#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mru n THR 2 N 0.00 0.24 -2.96 2.03 -2.24 -1.26 -4.63 114.28 105.46 1mru n THR 2 Ca 0.00 0.06 -0.40 0.00 -2.27 0.00 0.00 64.05 61.44 1mru n THR 2 Cb 0.00 -0.65 -0.04 0.00 -2.10 0.00 0.00 70.33 67.53 1mru n THR 2 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1mru s THR 3 N -2.66 5.00 0.81 4.28 -4.23 -1.26 -5.03 115.64 112.55 1mru s THR 3 Ca 0.21 1.60 -0.09 0.00 -1.18 0.00 0.00 61.69 62.22 1mru s THR 3 Cb 0.16 -4.11 0.08 0.00 1.34 0.00 0.00 72.50 69.98 1mru s THR 3 CO 0.39 0.22 0.09 -2.65 -0.54 0.00 0.00 174.62 172.12 1mru n PRO 4 N 3.89 -1.27 -0.02 3.99 -0.02 -1.26 -4.96 135.00 135.35 1mru n PRO 4 Ca 0.01 -0.38 0.06 0.00 -2.02 0.00 0.00 63.50 61.17 1mru n PRO 4 Cb 0.51 -1.26 -0.13 0.00 -0.02 0.00 0.00 33.50 32.60 1mru n PRO 4 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1mru n SER 5 N 0.65 1.08 -3.62 2.55 7.64 -1.26 -4.75 113.62 115.92 1mru n SER 5 Ca 0.03 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.62 1mru n SER 5 Cb 0.24 1.63 -0.15 0.00 -1.01 0.00 0.00 64.21 64.92 1mru n SER 5 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1mru s HIS 6 N -3.05 0.92 -0.03 1.43 3.76 -1.25 -2.19 115.29 114.87 1mru s HIS 6 Ca -0.07 -1.29 -0.30 0.00 -0.15 0.00 0.00 55.06 53.25 1mru s HIS 6 Cb 0.10 -1.24 -0.04 0.00 1.11 0.00 0.00 32.58 32.50 1mru s HIS 6 CO 0.70 -0.85 1.35 -0.51 -0.85 0.00 0.00 174.74 174.59 1mru s LEU 7 N 1.82 4.29 -1.44 0.89 1.43 0.43 -1.99 118.68 124.11 1mru s LEU 7 Ca 0.10 2.00 0.00 0.00 -1.03 0.00 0.00 54.13 55.20 1mru s LEU 7 Cb -0.17 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.49 1mru s LEU 7 CO -0.30 -0.70 0.00 -1.20 0.23 0.00 0.00 176.35 174.38 1mru n SER 8 N 5.58 -3.99 -0.41 2.29 7.64 -1.26 -0.82 113.62 122.64 1mru n SER 8 Ca 0.13 0.29 -0.04 0.00 1.01 0.00 0.00 58.87 60.25 1mru n SER 8 Cb 0.44 -3.58 -0.02 0.00 -1.01 0.00 0.00 64.21 60.05 1mru n SER 8 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1mru n ASP 9 N -1.04 -4.52 -0.08 6.43 8.00 -0.84 -4.72 116.55 119.78 1mru n ASP 9 Ca -0.15 0.11 -0.11 0.00 0.71 0.00 0.00 54.79 55.35 1mru n ASP 9 Cb 0.52 -3.10 -0.07 0.00 -0.02 0.00 0.00 41.12 38.45 1mru n ASP 9 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1mru n ARG 10 N -0.02 0.37 -3.65 -1.24 0.63 -0.00 -4.96 116.66 107.79 1mru n ARG 10 Ca -0.04 0.09 -0.37 0.00 -0.92 0.00 0.00 57.85 56.60 1mru n ARG 10 Cb 0.43 -1.29 -0.10 0.00 0.45 0.00 0.00 32.46 31.94 1mru n ARG 10 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1mru s TYR 11 N -2.30 3.27 -0.41 -0.14 2.02 -0.83 -1.68 117.35 117.28 1mru s TYR 11 Ca -0.20 0.17 -0.15 0.00 -0.37 0.00 0.00 57.07 56.52 1mru s TYR 11 Cb 0.05 -2.30 0.03 0.00 -0.40 0.00 0.00 41.96 39.34 1mru s TYR 11 CO 0.34 -0.02 0.30 -2.00 -1.57 0.00 0.00 175.55 172.60 1mru s GLU 12 N 1.30 2.95 0.40 -0.62 2.12 -0.51 -0.43 118.70 123.92 1mru s GLU 12 Ca 0.07 -1.06 -0.25 0.00 0.36 0.00 0.00 54.97 54.10 1mru s GLU 12 Cb -0.14 -3.96 -0.08 0.00 0.26 0.00 0.00 34.13 30.20 1mru s GLU 12 CO 0.07 -0.77 1.13 -0.51 -0.54 0.00 0.00 175.26 174.63 1mru s LEU 13 N 1.66 4.16 0.00 2.70 1.43 -0.93 -0.15 118.68 127.55 1mru s LEU 13 Ca 0.05 2.23 0.00 0.00 -1.03 0.00 0.00 54.13 55.38 1mru s LEU 13 Cb -0.19 -4.10 0.00 0.00 0.03 0.00 0.00 46.19 41.93 1mru s LEU 13 CO 0.09 -0.64 0.00 0.61 0.23 0.00 0.00 176.35 176.65 1mru n GLY 14 N 0.53 3.77 3.75 -3.19 0.00 0.29 -4.91 105.19 105.42 1mru n GLY 14 Ca 0.05 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 45.13 1mru n GLY 14 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1mru s GLU 15 N 4.28 2.95 -0.13 1.61 -1.05 -1.25 -4.57 118.70 120.54 1mru s GLU 15 Ca 0.00 2.02 -0.24 0.00 -0.15 0.00 0.00 54.97 56.60 1mru s GLU 15 Cb 0.00 -2.04 -0.03 0.00 -0.44 0.00 0.00 34.13 31.63 1mru s GLU 15 CO 0.00 -1.27 0.75 -1.50 0.95 0.00 0.00 175.26 174.18 1mru s ILE 16 N -1.44 4.97 -0.02 1.83 2.07 -1.26 -0.57 121.20 126.78 1mru s ILE 16 Ca 0.76 1.49 -0.21 0.00 -1.41 0.00 0.00 60.65 61.29 1mru s ILE 16 Cb -0.35 -4.07 -0.28 0.00 0.13 0.00 0.00 42.46 37.89 1mru s ILE 16 CO 0.40 0.14 0.99 -0.07 -1.91 0.00 0.00 174.94 174.49 1mru h LEU 17 N 7.62 0.52 -7.92 8.50 3.38 -0.02 -3.47 115.31 123.91 1mru h LEU 17 Ca -0.35 -0.86 0.28 0.00 0.09 0.00 0.00 57.88 57.04 1mru h LEU 17 Cb 1.16 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.69 1mru h LEU 17 CO 0.79 1.33 0.79 -0.83 0.09 0.00 0.00 178.44 180.61 1mru s GLY 18 N -4.28 -0.06 -0.21 0.83 0.00 -0.90 -5.00 107.32 97.70 1mru s GLY 18 Ca -0.13 -0.06 -0.08 0.00 0.00 0.00 0.00 44.72 44.45 1mru s GLY 18 CO 0.83 4.27 0.47 -0.11 0.00 0.00 0.00 173.10 178.57 1mru s PHE 19 N -2.10 -0.86 0.00 1.90 -0.12 -1.26 0.14 117.98 115.69 1mru s PHE 19 Ca 0.26 1.64 0.00 0.00 -0.05 0.00 0.00 56.93 58.78 1mru s PHE 19 Cb -0.01 0.40 0.00 0.00 -0.63 0.00 0.00 43.02 42.78 1mru s PHE 19 CO 0.01 -0.49 0.00 0.41 -0.05 0.00 0.00 175.22 175.11 1mru n GLY 20 N 5.09 0.33 0.30 1.99 0.00 -0.25 -4.95 105.19 107.70 1mru n GLY 20 Ca -0.13 -1.86 0.04 0.00 0.00 0.00 0.00 46.02 44.07 1mru n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mru n GLY 21 N 5.00 -0.26 1.45 -0.02 0.00 -1.26 -4.11 105.19 105.99 1mru n GLY 21 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1mru n GLY 21 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1mru n MET 22 N -0.06 0.00 -2.58 1.61 0.00 -1.26 -5.04 117.12 109.78 1mru n MET 22 Ca 0.07 0.00 -0.07 0.00 -0.00 0.00 0.00 57.70 57.71 1mru n MET 22 Cb 0.15 -0.27 -0.02 0.00 0.00 0.00 0.00 33.22 33.08 1mru n MET 22 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1mru n SER 23 N -2.75 1.65 -4.05 6.12 3.41 -1.26 0.70 113.62 117.44 1mru n SER 23 Ca 0.00 -1.51 -0.21 0.00 -0.26 0.00 0.00 58.87 56.89 1mru n SER 23 Cb 0.26 0.16 -0.15 0.00 -0.26 0.00 0.00 64.21 64.22 1mru n SER 23 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1mru s GLU 24 N -2.39 1.02 -0.17 4.33 8.01 -0.57 -1.09 118.70 127.83 1mru s GLU 24 Ca 0.02 -0.40 -0.02 0.00 0.01 0.00 0.00 54.97 54.59 1mru s GLU 24 Cb 0.00 -0.96 -0.01 0.00 -4.31 0.00 0.00 34.13 28.85 1mru s GLU 24 CO 0.02 0.21 -0.10 0.08 0.01 0.00 0.00 175.26 175.48 1mru s VAL 25 N -0.12 3.13 0.36 2.63 1.01 0.38 -0.54 120.40 127.26 1mru s VAL 25 Ca 0.02 -0.60 0.08 0.00 0.00 0.00 0.00 61.98 61.48 1mru s VAL 25 Cb -0.06 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 1mru s VAL 25 CO -0.00 0.48 0.15 -1.00 0.00 0.00 0.00 175.10 174.74 1mru s HIS 26 N 0.92 2.67 -0.34 5.22 3.76 -0.76 0.69 115.29 127.45 1mru s HIS 26 Ca -0.02 -0.44 -0.10 0.00 -0.15 0.00 0.00 55.06 54.35 1mru s HIS 26 Cb -0.15 -1.73 0.01 0.00 1.11 0.00 0.00 32.58 31.82 1mru s HIS 26 CO -0.00 0.29 0.17 -1.17 -0.85 0.00 0.00 174.74 173.18 1mru s LEU 27 N -3.87 4.36 0.00 0.89 2.96 0.26 -1.90 118.68 121.38 1mru s LEU 27 Ca 0.39 -0.73 0.00 0.00 -0.22 0.00 0.00 54.13 53.57 1mru s LEU 27 Cb -0.01 -2.01 -0.00 0.00 0.50 0.00 0.00 46.19 44.67 1mru s LEU 27 CO 0.23 -0.27 0.00 0.00 -1.32 0.00 0.00 176.35 174.99 1mru n ALA 28 N 4.98 0.40 -3.01 5.97 0.00 0.41 0.10 120.51 129.37 1mru n ALA 28 Ca -0.13 -2.09 -0.22 0.00 0.00 0.00 0.00 53.44 50.99 1mru n ALA 28 Cb 0.48 1.15 -0.16 0.00 0.00 0.00 0.00 19.45 20.92 1mru n ALA 28 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1mru s ARG 29 N -3.68 1.27 -0.68 0.00 3.52 0.79 -1.21 118.95 118.96 1mru s ARG 29 Ca 0.01 -0.41 -0.26 0.00 -0.13 0.00 0.00 55.73 54.93 1mru s ARG 29 Cb 0.00 -1.14 0.04 0.00 -1.56 0.00 0.00 34.95 32.29 1mru s ARG 29 CO 0.00 0.15 1.18 0.34 -0.81 0.00 0.00 175.30 176.16 1mru s ASP 30 N 0.17 6.23 0.08 -2.12 -1.08 -0.47 -1.42 116.67 118.06 1mru s ASP 30 Ca -0.04 -0.43 0.12 0.00 -0.52 0.00 0.00 52.55 51.69 1mru s ASP 30 Cb -0.10 -2.52 0.55 0.00 -1.46 0.00 0.00 42.92 39.39 1mru s ASP 30 CO 0.01 -1.65 1.38 0.18 0.52 0.00 0.00 175.17 175.62 1mru n LEU 31 N 8.73 0.17 -0.10 -1.34 4.77 -0.68 0.53 117.00 129.08 1mru n LEU 31 Ca 0.03 0.55 -0.15 0.00 -0.03 0.00 0.00 56.01 56.41 1mru n LEU 31 Cb 0.48 -0.55 -0.06 0.00 -2.33 0.00 0.00 43.42 40.96 1mru n LEU 31 CO 0.69 -0.45 -0.71 0.54 -1.33 0.00 0.00 177.39 176.13 1mru n ARG 32 N -1.70 0.53 0.00 3.23 1.74 -1.26 -4.49 116.66 114.71 1mru n ARG 32 Ca 0.02 0.40 0.14 0.00 -0.77 0.00 0.00 57.85 57.64 1mru n ARG 32 Cb 0.11 -1.59 0.62 0.00 -1.02 0.00 0.00 32.46 30.58 1mru n ARG 32 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1mru n LEU 33 N -4.46 0.31 -3.75 0.55 4.77 -1.17 -4.95 117.00 108.29 1mru n LEU 33 Ca -0.25 0.12 -0.22 0.00 -0.03 0.00 0.00 56.01 55.64 1mru n LEU 33 Cb 0.56 -0.24 0.02 0.00 -2.33 0.00 0.00 43.42 41.43 1mru n LEU 33 CO 0.14 0.06 -0.10 1.41 -1.33 0.00 0.00 177.39 177.56 1mru n HIS 34 N -1.13 -1.85 -4.05 -1.77 8.25 0.19 -5.00 115.22 109.86 1mru n HIS 34 Ca 0.13 0.82 -0.11 0.00 -0.26 0.00 0.00 57.72 58.29 1mru n HIS 34 Cb 0.28 -4.25 -0.11 0.00 1.12 0.00 0.00 29.99 27.02 1mru n HIS 34 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1mru s ARG 35 N -6.10 0.50 0.18 -0.41 1.70 -1.22 -4.96 118.95 108.64 1mru s ARG 35 Ca 0.00 -0.78 -0.27 0.00 -0.47 0.00 0.00 55.73 54.21 1mru s ARG 35 Cb -0.00 -0.16 -0.08 0.00 -0.57 0.00 0.00 34.95 34.14 1mru s ARG 35 CO 0.83 0.01 0.84 -0.51 -1.08 0.00 0.00 175.30 175.39 1mru s ASP 36 N -1.72 7.47 0.12 -2.89 1.01 -1.26 -1.37 116.67 118.03 1mru s ASP 36 Ca -0.09 1.74 -0.01 0.00 0.71 0.00 0.00 52.55 54.90 1mru s ASP 36 Cb -0.08 