.00 0.00 33.01 30.80 3a6o s GLN 526 CO 0.54 -0.48 -0.19 -1.01 -0.55 0.00 0.00 175.29 173.59 3a6o s HIS 527 N 2.03 2.71 -0.13 1.67 3.76 -1.26 -2.02 115.29 122.04 3a6o s HIS 527 Ca 0.61 -1.20 0.02 0.00 -0.15 0.00 0.00 55.06 54.33 3a6o s HIS 527 Cb -0.30 -1.84 -0.00 0.00 1.11 0.00 0.00 32.58 31.55 3a6o s HIS 527 CO 0.26 -0.55 -0.19 0.08 -0.85 0.00 0.00 174.74 173.50 3a6o s VAL 528 N 0.79 2.41 -0.17 -0.90 1.01 -0.09 -0.96 120.40 122.48 3a6o s VAL 528 Ca -0.07 -0.87 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 3a6o s VAL 528 Cb -0.16 -1.98 -0.00 0.00 0.00 0.00 0.00 36.38 34.24 3a6o s VAL 528 CO -0.01 0.54 -0.13 -0.83 0.00 0.00 0.00 175.10 174.67 3a6o s GLY 529 N 0.62 1.51 -0.14 4.51 0.00 0.32 -1.34 107.32 112.80 3a6o s GLY 529 Ca -0.10 -1.07 -0.04 0.00 0.00 0.00 0.00 44.72 43.51 3a6o s GLY 529 CO 0.03 0.12 -0.00 0.14 0.00 0.00 0.00 173.10 173.38 3a6o s VAL 530 N 0.96 4.22 -0.05 1.40 1.01 -0.15 -0.88 120.40 126.91 3a6o s VAL 530 Ca -0.02 -0.26 0.06 0.00 0.00 0.00 0.00 61.98 61.77 3a6o s VAL 530 Cb -0.15 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.39 3a6o s VAL 530 CO -0.02 0.53 -0.24 0.68 0.00 0.00 0.00 175.10 176.05 3a6o s VAL 531 N -0.09 1.95 -0.23 2.92 -7.23 0.10 -1.95 120.40 115.88 3a6o s VAL 531 Ca 0.04 -1.02 0.02 0.00 -1.81 0.00 0.00 61.98 59.20 3a6o s VAL 531 Cb -0.13 -1.65 0.05 0.00 0.56 0.00 0.00 36.38 35.22 3a6o s VAL 531 CO 0.02 0.55 -0.11 -0.76 -0.31 0.00 0.00 175.10 174.49 3a6o s LEU 532 N -0.24 2.92 -1.22 1.32 1.43 0.12 -1.40 118.68 121.61 3a6o s LEU 532 Ca -0.01 -1.18 -0.12 0.00 -1.03 0.00 0.00 54.13 51.80 3a6o s LEU 532 Cb -0.12 -1.41 0.18 0.00 0.03 0.00 0.00 46.19 44.86 3a6o s LEU 532 CO 0.02 -0.17 1.51 -3.20 0.23 0.00 0.00 176.35 174.74 3a6o n ASN 533 N 4.54 5.24 -3.19 2.29 5.15 -0.48 -1.30 115.26 127.51 3a6o n ASN 533 Ca -0.15 -3.02 -0.36 0.00 -0.60 0.00 0.00 54.58 50.46 3a6o n ASN 533 Cb 0.44 -1.53 -0.03 0.00 -0.53 0.00 0.00 39.78 38.13 3a6o n ASN 533 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 3a6o n ASN 534 N 5.00 7.79 -3.93 1.20 5.15 -1.08 -1.64 115.26 127.74 3a6o n ASN 534 Ca 0.36 -2.99 -0.10 0.00 -0.60 0.00 0.00 54.58 51.26 3a6o n ASN 534 Cb 0.41 -1.39 -0.12 0.00 -0.53 0.00 0.00 39.78 38.15 3a6o n ASN 534 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 3a6o s ARG 535 N -0.39 0.25 0.51 1.20 3.00 -1.26 -4.85 118.95 117.41 3a6o s ARG 535 Ca 0.59 -0.40 0.22 0.00 -1.00 0.00 0.00 55.73 55.15 3a6o s ARG 535 Cb 0.22 0.09 1.35 0.00 0.00 0.00 0.00 34.95 36.62 3a6o s ARG 535 CO -0.10 -0.04 2.08 0.78 0.00 0.00 0.00 175.30 178.02 3a6o h GLY 536 N 5.02 