#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qj0 n SER -4 N 0.00 2.98 -0.02 1.61 2.88 -1.26 -4.49 113.62 115.32 2qj0 n SER -4 Ca 0.00 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.61 2qj0 n SER -4 Cb 0.00 0.54 0.39 0.00 -0.75 0.00 0.00 64.21 64.40 2qj0 n SER -4 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2qj0 n GLU -3 N -0.98 1.03 -0.12 -1.46 0.00 -1.26 -2.17 120.64 115.69 2qj0 n GLU -3 Ca 0.00 -0.05 -0.25 0.00 0.00 0.00 0.00 57.16 56.86 2qj0 n GLU -3 Cb 0.05 -1.22 -0.11 0.00 0.00 0.00 0.00 31.44 30.17 2qj0 n GLU -3 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 2qj0 n PHE -2 N -0.67 0.50 0.33 -1.84 7.35 -1.26 -4.08 117.46 117.79 2qj0 n PHE -2 Ca 0.10 0.20 0.09 0.00 -0.76 0.00 0.00 57.45 57.08 2qj0 n PHE -2 Cb 0.06 -1.05 0.48 0.00 0.35 0.00 0.00 39.48 39.32 2qj0 n PHE -2 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2qj0 h ARG -1 N -0.88 0.00 -0.90 -4.13 2.47 -1.66 0.12 114.38 109.40 2qj0 h ARG -1 Ca -0.54 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.18 2qj0 h ARG -1 Cb 1.53 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.85 2qj0 h ARG -1 CO -0.29 0.00 0.00 0.45 0.56 0.00 0.00 179.97 180.69 2qj0 n SER 0 N -2.74 1.60 0.00 7.04 2.88 -1.24 -2.69 113.62 118.47 2qj0 n SER 0 Ca -0.01 -2.12 0.00 0.00 -1.33 0.00 0.00 58.87 55.41 2qj0 n SER 0 Cb 0.65 -0.50 0.00 0.00 -0.75 0.00 0.00 64.21 63.60 2qj0 n SER 0 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2qj0 n THR 2 N 0.07 0.00 0.10 2.46 -1.04 0.42 -0.91 114.28 115.38 2qj0 n THR 2 Ca 0.04 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 62.02 2qj0 n THR 2 Cb 0.37 0.00 0.17 0.00 -1.82 0.00 0.00 70.33 69.05 2qj0 n THR 2 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2qj0 h ALA 3 N 0.00 0.98 -0.25 2.41 0.00 -1.73 -2.51 119.26 118.16 2qj0 h ALA 3 Ca 0.00 -0.50 -0.10 0.00 0.00 0.00 0.00 54.91 54.32 2qj0 h ALA 3 Cb 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2qj0 h ALA 3 CO 0.00 0.68 -0.27 0.82 0.00 0.00 0.00 179.25 180.48 2qj0 h ILE 4 N 0.14 1.27 0.14 0.00 2.04 -1.32 -2.35 117.51 117.43 2qj0 h ILE 4 Ca 0.00 -1.30 -0.01 0.00 1.00 0.00 0.00 64.86 64.56 2qj0 h ILE 4 Cb 0.99 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.45 2qj0 h ILE 4 CO 0.08 0.41 -0.07 -0.33 0.00 0.00 0.00 178.15 178.24 2qj0 h GLU 5 N 0.42 -0.18 0.00 2.37 5.08 -1.70 -1.23 114.58 119.34 2qj0 h GLU 5 Ca 0.06 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2qj0 h GLU 5 Cb 0.69 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.98 2qj0 h GLU 5 CO 0.05 0.05 0.00 -0.25 -1.00 0.00 0.00 179.01 177.86 2qj0 n ASP 6 N -5.08 0.28 -0.12 1.42 8.00 -0.97 0.28 116.55 120.36 2qj0 n ASP 6 Ca -0.09 0.55 -0.26 0.00 0.71 0.00 0.00 54.79 55.70 2qj0 n ASP 6 Cb 0.18 -0.62 -0.11 0.00 -0.02 0.00 0.00 41.12 40.55 2qj0 n ASP 6 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2qj0 n ILE 7 N -1.79 1.54 1.55 0.53 5.41 -0.89 -4.32 119.36 121.39 2qj0 n ILE 7 Ca 0.05 -0.29 0.14 0.00 1.00 0.00 0.00 62.75 63.65 2qj0 n ILE 7 Cb 0.27 -1.90 0.59 0.00 -0.71 0.00 0.00 39.64 37.90 2qj0 n ILE 7 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2qj0 n LEU 8 N -4.20 1.07 -3.92 1.39 4.77 -0.47 -4.54 117.00 111.11 2qj0 n LEU 8 Ca -0.45 -0.33 -0.36 0.00 -0.03 0.00 0.00 56.01 54.84 2qj0 n LEU 8 Cb 0.83 -0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.90 2qj0 n LEU 8 CO 0.12 0.18 -0.18 0.00 -1.33 0.00 0.00 177.39 176.18 2qj0 n GLN 9 N -0.24 -0.85 -3.64 3.23 6.02 0.14 -4.93 117.38 117.10 2qj0 n GLN 9 Ca 0.19 0.41 -0.10 0.00 -0.01 0.00 0.00 57.00 57.49 2qj0 n GLN 9 Cb 0.30 -2.58 -0.07 0.00 1.02 0.00 0.00 30.24 28.91 2qj0 n GLN 9 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 2qj0 s ILE 10 N -3.29 0.00 0.28 5.09 2.07 -1.09 -2.68 121.20 121.58 2qj0 s ILE 10 Ca 0.28 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.54 2qj0 s ILE 10 Cb -0.15 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.43 2qj0 s ILE 10 CO 0.93 0.00 0.08 0.35 -1.91 0.00 0.00 174.94 174.39 2qj0 n THR 11 N 3.64 0.00 0.00 4.00 -2.24 -0.85 -4.43 114.28 114.40 2qj0 n THR 11 Ca -0.17 -1.57 0.00 0.00 -2.27 0.00 0.00 64.05 60.03 2qj0 n THR 11 Cb 0.57 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.33 2qj0 n THR 11 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2qj0 n THR 12 N -0.64 0.00 -2.88 4.28 -1.04 -1.26 -3.15 114.28 109.59 2qj0 n THR 12 Ca -0.05 -0.27 -0.42 0.00 -2.04 0.00 0.00 64.05 61.26 2qj0 n THR 12 Cb 0.41 0.78 -0.04 0.00 -1.82 0.00 0.00 70.33 69.65 2qj0 n THR 12 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 2qj0 s ASP 13 N -1.36 6.83 0.00 8.00 -4.77 -1.26 -4.87 116.67 119.23 2qj0 s ASP 13 Ca 0.00 1.01 0.00 0.00 -3.30 0.00 0.00 52.55 50.26 2qj0 s ASP 13 Cb 0.00 -2.44 0.00 0.00 -1.09 0.00 0.00 