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 1mru s ASP 36 CO -0.01 0.16 0.02 0.68 0.21 0.00 0.00 175.17 176.23 1mru s VAL 37 N -0.97 0.23 -0.19 -1.27 -7.23 -0.35 -4.50 120.40 106.11 1mru s VAL 37 Ca 0.39 -1.90 -0.10 0.00 -1.81 0.00 0.00 61.98 58.56 1mru s VAL 37 Cb -0.24 -1.92 -0.05 0.00 0.56 0.00 0.00 36.38 34.73 1mru s VAL 37 CO 0.28 -0.60 0.13 0.00 -0.31 0.00 0.00 175.10 174.60 1mru s ALA 38 N -3.95 3.72 -0.19 1.32 0.00 -0.67 -0.44 121.76 121.53 1mru s ALA 38 Ca 0.20 -0.68 -0.00 0.00 0.00 0.00 0.00 51.96 51.47 1mru s ALA 38 Cb 0.07 -2.14 0.05 0.00 0.00 0.00 0.00 23.12 21.10 1mru s ALA 38 CO -0.01 0.22 -0.05 0.08 0.00 0.00 0.00 175.76 176.00 1mru s VAL 39 N 0.17 1.26 -0.15 0.00 1.01 -0.80 0.66 120.40 122.55 1mru s VAL 39 Ca 0.09 -0.85 -0.23 0.00 0.00 0.00 0.00 61.98 60.99 1mru s VAL 39 Cb -0.11 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 1mru s VAL 39 CO -0.01 0.04 0.71 -0.75 0.00 0.00 0.00 175.10 175.09 1mru s LYS 40 N 1.55 4.31 -0.16 2.72 2.20 0.07 -1.84 119.74 128.59 1mru s LYS 40 Ca -0.02 0.81 -0.02 0.00 -0.36 0.00 0.00 55.97 56.38 1mru s LYS 40 Cb -0.17 -3.54 -0.02 0.00 -1.51 0.00 0.00 37.83 32.60 1mru s LYS 40 CO -0.07 -0.17 -0.07 0.08 -0.36 0.00 0.00 175.35 174.75 1mru s VAL 41 N 1.64 3.42 0.24 4.02 1.01 0.30 -0.95 120.40 130.09 1mru s VAL 41 Ca 0.34 -0.51 -0.31 0.00 0.00 0.00 0.00 61.98 61.50 1mru s VAL 41 Cb -0.17 -2.49 -0.14 0.00 0.00 0.00 0.00 36.38 33.58 1mru s VAL 41 CO 0.13 0.48 1.25 -0.11 0.00 0.00 0.00 175.10 176.85 1mru n LEU 42 N 3.89 2.44 -2.68 3.92 7.94 -0.47 -1.52 117.00 130.52 1mru n LEU 42 Ca -0.18 1.16 -0.25 0.00 -1.11 0.00 0.00 56.01 55.63 1mru n LEU 42 Cb 0.52 -1.35 -0.09 0.00 0.53 0.00 0.00 43.42 43.04 1mru n LEU 42 CO 0.31 -0.90 1.33 -1.14 -1.11 0.00 0.00 177.39 175.88 1mru n ARG 43 N 1.54 0.00 -0.07 1.96 0.63 0.22 -4.07 116.66 116.87 1mru n ARG 43 Ca 0.11 0.00 -0.01 0.00 -0.92 0.00 0.00 57.85 57.04 1mru n ARG 43 Cb 0.30 -0.89 -0.01 0.00 0.45 0.00 0.00 32.46 32.31 1mru n ARG 43 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1mru n ALA 44 N 6.25 0.05 -3.23 5.13 0.00 -1.26 0.03 120.51 127.47 1mru n ALA 44 Ca 0.39 -0.04 -0.24 0.00 0.00 0.00 0.00 53.44 53.55 1mru n ALA 44 Cb 0.02 -0.10 -0.05 0.00 0.00 0.00 0.00 19.45 19.32 1mru n ALA 44 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1mru n ASP 45 N 0.27 -1.06 -0.12 0.00 4.64 -1.26 -4.69 116.55 114.33 1mru n ASP 45 Ca 0.03 -0.69 -0.24 0.00 -1.38 0.00 0.00 54.79 52.51 1mru n ASP 45 Cb 0.01 -0.93 -0.09 0.00 -1.04 0.00 0.00 41.12 39.07 1mru n ASP 45 CO 0.00 0.00 0.00 -0.11 -0.82 0.00 0.00 177.20 176.27 1mru n LEU 46 N -2.56 1.90 -0.58 -2.67 0.00 0.10 -4.48 117.00 108.70 1mru n LEU 46 Ca 0.07 0.22 0.07 0.00 0.00 0.00 0.00 56.01 56.37 1mru n LEU 46 Cb 0.27 -0.71 0.06 0.00 0.00 0.00 0.00 43.42 43.04 1mru n LEU 46 CO 0.55 0.56 0.47 0.00 0.00 0.00 0.00 177.39 178.97 1mru n ALA 47 N -3.90 2.51 0.00 1.96 0.00 -1.18 -4.76 120.51 115.15 1mru n ALA 47 Ca -0.45 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.38 1mru n ALA 47 Cb 0.85 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 19.79 1mru n ALA 47 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1mru n ARG 48 N 0.78 0.00 0.00 0.00 3.00 -1.25 -3.90 116.66 115.30 1mru n ARG 48 Ca 0.09 0.02 0.00 0.00 -0.00 0.00 0.00 57.85 57.96 1mru n ARG 48 Cb 0.37 -1.53 0.00 0.00 0.00 0.00 0.00 32.46 31.30 1mru n ARG 48 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1mru n ASP 49 N -0.74 1.30 0.00 6.15 8.00 -1.26 -4.57 116.55 125.42 1mru n ASP 49 Ca 0.00 -0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.47 1mru n ASP 49 Cb 0.03 0.31 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 1mru n ASP 49 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1mru n PRO 50 N -0.44 0.00 -0.77 -0.24 -0.02 -1.25 -4.74 135.00 127.54 1mru n PRO 50 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.46 1mru n PRO 50 Cb 0.00 0.00 0.24 0.00 -0.02 0.00 0.00 33.50 33.72 1mru n PRO 50 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1mru n SER 51 N 0.00 3.56 -0.08 2.55 3.41 -1.26 -4.55 113.62 117.25 1mru n SER 51 Ca 0.00 -3.39 -0.10 0.00 -0.26 0.00 0.00 58.87 55.12 1mru n SER 51 Cb 0.00 -0.65 -0.05 0.00 -0.26 0.00 0.00 64.21 63.25 1mru n SER 51 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1mru h PHE 52 N 1.62 0.00 0.00 7.33 0.04 -1.85 -3.10 116.94 120.98 1mru h PHE 52 Ca 0.20 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.97 1mru h PHE 52 Cb 1.84 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.99 1mru h PHE 52 CO 0.96 0.51 0.00 2.48 -0.60 0.00 0.00 178.31 181.66 1mru n TYR 53 N -4.57 0.00 -0.03 -0.55 0.18 -1.26 0.62 117.16 111.54 1mru n TYR 53 Ca -0.15 0.00 -0.01 0.00 1.88 0.00 0.00 57.90 59.63 1mru n TYR 53 Cb 0.38 -0.47 -0.00 0.00 -0.38 0.00 0.00 39.34 38.87 1mru n TYR 53 CO 0.00 0.00 0.00 1.25 -2.08 0.00 0.00 176.86 176.03 1mru h LEU 54 N 0.00 -0.03 -1.32 -3.48 6.46 -1.82 -2.70 115.31 112.42 1mru h LEU 54 Ca 0.00 0.00 -0.07 0.00 -0.12 0.00 0.00 57.88 57.69 1mru h LEU 54 Cb 0.14 0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.07 1mru h LEU 54 CO 0.00 0.43 -0.33 0.08 -0.62 0.00 0.00 178.44 178.00 1mru h ARG 55 N -0.94 0.00 -0.52 1.25 0.11 -1.33 -2.08 114.38 110.88 1mru h ARG 55 Ca -0.00 0.00 0.04 0.00 0.10 0.00 0.00 59.98 60.11 1mru h ARG 55 Cb 0.03 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.07 1mru h ARG 55 CO 0.01 0.33 0.28 0.35 0.10 0.00 0.00 179.97 181.04 1mru h PHE 56 N 0.00 0.52 -0.13 4.08 3.57 0.07 0.64 116.94 125.69 1mru h PHE 56 Ca -0.00 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 1mru h PHE 56 Cb 0.64 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.21 1mru h PHE 56 CO 0.00 0.28 -0.06 -0.09 -2.23 0.00 0.00 178.31 176.21 1mru h ARG 57 N 0.55 0.19 0.00 1.11 9.65 -1.04 0.16 114.38 125.00 1mru h ARG 57 Ca 0.22 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 59.05 1mru h ARG 57 Cb 0.09 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 28.63 1mru h ARG 57 CO -0.13 0.27 -0.07 -0.09 2.80 0.00 0.00 179.97 182.74 1mru h ARG 58 N 0.19 0.00 -0.18 0.20 2.43 -0.23 -2.21 114.38 114.58 1mru h ARG 58 Ca 0.04 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.15 1mru h ARG 58 Cb 0.23 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.78 1mru h ARG 58 CO 0.01 0.07 -0.13 1.49 -1.51 0.00 0.00 179.97 179.90 1mru h GLU 59 N 0.00 0.40 -0.16 0.20 4.81 0.30 0.12 114.58 120.26 1mru h GLU 59 Ca -0.00 -0.20 -0.08 0.00 -0.13 0.00 0.00 59.36 58.95 1mru h GLU 59 Cb 0.96 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.32 1mru h GLU 59 CO 0.01 0.74 -0.27 0.00 -0.73 0.00 0.00 179.01 178.76 1mru h ALA 60 N 0.65 1.25 -0.19 2.92 0.00 -1.32 -1.93 119.26 120.64 1mru h ALA 60 Ca 0.03 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 1mru h ALA 60 Cb 0.65 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1mru h ALA 60 CO 0.04 0.50 -0.04 1.96 0.00 0.00 0.00 179.25 181.70 1mru h GLN 61 N 0.26 0.37 0.17 0.00 4.20 -0.99 -1.71 115.11 117.41 1mru h GLN 61 Ca 0.04 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 1mru h GLN 61 Cb 0.62 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.38 1mru h GLN 61 CO 0.04 0.62 -0.08 -0.91 -0.67 0.00 0.00 178.83 177.84 1mru h ASN 62 N 0.09 -0.19 -0.97 1.46 2.35 -0.63 -2.87 115.58 114.82 1mru h ASN 62 Ca 0.05 -0.10 0.16 0.00 -0.55 0.00 0.00 56.30 55.86 1mru h ASN 62 Cb 0.48 0.05 -0.09 0.00 0.05 0.00 0.00 38.32 38.82 1mru h ASN 62 CO 0.02 -0.02 0.61 0.00 -1.65 0.00 0.00 177.43 176.39 1mru h ALA 63 N 0.45 1.74 0.00 -0.83 0.00 -1.37 0.17 119.26 119.43 1mru h ALA 63 Ca -0.02 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1mru h ALA 63 Cb 0.28 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1mru h ALA 63 CO 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.24 1mru n ALA 64 N -2.38 1.82 1.49 0.00 0.00 -0.65 -2.18 120.51 118.62 1mru n ALA 64 Ca 0.20 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.80 1mru n ALA 64 Cb 0.51 -1.36 0.74 0.00 0.00 0.00 0.00 19.45 19.35 1mru n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mru n ALA 65 N -1.65 2.58 -2.47 0.00 0.00 0.61 -4.78 120.51 114.79 1mru n ALA 65 Ca 0.04 -0.18 -0.32 0.00 0.00 0.00 0.00 53.44 52.98 1mru n ALA 65 Cb 0.25 -1.45 -0.13 0.00 0.00 0.00 0.00 19.45 18.12 1mru n ALA 65 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1mru s LEU 66 N -2.48 2.70 -0.38 0.00 1.43 -0.92 -5.08 118.68 113.94 1mru s LEU 66 Ca 0.31 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 1mru s LEU 66 Cb 0.20 -1.56 0.14 0.00 0.03 0.00 0.00 46.19 45.00 1mru s LEU 66 CO 0.45 0.31 0.23 0.21 0.23 0.00 0.00 176.35 177.78 1mru s ASN 67 N -1.05 3.10 -0.01 2.29 3.84 -1.26 -4.80 114.94 117.04 1mru s ASN 67 Ca 0.13 -2.38 -0.01 0.00 0.21 0.00 0.00 52.86 50.81 1mru s ASN 67 Cb -0.11 -0.60 0.01 0.00 -0.55 0.00 0.00 41.25 40.00 1mru s ASN 67 CO 0.03 -0.29 0.03 -2.28 -2.79 0.00 0.00 177.10 171.80 1mru s HIS 68 N 0.78 -0.02 -1.54 0.43 2.46 -1.26 -5.01 115.29 111.12 1mru s HIS 68 Ca 0.19 0.09 0.08 0.00 0.47 0.00 0.00 55.06 55.89 1mru s HIS 68 Cb -0.22 -0.05 0.40 0.00 -0.13 0.00 0.00 32.58 32.58 1mru s HIS 68 CO -0.01 -0.04 1.07 -0.35 -2.47 0.00 0.00 174.74 172.95 1mru n PRO 69 N 3.36 0.13 -0.03 2.88 -0.04 -1.26 -1.11 135.00 138.93 1mru n PRO 69 Ca -0.16 0.17 0.04 0.00 -0.04 0.00 0.00 63.50 63.51 1mru