0.00 0.00 8.12 0.00 -1.95 -1.94 103.07 112.32 3a6o h GLY 536 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.03 3a6o h GLY 536 CO 0.43 0.00 0.00 -1.84 0.00 0.00 0.00 176.54 175.13 3a6o n GLU 537 N -3.97 1.11 -4.31 4.80 0.28 -1.26 -4.68 120.64 112.60 3a6o n GLU 537 Ca -0.02 0.00 -0.34 0.00 -0.16 0.00 0.00 57.16 56.64 3a6o n GLU 537 Cb 0.20 0.00 -0.14 0.00 1.43 0.00 0.00 31.44 32.93 3a6o n GLU 537 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 3a6o s LYS 538 N -1.85 3.42 0.28 3.44 2.20 -1.26 -3.45 119.74 122.52 3a6o s LYS 538 Ca 0.00 -0.64 0.05 0.00 -0.36 0.00 0.00 55.97 55.03 3a6o s LYS 538 Cb 0.00 -2.84 -0.06 0.00 -1.51 0.00 0.00 37.83 33.42 3a6o s LYS 538 CO 0.00 0.02 -0.02 -0.65 -0.36 0.00 0.00 175.35 174.34 3a6o s GLN 539 N 0.88 1.54 0.07 4.03 -0.21 -1.10 -4.96 119.66 119.92 3a6o s GLN 539 Ca -0.02 -1.80 0.07 0.00 0.02 0.00 0.00 55.36 53.64 3a6o s GLN 539 Cb -0.15 -1.00 -0.04 0.00 1.00 0.00 0.00 33.01 32.82 3a6o s GLN 539 CO 0.01 -0.04 -0.16 0.99 -2.12 0.00 0.00 175.29 173.97 3a6o s THR 540 N -3.14 2.97 0.03 -0.19 2.01 -1.26 -1.11 115.64 114.95 3a6o s THR 540 Ca 0.31 -1.27 -0.07 0.00 0.31 0.00 0.00 61.69 60.96 3a6o s THR 540 Cb 0.05 -2.32 -0.00 0.00 0.01 0.00 0.00 72.50 70.25 3a6o s THR 540 CO 0.12 0.23 0.14 0.68 -0.69 0.00 0.00 174.62 175.10 3a6o s VAL 541 N -1.05 0.11 -0.32 3.82 -7.23 -0.61 -4.96 120.40 110.16 3a6o s VAL 541 Ca 0.17 -0.92 0.01 0.00 -1.81 0.00 0.00 61.98 59.43 3a6o s VAL 541 Cb -0.11 -0.79 0.08 0.00 0.56 0.00 0.00 36.38 36.13 3a6o s VAL 541 CO 0.08 -0.51 0.03 -0.76 -0.31 0.00 0.00 175.10 173.64 3a6o s LEU 542 N -1.93 4.32 -0.10 1.32 1.43 -1.26 -1.04 118.68 121.42 3a6o s LEU 542 Ca -0.07 -1.72 -0.17 0.00 -1.03 0.00 0.00 54.13 51.14 3a6o s LEU 542 Cb -0.03 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.47 3a6o s LEU 542 CO -0.03 -0.34 0.43 -0.76 0.23 0.00 0.00 176.35 175.88 3a6o s LEU 543 N 1.09 4.32 -0.45 1.79 1.43 0.09 -4.88 118.68 122.07 3a6o s LEU 543 Ca 0.01 0.79 -0.28 0.00 -1.03 0.00 0.00 54.13 53.63 3a6o s LEU 543 Cb -0.20 -2.61 -0.02 0.00 0.03 0.00 0.00 46.19 43.39 3a6o s LEU 543 CO -0.05 0.09 1.80 -1.10 0.23 0.00 0.00 176.35 177.33 3a6o s GLN 544 N 0.20 3.06 -0.33 1.70 -1.52 -1.26 -1.22 119.66 120.30 3a6o s GLN 544 Ca 0.24 1.08 0.03 0.00 -1.95 0.00 0.00 55.36 54.75 3a6o s GLN 544 Cb -0.15 -4.26 0.10 0.00 -0.22 0.00 0.00 33.01 28.48 3a6o s GLN 544 CO 0.10 -2.19 0.06 0.14 -0.25 0.00 0.00 175.29 173.14 3a6o s VAL 545 N 7.70 1.97 0.66 1.09 -7.23 0.11 -4.96 120.40 119.73 3a6o s VAL 545 Ca 0.74 -2.13 -0.17 0.00 -1.81 0.00 0.00 61.98 58.61 3a6o s