42.92 39.39 2qj0 s ASP 13 CO 0.00 -0.55 0.72 -2.65 0.70 0.00 0.00 175.17 173.39 2qj0 n PRO 14 N 6.07 0.00 -3.56 2.11 -0.02 -1.26 -3.41 135.00 134.94 2qj0 n PRO 14 Ca 0.06 0.25 -0.27 0.00 -2.02 0.00 0.00 63.50 61.52 2qj0 n PRO 14 Cb 0.47 -1.67 -0.09 0.00 -0.02 0.00 0.00 33.50 32.19 2qj0 n PRO 14 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2qj0 n SER 15 N -1.22 2.75 -4.71 2.55 7.64 -1.26 -5.08 113.62 114.29 2qj0 n SER 15 Ca 0.00 -3.19 -0.35 0.00 1.01 0.00 0.00 58.87 56.34 2qj0 n SER 15 Cb 0.17 -0.69 -0.09 0.00 -1.01 0.00 0.00 64.21 62.60 2qj0 n SER 15 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2qj0 s ASP 16 N -1.78 5.77 0.00 6.43 2.15 -1.22 -4.97 116.67 123.05 2qj0 s ASP 16 Ca 0.34 0.20 0.00 0.00 0.43 0.00 0.00 52.55 53.52 2qj0 s ASP 16 Cb 0.08 -1.89 0.00 0.00 -0.30 0.00 0.00 42.92 40.81 2qj0 s ASP 16 CO -0.09 0.28 0.52 0.41 -0.17 0.00 0.00 175.17 176.11 2qj0 n THR 17 N 2.84 0.00 -4.11 1.71 -1.04 -1.26 -4.73 114.28 107.69 2qj0 n THR 17 Ca -0.18 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.74 2qj0 n THR 17 Cb 0.53 -0.23 -0.10 0.00 -1.82 0.00 0.00 70.33 68.71 2qj0 n THR 17 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 2qj0 s ARG 18 N -1.86 0.66 0.00 -2.82 6.06 -1.26 -5.04 118.95 114.69 2qj0 s ARG 18 Ca 0.00 -1.14 0.00 0.00 -2.50 0.00 0.00 55.73 52.09 2qj0 s ARG 18 Cb 0.00 -0.04 0.00 0.00 0.06 0.00 0.00 34.95 34.97 2qj0 s ARG 18 CO 0.00 -0.04 0.69 0.41 -2.50 0.00 0.00 175.30 173.86 2qj0 n GLY 19 N 0.40 1.18 3.78 8.12 0.00 -1.26 -4.87 105.19 112.54 2qj0 n GLY 19 Ca -0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 2qj0 n GLY 19 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qj0 s TYR 20 N 0.72 3.45 0.37 1.61 1.51 -1.26 -4.99 117.35 118.75 2qj0 s TYR 20 Ca 0.00 1.70 -0.27 0.00 -1.01 0.00 0.00 57.07 57.48 2qj0 s TYR 20 Cb 0.00 -3.10 -0.09 0.00 -0.11 0.00 0.00 41.96 38.66 2qj0 s TYR 20 CO 0.00 -0.38 1.28 -1.12 -1.11 0.00 0.00 175.55 174.23 2qj0 s SER 21 N -1.45 6.58 -0.19 2.29 0.01 -1.09 -4.71 113.70 115.13 2qj0 s SER 21 Ca 0.53 2.62 -0.09 0.00 1.31 0.00 0.00 55.95 60.32 2qj0 s SER 21 Cb -0.23 -2.64 -0.05 0.00 0.21 0.00 0.00 66.02 63.31 2qj0 s SER 21 CO 0.29 -0.66 0.11 -0.76 0.41 0.00 0.00 173.24 172.63 2qj0 s LEU 22 N -2.12 4.12 0.02 2.44 1.02 -1.26 -2.00 118.68 120.91 2qj0 s LEU 22 Ca 0.53 0.20 0.00 0.00 0.02 0.00 0.00 54.13 54.88 2qj0 s LEU 22 Cb -0.38 -2.06 -0.04 0.00 0.02 0.00 0.00 46.19 43.73 2qj0 s LEU 22 CO 0.49 0.19 0.10 -1.48 0.02 0.00 0.00 176.35 175.67 2qj0 s LEU 23 N 0.31 3.97 -0.15 1.79 2.34 -1.19 -5.02 118.68 120.73 2qj0 s LEU 23 Ca 0.07 0.14 -0.04 0.00 0.06 0.00 0.00 54.13 54.36 2qj0 s LEU 23 Cb -0.11 -2.44 0.06 0.00 -0.56 0.00 0.00 46.19 43.14 2qj0 s LEU 23 CO -0.01 0.23 0.12 -0.54 -1.06 0.00 0.00 176.35 175.09 2qj0 s LYS 24 N -2.02 0.07 0.00 1.48 1.02 -1.26 -4.84 119.74 114.19 2qj0 s LYS 24 Ca 0.26 0.08 0.00 0.00 0.02 0.00 0.00 55.97 56.33 2qj0 s LYS 24 Cb -0.12 -1.43 0.00 0.00 -0.52 0.00 0.00 37.83 35.75 2qj0 s LYS 24 CO 0.18 -0.60 0.00 0.45 -0.92 0.00 0.00 175.35 174.46 2qj0 n SER 25 N 5.29 0.00 0.00 2.83 2.88 -1.26 -5.22 113.62 118.14 2qj0 n SER 25 Ca -0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 2qj0 n SER 25 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 2qj0 n SER 25 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2qj0 n LEU 34 N 0.00 0.00 0.00 2.46 4.32 -1.26 -5.22 117.00 117.30 2qj0 n LEU 34 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2qj0 n LEU 34 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 2qj0 n LEU 34 CO 0.00 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.78 2qj0 n GLY 35 N 0.00 1.81 0.00 -0.72 0.00 -1.26 -4.77 105.19 100.25 2qj0 n GLY 35 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.56 2qj0 n GLY 35 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2qj0 n VAL 36 N 0.00 0.00 0.66 1.61 0.31 -1.26 -4.39 118.33 115.26 2qj0 n VAL 36 Ca 0.00 -0.45 0.10 0.00 -0.01 0.00 0.00 64.34 63.98 2qj0 n VAL 36 Cb 0.00 1.05 0.27 0.00 -0.91 0.00 0.00 33.84 34.26 2qj0 n VAL 36 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2qj0 n ASP 37 N -0.43 2.58 -0.00 4.52 8.00 -1.26 -3.40 116.55 126.56 2qj0 n ASP 37 Ca 0.00 -1.90 0.08 0.00 0.71 0.00 0.00 54.79 53.68 2qj0 n ASP 37 Cb 0.01 -0.23 -0.11 0.00 -0.02 0.00 0.00 41.12 40.78 2qj0 n ASP 37 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2qj0 n PHE 38 N 0.91 0.00 0.41 1.24 7.35 -1.26 -4.44 117.46 121.68 2qj0 n PHE 38 Ca 0.17 0.00 0.13 0.00 -0.76 0.00 0.00 57.45 57.00 2qj0 n PHE 38 Cb 0.45 -0.17 0.44 0.00 0.35 0.00 0.00 39.48 40.55 2qj0 n PHE 38 CO 0.00 0.00 0.00 -0.84 -0.76 0.00 0.00 176.76 175.16 2qj0 h ILE 39 N 0.00 0.00 -0.00 -2.13 3.07 -1.80 -0.63 117.51 116.01 2qj0 h ILE 39 Ca 0.00 -0.52 -0.22 0.00 1.55 0.00 0.00 64.86 65.67 2qj0 h ILE 39 Cb 0.55 1.45 -0.00 0.00 -0.27 0.00 0.00 36.82 38.55 2qj0 h ILE 39 CO 0.00 0.00 -0.91 -0.78 -1.05 0.00 0.00 178.15 175.41 2qj0 h ASP 40 N 0.00 0.46 -0.32 2.16 1.82 -1.81 -2.68 116.42 116.06 2qj0 h ASP 40 Ca 0.00 -0.37 -0.15 0.00 -0.39 0.00 0.00 57.03 56.12 2qj0 h ASP 40 Cb 0.64 -0.14 -0.00 0.00 0.68 0.00 0.00 39.33 40.51 2qj0 h ASP 40 CO 0.00 1.16 -0.39 0.74 -1.61 0.00 0.00 179.24 179.14 2qj0 h THR 41 N 0.20 1.29 -0.39 2.25 2.02 -1.67 -1.78 112.91 114.83 2qj0 h THR 41 Ca -0.07 -1.57 0.05 0.00 0.77 0.00 0.00 66.41 65.59 2qj0 h THR 41 Cb 1.54 1.55 -0.05 0.00 -1.74 0.00 0.00 68.15 69.45 2qj0 h THR 41 CO 0.15 0.51 0.10 -0.07 0.37 0.00 0.00 175.52 176.59 2qj0 h LEU 42 N 0.60 0.07 0.76 2.58 3.38 -1.13 -2.89 115.31 118.68 2qj0 h LEU 42 Ca 0.04 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 2qj0 h LEU 42 Cb 0.99 0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.81 2qj0 h LEU 42 CO 0.09 0.07 -0.37 -0.07 0.09 0.00 0.00 178.44 178.26 2qj0 h LEU 43 N 0.24 -0.87 -1.87 1.67 4.07 -1.37 -2.21 115.31 114.98 2qj0 h LEU 43 Ca 0.18 0.03 0.40 0.00 0.08 0.00 0.00 57.88 58.57 2qj0 h LEU 43 Cb 0.20 0.22 -0.06 0.00 1.08 0.00 0.00 40.66 42.11 2qj0 h LEU 43 CO -0.22 -0.56 1.07 0.25 -1.08 0.00 0.00 178.44 177.90 2qj0 h LEU 44 N -1.15 0.00 0.14 1.67 6.46 -1.33 -0.02 115.31 121.08 2qj0 h LEU 44 Ca -0.10 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.65 2qj0 h LEU 44 Cb 0.79 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.72 2qj0 h LEU 44 CO 0.17 0.00 -0.07 0.22 -0.62 0.00 0.00 178.44 178.14 2qj0 h TYR 45 N 0.00 -0.18 -1.55 1.25 3.20 -1.33 -1.05 116.97 117.31 2qj0 h TYR 45 Ca 0.65 -0.00 0.45 0.00 3.14 0.00 0.00 58.73 62.97 2qj0 h TYR 45 Cb 2.78 0.06 -0.06 0.00 1.54 0.00 0.00 36.73 41.05 2qj0 h TYR 45 CO 0.00 -0.11 1.11 1.96 -1.64 0.00 0.00 178.16 179.48 2qj0 h GLN 46 N -0.54 0.00 0.05 1.82 1.08 -0.41 0.30 115.11 117.41 2qj0 h GLN 46 Ca -0.02 -0.00 -0.33 0.00 -1.45 0.00 0.00 58.65 56.85 2qj0 h GLN 46 Cb 0.15 -0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.54 2qj0 h GLN 46 CO 0.03 0.00 -1.91 1.28 -0.95 0.00 0.00 178.83 177.28 2qj0 n LEU 47 N -4.08 1.65 -0.27 1.46 4.77 -0.49 -4.23 117.00 115.80 2qj0 n LEU 47 Ca 0.34 0.28 0.03 0.00 -0.03 0.00 0.00 56.01 56.63 2qj0 n LEU 47 Cb 1.60 -0.39 0.05 0.00 -2.33 0.00 0.00 43.42 42.35 2qj0 n LEU 47 CO 0.42 0.62 0.47 0.35 -1.33 0.00 0.00 177.39 177.92 2qj0 n THR 48 N -3.21 0.60 0.05 -5.08 -2.24 -0.40 -4.63 114.28 99.37 2qj0 n THR 48 Ca -0.26 -0.80 0.00 0.00 -2.27 0.00 0.00 64.05 60.73 2qj0 n THR 48 Cb 1.05 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 70.03 2qj0 n THR 48 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2qj0 n GLU 49 N 0.12 0.00 -1.54 -0.78 -0.58 0.94 -5.00 120.64 113.79 2qj0 n GLU 49 Ca 0.05 0.00 -0.39 0.00 -0.42 0.00 0.00 57.16 56.40 2qj0 n GLU 49 Cb 0.26 -0.23 -0.05 0.00 -0.57 0.00 0.00 31.44 30.85 2qj0 n GLU 49 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2qj0 n ASN 50 N -3.08 2.14 0.00 1.62 4.05 -1.07 -4.78 115.26 114.14 2qj0 n ASN 50 Ca 0.00 -0.26 0.09 0.00 0.45 0.00 0.00 54.58 54.86 2qj0 n ASN 50 Cb 0.13 -1.47 0.47 0.00 1.23 0.00 0.00 39.78 40.13 2qj0 n ASN 50 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 2qj0 n GLU 51 N 8.85 0.21 0.04 1.20 4.71 -1.26 -2.62 120.64 131.77 2qj0 n GLU 51 Ca 0.41 0.12 0.13 0.00 -0.01 0.00 0.00 57.16 57.81 2qj0 n GLU 51 Cb 0.44 -1.50 0.49 0.00 -1.01 0.00 0.00 31.44 29.87 2qj0 n GLU 51 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 2qj0 n LYS 52 N -1.33 0.11 -3.21 3.49 4.81 -1.26 -4.60 118.16 116.16 2qj0 n LYS 52 Ca 0.08 0.08 -0.45 0.00 -0.87 0.00 0.00 58.31 57.15 2qj0 n LYS 52 Cb 0.17 -1.62 -0.05 0.00 0.02 0.00 0.00 35.03 33.55 2qj0 n LYS 52 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2qj0 s LEU 53 N -3.59 5.58 0.10 3.14 1.43 -1.08 -4.88 118.68 119.38 2qj0 s LEU 53 Ca 0.12 -1.44 0.14 0.00 -1.03 0.00 0.00 54.13 51.92 2qj0 s LEU 53 Cb 0.16 -2.28 -0.12 0.00 0.03 0.00 0.00 46.19 43.98 2qj0 s LEU 53 CO 0.58 -0.95 0.98 0.44 0.23 0.00 0.00 176.35 177.63 2qj0 h ASP 54 N 9.02 0.00 -2.69 2.29 3.32 -1.88 -3.39 116.42 123.08 2qj0 h ASP 54 Ca -0.29 0.00 -0.65 0.00 0.02 0.00 0.00 57.03 56.11 2qj0 h ASP 54 Cb 1.09 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 40.26 2qj0 h ASP 54 CO 1.04 0.69 -0.31 0.29 -1.72 0.00 0.00 179.24 179.22 2qj0 n LYS 55 N -3.04 2.66 -0.22 3.56 5.02 -1.26 -4.28 118.16 120.59 2qj0 n LYS 55 Ca -0.07 -4.59 0.02 0.00 -2.02 0.00 0.00 58.31 51.66 2qj0 n LYS 55 Cb 0.87 -2.33 0.13 0.00 -0.02 0.00 0.00 35.03 33.68 2qj0 n LYS 55 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 2qj0 h PRO 56 N 4.94 0.16 -0.00 1.97 0.11 -1.78 -1.13 132.00 136.28 2qj0 h PRO 56 