n PRO 69 Cb 0.57 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.59 1mru n PRO 69 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mru n ALA 70 N -1.23 2.39 -3.63 0.55 0.00 -1.26 -4.84 120.51 112.49 1mru n ALA 70 Ca 0.04 -0.71 -0.29 0.00 0.00 0.00 0.00 53.44 52.48 1mru n ALA 70 Cb 0.05 -0.28 -0.17 0.00 0.00 0.00 0.00 19.45 19.06 1mru n ALA 70 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1mru s ILE 71 N -0.75 1.63 0.25 0.00 1.01 -0.27 -1.00 121.20 122.07 1mru s ILE 71 Ca 0.11 -0.73 -0.31 0.00 0.00 0.00 0.00 60.65 59.73 1mru s ILE 71 Cb 0.07 -1.47 -0.12 0.00 0.01 0.00 0.00 42.46 40.95 1mru s ILE 71 CO 0.10 0.47 1.57 0.52 0.00 0.00 0.00 174.94 177.60 1mru n VAL 72 N 4.12 0.70 -3.46 2.92 0.31 -0.98 -4.36 118.33 117.58 1mru n VAL 72 Ca -0.19 -0.17 -0.26 0.00 -0.01 0.00 0.00 64.34 63.70 1mru n VAL 72 Cb 0.51 -1.80 -0.02 0.00 -0.91 0.00 0.00 33.84 31.62 1mru n VAL 72 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1mru s ALA 73 N 0.30 3.72 -0.13 3.52 0.00 -1.26 -4.92 121.76 122.99 1mru s ALA 73 Ca 0.69 -0.81 -0.05 0.00 0.00 0.00 0.00 51.96 51.79 1mru s ALA 73 Cb -0.55 -2.12 -0.04 0.00 0.00 0.00 0.00 23.12 20.41 1mru s ALA 73 CO 0.45 0.17 0.05 0.08 0.00 0.00 0.00 175.76 176.51 1mru s VAL 74 N -2.14 4.74 -0.12 0.00 1.01 -1.26 -1.02 120.40 121.61 1mru s VAL 74 Ca 0.40 -0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.33 1mru s VAL 74 Cb -0.10 -3.07 -0.08 0.00 0.00 0.00 0.00 36.38 33.13 1mru s VAL 74 CO 0.33 0.55 -0.10 -1.22 0.00 0.00 0.00 175.10 174.66 1mru n TYR 75 N 2.68 0.00 -3.92 5.22 4.01 -0.06 -4.87 117.16 120.22 1mru n TYR 75 Ca -0.18 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.47 1mru n TYR 75 Cb 0.53 -0.46 -0.02 0.00 -0.31 0.00 0.00 39.34 39.08 1mru n TYR 75 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1mru s ASP 76 N -5.12 0.02 -0.12 7.72 2.15 -1.15 -5.01 116.67 115.16 1mru s ASP 76 Ca -0.16 -0.96 -0.21 0.00 0.43 0.00 0.00 52.55 51.65 1mru s ASP 76 Cb 0.04 0.71 0.05 0.00 -0.30 0.00 0.00 42.92 43.42 1mru s ASP 76 CO 0.28 -1.37 0.53 -0.89 -0.17 0.00 0.00 175.17 173.55 1mru s THR 77 N -3.43 0.01 0.00 1.71 2.01 -1.26 -1.34 115.64 113.35 1mru s THR 77 Ca 0.18 -0.11 0.00 0.00 0.31 0.00 0.00 61.69 62.07 1mru s THR 77 Cb -0.03 -0.79 0.00 0.00 0.01 0.00 0.00 72.50 71.69 1mru s THR 77 CO 0.11 -0.06 0.00 0.61 -0.69 0.00 0.00 174.62 174.58 1mru n GLY 78 N 1.93 3.61 2.97 4.40 0.00 -0.92 -5.00 105.19 112.18 1mru n GLY 78 Ca -0.17 -1.11 -0.08 0.00 0.00 0.00 0.00 46.02 44.66 1mru n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mru s GLU 79 N 0.10 0.71 0.81 1.61 0.41 -1.26 -1.99 118.70 119.09 1mru s GLU 79 Ca 0.00 -0.52 -0.13 0.00 -0.41 0.00 0.00 54.97 53.91 1mru s GLU 79 Cb 0.00 -0.32 0.08 0.00 -1.78 0.00 0.00 34.13 32.11 1mru s GLU 79 CO 0.00 -1.18 1.18 0.00 -0.49 0.00 0.00 175.26 174.77 1mru s ALA 80 N 1.69 1.87 -0.11 5.21 0.00 0.75 -4.33 121.76 126.85 1mru s ALA 80 Ca 0.16 0.74 -0.03 0.00 0.00 0.00 0.00 51.96 52.83 1mru s ALA 80 Cb -0.10 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.53 1mru s ALA 80 CO -0.07 -2.23 -0.00 -1.21 0.00 0.00 0.00 175.76 172.25 1mru s GLU 81 N -4.26 3.20 0.26 0.00 8.01 -1.26 0.14 118.70 124.79 1mru s GLU 81 Ca 0.71 -0.43 -0.06 0.00 0.01 0.00 0.00 54.97 55.20 1mru s GLU 81 Cb -0.26 -2.85 -0.02 0.00 -4.31 0.00 0.00 34.13 26.69 1mru s GLU 81 CO 0.51 0.57 0.35 0.95 0.01 0.00 0.00 175.26 177.66 1mru s THR 82 N -0.53 0.00 0.47 3.63 -4.23 -0.41 -4.96 115.64 109.62 1mru s THR 82 Ca 0.09 -1.68 0.17 0.00 -1.18 0.00 0.00 61.69 59.09 1mru s THR 82 Cb -0.12 -2.41 0.22 0.00 1.34 0.00 0.00 72.50 71.53 1mru s THR 82 CO 0.02 0.00 2.05 -0.65 -0.54 0.00 0.00 174.62 175.50 1mru h PRO 83 N 2.34 0.00 -0.61 3.99 0.11 -1.98 -1.05 132.00 134.79 1mru h PRO 83 Ca -0.30 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.76 1mru h PRO 83 Cb 1.25 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 1mru h PRO 83 CO 0.42 0.13 0.15 0.00 -0.21 0.00 0.00 178.00 178.48 1mru h ALA 84 N 1.87 1.12 0.00 -0.75 0.00 -1.99 -3.49 119.26 116.02 1mru h ALA 84 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1mru h ALA 84 Cb 0.23 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1mru h ALA 84 CO 0.02 0.59 0.00 0.41 0.00 0.00 0.00 179.25 180.27 1mru n GLY 85 N -0.79 0.53 3.75 0.00 0.00 -0.40 -5.09 105.19 103.20 1mru n GLY 85 Ca 0.05 -1.40 -0.40 0.00 0.00 0.00 0.00 46.02 44.27 1mru n GLY 85 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1mru s PRO 86 N -2.00 4.77 -0.38 1.61 0.02 -1.26 -1.28 135.00 136.48 1mru s PRO 86 Ca 0.00 1.62 0.02 0.00 0.02 0.00 0.00 61.00 62.66 1mru s PRO 86 Cb 0.00 -3.24 0.11 0.00 0.02 0.00 0.00 34.50 31.39 1mru s PRO 86 CO 0.00 0.40 0.14 -1.17 -0.33 0.00 0.00 177.00 176.04 1mru s LEU 87 N -1.29 3.32 0.25 -5.54 2.96 0.37 -4.85 118.68 113.91 1mru s LEU 87 Ca 0.42 -2.21 -0.31 0.00 -0.22 0.00 0.00 54.13 51.82 1mru s LEU 87 Cb -0.28 -1.22 -0.11 0.00 0.50 0.00 0.00 46.19 45.07 1mru s LEU 87 CO 0.36 -0.34 1.61 -2.84 -1.32 0.00 0.00 176.35 173.81 1mru s PRO 88 N 0.85 4.15 0.09 0.98 0.02 -1.26 -0.18 135.00 139.65 1mru s PRO 88 Ca 0.13 2.53 -0.01 0.00 0.02 0.00 0.00 61.00 63.67 1mru s PRO 88 Cb -0.21 -3.06 -0.04 0.00 0.02 0.00 0.00 34.50 31.21 1mru s PRO 88 CO -0.11 -0.64 0.01 1.52 -0.33 0.00 0.00 177.00 177.46 1mru s TYR 89 N 0.44 0.71 -0.07 6.54 -0.85 -0.84 -1.37 117.35 121.91 1mru s TYR 89 Ca 0.67 -1.15 0.01 0.00 -0.52 0.00 0.00 57.07 56.07 1mru s TYR 89 Cb -0.47 -0.44 0.02 0.00 0.38 0.00 0.00 41.96 41.45 1mru s TYR 89 CO 0.41 -0.44 -0.06 0.42 -1.52 0.00 0.00 175.55 174.36 1mru s ILE 90 N -3.97 0.75 -0.21 -3.49 1.01 -0.12 -2.16 121.20 113.00 1mru s ILE 90 Ca 0.16 -0.20 -0.17 0.00 0.00 0.00 0.00 60.65 60.45 1mru s ILE 90 Cb 0.08 -0.78 -0.04 0.00 0.01 0.00 0.00 42.46 41.73 1mru s ILE 90 CO -0.04 0.29 0.44 -0.69 0.00 0.00 0.00 174.94 174.95 1mru s VAL 91 N 1.24 5.16 0.17 2.92 1.01 -0.45 -0.75 120.40 129.70 1mru s VAL 91 Ca -0.05 0.79 0.03 0.00 0.00 0.00 0.00 61.98 62.75 1mru s VAL 91 Cb -0.14 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 1mru s VAL 91 CO -0.02 0.21 -0.05 0.00 0.00 0.00 0.00 175.10 175.24 1mru s MET 92 N 1.56 1.12 -0.00 2.72 0.23 0.21 -0.88 119.30 124.25 1mru s MET 92 Ca 0.20 -1.52 -0.37 0.00 -1.03 0.00 0.00 55.69 52.98 1mru s MET 92 Cb -0.15 -0.48 -0.16 0.00 -1.53 0.00 0.00 34.83 32.51 1mru s MET 92 CO 0.09 -0.03 1.52 -1.91 -2.03 0.00 0.00 175.02 172.65 1mru n GLU 93 N -0.25 1.39 -2.77 3.16 2.13 -0.19 -1.67 120.64 122.44 1mru n GLU 93 Ca -0.08 0.50 -0.42 0.00 0.66 0.00 0.00 57.16 57.83 1mru n GLU 93 Cb 0.62 -2.19 -0.03 0.00 0.27 0.00 0.00 31.44 30.11 1mru n GLU 93 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1mru s TYR 94 N 1.55 3.64 -0.33 4.31 5.04 -1.26 -4.50 117.35 125.80 1mru s TYR 94 Ca 0.87 1.62 -0.05 0.00 -2.44 0.00 0.00 57.07 57.07 1mru s TYR 94 Cb -0.92 -3.06 0.05 0.00 0.35 0.00 0.00 41.96 38.38 1mru s TYR 94 CO 0.50 0.00 0.08 0.08 -1.34 0.00 0.00 175.55 174.88 1mru s VAL 95 N 0.99 3.54 -0.57 3.14 1.01 -1.26 -4.94 120.40 122.30 1mru s VAL 95 Ca 0.49 -1.26 -0.27 0.00 0.00 0.00 0.00 61.98 60.95 1mru s VAL 95 Cb -0.20 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.17 1mru s VAL 95 CO 0.26 -0.19 1.12 -0.62 0.00 0.00 0.00 175.10 175.67 1mru s ASP 96 N 1.41 6.41 0.00 3.32 2.15 -1.26 -4.86 116.67 123.84 1mru s ASP 96 Ca -0.02 -0.04 0.00 0.00 0.43 0.00 0.00 52.55 52.92 1mru s ASP 96 Cb -0.20 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 39.90 1mru s ASP 96 CO 0.01 -1.41 0.00 0.61 -0.17 0.00 0.00 175.17 174.21 1mru n GLY 97 N 5.08 -1.48 3.65 2.66 0.00 -1.26 -0.39 105.19 113.46 1mru n GLY 97 Ca 0.06 -1.14 -0.28 0.00 0.00 0.00 0.00 46.02 44.67 1mru n GLY 97 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1mru s VAL 98 N -2.89 2.01 0.16 1.61 -7.23 -1.05 -4.96 120.40 108.05 1mru s VAL 98 Ca 0.00 -1.94 -0.01 0.00 -1.81 0.00 0.00 61.98 58.23 1mru s VAL 98 Cb 0.00 -2.95 -0.04 0.00 0.56 0.00 0.00 36.38 33.95 1mru s VAL 98 CO 0.00 0.00 0.34 0.42 -0.31 0.00 0.00 175.10 175.55 1mru s THR 99 N -2.70 5.25 0.40 5.32 -4.23 -1.26 -1.41 115.64 117.00 1mru s THR 99 Ca 0.35 -0.35 0.18 0.00 -1.18 0.00 0.00 61.69 60.69 1mru s THR 99 Cb 0.08 -3.70 0.39 0.00 1.34 0.00 0.00 72.50 70.61 1mru s THR 99 CO 0.18 -0.08 1.77 -0.07 -0.54 0.00 0.00 174.62 175.89 1mru h LEU 100 N 2.33 0.45 -0.11 4.79 3.38 -0.98 0.73 115.31 125.90 1mru h LEU 100 Ca -0.47 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.58 1mru h LEU 100 Cb 1.18 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1mru h LEU 100 CO 0.70 0.09 0.06 -0.09 0.09 0.00 0.00 178.44 179.29 1mru h ARG 101 N 0.39 0.16 -0.27 1.13 2.43 -1.78 -1.20 114.38 115.24 1mru h ARG 101 Ca 0.59 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.65 1mru h ARG 101 Cb 1.50 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 31.02 1mru h ARG 101 CO -0.30 0.21 -0.18 -0.44 -1.51 0.00 0.00 179.97 177.75 1mru h ASP 102 N 0.07 0.63 -0.03 -3.80 3.32 -0.86 -0.56 116.42 115.20 1mru h ASP 102 Ca 0.04 -0.44 0.01 0.00 0.02 0.00 0.00 57.03 56.66 1mru h ASP 102 Cb 0.10 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 1mru h ASP 102 CO -0.01 0.93 0.02 0.40 -1.72 0.00 0.00 179.24 178.87 1mru h ILE 103 N 0.33 0.94 0.13 0.35 2.04 0.35 -2.35 117.51 119.31 1mru h ILE 103 Ca 0.05 0.00 -0.33 0.00 1.00 0.00 0.00 64.86 65.58 1mru h ILE 