VAL 545 Cb -0.18 -2.46 -0.00 0.00 0.56 0.00 0.00 36.38 34.30 3a6o s VAL 545 CO 0.28 -0.61 1.18 -2.16 -0.31 0.00 0.00 175.10 173.49 3a6o s PRO 546 N 1.06 2.63 0.41 4.82 0.04 -1.26 -3.93 135.00 138.77 3a6o s PRO 546 Ca 0.10 1.70 0.14 0.00 0.04 0.00 0.00 61.00 62.98 3a6o s PRO 546 Cb -0.19 -1.90 0.98 0.00 0.04 0.00 0.00 34.50 33.43 3a6o s PRO 546 CO -0.12 -1.44 1.91 0.93 0.04 0.00 0.00 177.00 178.33 3a6o h GLU 547 N 0.27 0.48 -0.51 4.56 4.39 -1.92 -2.16 114.58 119.69 3a6o h GLU 547 Ca -0.49 -0.03 0.10 0.00 0.34 0.00 0.00 59.36 59.28 3a6o h GLU 547 Cb 1.28 -0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 29.75 3a6o h GLU 547 CO 0.53 0.32 0.03 1.03 -1.16 0.00 0.00 179.01 179.76 3a6o h SER 548 N 0.50 -0.16 0.00 1.42 0.87 -2.04 -3.03 113.55 111.11 3a6o h SER 548 Ca 0.38 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 61.05 3a6o h SER 548 Cb 0.77 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.92 3a6o h SER 548 CO -0.14 -0.05 0.00 0.61 -0.53 0.00 0.00 176.83 176.72 3a6o n GLY 549 N -1.31 0.11 0.00 5.77 0.00 -0.81 -4.95 105.19 103.99 3a6o n GLY 549 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3a6o n GLY 549 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a6o n GLY 550 N 0.12 -0.37 0.00 -0.02 0.00 -1.15 -4.93 105.19 98.85 3a6o n GLY 550 Ca 0.00 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.29 3a6o n GLY 550 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3a6o n LYS 551 N -0.34 0.63 -5.06 1.61 2.85 -1.26 -4.49 118.16 112.09 3a6o n LYS 551 Ca 0.00 0.00 -0.31 0.00 -1.05 0.00 0.00 58.31 56.95 3a6o n LYS 551 Cb 0.00 -0.05 -0.17 0.00 -0.65 0.00 0.00 35.03 34.16 3a6o n LYS 551 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 3a6o s THR 552 N 0.00 1.96 0.23 0.58 2.01 -1.26 -0.68 115.64 118.49 3a6o s THR 552 Ca 0.00 -0.96 0.11 0.00 0.31 0.00 0.00 61.69 61.15 3a6o s THR 552 Cb 0.00 -1.71 -0.05 0.00 0.01 0.00 0.00 72.50 70.75 3a6o s THR 552 CO 0.00 0.54 -0.20 0.26 -0.69 0.00 0.00 174.62 174.53 3a6o s TRP 553 N 0.46 2.12 -0.16 4.92 0.51 -0.33 -4.49 118.94 121.96 3a6o s TRP 553 Ca -0.17 -0.40 -0.00 0.00 -2.12 0.00 0.00 56.10 53.41 3a6o s TRP 553 Cb -0.17 -0.97 -0.00 0.00 -0.81 0.00 0.00 33.47 31.51 3a6o s TRP 553 CO 0.07 0.55 -0.14 -1.17 -0.51 0.00 0.00 176.95 175.75 3a6o s LEU 554 N -3.17 2.54 -0.30 2.99 2.96 -0.26 -1.34 118.68 122.11 3a6o s LEU 554 Ca 0.25 -0.44 -0.29 0.00 -0.22 0.00 0.00 54.13 53.42 3a6o s LEU 554 Cb -0.05 -1.58 -0.00 0.00 0.50 0.00 0.00 46.19 45.06 3a6o s LEU 554 CO 0.11 0.09 1.34 -0.62 -1.32 0.00 0.00 176.35 175.95 3a6o s ASP 555 N 0.80 6.63 