Ca 0.18 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.28 2qj0 h PRO 56 Cb 0.70 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.77 2qj0 h PRO 56 CO 0.88 0.11 -0.00 0.35 -0.21 0.00 0.00 178.00 179.13 2qj0 h PHE 57 N 0.17 0.01 -0.34 0.65 3.57 -1.92 -0.46 116.94 118.62 2qj0 h PHE 57 Ca 0.35 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.95 2qj0 h PHE 57 Cb 0.58 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 2qj0 h PHE 57 CO -0.33 0.47 0.35 1.49 -2.23 0.00 0.00 178.31 178.06 2qj0 h GLU 58 N -0.45 0.00 0.21 1.11 4.81 -1.83 -1.06 114.58 117.36 2qj0 h GLU 58 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2qj0 h GLU 58 Cb 0.47 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.85 2qj0 h GLU 58 CO 0.00 0.00 -0.10 -0.92 -0.73 0.00 0.00 179.01 177.26 2qj0 h TYR 59 N 0.00 -0.26 -1.38 0.92 3.20 -0.83 -2.65 116.97 115.98 2qj0 h TYR 59 Ca 0.16 -0.01 0.40 0.00 3.14 0.00 0.00 58.73 62.43 2qj0 h TYR 59 Cb 0.86 0.08 -0.07 0.00 1.54 0.00 0.00 36.73 39.15 2qj0 h TYR 59 CO 0.00 -0.16 0.97 -0.07 -1.64 0.00 0.00 178.16 177.26 2qj0 h LEU 60 N -0.84 0.07 0.01 2.82 3.38 -0.40 0.63 115.31 120.98 2qj0 h LEU 60 Ca -0.03 0.02 -0.27 0.00 0.09 0.00 0.00 57.88 57.69 2qj0 h LEU 60 Cb 0.21 0.01 0.02 0.00 0.09 0.00 0.00 40.66 41.00 2qj0 h LEU 60 CO 0.05 -0.01 -1.10 -1.13 0.09 0.00 0.00 178.44 176.33 2qj0 h ASN 61 N 0.05 0.81 0.15 -0.43 -0.73 -1.27 -2.17 115.58 111.99 2qj0 h ASN 61 Ca 0.69 -0.69 -0.08 0.00 1.87 0.00 0.00 56.30 58.09 2qj0 h ASN 61 Cb 2.59 -0.25 -0.01 0.00 0.27 0.00 0.00 38.32 40.92 2qj0 h ASN 61 CO -0.08 1.50 -0.27 0.44 -0.37 0.00 0.00 177.43 178.65 2qj0 h ASP 62 N 0.31 0.20 0.49 1.15 3.32 0.56 0.44 116.42 122.89 2qj0 h ASP 62 Ca -0.14 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 2qj0 h ASP 62 Cb 1.76 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 41.26 2qj0 h ASP 62 CO 0.21 0.48 -0.23 0.00 -1.72 0.00 0.00 179.24 177.98 2qj0 h PHE 64 N -0.84 0.55 -0.27 0.00 3.57 -1.28 0.40 116.94 119.06 2qj0 h PHE 64 Ca -0.07 0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.44 2qj0 h PHE 64 Cb 0.50 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 2qj0 h PHE 64 CO 0.06 -0.17 0.01 -0.09 -2.23 0.00 0.00 178.31 175.89 2qj0 h ARG 65 N 0.27 0.40 0.17 1.11 2.43 0.07 -2.15 114.38 116.68 2qj0 h ARG 65 Ca 0.60 -0.07 -0.35 0.00 -0.81 0.00 0.00 59.98 59.35 2qj0 h ARG 65 Cb 1.24 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 2qj0 h ARG 65 CO -0.62 0.42 -1.75 0.00 -1.51 0.00 0.00 179.97 176.50 2qj0 h ARG 66 N 0.39 0.36 -0.95 0.20 3.08 0.15 -3.30 114.38 114.31 2qj0 h ARG 66 Ca 0.09 -0.61 0.12 0.00 0.07 0.00 0.00 59.98 59.65 2qj0 h ARG 66 Cb 0.24 0.23 -0.08 0.00 0.08 0.00 0.00 29.97 30.44 2qj0 h ARG 66 CO 0.00 1.27 0.61 -0.97 -1.07 0.00 0.00 179.97 179.81 2qj0 h ASN 67 N 0.10 0.85 0.06 7.04 -1.24 -0.58 0.36 115.58 122.16 2qj0 h ASN 67 Ca -0.34 0.04 0.00 0.00 0.71 0.00 0.00 56.30 56.71 2qj0 h ASN 67 Cb 2.08 -0.13 0.00 0.00 0.73 0.00 0.00 38.32 41.00 2qj0 h ASN 67 CO 0.16 0.46 0.00 1.67 -1.29 0.00 0.00 177.43 178.44 2qj0 n GLN 68 N -4.58 0.73 -0.05 6.67 -0.06 -0.82 -2.52 117.38 116.76 2qj0 n GLN 68 Ca 0.17 0.01 -0.06 0.00 -2.00 0.00 0.00 57.00 55.12 2qj0 n GLN 68 Cb 0.36 -1.50 -0.08 0.00 -4.06 0.00 0.00 30.24 24.96 2qj0 n GLN 68 CO 0.00 0.00 0.00 0.94 -0.20 0.00 0.00 177.06 177.80 2qj0 n GLN 69 N -1.04 1.93 -0.05 3.69 -0.06 0.98 -3.84 117.38 118.99 2qj0 n GLN 69 Ca 0.18 0.01 0.02 0.00 -2.00 0.00 0.00 57.00 55.21 2qj0 n GLN 69 Cb 0.10 -1.27 0.34 0.00 -4.06 0.00 0.00 30.24 25.35 2qj0 n GLN 69 CO 0.00 0.00 0.00 1.96 -0.20 0.00 0.00 177.06 178.82 2qj0 h GLN 70 N 0.00 0.64 -0.03 3.69 1.08 -0.50 -2.39 115.11 117.59 2qj0 h GLN 70 Ca -0.29 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 56.82 2qj0 h GLN 70 Cb 1.62 -0.13 -0.00 0.00 -0.05 0.00 0.00 27.48 28.92 2qj0 h GLN 70 CO 0.00 0.50 -0.04 0.87 -0.95 0.00 0.00 178.83 179.21 2qj0 h LYS 71 N 0.64 0.08 0.00 1.46 1.57 -1.68 0.13 116.57 118.77 2qj0 h LYS 71 Ca 0.16 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2qj0 h LYS 71 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 2qj0 h LYS 71 CO -0.02 0.58 0.00 0.54 -0.57 0.00 0.00 179.45 179.97 2qj0 n ARG 72 N -4.77 0.00 0.00 3.15 1.74 -0.91 -1.70 116.66 114.17 2qj0 n ARG 72 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 2qj0 n ARG 72 Cb 0.29 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 2qj0 n ARG 72 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2qj0 n ILE 73 N -0.94 0.00 0.11 0.55 5.41 -1.14 -4.71 119.36 118.64 2qj0 n ILE 73 Ca 0.00 -0.03 -0.00 0.00 1.00 0.00 0.00 62.75 63.72 2qj0 n ILE 73 Cb 0.00 0.32 -0.02 0.00 -0.71 0.00 0.00 39.64 39.23 2qj0 n ILE 73 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 2qj0 h THR 