103 Cb 0.72 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 1mru h ILE 103 CO 0.05 0.00 -1.77 0.58 0.00 0.00 0.00 178.15 177.01 1mru h VAL 104 N 0.00 0.80 -0.92 1.67 2.07 -1.14 -3.35 116.25 115.38 1mru h VAL 104 Ca 0.01 -2.38 0.20 0.00 0.82 0.00 0.00 66.70 65.35 1mru h VAL 104 Cb 0.06 2.58 -0.17 0.00 -1.52 0.00 0.00 31.29 32.24 1mru h VAL 104 CO -0.00 0.81 -0.16 -0.74 0.02 0.00 0.00 177.57 177.50 1mru h HIS 105 N -0.08 -0.36 -4.26 1.57 -0.00 -0.59 -3.20 115.15 108.22 1mru h HIS 105 Ca -0.38 0.08 -0.07 0.00 -0.00 0.00 0.00 60.37 60.00 1mru h HIS 105 Cb 1.94 0.30 -0.00 0.00 -0.00 0.00 0.00 27.41 29.65 1mru h HIS 105 CO 0.09 -0.39 -0.03 0.25 -0.00 0.00 0.00 177.93 177.86 1mru n THR 106 N -5.54 0.00 -0.74 6.26 -2.24 -0.95 -4.60 114.28 106.46 1mru n THR 106 Ca 0.16 -0.26 -0.03 0.00 -2.27 0.00 0.00 64.05 61.64 1mru n THR 106 Cb 0.52 -0.60 -0.01 0.00 -2.10 0.00 0.00 70.33 68.13 1mru n THR 106 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1mru n GLU 107 N -0.82 -1.71 0.00 -0.78 -0.58 -1.26 -4.73 120.64 110.76 1mru n GLU 107 Ca 0.00 0.34 0.00 0.00 -0.42 0.00 0.00 57.16 57.08 1mru n GLU 107 Cb 0.08 -4.01 0.00 0.00 -0.57 0.00 0.00 31.44 26.94 1mru n GLU 107 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1mru n GLY 108 N 0.22 0.99 0.00 0.62 0.00 -1.21 -4.64 105.19 101.16 1mru n GLY 108 Ca -0.03 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.46 1mru n GLY 108 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1mru n PRO 109 N 3.30 0.36 -4.51 1.61 -0.02 -1.26 -4.34 135.00 130.15 1mru n PRO 109 Ca 0.00 0.00 -0.25 0.00 -2.02 0.00 0.00 63.50 61.23 1mru n PRO 109 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 33.50 33.38 1mru n PRO 109 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1mru s MET 110 N -0.95 1.74 0.47 -0.52 -1.94 -1.09 -4.95 119.30 112.05 1mru s MET 110 Ca 0.00 -1.89 -0.19 0.00 -1.71 0.00 0.00 55.69 51.91 1mru s MET 110 Cb 0.00 -1.55 -0.09 0.00 2.01 0.00 0.00 34.83 35.20 1mru s MET 110 CO 0.00 0.12 0.97 0.95 -0.01 0.00 0.00 175.02 177.04 1mru s THR 111 N -2.72 4.47 0.41 2.05 -4.23 -1.26 -4.72 115.64 109.63 1mru s THR 111 Ca 0.32 1.35 0.32 0.00 -1.18 0.00 0.00 61.69 62.49 1mru s THR 111 Cb 0.03 -3.66 0.32 0.00 1.34 0.00 0.00 72.50 70.52 1mru s THR 111 CO 0.15 -0.51 1.97 -0.65 -0.54 0.00 0.00 174.62 175.04 1mru h PRO 112 N 1.40 0.00 0.01 3.99 0.11 -1.95 0.12 132.00 135.68 1mru h PRO 112 Ca -0.48 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 1mru h PRO 112 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1mru h PRO 112 CO 0.61 0.00 -0.01 -0.22 -0.21 0.00 0.00 178.00 178.18 1mru h LYS 113 N 0.00 -0.02 -0.41 1.05 3.64 -1.98 -1.90 116.57 116.94 1mru h LYS 113 Ca 0.00 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 1mru h LYS 113 Cb 0.26 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1mru h LYS 113 CO 0.00 0.78 -0.14 -0.09 -2.27 0.00 0.00 179.45 177.73 1mru h ARG 114 N -0.94 0.75 0.64 1.90 2.43 -1.76 -1.29 114.38 116.11 1mru h ARG 114 Ca -0.00 -0.26 -0.03 0.00 -0.81 0.00 0.00 59.98 58.88 1mru h ARG 114 Cb 0.80 -0.06 0.01 0.00 -0.42 0.00 0.00 29.97 30.30 1mru h ARG 114 CO 0.00 0.85 -0.31 0.00 -1.51 0.00 0.00 179.97 179.01 1mru h ALA 115 N 1.17 -1.16 -1.05 2.80 0.00 -0.90 0.30 119.26 120.41 1mru h ALA 115 Ca 0.11 -0.19 0.28 0.00 0.00 0.00 0.00 54.91 55.11 1mru h ALA 115 Cb 0.61 0.33 -0.11 0.00 0.00 0.00 0.00 17.79 18.63 1mru h ALA 115 CO 0.04 -1.10 0.66 0.82 0.00 0.00 0.00 179.25 179.67 1mru h ILE 116 N -0.90 0.47 0.47 0.00 1.08 -1.32 -2.07 117.51 115.24 1mru h ILE 116 Ca -0.09 -0.14 -0.02 0.00 -0.39 0.00 0.00 64.86 64.22 1mru h ILE 116 Cb 0.66 0.03 0.00 0.00 -3.07 0.00 0.00 36.82 34.44 1mru h ILE 116 CO 0.14 0.07 -0.22 -0.33 -0.69 0.00 0.00 178.15 177.12 1mru h GLU 117 N 0.41 -0.60 0.04 2.37 5.08 -0.80 -2.04 114.58 119.03 1mru h GLU 117 Ca 0.64 0.04 0.03 0.00 -1.00 0.00 0.00 59.36 59.07 1mru h GLU 117 Cb 1.54 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 30.88 1mru h GLU 117 CO -0.38 -0.35 -0.31 -0.39 -1.00 0.00 0.00 179.01 176.58 1mru h VAL 118 N -1.12 0.33 0.00 3.13 -1.51 0.07 -1.36 116.25 115.80 1mru h VAL 118 Ca -0.06 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.39 1mru h VAL 118 Cb 0.53 0.33 -0.00 0.00 -2.13 0.00 0.00 31.29 30.01 1mru h VAL 118 CO 0.11 0.00 -0.08 0.40 -1.23 0.00 0.00 177.57 176.77 1mru h ILE 119 N -0.48 0.74 -0.61 7.19 1.08 -1.53 -0.41 117.51 123.49 1mru h ILE 119 Ca 0.05 -0.30 -0.03 0.00 -0.39 0.00 0.00 64.86 64.20 1mru h ILE 119 Cb 0.55 1.18 -0.03 0.00 -3.07 0.00 0.00 36.82 35.45 1mru h ILE 119 CO -0.23 0.07 0.28 0.00 -0.69 0.00 0.00 178.15 177.58 1mru h ALA 120 N 1.92 0.79 -0.14 1.87 0.00 -0.51 -1.27 119.26 121.92 1mru h ALA 120 Ca -0.00 -0.14 -0.22 0.00 0.00 0.00 0.00 54.91 54.55 1mru h ALA 120 Cb 0.17 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.73 1mru h ALA 120 CO 0.01 0.36 -0.78 -0.44 0.00 0.00 0.00 179.25 178.40 1mru h ASP 121 N 0.84 0.90 -0.63 0.00 3.32 -0.38 -3.13 116.42 117.34 1mru h ASP 121 Ca 0.21 -0.59 0.01 0.00 0.02 0.00 0.00 57.03 56.67 1mru h ASP 121 Cb 0.14 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.39 1mru h ASP 121 CO -0.02 1.39 0.42 0.00 -1.72 0.00 0.00 179.24 179.30 1mru h ALA 122 N 0.59 1.56 -0.91 3.45 0.00 -0.86 -1.21 119.26 121.89 1mru h ALA 122 Ca -0.05 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1mru h ALA 122 Cb 1.41 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1mru h ALA 122 CO 0.16 0.40 0.60 0.00 0.00 0.00 0.00 179.25 180.41 1mru h GLN 124 N 1.23 -0.09 -0.32 0.00 4.20 -1.26 1.23 115.11 120.09 1mru h GLN 124 Ca 0.33 0.01 0.07 0.00 0.06 0.00 0.00 58.65 59.11 1mru h GLN 124 Cb -0.14 0.02 -0.07 0.00 0.30 0.00 0.00 27.48 27.60 1mru h GLN 124 CO -0.07 0.03 -0.11 0.00 -0.67 0.00 0.00 178.83 178.01 1mru h ALA 125 N 0.74 0.17 0.66 3.87 0.00 -0.92 1.14 119.26 124.92 1mru h ALA 125 Ca -0.01 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1mru h ALA 125 Cb 0.16 0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.25 1mru h ALA 125 CO 0.02 -0.49 -0.32 -0.07 0.00 0.00 0.00 179.25 178.39 1mru h LEU 126 N -0.04 -0.75 -1.25 0.00 4.07 -0.44 -1.37 115.31 115.54 1mru h LEU 126 Ca 0.16 -0.00 0.15 0.00 0.08 0.00 0.00 57.88 58.27 1mru h LEU 126 Cb 0.28 0.19 -0.07 0.00 1.08 0.00 0.00 40.66 42.14 1mru h LEU 126 CO -0.36 -0.48 0.59 -1.13 -1.08 0.00 0.00 178.44 175.98 1mru h ASN 127 N -0.98 0.68 0.29 -0.43 -1.24 0.19 0.36 115.58 114.46 1mru h ASN 127 Ca -0.09 0.04 -0.06 0.00 0.71 0.00 0.00 56.30 56.91 1mru h ASN 127 Cb 0.70 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.66 1mru h ASN 127 CO 0.15 0.34 -0.27 0.15 -1.29 0.00 0.00 177.43 176.51 1mru h PHE 128 N 0.72 0.00 0.03 0.67 3.57 0.17 -2.52 116.94 119.58 1mru h PHE 128 Ca 0.46 0.00 -0.24 0.00 3.53 0.00 0.00 57.97 61.73 1mru h PHE 128 Cb 0.72 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.47 1mru h PHE 128 CO -0.00 0.27 -1.01 1.03 -2.23 0.00 0.00 178.31 176.37 1mru h SER 129 N 0.00 0.53 -0.49 0.41 0.87 0.80 -3.26 113.55 112.41 1mru h SER 129 Ca -0.00 -0.45 -0.10 0.00 -1.23 0.00 0.00 61.79 60.00 1mru h SER 129 Cb 0.49 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.27 1mru h SER 129 CO 0.04 1.27 -0.10 0.45 -0.53 0.00 0.00 176.83 177.95 1mru h HIS 130 N 0.21 1.04 0.00 2.24 3.86 -0.77 -1.20 115.15 120.52 1mru h HIS 130 Ca -0.09 -0.22 -0.03 0.00 -1.16 0.00 0.00 60.37 58.86 1mru h HIS 130 Cb 1.66 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 29.87 1mru h HIS 130 CO 0.06 1.00 -0.16 1.96 0.86 0.00 0.00 177.93 181.65 1mru h GLN 131 N 0.78 0.00 -0.94 2.45 4.20 -1.57 -1.49 115.11 118.55 1mru h GLN 131 Ca 0.13 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.57 1mru h GLN 131 Cb 0.65 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 28.27 1mru h GLN 131 CO 0.04 0.16 0.34 0.09 -0.67 0.00 0.00 178.83 178.80 1mru n ASN 132 N -4.14 3.65 -3.94 1.46 3.02 -1.02 -4.91 115.26 109.38 1mru n ASN 132 Ca -0.02 -2.98 -0.31 0.00 -0.03 0.00 0.00 54.58 51.24 1mru n ASN 132 Cb 0.24 -0.70 0.02 0.00 -0.61 0.00 0.00 39.78 38.73 1mru n ASN 132 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mru n GLY 133 N -0.38 -0.49 3.06 7.41 0.00 -0.56 -4.99 105.19 109.24 1mru n GLY 133 Ca 0.35 0.19 -0.19 0.00 0.00 0.00 0.00 46.02 46.37 1mru n GLY 133 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1mru s ILE 134 N -3.31 0.84 -0.20 -0.61 1.01 -0.48 -2.43 121.20 116.02 1mru s ILE 134 Ca 0.66 -0.52 0.01 0.00 0.00 0.00 0.00 60.65 60.79 1mru s ILE 134 Cb -0.33 -0.72 0.04 0.00 0.01 0.00 0.00 42.46 41.47 1mru s ILE 134 CO 0.84 0.19 -0.09 -0.63 0.00 0.00 0.00 174.94 175.25 1mru s ILE 135 N -0.35 1.52 0.27 2.92 1.01 -0.74 -3.29 121.20 122.54 1mru s ILE 135 Ca 0.03 -0.96 -0.29 0.00 0.00 0.00 0.00 60.65 59.43 1mru s ILE 135 Cb -0.05 -1.64 -0.09 0.00 0.01 0.00 0.00 42.46 40.69 1mru s ILE 135 CO -0.00 0.12 1.13 -2.28 0.00 0.00 0.00 174.94 173.91 1mru s HIS 136 N 1.44 3.52 -0.19 3.97 5.65 -1.26 -1.22 115.29 127.20 1mru s HIS 136 Ca -0.01 1.64 0.19 0.00 0.25 0.00 0.00 55.06 57.12 1mru s HIS 136 Cb -0.16 -3.33 0.47 0.00 -1.18 0.00 0.00 32.58 28.37 1mru s HIS 136 CO -0.08 -0.74 1.16 0.54 -0.65 0.00 0.00 174.74 174.97 1mru n ARG 137 N 1.38 1.65 -2.79 2.88 1.74 -1.26 -4.67 116.66 115.59 1mru n ARG 137 Ca -0.00 -3.22 -0.01 0.00 -0.77 0.00 0.00 57.85 53.85 1mru n ARG 137 Cb 0.45 -1.33 0.07 0.00 -1.02 0.00 0.00 32.46 30.63 1mru n ARG 137 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1mru n ASP 138 N -0.41 0.80 -4.60 0.55 -0.08 -1.26 -4.95 116.55 106.59 1mru n ASP 138 Ca 0.16 -2.10 -0.43 0.00 -1.51 0.00 0.00 54.79 50.91 1mru n ASP 138 Cb 0.91 -0.18 -0.03 0.00 2.34 0.00 0.00 41.12 44.16 1mru n ASP 138 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1mru s VAL 139 N -2.79 3.49 0.15 5.18 1.01 -1.26 -4.79 120.40 121.38 1mru s VAL 139 Ca 0.23 0.50 -0.23 0.00 0.00 0.00 0.00 61.98 62.48 1mru s VAL 139 Cb 0.36 -3.63 0.07 0.00 0.00 0.00 0.00 36.38 33.17 1mru s VAL 139 CO -0.06 -0.39 0.60 -1.59 0.00 0.00 0.00 175.10 173.66 1mru s LYS 140 N 5.54 1.26 0.23 2.72 -2.85 -1.26 -4.71 119.74 120.67 1mru s LYS 140 Ca 0.80 -0.45 -0.09 0.00 -1.00 0.00 0.00 55.97 55.23 1mru s LYS 140 Cb -0.23 0.58 0.37 0.00 -2.06 0.00 0.00 37.83 36.49 1mru s LYS 140 CO 0.33 -0.55 1.66 -1.35 0.10 0.00 0.00 175.35 175.55 1mru h PRO 141 N 2.05 0.14 0.00 1.78 0.11 -1.92 0.54 132.00 134.70 1mru h PRO 141 Ca -0.34 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1mru h PRO 141 Cb 1.30 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1mru h PRO 141 CO 0.38 0.09 0.00 0.00 -0.21 0.00 0.00 178.00 178.26 1mru n ALA 142 N -2.81 1.81 -0.98 -0.75 0.00 -1.26 -2.22 120.51 114.29 1mru n ALA 142 Ca 0.11 -0.06 0.09 0.00 0.00 0.00 0.00 53.44 53.58 1mru n ALA 142 Cb 0.41 -1.19 0.19 0.00 0.00 0.00 0.00 19.45 18.86 1mru n ALA 142 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1mru n ASN 143 N -1.16 3.03 -3.68 0.00 3.02 0.18 -4.92 115.26 111.73 1mru n ASN 143 Ca 0.07 -3.00 -0.24 0.00 -0.03 0.00 0.00 54.58 51.39 1mru n ASN 143 Cb 0.07 -0.46 -0.17 0.00 -0.61 0.00 0.00 39.78 38.60 1mru n ASN 143 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1mru s ILE 144 N -2.75 0.11 -0.00 2.41 1.01 -0.94 -1.61 121.20 119.42 1mru s ILE 144 Ca 0.35 0.02 0.00 0.00 0.00 0.00 0.00 60.65 61.03 1mru s ILE 144 Cb 0.29 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 42.22 1mru s ILE 144 CO 0.06 -0.01 0.06 -0.04 0.00 0.00 0.00 174.94 175.01 1mru s MET 145 N 2.07 2.99 -0.16 2.79 -1.94 0.25 -1.35 119.30 123.95 1mru s MET 145 Ca 0.03 -0.52 -0.03 0.00 -1.71 0.00 0.00 55.69 53.46 1mru s MET 145 Cb -0.14 -2.81 -0.02 0.00 2.01 0.00 0.00 34.83 33.87 1mru s MET 145 CO -0.06 0.64 -0.06 0.42 -0.01 0.00 0.00 175.02 175.95 1mru s ILE 146 N -1.17 3.63 0.88 2.53 1.09 -0.50 0.43 121.20 128.08 1mru s ILE 146 Ca 0.22 -0.45 -0.09 0.00 -1.10 0.00 0.00 60.65 59.23 1mru s ILE 146 Cb -0.12 -2.58 0.19 0.00 -1.06 0.00 0.00 42.46 38.89 1mru s ILE 146 CO 0.13 0.49 1.20 -0.94 -0.10 0.00 0.00 174.94 175.72 1mru s SER 147 N 0.49 3.47 0.03 3.58 1.04 0.14 -2.53 113.70 119.92 1mru s SER 147 Ca -0.05 -0.16 -0.23 0.00 0.48 0.00 0.00 55.95 55.99 1mru s SER 147 Cb -0.15 0.06 -0.16 0.00 0.10 0.00 0.00 66.02 65.87 1mru s SER 147 CO 0.03 -2.47 1.44 0.00 0.98 0.00 0.00 173.24 173.22 1mru h ALA 148 N -1.21 0.11 0.00 5.32 0.00 -1.06 0.17 119.26 122.59 1mru h ALA 148 Ca -0.39 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1mru h ALA 148 Cb 1.24 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1mru h ALA 148 CO 0.34 -0.19 0.00 2.41 0.00 0.00 0.00 179.25 181.81 1mru n THR 149 N -4.82 0.00 -3.96 0.00 -1.04 -1.26 -4.75 114.28 98.44 1mru n THR 149 Ca -0.07 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.68 1mru n THR 149 Cb 0.21 -0.27 -0.02 0.00 -1.82 0.00 0.00 70.33 68.43 1mru n THR 149 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1mru n ASN 150 N -0.25 -0.82 -4.89 8.00 2.85 0.61 -4.99 115.26 115.78 1mru n ASN 150 Ca 0.00 -0.98 -0.24 0.00 -0.11 0.00 0.00 54.58 53.24 1mru n ASN 150 Cb 0.03 -3.13 -0.04 0.00 1.24 0.00 0.00 39.78 37.88 1mru n ASN 150 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1mru s ALA 151 N -3.85 3.78 -0.08 5.20 0.00 -1.25 -4.70 121.76 120.86 1mru s ALA 151 Ca 0.10 -1.19 -0.12 0.00 0.00 0.00 0.00 51.96 50.75 1mru s ALA 151 Cb -0.05 -1.57 -0.05 0.00 0.00 0.00 0.00 23.12 21.45 1mru s ALA 151 CO 0.88 0.42 0.30 0.08 0.00 0.00 0.00 175.76 177.44 1mru s VAL 152 N -1.86 5.25 -0.07 0.00 1.01 -1.26 0.27 120.40 123.74 1mru s VAL 152 Ca 0.33 0.58 -0.03 0.00 0.00 0.00 0.00 61.98 62.86 1mru s VAL 152 Cb -0.10 -3.60 0.04 0.00 0.00 0.00 0.00 36.38 32.72 1mru s VAL 152 CO 0.26 0.53 0.13 -0.54 0.00 0.00 0.00 175.10 175.48 1mru s LYS 153 N -0.58 0.00 0.04 2.72 -0.14 0.17 -4.28 119.74 117.67 1mru s LYS 153 Ca 0.19 0.48 -0.14 0.00 -1.36 0.00 0.00 55.97 55.15 1mru s LYS 153 Cb -0.14 -0.33 -0.06 0.00 -1.68 0.00 0.00 37.83 35.62 1mru s LYS 153 CO 0.08 -0.30 0.42 0.08 -0.76 0.00 0.00 175.35 174.88 1mru s VAL 154 N 2.11 5.02 0.00 3.17 1.01 -0.17 0.85 120.40 132.38 1mru s VAL 154 Ca 0.02 0.75 0.00 0.00 0.00 0.00 0.00 61.98 62.75 1mru s VAL 154 Cb -0.12 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.56 1mru s VAL 154 CO -0.05 0.47 0.60 1.15 0.00 0.00 0.00 175.10 177.27 1mru n MET 155 N 1.48 0.00 -3.82 2.72 0.00 -0.64 -2.32 117.12 114.54 1mru n MET 155 Ca -0.11 -0.47 -0.29 0.00 0.00 0.00 0.00 57.70 56.82 1mru n MET 155 Cb 0.52 -0.29 -0.13 0.00 0.00 0.00 0.00 33.22 33.32 1mru n MET 155 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1mru s ASP 156 N -0.36 4.07 -0.15 3.17 2.15 -1.26 -4.91 116.67 119.39 1mru s ASP 156 Ca 0.00 -3.23 0.02 0.00 0.43 0.00 0.00 52.55 49.76 1mru s ASP 156 Cb 0.00 -1.38 0.23 0.00 -0.30 0.00 0.00 42.92 41.47 1mru s ASP 156 CO 0.00 -0.18 1.27 0.49 -0.17 0.00 0.00 175.17 176.58 1mru n PHE 157 N 2.77 1.01 0.27 -5.34 3.72 -1.26 -4.35 117.46 114.28 1mru n PHE 157 Ca 0.13 -0.88 0.16 0.00 -0.05 0.00 0.00 57.45 56.81 1mru n PHE 157 Cb 0.35 -0.46 0.62 0.00 -0.94 0.00 0.00 39.48 39.05 1mru n PHE 157 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1mru h GLY 158 N 3.16 0.00 0.00 1.37 0.00 -1.90 -3.05 103.07 102.65 1mru h GLY 158 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1mru h GLY 158 CO 0.35 0.00 0.00 1.39 0.00 0.00 0.00 176.54 178.28 1mru n ILE 159 N -3.13 0.58 -1.47 2.60 2.08 -1.26 -4.93 119.36 113.82 1mru n ILE 159 Ca 0.01 -0.73 -0.36 0.00 0.56 0.00 0.00 62.75 62.23 1mru n ILE 159 Cb 0.34 0.75 0.09 0.00 -0.75 0.00 0.00 39.64 40.07 1mru n ILE 159 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1mru n ALA 160 N -0.29 0.50 -3.56 -1.39 0.00 -1.16 -4.35 120.51 110.27 1mru n ALA 160 Ca 0.00 -0.13 -0.21 0.00 0.00 0.00 0.00 53.44 53.10 1mru n ALA 160 Cb 0.19 -2.25 -0.16 0.00 0.00 0.00 0.00 19.45 17.22 1mru n ALA 160 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1mru s ARG 161 N -3.56 0.98 -0.79 0.00 6.06 -0.36 -4.94 118.95 116.35 1mru s ARG 161 Ca 0.78 -0.17 -0.21 0.00 -2.50 0.00 0.00 55.73 53.63 1mru s ARG 161 Cb -0.35 -0.92 0.10 0.00 0.06 0.00 0.00 34.95 33.83 1mru s ARG 161 CO 0.45 -0.05 1.05 0.00 -2.50 0.00 0.00 175.30 174.25 1mru s ALA 162 N 0.80 3.21 -0.15 6.12 0.00 -1.26 -1.79 121.76 128.70 1mru s ALA 162 Ca -0.12 -2.27 -0.22 0.00 0.00 0.00 0.00 51.96 49.34 1mru s ALA 162 Cb -0.14 -3.96 -0.20 0.00 0.00 0.00 0.00 23.12 18.82 1mru s ALA 162 CO 0.01 -2.89 0.49 -0.84 0.00 0.00 0.00 175.76 172.53 1mru h ILE 163 N 5.95 1.26 0.00 0.00 -2.65 -1.85 -3.49 117.51 116.73 1mru h ILE 163 Ca -0.07 -2.05 -0.03 0.00 1.03 0.00 0.00 64.86 63.74 1mru h ILE 163 Cb 1.05 2.49 -0.00 0.00 -2.05 0.00 0.00 36.82 38.30 1mru h ILE 163 CO 1.16 0.43 -0.13 0.71 0.03 0.00 0.00 178.15 180.34 1mru h THR 179 N -1.00 0.53 -0.01 0.16 1.35 -2.03 -3.50 112.91 108.40 1mru h THR 179 Ca -0.07 -0.62 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 1mru h THR 179 Cb 0.90 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 1mru h THR 179 CO -0.04 0.13 -0.00 0.00 -0.25 0.00 0.00 175.52 175.35 1mru n ALA 180 N -2.26 2.49 0.06 6.62 0.00 -1.26 -4.63 120.51 121.53 1mru n ALA 180 Ca -0.01 -0.59 -0.03 0.00 0.00 0.00 0.00 53.44 52.81 1mru n ALA 180 Cb 0.27 -0.37 -0.07 0.00 0.00 0.00 0.00 19.45 19.27 1mru n ALA 180 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1mru h GLN 181 N 2.17 0.00 0.00 0.00 4.20 -1.97 -3.36 115.11 116.15 1mru h GLN 181 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1mru h GLN 181 Cb 0.46 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1mru h GLN 181 CO 0.00 0.62 -0.61 0.66 -0.67 0.00 0.00 178.83 178.83 1mru n TYR 182 N -3.17 0.13 -1.91 2.96 4.01 -1.26 -4.87 117.16 113.05 1mru n TYR 182 Ca -0.04 0.04 -0.38 0.00 -0.16 0.00 0.00 57.90 57.36 1mru n TYR 182 Cb 0.88 -0.34 0.03 0.00 -0.31 0.00 0.00 39.34 39.60 1mru n TYR 182 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1mru s LEU 183 N -3.34 3.83 0.71 7.72 1.43 -1.26 -4.04 118.68 123.74 1mru s LEU 183 Ca 0.09 2.60 -0.10 0.00 -1.03 0.00 0.00 54.13 55.70 1mru s LEU 183 Cb 0.16 -4.35 0.04 0.00 0.03 0.00 0.00 46.19 42.07 1mru s LEU 183 CO 0.72 -1.49 1.07 -0.94 0.23 0.00 0.00 176.35 175.94 1mru s SER 184 N -1.17 5.16 0.08 2.29 1.04 -1.26 -4.86 113.70 114.98 1mru s SER 184 Ca 0.72 0.88 -0.19 0.00 0.48 0.00 0.00 55.95 57.85 1mru s SER 184 Cb -0.36 -1.62 -0.09 0.00 0.10 0.00 0.00 66.02 64.04 1mru s SER 184 CO 0.42 -1.46 1.49 -0.65 0.98 0.00 0.00 173.24 174.02 1mru h PRO 185 N -0.66 0.45 0.00 4.02 0.11 -1.90 0.25 132.00 134.26 1mru h PRO 185 Ca -0.45 -0.16 0.00 0.00 0.11 0.00 0.00 66.00 65.50 1mru h PRO 185 Cb 1.28 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1mru h PRO 185 CO 0.63 0.65 0.00 0.39 -0.21 