0.48 3.68 3.68 0.05 0.13 116.67 132.12 3a6o s ASP 555 Ca -0.05 1.22 0.25 0.00 2.13 0.00 0.00 52.55 56.10 3a6o s ASP 555 Cb -0.15 -2.54 1.23 0.00 -1.45 0.00 0.00 42.92 40.00 3a6o s ASP 555 CO 0.00 -1.11 1.98 0.00 0.13 0.00 0.00 175.17 176.17 3a6o h LEU 557 N 0.00 0.21 0.00 0.00 3.38 -1.92 -3.38 115.31 113.60 3a6o h LEU 557 Ca -0.00 -0.31 -0.21 0.00 0.09 0.00 0.00 57.88 57.44 3a6o h LEU 557 Cb 0.48 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 3a6o h LEU 557 CO 0.02 1.26 -1.82 0.35 0.09 0.00 0.00 178.44 178.34 3a6o n THR 558 N -3.33 0.80 0.00 0.22 -2.24 -1.21 -5.01 114.28 103.51 3a6o n THR 558 Ca -0.14 -0.51 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 3a6o n THR 558 Cb 1.02 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 3a6o n THR 558 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a6o n GLY 559 N 2.23 0.28 3.76 3.38 0.00 0.15 -5.06 105.19 109.93 3a6o n GLY 559 Ca -0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 3a6o n GLY 559 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3a6o s GLU 560 N -0.94 3.56 -0.11 1.61 2.12 -1.24 -4.68 118.70 119.02 3a6o s GLU 560 Ca 0.00 2.08 -0.02 0.00 0.36 0.00 0.00 54.97 57.38 3a6o s GLU 560 Cb 0.00 -2.44 -0.03 0.00 0.26 0.00 0.00 34.13 31.92 3a6o s GLU 560 CO 0.00 -0.81 -0.01 -2.00 -0.54 0.00 0.00 175.26 171.90 3a6o s GLU 561 N -2.67 3.21 0.04 4.30 2.12 -1.26 -0.77 118.70 123.67 3a6o s GLU 561 Ca 0.65 -0.45 0.03 0.00 0.36 0.00 0.00 54.97 55.56 3a6o s GLU 561 Cb -0.36 -2.83 -0.02 0.00 0.26 0.00 0.00 34.13 31.18 3a6o s GLU 561 CO 0.44 0.54 -0.09 0.14 -0.54 0.00 0.00 175.26 175.76 3a6o s VAL 562 N -0.45 0.67 -0.03 3.70 -7.23 -0.45 -4.99 120.40 111.61 3a6o s VAL 562 Ca 0.08 -0.93 0.03 0.00 -1.81 0.00 0.00 61.98 59.35 3a6o s VAL 562 Cb -0.12 -0.67 0.00 0.00 0.56 0.00 0.00 36.38 36.15 3a6o s VAL 562 CO 0.02 -0.21 -0.12 -1.00 -0.31 0.00 0.00 175.10 173.48 3a6o s HIS 563 N -1.05 1.24 -0.46 2.82 3.76 -1.26 -1.19 115.29 119.15 3a6o s HIS 563 Ca -0.05 -0.34 -0.10 0.00 -0.15 0.00 0.00 55.06 54.42 3a6o s HIS 563 Cb -0.08 -0.86 0.11 0.00 1.11 0.00 0.00 32.58 32.85 3a6o s HIS 563 CO 0.01 -0.13 0.34 0.20 -0.85 0.00 0.00 174.74 174.30 3a6o s GLY 564 N 0.17 2.02 -0.30 -2.22 0.00 0.15 -4.57 107.32 102.57 3a6o s GLY 564 Ca -0.04 -2.40 -0.29 0.00 0.00 0.00 0.00 44.72 41.99 3a6o s GLY 564 CO 0.01 1.07 1.29 -1.59 0.00 0.00 0.00 173.10 173.88 3a6o s LYS 565 N 1.41 3.93 -0.28 2.90 0.00 -1.11 -4.58 119.74 122.02 3a6o s LYS 565 Ca 0.05 1.25 -0.00 0.00 0.00 0.00 0.00 55.97 57.26 3a6o s LYS 565 Cb -0.25 -3.87 -0.00 0.00 0.00 0.00 0.00 37.83 33.70 3a6o