74 N 0.00 1.10 0.00 1.39 2.02 0.16 -3.18 112.91 114.41 2qj0 h THR 74 Ca 0.00 -2.56 0.00 0.00 0.77 0.00 0.00 66.41 64.62 2qj0 h THR 74 Cb 0.00 2.54 0.00 0.00 -1.74 0.00 0.00 68.15 68.95 2qj0 h THR 74 CO 0.00 0.63 -0.15 0.07 0.37 0.00 0.00 175.52 176.43 2qj0 h LYS 75 N 0.00 0.00 -0.84 6.66 2.10 -1.68 -3.20 116.57 119.61 2qj0 h LYS 75 Ca -0.01 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.57 2qj0 h LYS 75 Cb 1.50 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.79 2qj0 h LYS 75 CO 0.08 0.00 0.09 0.09 -2.00 0.00 0.00 179.45 177.71 2qj0 n ASN 76 N -2.43 3.45 -4.07 7.07 3.02 -1.20 -4.87 115.26 116.23 2qj0 n ASN 76 Ca 0.05 -2.57 -0.11 0.00 -0.03 0.00 0.00 54.58 51.92 2qj0 n ASN 76 Cb 0.46 -0.62 -0.11 0.00 -0.61 0.00 0.00 39.78 38.90 2qj0 n ASN 76 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2qj0 s LYS 77 N -1.87 0.55 0.16 3.52 1.02 -1.21 -5.06 119.74 116.86 2qj0 s LYS 77 Ca 0.29 -0.92 -0.11 0.00 0.02 0.00 0.00 55.97 55.25 2qj0 s LYS 77 Cb 0.22 -0.10 0.04 0.00 -0.52 0.00 0.00 37.83 37.47 2qj0 s LYS 77 CO 0.08 -0.01 1.62 -1.00 -0.92 0.00 0.00 175.35 175.11 2qj0 h PRO 78 N 4.00 0.93 -6.01 -1.68 0.13 -1.89 -3.38 132.00 124.09 2qj0 h PRO 78 Ca -0.34 -0.28 -0.61 0.00 -0.87 0.00 0.00 66.00 63.89 2qj0 h PRO 78 Cb 1.19 -0.09 -0.11 0.00 0.13 0.00 0.00 31.00 32.11 2qj0 h PRO 78 CO 0.50 0.93 0.54 -0.80 -0.23 0.00 0.00 178.00 178.94 2qj0 s ASN 79 N -6.39 6.44 -0.37 1.44 -0.87 -1.26 -4.85 114.94 109.07 2qj0 s ASN 79 Ca -0.12 -0.06 -0.03 0.00 -1.57 0.00 0.00 52.86 51.08 2qj0 s ASN 79 Cb 0.12 -2.44 0.22 0.00 -0.02 0.00 0.00 41.25 39.14 2qj0 s ASN 79 CO 0.83 -1.08 1.07 0.00 -2.57 0.00 0.00 177.10 175.34 2qj0 n ALA 80 N 7.19 -3.35 0.00 0.60 0.00 -1.26 -4.95 120.51 118.74 2qj0 n ALA 80 Ca 0.04 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2qj0 n ALA 80 Cb 0.48 -2.92 0.00 0.00 0.00 0.00 0.00 19.45 17.01 2qj0 n ALA 80 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qj0 n GLU 81 N 2.36 0.00 0.00 0.00 1.02 -1.26 -4.79 120.64 117.96 2qj0 n GLU 81 Ca 0.10 0.00 0.15 0.00 -0.02 0.00 0.00 57.16 57.39 2qj0 n GLU 81 Cb 0.65 -0.03 0.79 0.00 -0.02 0.00 0.00 31.44 32.82 2qj0 n GLU 81 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2qj0 n SER 82 N -2.42 0.07 0.03 1.62 2.88 -1.26 -2.25 113.62 112.29 2qj0 n SER 82 Ca 0.00 -0.42 0.13 0.00 -1.33 0.00 0.00 58.87 57.25 2qj0 n SER 82 Cb 0.00 -0.19 0.40 0.00 -0.75 0.00 0.00 64.21 63.67 2qj0 n SER 82 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2qj0 n LEU 83 N -1.16 0.41 0.07 2.46 4.77 -1.26 -3.33 117.00 118.96 2qj0 n LEU 83 Ca 0.17 0.33 -0.19 0.00 -0.03 0.00 0.00 56.01 56.28 2qj0 n LEU 83 Cb 0.21 -0.34 -0.15 0.00 -2.33 0.00 0.00 43.42 40.82 2qj0 n LEU 83 CO 0.22 -0.01 -0.38 -0.74 -1.33 0.00 0.00 177.39 175.15 2qj0 h HIS 84 N 0.00 0.58 -0.62 -1.77 2.76 -1.77 -1.04 115.15 113.29 2qj0 h HIS 84 Ca 0.00 -0.42 0.09 0.00 -2.20 0.00 0.00 60.37 57.84 2qj0 h HIS 84 Cb 0.59 -0.02 -0.04 0.00 1.55 0.00 0.00 27.41 29.48 2qj0 h HIS 84 CO 0.00 1.48 0.42 0.77 -1.30 0.00 0.00 177.93 179.30 2qj0 h SER 85 N 0.09 0.42 0.00 3.26 0.02 -1.65 -2.27 113.55 113.41 2qj0 h SER 85 Ca -0.27 0.01 -0.21 0.00 -0.84 0.00 0.00 61.79 60.47 2qj0 h SER 85 Cb 2.05 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 64.48 2qj0 h SER 85 CO 0.18 0.25 -1.33 0.35 -1.14 0.00 0.00 176.83 175.14 2qj0 n THR 86 N -4.47 1.51 -0.43 -2.27 -2.24 -1.24 -3.64 114.28 101.49 2qj0 n THR 86 Ca 0.10 -0.03 0.40 0.00 -2.27 0.00 0.00 64.05 62.25 2qj0 n THR 86 Cb 0.36 -2.10 0.75 0.00 -2.10 0.00 0.00 70.33 67.23 2qj0 n THR 86 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2qj0 h PHE 87 N -1.00 0.00 0.03 4.78 -1.00 -1.15 0.40 116.94 119.00 2qj0 h PHE 87 Ca -0.32 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.46 2qj0 h PHE 87 Cb 1.18 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.74 2qj0 h PHE 87 CO -0.03 0.00 -0.01 0.37 -1.61 0.00 0.00 178.31 177.02 2qj0 h GLN 88 N 0.00 -0.03 0.00 1.51 5.75 -1.57 -3.00 115.11 117.76 2qj0 h GLN 88 Ca 0.67 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 59.17 2qj0 h GLN 88 Cb 2.81 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 31.37 2qj0 h GLN 88 CO -0.01 0.68 -0.00 1.49 -2.65 0.00 0.00 178.83 178.34 2qj0 h GLU 89 N -0.89 0.00 0.32 1.69 4.57 -1.03 -0.47 114.58 118.77 2qj0 h GLU 89 Ca -0.00 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 2qj0 h GLU 89 Cb 0.73 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 2qj0 h GLU 89 CO 0.01 0.00 -0.16 0.82 -1.18 0.00 0.00 179.01 178.50 2qj0 h ILE 90 N 0.00 0.00 -1.16 2.32 2.04 -1.30 -2.62 117.51 116.79 2qj0 h ILE 90 Ca -0.00 -0.34 0.33 0.00 1.00 0.00 0.00 64.86 65.85 2qj0 h ILE 90 Cb 0.02 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.02 2qj0 h ILE 90 