0.00 0.00 178.00 179.46 1mru n GLU 186 N -4.60 0.00 -0.52 1.05 4.71 -1.26 -0.80 120.64 119.22 1mru n GLU 186 Ca -0.04 0.30 0.40 0.00 -0.01 0.00 0.00 57.16 57.82 1mru n GLU 186 Cb 0.27 -0.99 0.64 0.00 -1.01 0.00 0.00 31.44 30.36 1mru n GLU 186 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 1mru n GLN 187 N -0.79 -0.01 -0.10 3.49 7.27 -1.22 0.16 117.38 126.17 1mru n GLN 187 Ca 0.00 0.97 -0.06 0.00 0.07 0.00 0.00 57.00 57.98 1mru n GLN 187 Cb 0.00 -2.10 0.01 0.00 2.41 0.00 0.00 30.24 30.57 1mru n GLN 187 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1mru h ALA 188 N 1.05 0.34 0.06 1.69 0.00 0.16 -3.12 119.26 119.44 1mru h ALA 188 Ca 0.77 0.08 -0.17 0.00 0.00 0.00 0.00 54.91 55.59 1mru h ALA 188 Cb 2.86 0.13 0.02 0.00 0.00 0.00 0.00 17.79 20.79 1mru h ALA 188 CO -0.17 -0.37 -0.71 0.00 0.00 0.00 0.00 179.25 178.00 1mru h ARG 189 N 0.14 0.38 0.00 0.00 3.08 0.17 -3.47 114.38 114.68 1mru h ARG 189 Ca 0.17 -0.49 0.00 0.00 0.07 0.00 0.00 59.98 59.73 1mru h ARG 189 Cb 0.21 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1mru h ARG 189 CO -0.25 1.17 0.00 0.41 -1.07 0.00 0.00 179.97 180.23 1mru n GLY 190 N 1.30 0.93 3.57 0.04 0.00 -1.11 -5.11 105.19 104.81 1mru n GLY 190 Ca -0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.46 1mru n GLY 190 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mru n ASP 191 N 0.00 0.94 -2.47 1.61 8.00 -1.23 -4.66 116.55 118.75 1mru n ASP 191 Ca 0.00 1.12 -0.35 0.00 0.71 0.00 0.00 54.79 56.27 1mru n ASP 191 Cb 0.00 -1.27 -0.05 0.00 -0.02 0.00 0.00 41.12 39.78 1mru n ASP 191 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1mru n SER 192 N 1.12 0.54 -4.84 -2.24 7.64 -1.26 -3.89 113.62 110.69 1mru n SER 192 Ca 0.10 0.62 -0.36 0.00 1.01 0.00 0.00 58.87 60.24 1mru n SER 192 Cb 0.34 -0.46 -0.06 0.00 -1.01 0.00 0.00 64.21 63.01 1mru n SER 192 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1mru s VAL 193 N 1.35 5.24 0.00 0.44 1.01 -1.26 -4.69 120.40 122.49 1mru s VAL 193 Ca 0.54 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.56 1mru s VAL 193 Cb -0.77 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.31 1mru s VAL 193 CO 0.41 0.56 0.00 -0.90 0.00 0.00 0.00 175.10 175.17 1mru n ASP 194 N 1.80 0.00 -0.31 3.32 3.85 -1.26 -5.00 116.55 118.94 1mru n ASP 194 Ca -0.18 -0.85 0.11 0.00 -0.71 0.00 0.00 54.79 53.16 1mru n ASP 194 Cb 0.54 0.00 0.24 0.00 -1.35 0.00 0.00 41.12 40.55 1mru n ASP 194 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1mru h ALA 195 N 1.73 1.03 0.00 2.12 0.00 -1.95 0.77 119.26 122.96 1mru h ALA 195 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1mru h ALA 195 Cb 0.00 0.52 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1mru h ALA 195 CO 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 179.25 178.75 1mru h ARG 196 N 0.06 0.00 -0.02 0.00 3.08 -1.87 -0.07 114.38 115.56 1mru h ARG 196 Ca 0.53 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.55 1mru h ARG 196 Cb 1.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.08 1mru h ARG 196 CO -0.82 0.00 -0.11 0.77 -1.07 0.00 0.00 179.97 178.74 1mru h SER 197 N 0.00 0.12 -0.57 7.04 0.02 0.17 -1.93 113.55 118.39 1mru h SER 197 Ca 0.00 -0.69 0.06 0.00 -0.84 0.00 0.00 61.79 60.32 1mru h SER 197 Cb 0.29 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 62.75 1mru h SER 197 CO 0.00 0.79 0.28 0.44 -1.14 0.00 0.00 176.83 177.20 1mru h ASP 198 N -0.55 0.38 0.10 3.07 5.19 -0.75 -0.98 116.42 122.88 1mru h ASP 198 Ca -0.01 0.04 0.02 0.00 -0.62 0.00 0.00 57.03 56.46 1mru h ASP 198 Cb 0.80 -0.03 -0.04 0.00 0.18 0.00 0.00 39.33 40.24 1mru h ASP 198 CO 0.02 0.25 -0.30 0.58 -3.12 0.00 0.00 179.24 176.67 1mru h VAL 199 N 0.52 0.35 -0.59 -1.35 2.07 -1.05 0.14 116.25 116.35 1mru h VAL 199 Ca 0.26 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.89 1mru h VAL 199 Cb 0.20 0.35 -0.11 0.00 -1.52 0.00 0.00 31.29 30.21 1mru h VAL 199 CO -0.20 0.00 -0.30 0.22 0.02 0.00 0.00 177.57 177.31 1mru h TYR 200 N -0.51 -0.80 -0.98 1.57 3.20 -0.61 0.76 116.97 119.60 1mru h TYR 200 Ca 0.04 0.07 0.07 0.00 3.14 0.00 0.00 58.73 62.04 1mru h TYR 200 Cb 0.54 0.44 -0.07 0.00 1.54 0.00 0.00 36.73 39.19 1mru h TYR 200 CO -0.28 -0.36 0.64 0.77 -1.64 0.00 0.00 178.16 177.28 1mru h SER 201 N -0.14 1.00 0.27 -2.11 0.02 -0.52 0.23 113.55 112.31 1mru h SER 201 Ca 0.25 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.13 1mru h SER 201 Cb 0.54 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1mru h SER 201 CO -0.67 0.64 -0.32 0.25 -1.14 0.00 0.00 176.83 175.58 1mru h LEU 202 N 1.13 0.08 -0.39 5.07 5.85 0.26 -0.40 115.31 126.92 1mru h LEU 202 Ca 0.43 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 59.08 1mru h LEU 202 Cb 0.19 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1mru h LEU 202 CO -0.17 0.41 0.10 1.23 -0.34 0.00 0.00 178.44 179.67 1mru h GLY 203 N 1.03 0.67 1.93 3.75 0.00 0.35 0.41 103.07 111.21 1mru h GLY 203 Ca 0.01 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 46.87 1mru h GLY 203 CO 0.04 0.39 -0.22 0.00 0.00 0.00 0.00 176.54 176.75 1mru h VAL 205 N 0.08 1.29 -0.07 0.00 2.07 -0.64 -2.98 116.25 116.00 1mru h VAL 205 Ca 0.01 -2.60 0.04 0.00 0.82 0.00 0.00 66.70 64.97 1mru h VAL 205 Cb 0.44 2.88 -0.04 0.00 -1.52 0.00 0.00 31.29 33.05 1mru h VAL 205 CO 0.03 0.78 -0.19 0.25 0.02 0.00 0.00 177.57 178.47 1mru h LEU 206 N 0.21 -0.57 -0.41 2.57 5.85 0.20 -2.90 115.31 120.27 1mru h LEU 206 Ca -0.22 0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.67 1mru h LEU 206 Cb 2.05 0.25 -0.08 0.00 0.37 0.00 0.00 40.66 43.25 1mru h LEU 206 CO 0.26 -0.25 -0.12 0.22 -0.34 0.00 0.00 178.44 178.21 1mru h TYR 207 N -0.27 -0.28 0.00 1.25 3.20 -1.27 -1.32 116.97 118.28 1mru h TYR 207 Ca 0.08 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.99 1mru h TYR 207 Cb 0.38 0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.84 1mru h TYR 207 CO -0.27 -0.20 0.00 -1.91 -1.64 0.00 0.00 178.16 174.14 1mru n GLU 208 N -5.33 0.16 -0.06 1.82 2.13 -1.11 -0.48 120.64 117.76 1mru n GLU 208 Ca 0.02 0.57 -0.06 0.00 0.66 0.00 0.00 57.16 58.35 1mru n GLU 208 Cb 0.24 -1.93 -0.04 0.00 0.27 0.00 0.00 31.44 29.98 1mru n GLU 208 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1mru h VAL 209 N 0.00 0.41 -0.91 6.31 2.07 -1.09 -3.32 116.25 119.73 1mru h VAL 209 Ca 0.00 -1.36 0.10 0.00 0.82 0.00 0.00 66.70 66.26 1mru h VAL 209 Cb 0.12 0.83 -0.07 0.00 -1.52 0.00 0.00 31.29 30.65 1mru h VAL 209 CO 0.00 0.14 0.59 -0.07 0.02 0.00 0.00 177.57 178.25 1mru h LEU 210 N -1.00 0.82 -7.96 2.57 4.07 -1.05 -2.89 115.31 109.86 1mru h LEU 210 Ca -0.04 0.03 -0.49 0.00 0.08 0.00 0.00 57.88 57.46 1mru h LEU 210 Cb 0.45 -0.14 -0.33 0.00 1.08 0.00 0.00 40.66 41.71 1mru h LEU 210 CO -0.02 0.47 -0.81 0.42 -1.08 0.00 0.00 178.44 177.42 1mru s THR 211 N -5.83 1.02 -0.47 0.22 -4.23 0.37 -4.79 115.64 101.93 1mru s THR 211 Ca -0.11 -0.42 0.00 0.00 -1.18 0.00 0.00 61.69 59.98 1mru s THR 211 Cb 0.21 -0.94 0.00 0.00 1.34 0.00 0.00 72.50 73.11 1mru s THR 211 CO 0.80 0.33 0.58 0.61 -0.54 0.00 0.00 174.62 176.39 1mru n GLY 212 N 3.76 -0.15 3.42 3.99 0.00 -1.25 -3.78 105.19 111.18 1mru n GLY 212 Ca -0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 1mru n GLY 212 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1mru s GLU 213 N -2.16 2.07 0.57 1.61 2.02 -1.26 -4.95 118.70 116.59 1mru s GLU 213 Ca 0.00 -0.97 -0.19 0.00 0.02 0.00 0.00 54.97 53.83 1mru s GLU 213 Cb 0.00 -2.15 -0.05 0.00 0.10 0.00 0.00 34.13 32.03 1mru s GLU 213 CO 0.00 0.55 1.18 -1.25 0.02 0.00 0.00 175.26 175.75 1mru s PRO 214 N -1.21 3.16 0.61 0.39 0.04 -1.26 -3.82 135.00 132.91 1mru s PRO 214 Ca 0.13 1.74 0.27 0.00 0.04 0.00 0.00 61.00 63.18 1mru s PRO 214 Cb -0.10 -1.98 1.22 0.00 0.04 0.00 0.00 34.50 33.68 1mru s PRO 214 CO 0.03 -1.03 1.64 -1.00 0.04 0.00 0.00 177.00 176.68 1mru h PRO 215 N 1.06 0.00 -3.26 0.56 0.13 -1.92 -3.38 132.00 125.19 1mru h PRO 215 Ca -0.50 0.00 -0.34 0.00 -0.87 0.00 0.00 66.00 64.28 1mru h PRO 215 Cb 1.28 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 32.03 1mru h PRO 215 CO 0.56 0.00 -0.71 -0.06 -0.23 0.00 0.00 178.00 177.56 1mru s PHE 216 N -4.46 -0.01 0.04 1.56 0.08 -1.26 -4.54 117.98 109.39 1mru s PHE 216 Ca -0.03 0.35 0.05 0.00 0.12 0.00 0.00 56.93 57.42 1mru s PHE 216 Cb 0.13 -0.40 -0.02 0.00 -0.57 0.00 0.00 43.02 42.16 1mru s PHE 216 CO 0.46 -0.21 -0.15 0.99 -0.10 0.00 0.00 175.22 176.21 1mru s THR 217 N 2.13 1.20 0.00 0.64 2.01 -1.26 -4.96 115.64 115.40 1mru s THR 217 Ca 0.03 -1.06 0.00 0.00 0.31 0.00 0.00 61.69 60.97 1mru s THR 217 Cb -0.12 -1.09 0.00 0.00 0.01 0.00 0.00 72.50 71.30 1mru s THR 217 CO -0.04 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.52 1mru n GLY 218 N 1.83 3.88 0.42 4.40 0.00 -1.26 -4.96 105.19 109.50 1mru n GLY 218 Ca -0.18 -1.23 0.08 0.00 0.00 0.00 0.00 46.02 44.69 1mru n GLY 218 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mru n ASP 219 N -0.75 2.91 -3.54 1.61 8.00 -1.26 -5.00 116.55 118.51 1mru n ASP 219 Ca 0.00 -2.77 -0.11 0.00 0.71 0.00 0.00 54.79 52.62 1mru n ASP 219 Cb 0.00 -0.38 -0.04 0.00 -0.02 0.00 0.00 41.12 40.68 1mru n ASP 219 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1mru s SER 220 N -2.04 -0.41 0.16 -2.24 1.04 -1.26 -5.04 113.70 103.90 1mru s SER 220 Ca 0.30 0.30 -0.16 0.00 0.48 0.00 0.00 55.95 56.87 1mru s