s LYS 565 CO 0.01 -1.10 0.23 1.04 0.00 0.00 0.00 175.35 175.53 3a6o n GLN 566 N 7.28 -1.39 -0.94 1.78 6.02 -1.26 -3.22 117.38 125.65 3a6o n GLN 566 Ca 0.15 0.20 0.00 0.00 -0.01 0.00 0.00 57.00 57.34 3a6o n GLN 566 Cb 0.47 -3.17 0.00 0.00 1.02 0.00 0.00 30.24 28.56 3a6o n GLN 566 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3a6o n GLY 567 N -1.10 0.24 3.14 1.08 0.00 -1.26 -4.99 105.19 102.30 3a6o n GLY 567 Ca -0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.76 3a6o n GLY 567 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3a6o s GLN 568 N -1.08 0.95 -0.22 1.61 -0.21 -1.20 -0.72 119.66 118.80 3a6o s GLN 568 Ca 0.00 -0.74 0.02 0.00 0.02 0.00 0.00 55.36 54.65 3a6o s GLN 568 Cb 0.00 -0.95 0.04 0.00 1.00 0.00 0.00 33.01 33.09 3a6o s GLN 568 CO 0.00 0.24 -0.16 -1.17 -2.12 0.00 0.00 175.29 172.08 3a6o s LEU 569 N -1.09 2.73 -0.18 2.90 2.96 -0.36 -2.74 118.68 122.89 3a6o s LEU 569 Ca 0.02 -0.99 -0.19 0.00 -0.22 0.00 0.00 54.13 52.74 3a6o s LEU 569 Cb -0.08 -1.51 -0.03 0.00 0.50 0.00 0.00 46.19 45.07 3a6o s LEU 569 CO 0.01 -0.09 0.55 -0.75 -1.32 0.00 0.00 176.35 174.75 3a6o s LYS 570 N 1.21 4.22 -0.03 1.98 2.20 -1.26 -0.73 119.74 127.34 3a6o s LYS 570 Ca -0.01 0.49 0.01 0.00 -0.36 0.00 0.00 55.97 56.09 3a6o s LYS 570 Cb -0.16 -3.55 0.02 0.00 -1.51 0.00 0.00 37.83 32.63 3a6o s LYS 570 CO -0.09 -0.13 -0.01 -1.17 -0.36 0.00 0.00 175.35 173.59 3a6o s LEU 571 N 1.55 1.32 -0.23 5.43 2.96 -0.21 -4.96 118.68 124.54 3a6o s LEU 571 Ca 0.26 -0.05 -0.00 0.00 -0.22 0.00 0.00 54.13 54.12 3a6o s LEU 571 Cb -0.16 -0.25 0.03 0.00 0.50 0.00 0.00 46.19 46.31 3a6o s LEU 571 CO 0.10 -0.07 -0.11 -0.89 -1.32 0.00 0.00 176.35 174.06 3a6o s THR 572 N 0.84 2.55 0.09 3.68 2.01 -1.26 -1.57 115.64 121.98 3a6o s THR 572 Ca -0.09 -1.06 0.04 0.00 0.31 0.00 0.00 61.69 60.89 3a6o s THR 572 Cb -0.12 -2.26 -0.04 0.00 0.01 0.00 0.00 72.50 70.09 3a6o s THR 572 CO -0.01 0.28 0.06 -0.76 -0.69 0.00 0.00 174.62 173.50 3a6o s LEU 573 N 1.29 3.69 0.51 4.42 2.01 -0.26 -5.00 118.68 125.34 3a6o s LEU 573 Ca 0.01 -0.07 -0.05 0.00 0.01 0.00 0.00 54.13 54.02 3a6o s LEU 573 Cb -0.16 -2.39 -0.03 0.00 0.01 0.00 0.00 46.19 43.63 3a6o s LEU 573 CO -0.07 0.17 0.81 -0.60 1.01 0.00 0.00 176.35 177.67 3a6o s ARG 574 N -2.41 3.39 0.13 1.70 3.52 -1.26 -2.70 118.95 121.31 3a6o s ARG 574 Ca 0.28 0.14 -0.35 0.00 -0.13 0.00 0.00 55.73 55.67 3a6o s ARG 574 Cb -0.12 -2.35 -0.15 0.00 -1.56 0.00 0.00 34.95 30.76 3a6o s ARG 574 CO 0.21 -0.32 1.44 -2.30 -0.81 0.00 0.00 175.30 173.52 3a6o n PRO 575 N -2.33 1.60 -1.23 5.12 -0.02 -1.22 0.18 135.00 