CO 0.00 0.00 0.78 0.44 0.00 0.00 0.00 178.15 179.37 2qj0 h ASP 91 N -0.77 0.26 0.14 1.72 3.32 -1.24 0.37 116.42 120.23 2qj0 h ASP 91 Ca -0.04 0.06 -0.15 0.00 0.02 0.00 0.00 57.03 56.92 2qj0 h ASP 91 Cb 0.33 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 2qj0 h ASP 91 CO 0.07 0.01 -0.54 -0.09 -1.72 0.00 0.00 179.24 176.98 2qj0 h ARG 92 N 0.21 0.42 0.00 3.56 2.43 -1.09 -3.09 114.38 116.82 2qj0 h ARG 92 Ca 0.63 -0.26 -0.20 0.00 -0.81 0.00 0.00 59.98 59.34 2qj0 h ARG 92 Cb 1.99 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 31.52 2qj0 h ARG 92 CO -0.22 0.85 -2.07 1.28 -1.51 0.00 0.00 179.97 178.31 2qj0 n LEU 93 N -3.95 0.16 0.06 3.80 4.77 0.52 -2.37 117.00 120.00 2qj0 n LEU 93 Ca -0.03 0.07 -0.13 0.00 -0.03 0.00 0.00 56.01 55.90 2qj0 n LEU 93 Cb 0.59 0.24 -0.09 0.00 -2.33 0.00 0.00 43.42 41.83 2qj0 n LEU 93 CO 0.45 0.26 0.59 0.58 -1.33 0.00 0.00 177.39 177.94 2qj0 h VAL 94 N 0.00 1.03 -0.24 4.08 2.07 -0.54 -0.27 116.25 122.39 2qj0 h VAL 94 Ca -0.28 -0.86 -0.12 0.00 0.82 0.00 0.00 66.70 66.26 2qj0 h VAL 94 Cb 1.68 1.55 -0.00 0.00 -1.52 0.00 0.00 31.29 33.00 2qj0 h VAL 94 CO 0.02 0.20 -0.33 0.16 0.02 0.00 0.00 177.57 177.64 2qj0 h ILE 95 N -0.60 1.32 -0.83 4.57 3.07 -1.74 0.23 117.51 123.52 2qj0 h ILE 95 Ca -0.02 -1.53 0.16 0.00 1.55 0.00 0.00 64.86 65.02 2qj0 h ILE 95 Cb 0.46 1.74 -0.06 0.00 -0.27 0.00 0.00 36.82 38.69 2qj0 h ILE 95 CO 0.03 0.48 0.55 1.23 -1.05 0.00 0.00 178.15 179.38 2qj0 h GLY 96 N 0.34 0.92 1.03 0.16 0.00 -1.50 -1.16 103.07 102.87 2qj0 h GLY 96 Ca 0.03 -0.23 -0.33 0.00 0.00 0.00 0.00 47.33 46.80 2qj0 h GLY 96 CO 0.08 0.06 -1.68 -0.97 0.00 0.00 0.00 176.54 174.03 2qj0 h TYR 97 N 0.52 0.54 -0.39 5.60 0.05 -0.87 -3.27 116.97 119.15 2qj0 h TYR 97 Ca 0.42 -0.39 0.11 0.00 0.05 0.00 0.00 58.73 58.92 2qj0 h TYR 97 Cb 0.85 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.55 2qj0 h TYR 97 CO -0.00 1.52 0.47 0.78 -1.05 0.00 0.00 178.16 179.88 2qj0 h GLY 98 N 1.33 0.00 1.56 3.88 0.00 0.62 0.23 103.07 110.69 2qj0 h GLY 98 Ca -0.30 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.74 2qj0 h GLY 98 CO 0.16 0.00 -1.29 -2.08 0.00 0.00 0.00 176.54 173.33 2qj0 h VAL 99 N 0.00 1.46 -0.07 4.60 2.07 -1.35 -3.24 116.25 119.72 2qj0 h VAL 99 Ca 0.18 -3.00 -0.14 0.00 0.82 0.00 0.00 66.70 64.57 2qj0 h VAL 99 Cb 1.13 2.96 -0.01 0.00 -1.52 0.00 0.00 31.29 33.85 2qj0 h VAL 99 CO -0.00 0.88 -0.57 0.58 0.02 0.00 0.00 177.57 178.48 2qj0 h VAL 100 N 0.09 1.37 -0.58 2.57 2.07 -0.70 -2.93 116.25 118.14 2qj0 h VAL 100 Ca -0.16 -1.89 0.08 0.00 0.82 0.00 0.00 66.70 65.55 2qj0 h VAL 100 Cb 2.01 1.94 -0.06 0.00 -1.52 0.00 0.00 31.29 33.66 2qj0 h VAL 100 CO 0.22 0.56 0.25 0.00 0.02 0.00 0.00 177.57 178.62 2qj0 h ALA 101 N 1.24 0.76 -1.01 1.67 0.00 -1.21 -1.62 119.26 119.08 2qj0 h ALA 101 Ca -0.00 0.06 -0.71 0.00 0.00 0.00 0.00 54.91 54.25 2qj0 h ALA 101 Cb 1.05 0.00 -0.29 0.00 0.00 0.00 0.00 17.79 18.55 2qj0 h ALA 101 CO 0.09 -0.14 0.87 1.28 0.00 0.00 0.00 179.25 181.35 2qj0 n LEU 102 N -4.94 7.48 0.00 0.00 4.77 -1.11 -4.40 117.00 118.80 2qj0 n LEU 102 Ca 0.07 -4.57 0.00 0.00 -0.03 0.00 0.00 56.01 51.48 2qj0 n LEU 102 Cb 0.23 -0.99 0.00 0.00 -2.33 0.00 0.00 43.42 40.33 2qj0 n LEU 102 CO 0.25 1.64 0.00 0.00 -1.33 0.00 0.00 177.39 177.94 2qj0 n GLN 103 N -0.73 0.00 -3.84 3.23 6.02 -0.81 -4.35 117.38 116.89 2qj0 n GLN 103 Ca 0.58 0.00 -0.36 0.00 -0.01 0.00 0.00 57.00 57.21 2qj0 n GLN 103 Cb 0.48 -0.22 -0.13 0.00 1.02 0.00 0.00 30.24 31.39 2qj0 n GLN 103 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2qj0 s ILE 104 N -1.00 3.81 0.00 5.09 -1.09 -0.68 -4.98 121.20 122.36 2qj0 s ILE 104 Ca 0.00 -0.34 0.00 0.00 -2.23 0.00 0.00 60.65 58.08 2qj0 s ILE 104 Cb 0.00 -2.76 0.00 0.00 -1.58 0.00 0.00 42.46 38.12 2qj0 s ILE 104 CO 0.00 0.38 0.31 1.21 -1.23 0.00 0.00 174.94 175.62 2qj0 n GLU 105 N 4.85 0.00 -3.31 2.79 4.07 -1.26 -3.43 120.64 124.35 2qj0 n GLU 105 Ca -0.17 0.31 -0.28 0.00 -0.06 0.00 0.00 57.16 56.96 2qj0 n GLU 105 Cb 0.51 -0.65 -0.07 0.00 -0.06 0.00 0.00 31.44 31.18 2qj0 n GLU 105 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2qj0 n ASN 106 N -0.77 4.12 0.17 4.31 3.02 -1.26 -4.37 115.26 120.47 2qj0 n ASN 106 Ca 0.00 -3.48 0.06 0.00 -0.03 0.00 0.00 54.58 51.13 2qj0 n ASN 106 Cb 0.00 -0.70 0.08 0.00 -0.61 0.00 0.00 39.78 38.54 2qj0 n ASN 106 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2qj0 h PHE 107 N 4.10 0.00 0.00 3.10 3.04 -1.90 -3.51 116.94 121.77 2qj0 h PHE 107 Ca 0.19 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.14 2qj0 h PHE 107 Cb 0.63 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.14 2qj0 h PHE 107 CO 0.77 0.30 0.00 0.00 -2.02 0.00 0.00 178.31 177.35 2qj0 n ASN 110 N 0.00 -0.60 0.00 0.00 3.02 -1.26 -5.00 115.26 