SER 220 Cb 0.24 0.37 0.09 0.00 0.10 0.00 0.00 66.02 66.83 1mru s SER 220 CO 0.06 -0.49 1.71 1.55 0.98 0.00 0.00 173.24 177.05 1mru h PRO 221 N 2.42 0.12 -0.56 4.02 0.13 -1.99 -2.10 132.00 134.04 1mru h PRO 221 Ca -0.21 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 64.92 1mru h PRO 221 Cb 1.19 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 1mru h PRO 221 CO 0.32 0.08 0.37 0.28 -0.23 0.00 0.00 178.00 178.82 1mru h VAL 222 N 0.12 1.14 0.00 1.56 2.07 -1.98 0.47 116.25 119.63 1mru h VAL 222 Ca 0.18 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1mru h VAL 222 Cb 0.25 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1mru h VAL 222 CO -0.29 0.14 0.00 0.77 0.02 0.00 0.00 177.57 178.21 1mru h SER 223 N 0.75 0.00 0.00 0.57 4.64 -1.85 -0.91 113.55 116.75 1mru h SER 223 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1mru h SER 223 Cb -0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1mru h SER 223 CO -0.05 0.00 -0.02 1.62 -0.87 0.00 0.00 176.83 177.52 1mru h VAL 224 N 0.00 0.00 -0.99 0.95 3.04 0.44 -3.13 116.25 116.56 1mru h VAL 224 Ca 0.00 -0.71 0.21 0.00 -1.01 0.00 0.00 66.70 65.19 1mru h VAL 224 Cb 0.58 0.00 -0.11 0.00 -2.01 0.00 0.00 31.29 29.75 1mru h VAL 224 CO 0.00 0.00 0.58 0.00 -1.01 0.00 0.00 177.57 177.14 1mru h ALA 225 N -1.29 1.68 0.02 3.17 0.00 -0.70 -1.84 119.26 120.30 1mru h ALA 225 Ca 0.00 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1mru h ALA 225 Cb 0.02 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1mru h ALA 225 CO 0.00 -0.16 -0.31 -0.92 0.00 0.00 0.00 179.25 177.86 1mru h TYR 226 N 0.66 -0.91 -0.88 0.00 3.20 -1.29 -2.54 116.97 115.22 1mru h TYR 226 Ca 0.60 0.03 0.24 0.00 3.14 0.00 0.00 58.73 62.73 1mru h TYR 226 Cb 1.03 0.39 -0.14 0.00 1.54 0.00 0.00 36.73 39.55 1mru h TYR 226 CO -0.02 -0.34 0.25 1.96 -1.64 0.00 0.00 178.16 178.38 1mru h GLN 227 N -0.41 0.21 -0.21 1.82 4.20 -1.28 0.17 115.11 119.61 1mru h GLN 227 Ca 0.00 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.76 1mru h GLN 227 Cb 0.43 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 1mru h GLN 227 CO -0.19 0.14 0.20 0.45 -0.67 0.00 0.00 178.83 178.76 1mru h HIS 228 N 0.22 0.00 0.03 2.96 3.86 -1.29 -0.08 115.15 120.84 1mru h HIS 228 Ca 0.56 0.00 -0.37 0.00 -1.16 0.00 0.00 60.37 59.40 1mru h HIS 228 Cb 1.13 0.00 -0.06 0.00 1.06 0.00 0.00 27.41 29.55 1mru h HIS 228 CO -0.25 0.00 -2.25 0.28 0.86 0.00 0.00 177.93 176.57 1mru n VAL 229 N -4.00 1.54 -1.21 2.45 0.31 0.54 -4.73 118.33 113.24 1mru n VAL 229 Ca 0.02 -0.70 0.04 0.00 -0.01 0.00 0.00 64.34 63.69 1mru n VAL 229 Cb 0.34 -1.16 0.05 0.00 -0.91 0.00 0.00 33.84 32.16 1mru n VAL 229 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1mru n ARG 230 N -3.13 0.94 -4.31 5.55 1.74 -0.94 -5.01 116.66 111.49 1mru n ARG 230 Ca -0.35 -1.59 -0.27 0.00 -0.77 0.00 0.00 57.85 54.87 1mru n ARG 230 Cb 1.06 -0.95 -0.17 0.00 -1.02 0.00 0.00 32.46 31.38 1mru n ARG 230 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1mru s GLU 231 N -1.22 1.82 -0.07 5.56 0.41 -0.05 -5.01 118.70 120.14 1mru s GLU 231 Ca 0.12 -0.41 -0.29 0.00 -0.41 0.00 0.00 54.97 53.98 1mru s GLU 231 Cb 0.10 -1.63 -0.02 0.00 -1.78 0.00 0.00 34.13 30.80 1mru s GLU 231 CO 0.01 -0.10 0.97 -0.51 -0.49 0.00 0.00 175.26 175.13 1mru s ASP 232 N 1.12 7.25 -0.05 -0.19 -0.00 -1.26 -4.62 116.67 118.93 1mru s ASP 232 Ca -0.05 1.53 -0.36 0.00 -0.00 0.00 0.00 52.55 53.66 1mru s ASP 232 Cb -0.14 -2.54 -0.14 0.00 -0.00 0.00 0.00 42.92 40.09 1mru s ASP 232 CO -0.02 -0.36 1.66 -0.81 -0.00 0.00 0.00 175.17 175.64 1mru n PRO 233 N 4.56 1.67 -1.47 8.23 -0.04 -1.26 -4.84 135.00 141.86 1mru n PRO 233 Ca 0.07 0.61 -0.48 0.00 -0.04 0.00 0.00 63.50 63.66 1mru n PRO 233 Cb 0.50 -2.35 -0.07 0.00 -0.04 0.00 0.00 33.50 31.54 1mru n PRO 233 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1mru n ILE 234 N 4.05 0.17 -1.48 0.52 2.08 -1.26 -4.81 119.36 118.62 1mru n ILE 234 Ca 0.21 -0.31 -0.49 0.00 0.56 0.00 0.00 62.75 62.73 1mru n ILE 234 Cb 0.23 -1.77 -0.04 0.00 -0.75 0.00 0.00 39.64 37.31 1mru n ILE 234 CO 0.00 0.00 0.00 -2.65 0.56 0.00 0.00 176.55 174.46 1mru n PRO 235 N 8.34 0.47 -0.39 0.38 -0.02 -1.26 -4.78 135.00 137.73 1mru n PRO 235 Ca 0.41 0.16 -0.21 0.00 -2.02 0.00 0.00 63.50 61.85 1mru n PRO 235 Cb 0.27 -1.39 0.20 0.00 -0.02 0.00 0.00 33.50 32.56 1mru n PRO 235 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1mru n PRO 236 N 1.13 -2.70 -1.85 0.52 -0.02 -1.26 -2.27 135.00 128.55 1mru n PRO 236 Ca 0.16 -1.00 -0.19 0.00 -2.02 0.00 0.00 63.50 60.46 1mru n PRO 236 Cb 0.24 -1.63 -0.06 0.00 -0.02 0.00 0.00 33.50 32.04 1mru n PRO 236 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1mru n SER 237 N -3.00 -5.14 0.00 2.55 3.41 -1.26 -4.86 113.62 105.33 1mru n SER 237 Ca 0.09 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 1mru n SER 237 Cb 0.41 -4.48 0.00 0.00 -0.26 0.00 0.00 64.21 59.88 1mru n SER 237 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mru n ALA 238 N 0.02 0.00 -1.32 7.33 0.00 -0.96 -4.45 120.51 121.12 1mru n ALA 238 Ca -0.20 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 52.99 1mru n ALA 238 Cb 0.64 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.24 1mru n ALA 238 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1mru n ARG 239 N 0.00 2.37 -3.86 0.00 1.74 -1.26 -4.86 116.66 110.79 1mru n ARG 239 Ca 0.00 -3.15 -0.12 0.00 -0.77 0.00 0.00 57.85 53.81 1mru n ARG 239 Cb 0.00 -2.17 -0.13 0.00 -1.02 0.00 0.00 32.46 29.14 1mru n ARG 239 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1mru s HIS 240 N -3.45 -0.05 0.25 -1.55 2.46 -1.26 -4.94 115.29 106.75 1mru s HIS 240 Ca 0.57 0.13 -0.05 0.00 0.47 0.00 0.00 55.06 56.19 1mru s HIS 240 Cb 0.48 0.01 -0.05 0.00 -0.13 0.00 0.00 32.58 32.88 1mru s HIS 240 CO 0.06 -0.07 0.50 -1.21 -2.47 0.00 0.00 174.74 171.55 1mru s GLU 241 N -0.17 3.63 -0.68 2.88 2.02 -1.26 -3.99 118.70 121.13 1mru s GLU 241 Ca -0.02 -0.03 -0.02 0.00 0.02 0.00 0.00 54.97 54.91 1mru s GLU 241 Cb -0.02 -2.70 -0.02 0.00 0.10 0.00 0.00 34.13 31.49 1mru s GLU 241 CO 0.00 0.29 0.62 0.41 0.02 0.00 0.00 175.26 176.60 1mru n GLY 242 N -0.67 -0.91 2.62 -1.39 0.00 -1.26 -4.99 105.19 98.59 1mru n GLY 242 Ca -0.02 0.36 -0.29 0.00 0.00 0.00 0.00 46.02 46.07 1mru n GLY 242 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mru s LEU 243 N -4.11 1.51 -0.29 0.99 1.43 -1.26 -4.92 118.68 112.03 1mru s LEU 243 Ca 0.15 -1.73 -0.27 0.00 -1.03 0.00 0.00 54.13 51.25 1mru s LEU 243 Cb -0.02 -0.63 -0.12 0.00 0.03 0.00 0.00 46.19 45.45 1mru s LEU 243 CO 0.59 -0.39 1.01 -1.54 0.23 0.00 0.00 176.35 176.25 1mru n SER 244 N 4.69 0.64 -0.26 2.29 3.41 -1.26 -4.61 113.62 118.52 1mru n SER 244 Ca 0.00 0.62 0.25 0.00 -0.26 0.00 0.00 58.87 59.49 1mru n SER 244 Cb 0.40 -0.52 0.61 0.00 -0.26 0.00 0.00 64.21 64.44 1mru n SER 244 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mru h ALA 245 N 3.46 2.54 -0.75 7.33 0.00 -1.99 0.32 119.26 130.18 1mru h ALA 245 Ca -0.21 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1mru h ALA 245 Cb 0.81 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 1mru h ALA 245 CO 0.59 -0.86 0.41 -0.44 0.00 0.00 0.00 179.25 178.95 1mru h ASP 246 N 0.22 0.92 0.21 0.00 3.45 -2.00 0.12 116.42 119.35 1mru h ASP 246 Ca 0.51 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.89 1mru h ASP 246 Cb 1.59 -0.23 0.00 0.00 -0.56 0.00 0.00 39.33 40.12 1mru h ASP 246 CO -0.14 0.74 0.00 0.25 -1.57 0.00 0.00 179.24 178.52 1mru h LEU 247 N 1.04 0.00 0.10 1.55 5.85 -0.68 -2.68 115.31 120.48 1mru h LEU 247 Ca 0.26 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.80 1mru h LEU 247 Cb 0.02 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.06 1mru h LEU 247 CO -0.04 0.00 -0.89 0.44 -0.34 0.00 0.00 178.44 177.60 1mru h ASP 248 N 0.00 0.32 -0.39 1.25 5.19 -0.65 -2.59 116.42 119.56 1mru h ASP 248 Ca 0.00 -0.90 0.11 0.00 -0.62 0.00 0.00 57.03 55.63 1mru h ASP 248 Cb 0.10 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 39.49 1mru h ASP 248 CO 0.00 1.40 0.33 0.00 -3.12 0.00 0.00 179.24 177.85 1mru h ALA 249 N -0.02 2.21 0.18 3.45 0.00 -1.29 0.45 119.26 124.23 1mru h ALA 249 Ca -0.18 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1mru h ALA 249 Cb 1.54 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1mru h ALA 249 CO 0.07 -0.53 -0.08 0.28 0.00 0.00 0.00 179.25 178.99 1mru h VAL 250 N 0.00 0.00 -0.87 0.00 2.07 -1.55 -1.95 116.25 113.96 1mru h VAL 250 Ca 0.18 -0.35 0.18 0.00 0.82 0.00 0.00 66.70 67.53 1mru h VAL 250 Cb 0.84 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 1mru h VAL 250 CO -0.00 0.00 0.57 0.58 0.02 0.00 0.00 177.57 178.74 1mru h VAL 251 N -0.58 0.74 0.00 2.57 2.07 -1.00 -0.74 116.25 119.31 1mru h VAL 251 Ca -0.02 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.33 1mru h VAL 251 Cb 0.18 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1mru h VAL 251 CO 0.04 0.09 -0.16 0.18 0.02 0.00 0.00 177.57 177.74 1mru n LEU 252 N -4.52 0.37 -0.05 2.57 4.32 0.15 -2.76 117.00 117.08 1mru n LEU 252 Ca 0.18 0.40 -0.21 0.00 -0.02 0.00 0.00 56.01 56.35 1mru n LEU 252 Cb 0.60 -0.38 -0.13 0.00 -1.62 0.00 0.00 43.42 41.90 1mru n LEU 252 CO 0.31 -0.03 -0.50 0.50 -1.22 0.00 0.00 177.39 176.45 1mru h LYS 253 N 0.00 0.11 -0.04 3.23 3.64 -0.35 -3.21 116.57 119.95 1mru h LYS 253 Ca 0.00 -0.19 0.01 0.00 -1.27 0.00 0.00 60.65 59.20 1mru h LYS 253 Cb 0.59 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.48 1mru h LYS 253 CO 0.00 1.09 0.22 0.00 -2.27 0.00 0.00 179.45 178.49 1mru h ALA 254 N -0.24 1.33 -0.47 5.00 0.00 -1.34 0.74 119.26 124.29 1mru h ALA 254 Ca -0.33 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1mru h ALA 254 Cb 1.