137.10 3a6o n PRO 575 Ca 0.01 0.58 -0.11 0.00 -2.02 0.00 0.00 63.50 61.97 3a6o n PRO 575 Cb 0.56 -2.27 -0.05 0.00 -0.02 0.00 0.00 33.50 31.72 3a6o n PRO 575 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3a6o n TYR 576 N 2.85 -0.18 -2.52 6.00 4.02 -0.65 -4.96 117.16 121.71 3a6o n TYR 576 Ca 0.17 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.68 3a6o n TYR 576 Cb 0.24 -2.46 -0.04 0.00 -0.02 0.00 0.00 39.34 37.06 3a6o n TYR 576 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 3a6o s GLN 577 N -2.74 4.44 0.01 -0.72 0.74 0.13 -4.70 119.66 116.83 3a6o s GLN 577 Ca 0.00 1.66 0.08 0.00 0.05 0.00 0.00 55.36 57.14 3a6o s GLN 577 Cb 0.00 -2.91 -0.02 0.00 1.10 0.00 0.00 33.01 31.18 3a6o s GLN 577 CO 0.00 0.08 -0.23 0.20 -0.55 0.00 0.00 175.29 174.78 3a6o s GLY 578 N -1.20 1.20 0.04 2.59 0.00 -1.26 -1.39 107.32 107.30 3a6o s GLY 578 Ca 0.50 -1.08 0.07 0.00 0.00 0.00 0.00 44.72 44.21 3a6o s GLY 578 CO 0.35 -0.95 -0.16 1.06 0.00 0.00 0.00 173.10 173.39 3a6o s MET 579 N -0.89 2.11 -0.40 2.90 1.00 -0.49 -4.94 119.30 118.58 3a6o s MET 579 Ca 0.09 -0.97 0.03 0.00 0.00 0.00 0.00 55.69 54.85 3a6o s MET 579 Cb -0.09 -2.23 0.11 0.00 0.00 0.00 0.00 34.83 32.62 3a6o s MET 579 CO 0.01 0.54 0.13 0.42 0.00 0.00 0.00 175.02 176.12 3a6o s ILE 580 N -0.96 2.48 -0.45 2.53 1.01 -1.26 0.03 121.20 124.58 3a6o s ILE 580 Ca 0.15 -2.63 -0.19 0.00 0.00 0.00 0.00 60.65 57.99 3a6o s ILE 580 Cb -0.11 -2.78 0.03 0.00 0.01 0.00 0.00 42.46 39.61 3a6o s ILE 580 CO 0.06 -0.67 0.56 -0.76 0.00 0.00 0.00 174.94 174.13 3a6o s LEU 581 N 0.54 4.75 -0.15 2.97 1.02 -0.06 -0.47 118.68 127.28 3a6o s LEU 581 Ca 0.13 -0.60 -0.17 0.00 0.02 0.00 0.00 54.13 53.51 3a6o s LEU 581 Cb -0.21 -2.54 -0.04 0.00 0.02 0.00 0.00 46.19 43.42 3a6o s LEU 581 CO -0.05 -0.73 0.42 0.86 0.02 0.00 0.00 176.35 176.87 3a6o s TRP 582 N 2.51 3.46 -0.68 0.29 -0.00 0.12 -0.52 118.94 124.13 3a6o s TRP 582 Ca 0.17 0.76 0.00 0.00 -0.00 0.00 0.00 56.10 57.03 3a6o s TRP 582 Cb -0.16 -2.51 0.00 0.00 -0.00 0.00 0.00 33.47 30.80 3a6o s TRP 582 CO 0.15 0.12 0.58 0.27 -0.00 0.00 0.00 176.95 178.07 3a6o n ASN 583 N 3.91 1.43 0.00 5.86 6.94 -0.14 -1.10 115.26 132.17 3a6o n ASN 583 Ca -0.08 -1.74 0.00 0.00 -0.02 0.00 0.00 54.58 52.74 3a6o n ASN 583 Cb 0.51 -0.44 0.00 0.00 -2.36 0.00 0.00 39.78 37.50 3a6o n ASN 583 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3a6o n GLY 584 N 0.23 0.95 0.05 4.83 0.00 -1.26 -4.86 105.19 105.13 3a6o n GLY 584 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.18 3a6o n GLY 584 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86