111.42 2qj0 n ASN 110 Ca 0.00 0.99 0.00 0.00 -0.03 0.00 0.00 54.58 55.54 2qj0 n ASN 110 Cb 0.00 -0.81 0.00 0.00 -0.61 0.00 0.00 39.78 38.36 2qj0 n ASN 110 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2qj0 n GLY 111 N 1.54 -2.23 2.48 7.41 0.00 -1.26 -4.46 105.19 108.67 2qj0 n GLY 111 Ca 0.16 -1.49 -0.17 0.00 0.00 0.00 0.00 46.02 44.53 2qj0 n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qj0 n ALA 112 N -1.87 0.49 -0.34 4.61 0.00 -1.26 -4.91 120.51 117.23 2qj0 n ALA 112 Ca 0.00 -1.52 0.00 0.00 0.00 0.00 0.00 53.44 51.92 2qj0 n ALA 112 Cb 0.00 1.13 0.05 0.00 0.00 0.00 0.00 19.45 20.63 2qj0 n ALA 112 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2qj0 n PHE 113 N -0.59 0.09 -0.30 0.00 3.72 -1.26 -0.58 117.46 118.54 2qj0 n PHE 113 Ca 0.01 1.09 0.08 0.00 -0.05 0.00 0.00 57.45 58.57 2qj0 n PHE 113 Cb 0.46 -0.87 0.23 0.00 -0.94 0.00 0.00 39.48 38.36 2qj0 n PHE 113 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 2qj0 h ILE 114 N 0.00 0.73 -0.29 4.37 5.03 -1.94 -0.94 117.51 124.46 2qj0 h ILE 114 Ca 0.33 -0.22 -0.11 0.00 -0.12 0.00 0.00 64.86 64.75 2qj0 h ILE 114 Cb 0.55 0.03 -0.01 0.00 -3.03 0.00 0.00 36.82 34.37 2qj0 h ILE 114 CO -0.89 0.12 -0.23 0.78 -0.68 0.00 0.00 178.15 177.25 2qj0 h ASN 115 N 0.64 0.71 0.01 1.72 4.21 -1.23 -1.63 115.58 119.99 2qj0 h ASN 115 Ca 0.47 -0.45 -0.00 0.00 1.21 0.00 0.00 56.30 57.53 2qj0 h ASN 115 Cb 0.68 -0.20 0.00 0.00 -1.12 0.00 0.00 38.32 37.68 2qj0 h ASN 115 CO -0.37 1.01 -0.00 1.88 -1.29 0.00 0.00 177.43 178.66 2qj0 h TYR 116 N 0.41 -0.01 0.00 1.19 0.05 -1.05 -1.93 116.97 115.63 2qj0 h TYR 116 Ca 0.05 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.83 2qj0 h TYR 116 Cb 0.79 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.53 2qj0 h TYR 116 CO 0.07 0.28 0.00 -0.84 -1.05 0.00 0.00 178.16 176.62 2qj0 h ILE 117 N -0.30 0.00 -0.38 -2.88 -0.00 -1.27 -0.55 117.51 112.13 2qj0 h ILE 117 Ca -0.00 -0.46 -0.16 0.00 -0.00 0.00 0.00 64.86 64.24 2qj0 h ILE 117 Cb 0.30 1.44 -0.01 0.00 -0.00 0.00 0.00 36.82 38.55 2qj0 h ILE 117 CO 0.00 0.00 -0.38 0.74 -0.00 0.00 0.00 178.15 178.51 2qj0 h THR 118 N 0.00 1.27 -0.32 0.16 2.02 -0.99 -0.40 112.91 114.65 2qj0 h THR 118 Ca 0.00 -1.56 -0.05 0.00 0.77 0.00 0.00 66.41 65.57 2qj0 h THR 118 Cb 0.47 1.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.26 2qj0 h THR 118 CO 0.00 0.52 0.01 1.23 0.37 0.00 0.00 175.52 177.65 2qj0 h GLY 119 N 0.75 0.61 0.69 2.16 0.00 -0.47 -2.12 103.07 104.70 2qj0 h GLY 119 Ca 0.06 -0.45 0.05 0.00 0.00 0.00 0.00 47.33 46.99 2qj0 h GLY 119 CO 0.09 0.41 0.19 -2.22 0.00 0.00 0.00 176.54 175.02 2qj0 h ILE 120 N 0.37 0.92 -0.56 2.60 2.04 -1.00 -2.15 117.51 119.73 2qj0 h ILE 120 Ca 0.09 -0.13 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 2qj0 h ILE 120 Cb 0.43 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 2qj0 h ILE 120 CO 0.02 0.07 0.28 0.58 0.00 0.00 0.00 178.15 179.10 2qj0 h VAL 121 N 0.39 1.18 0.85 1.67 2.07 -0.90 -1.84 116.25 119.67 2qj0 h VAL 121 Ca 0.20 -0.49 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 2qj0 h VAL 121 Cb 0.15 0.45 0.01 0.00 -1.52 0.00 0.00 31.29 30.37 2qj0 h VAL 121 CO -0.17 0.21 -0.44 0.28 0.02 0.00 0.00 177.57 177.47 2qj0 h SER 122 N 0.79 -1.05 -2.96 0.57 0.02 -0.71 -3.35 113.55 106.85 2qj0 h SER 122 Ca 0.20 0.04 -0.61 0.00 -0.84 0.00 0.00 61.79 60.58 2qj0 h SER 122 Cb 0.06 0.28 -0.41 0.00 0.14 0.00 0.00 62.40 62.48 2qj0 h SER 122 CO -0.03 -0.72 -0.70 0.21 -1.14 0.00 0.00 176.83 174.45 2qj0 s ASN 123 N -4.17 3.77 0.19 3.07 3.84 -1.12 -4.96 114.94 115.56 2qj0 s ASN 123 Ca -0.19 -3.53 -0.08 0.00 0.21 0.00 0.00 52.86 49.27 2qj0 s ASN 123 Cb 0.03 -1.26 0.10 0.00 -0.55 0.00 0.00 41.25 39.57 2qj0 s ASN 123 CO 0.61 -0.12 1.64 1.62 -2.79 0.00 0.00 177.10 178.05 2qj0 h VAL 124 N 4.55 1.26 0.00 -5.21 3.04 -1.47 -3.03 116.25 115.39 2qj0 h VAL 124 Ca 0.16 -1.21 0.00 0.00 -1.01 0.00 0.00 66.70 64.65 2qj0 h VAL 124 Cb 0.81 0.91 0.00 0.00 -2.01 0.00 0.00 31.29 31.00 2qj0 h VAL 124 CO 0.60 0.43 0.00 0.59 -1.01 0.00 0.00 177.57 178.18 2qj0 n ASN 125 N -4.16 0.00 -0.46 3.17 3.02 -1.26 -1.53 115.26 114.04 2qj0 n ASN 125 Ca 0.02 0.19 0.08 0.00 -0.03 0.00 0.00 54.58 54.85 2qj0 n ASN 125 Cb 0.38 -0.19 0.02 0.00 -0.61 0.00 0.00 39.78 39.37 2qj0 n ASN 125 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2qj0 n SER 126 N -1.19 1.86 -0.07 6.41 7.64 -1.15 -4.22 113.62 122.90 2qj0 n SER 126 Ca 0.00 -1.43 0.01 0.00 1.01 0.00 0.00 58.87 58.46 2qj0 n SER 126 Cb 0.00 0.35 0.00 0.00 -1.01 0.00 0.00 64.21 63.55 2qj0 n SER 126 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2qj0 n TYR 127 N 0.17 0.00 0.07 1.43 4.01 -0.58 -4.78 117.16 117.48 2qj0 n TYR 127 Ca 0.08 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.66 2qj0 