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.34 1mru h ALA 254 CO -0.07 -0.24 0.00 1.28 0.00 0.00 0.00 179.25 180.22 1mru n LEU 255 N -3.11 3.28 -4.50 0.00 4.77 -1.11 -3.75 117.00 112.58 1mru n LEU 255 Ca -0.01 -1.92 -0.37 0.00 -0.03 0.00 0.00 56.01 53.68 1mru n LEU 255 Cb 0.29 -0.31 0.05 0.00 -2.33 0.00 0.00 43.42 41.12 1mru n LEU 255 CO 0.18 0.80 0.16 0.00 -1.33 0.00 0.00 177.39 177.20 1mru n ALA 256 N 0.98 -1.02 -0.08 -1.18 0.00 0.25 -4.90 120.51 114.56 1mru n ALA 256 Ca 0.16 -0.11 -0.14 0.00 0.00 0.00 0.00 53.44 53.35 1mru n ALA 256 Cb 0.50 -1.90 -0.05 0.00 0.00 0.00 0.00 19.45 18.01 1mru n ALA 256 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1mru h LYS 257 N 0.03 0.76 -5.19 0.00 1.79 -1.92 -3.43 116.57 108.61 1mru h LYS 257 Ca -0.46 -0.47 -0.62 0.00 -2.18 0.00 0.00 60.65 56.92 1mru h LYS 257 Cb 1.37 0.05 -0.16 0.00 -1.58 0.00 0.00 32.23 31.91 1mru h LYS 257 CO 0.46 1.10 -0.56 1.21 -1.08 0.00 0.00 179.45 180.58 1mru s ASN 258 N -6.76 5.68 0.21 0.86 2.47 -1.26 -4.90 114.94 111.25 1mru s ASN 258 Ca -0.12 0.05 -0.18 0.00 0.42 0.00 0.00 52.86 53.03 1mru s ASN 258 Cb 0.09 -1.99 0.21 0.00 -1.45 0.00 0.00 41.25 38.10 1mru s ASN 258 CO 0.86 0.12 1.58 -0.65 -3.72 0.00 0.00 177.10 175.28 1mru h PRO 259 N 7.10 -0.08 -1.14 0.43 0.11 -1.95 0.45 132.00 136.93 1mru h PRO 259 Ca -0.37 0.01 0.38 0.00 0.11 0.00 0.00 66.00 66.12 1mru h PRO 259 Cb 1.17 0.02 -0.14 0.00 0.11 0.00 0.00 31.00 32.16 1mru h PRO 259 CO 0.68 -0.05 0.69 0.93 -0.21 0.00 0.00 178.00 180.04 1mru h GLU 260 N -0.08 0.18 -0.04 1.05 3.07 -1.96 1.50 114.58 118.30 1mru h GLU 260 Ca 0.30 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 1mru h GLU 260 Cb 0.58 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 1mru h GLU 260 CO -0.82 0.12 0.00 0.09 -1.40 0.00 0.00 179.01 177.00 1mru n ASN 261 N -4.88 0.94 -5.02 1.42 3.02 0.14 -4.87 115.26 106.00 1mru n ASN 261 Ca 0.34 -1.41 -0.20 0.00 -0.03 0.00 0.00 54.58 53.29 1mru n ASN 261 Cb 1.20 -0.02 0.05 0.00 -0.61 0.00 0.00 39.78 40.40 1mru n ASN 261 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1mru s ARG 262 N -1.95 2.36 0.08 3.52 0.52 0.51 -4.78 118.95 119.21 1mru s ARG 262 Ca 0.38 -1.62 -0.31 0.00 -0.52 0.00 0.00 55.73 53.66 1mru s ARG 262 Cb 0.19 -2.63 -0.08 0.00 0.52 0.00 0.00 34.95 32.95 1mru s ARG 262 CO 0.31 -0.78 1.54 0.71 0.02 0.00 0.00 175.30 177.11 1mru s TYR 263 N -2.64 2.76 -0.88 -0.53 2.02 -1.26 -4.85 117.35 111.97 1mru s TYR 263 Ca 0.59 0.58 0.19 0.00 -0.37 0.00 0.00 57.07 58.07 1mru s TYR 263 Cb -0.06 -3.85 0.81 0.00 -0.40 0.00 0.00 41.96 38.46 1mru s TYR 263 CO 0.37 -3.26 1.61 1.04 -1.57 0.00 0.00 175.55 173.74 1mru n GLN 264 N 5.00 0.05 -4.09 -0.62 3.00 -1.26 -4.79 117.38 114.67 1mru n GLN 264 Ca 0.14 0.24 -0.11 0.00 -0.01 0.00 0.00 57.00 57.26 1mru n GLN 264 Cb 0.41 -1.59 -0.07 0.00 0.00 0.00 0.00 30.24 28.99 1mru n GLN 264 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 1mru s THR 265 N -3.07 0.00 -0.22 5.09 -4.23 -1.26 -4.65 115.64 107.30 1mru s THR 265 Ca 0.08 -1.66 0.20 0.00 -1.18 0.00 0.00 61.69 59.12 1mru s THR 265 Cb 0.11 -2.36 0.03 0.00 1.34 0.00 0.00 72.50 71.62 1mru s THR 265 CO 0.35 0.00 1.15 0.00 -0.54 0.00 0.00 174.62 175.58 1mru h ALA 266 N 2.38 0.66 -0.13 3.99 0.00 -1.88 -3.01 119.26 121.27 1mru h ALA 266 Ca -0.30 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.19 1mru h ALA 266 Cb 1.25 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1mru h ALA 266 CO 0.42 0.37 -0.29 0.00 0.00 0.00 0.00 179.25 179.75 1mru h ALA 267 N 1.75 0.21 -0.28 0.00 0.00 -1.95 -1.73 119.26 117.27 1mru h ALA 267 Ca -0.05 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.47 1mru h ALA 267 Cb 1.23 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 1mru h ALA 267 CO 0.02 0.23 0.13 1.49 0.00 0.00 0.00 179.25 181.12 1mru h GLU 268 N 0.03 0.26 -0.24 0.00 4.81 -1.96 -2.25 114.58 115.23 1mru h GLU 268 Ca 0.00 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.26 1mru h GLU 268 Cb 0.90 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.18 1mru h GLU 268 CO 0.06 0.17 -0.00 1.98 -0.73 0.00 0.00 179.01 180.49 1mru h MET 269 N 0.27 0.07 0.03 1.92 4.05 -1.50 -3.03 114.93 116.73 1mru h MET 269 Ca 0.12 -0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.54 1mru h MET 269 Cb 0.05 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 30.81 1mru h MET 269 CO -0.09 0.04 -0.29 -0.09 0.23 0.00 0.00 176.91 176.71 1mru h ARG 270 N 0.07 -0.38 -0.69 0.39 2.43 -0.80 -2.46 114.38 112.94 1mru h ARG 270 Ca 0.12 0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.43 1mru h ARG 270 Cb 0.15 0.09 -0.12 0.00 -0.42 0.00 0.00 29.97 29.67 1mru h ARG 270 CO -0.20 -0.25 -0.25 0.00 -1.51 0.00 0.00 179.97 177.76 1mru n ALA 271 N -2.74 -0.02 -0.34 2.80 0.00 -0.89 0.18 120.51 119.50 1mru n ALA 271 Ca -0.04 0.71 0.07 0.00 0.00 0.00 0.00 53.44 54.17 1mru n ALA 271 Cb 0.22 -0.34 0.25 0.00 0.00 0.00 0.00 19.45 19.58 1mru n ALA 271 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1mru h ASP 272 N 0.00 0.90 -0.69 0.00 5.19 -1.40 -0.85 116.42 119.57 1mru h ASP 272 Ca 0.26 0.04 -0.05 0.00 -0.62 0.00 0.00 57.03 56.66 1mru h ASP 272 Cb 0.44 -0.15 -0.03 0.00 0.18 0.00 0.00 39.33 39.77 1mru h ASP 272 CO -0.69 0.50 0.25 -0.07 -3.12 0.00 0.00 179.24 176.11 1mru h LEU 273 N 0.98 0.99 -0.63 1.55 3.38 0.23 -0.49 115.31 121.32 1mru h LEU 273 Ca 0.46 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 58.16 1mru h LEU 273 Cb 0.44 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1mru h LEU 273 CO -0.23 0.90 -0.11 0.58 0.09 0.00 0.00 178.44 179.67 1mru h VAL 274 N 1.03 1.27 0.36 1.22 2.07 -0.56 0.28 116.25 121.92 1mru h VAL 274 Ca 0.23 -1.25 -0.02 0.00 0.82 0.00 0.00 66.70 66.48 1mru h VAL 274 Cb 0.25 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1mru h VAL 274 CO -0.01 0.44 -0.17 0.03 0.02 0.00 0.00 177.57 177.87 1mru h ARG 275 N 0.86 -0.46 -0.21 1.57 3.08 -0.85 0.41 114.38 118.78 1mru h ARG 275 Ca 0.14 0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.28 1mru h ARG 275 Cb 0.66 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 1mru h ARG 275 CO 0.05 -0.18 0.16 0.28 -1.07 0.00 0.00 179.97 179.21 1mru h VAL 276 N -0.71 0.80 0.00 2.04 2.07 -1.02 0.22 116.25 119.65 1mru h VAL 276 Ca -0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1mru h VAL 276 Cb 0.49 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1mru h VAL 276 CO 0.08 0.00 0.00 1.57 0.02 0.00 0.00 177.57 179.24 1mru n HIS 277 N -4.32 0.00 0.00 1.57 -0.00 0.98 -4.19 115.22 109.26 1mru n HIS 277 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.74 1mru n HIS 277 Cb 0.30 -0.08 0.00 0.00 -0.00 0.00 0.00 29.99 30.21 1mru n HIS 277 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 1mru n ASN 278 N -0.74 0.00 0.01 0.26 3.02 0.13 -4.97 115.26 112.97 1mru n ASN 278 Ca 0.00 0.58 0.00 0.00 -0.03 0.00 0.00 54.58 55.13 1mru n ASN 278 Cb 0.00 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 1mru n ASN 278 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mru n GLY 279 N -0.83 -1.98 0.60 7.41 0.00 0.77 -5.07 105.19 106.10 1mru n GLY 279 Ca 0.00 0.59 -0.07 0.00 0.00 0.00 0.00 46.02 46.54 1mru n GLY 279 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1mru n GLU 280 N -2.06 0.00 -2.07 1.61 1.02 -1.24 -4.49 120.64 113.40 1mru n GLU 280 Ca 0.00 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 56.75 1mru n GLU 280 Cb 0.00 -0.18 -0.01 0.00 -0.02 0.00 0.00 31.44 31.23 1mru n GLU 280 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 1mru s PRO 281 N -0.18 3.95 1.01 3.49 0.02 -1.26 -4.02 135.00 138.00 1mru s PRO 281 Ca 0.11 2.12 -0.15 0.00 0.02 0.00 0.00 61.00 63.10 1mru s PRO 281 Cb -0.10 -2.73 0.19 0.00 0.02 0.00 0.00 34.50 31.88 1mru s PRO 281 CO 0.12 -0.49 1.15 -1.25 -0.33 0.00 0.00 177.00 176.20 1mru s PRO 282 N -2.26 0.35 -0.14 5.54 0.04 -1.26 -4.90 135.00 132.37 1mru s PRO 282 Ca 0.57 0.12 0.04 0.00 0.04 0.00 0.00 61.00 61.77 1mru s PRO 282 Cb -0.37 -1.76 0.30 0.00 0.04 0.00 0.00 34.50 32.71 1mru s PRO 282 CO 0.48 -2.70 1.18 0.39 0.04 0.00 0.00 177.00 176.39 1mru n GLU 283 N -4.08 2.06 -3.15 4.56 1.02 -1.26 -4.85 120.64 114.94 1mru n GLU 283 Ca 0.09 -1.24 -0.43 0.00 -0.02 0.00 0.00 57.16 55.56 1mru n GLU 283 Cb 0.59 -1.65 -0.07 0.00 -0.02 0.00 0.00 31.44 30.29 1mru n GLU 283 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1mru s ALA 284 N -1.52 3.37 0.97 0.62 0.00 -1.26 -5.06 121.76 118.87 1mru s ALA 284 Ca 0.22 -1.25 -0.18 0.00 0.00 0.00 0.00 51.96 50.75 1mru s ALA 284 Cb 0.18 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 20.06 1mru s ALA 284 CO 0.05 -1.72 -0.45 -2.30 0.00 0.00 0.00 175.76 171.35 1mru n PRO 285 N 6.12 -1.02 -0.44 0.00 -0.02 -1.26 -4.83 135.00 133.54 1mru n PRO 285 Ca -0.03 -0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.16 1mru n PRO 285 Cb 0.48 -1.31 0.00 0.00 -0.02 0.00 0.00 33.50 32.65 1mru n PRO 285 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65