n TYR 127 Cb 0.37 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.30 2qj0 n TYR 127 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2qj0 h THR 128 N 0.36 0.00 0.59 -0.72 1.03 -1.67 0.24 112.91 112.74 2qj0 h THR 128 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 66.41 66.38 2qj0 h THR 128 Cb 0.09 0.00 -0.01 0.00 -1.07 0.00 0.00 68.15 67.16 2qj0 h THR 128 CO 0.00 0.00 -0.39 0.44 -0.01 0.00 0.00 175.52 175.56 2qj0 h ASP 129 N -0.68 -0.99 -0.31 0.00 5.19 -1.86 -1.16 116.42 116.61 2qj0 h ASP 129 Ca 0.01 0.06 0.06 0.00 -0.62 0.00 0.00 57.03 56.54 2qj0 h ASP 129 Cb 0.72 0.30 -0.06 0.00 0.18 0.00 0.00 39.33 40.46 2qj0 h ASP 129 CO -0.33 -0.59 -0.09 0.15 -3.12 0.00 0.00 179.24 175.25 2qj0 h PHE 130 N -0.94 -0.21 -0.22 4.55 3.57 -1.86 -1.95 116.94 119.89 2qj0 h PHE 130 Ca -0.07 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.48 2qj0 h PHE 130 Cb 0.77 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.63 2qj0 h PHE 130 CO -0.12 -0.16 0.09 -0.07 -2.23 0.00 0.00 178.31 175.83 2qj0 h LEU 131 N -0.02 0.12 -0.70 0.59 3.38 -0.46 -0.34 115.31 117.87 2qj0 h LEU 131 Ca 0.15 0.02 0.14 0.00 0.09 0.00 0.00 57.88 58.28 2qj0 h LEU 131 Cb 0.26 -0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.87 2qj0 h LEU 131 CO -0.34 0.10 -0.15 -1.28 0.09 0.00 0.00 178.44 176.87 2qj0 h SER 132 N 0.20 -0.60 0.19 -0.43 0.87 -0.73 0.51 113.55 113.57 2qj0 h SER 132 Ca 0.09 0.20 -0.08 0.00 -1.23 0.00 0.00 61.79 60.78 2qj0 h SER 132 Cb 0.05 0.41 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 2qj0 h SER 132 CO -0.08 -0.22 -0.29 1.56 -0.53 0.00 0.00 176.83 177.27 2qj0 h GLN 133 N 0.01 0.16 -0.23 2.24 1.08 -0.71 -2.34 115.11 115.32 2qj0 h GLN 133 Ca 0.34 -0.06 -0.13 0.00 -1.45 0.00 0.00 58.65 57.35 2qj0 h GLN 133 Cb 0.53 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.94 2qj0 h GLN 133 CO -0.70 0.44 -0.41 0.82 -0.95 0.00 0.00 178.83 178.03 2qj0 h ILE 134 N 0.15 1.30 0.49 2.54 2.04 0.16 -2.11 117.51 122.07 2qj0 h ILE 134 Ca 0.02 -1.58 -0.02 0.00 1.00 0.00 0.00 64.86 64.28 2qj0 h ILE 134 Cb 0.59 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 2qj0 h ILE 134 CO 0.04 0.50 -0.23 0.40 0.00 0.00 0.00 178.15 178.86 2qj0 h ILE 135 N 0.45 0.42 -0.67 -0.67 2.04 -0.17 -1.34 117.51 117.57 2qj0 h ILE 135 Ca 0.04 -0.41 0.14 0.00 1.00 0.00 0.00 64.86 65.63 2qj0 h ILE 135 Cb 0.91 0.57 -0.11 0.00 -0.74 0.00 0.00 36.82 37.45 2qj0 h ILE 135 CO 0.08 0.06 0.06 1.56 0.00 0.00 0.00 178.15 179.90 2qj0 h GLN 136 N -0.93 0.16 -0.22 2.37 4.20 -1.44 0.26 115.11 119.51 2qj0 h GLN 136 Ca -0.07 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 58.69 2qj0 h GLN 136 Cb 0.59 -0.04 -0.06 0.00 0.30 0.00 0.00 27.48 28.28 2qj0 h GLN 136 CO 0.11 0.11 -0.17 -0.09 -0.67 0.00 0.00 178.83 178.11 2qj0 h ARG 137 N 0.16 -0.16 -0.08 1.46 1.12 -1.33 -1.24 114.38 114.31 2qj0 h ARG 137 Ca 0.36 0.01 0.04 0.00 -1.11 0.00 0.00 59.98 59.28 2qj0 h ARG 137 Cb 0.60 0.04 -0.05 0.00 -0.01 0.00 0.00 29.97 30.55 2qj0 h ARG 137 CO -0.54 -0.11 -0.22 0.00 -3.11 0.00 0.00 179.97 175.99 2qj0 h ALA 138 N 0.95 -0.23 -0.17 2.80 0.00 0.65 -0.94 119.26 122.33 2qj0 h ALA 138 Ca 0.13 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2qj0 h ALA 138 Cb 0.36 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2qj0 h ALA 138 CO -0.32 -0.69 0.06 -0.84 0.00 0.00 0.00 179.25 177.45 2qj0 h ILE 139 N -0.31 1.18 -0.95 0.00 3.07 -0.83 -2.15 117.51 117.53 2qj0 h ILE 139 Ca 0.08 -0.56 0.05 0.00 1.55 0.00 0.00 64.86 65.98 2qj0 h ILE 139 Cb 0.43 1.23 -0.06 0.00 -0.27 0.00 0.00 36.82 38.15 2qj0 h ILE 139 CO -0.25 0.17 0.62 -0.07 -1.05 0.00 0.00 178.15 177.57 2qj0 h LEU 140 N 0.11 1.00 -0.08 0.16 3.38 -1.12 0.43 115.31 119.19 2qj0 h LEU 140 Ca 0.06 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2qj0 h LEU 140 Cb 0.22 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2qj0 h LEU 140 CO -0.00 0.67 0.00 -0.62 0.09 0.00 0.00 178.44 178.57 2qj0 n GLU 141 N -4.47 1.06 0.00 1.13 1.02 -0.37 -4.93 120.64 114.09 2qj0 n GLU 141 Ca 0.14 -0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 2qj0 n GLU 141 Cb 0.14 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 2qj0 n GLU 141 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qj0 n GLY 142 N 0.98 1.94 3.43 0.62 0.00 0.14 -4.98 105.19 107.32 2qj0 n GLY 142 Ca 0.22 -0.52 -0.51 0.00 0.00 0.00 0.00 46.02 45.21 2qj0 n GLY 142 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2qj0 n THR 143 N 0.00 0.17 0.00 2.61 5.66 -1.15 -4.56 114.28 117.01 2qj0 n THR 143 Ca 0.00 -0.25 0.00 0.00 -3.05 0.00 0.00 64.05 60.75 2qj0 n THR 143 Cb 0.00 -1.58 0.00 0.00 -1.55 0.00 0.00 70.33 67.20 2qj0 n THR 143 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2qj0 n ALA 144 N 9.80 1.02 -0.33 1.79 0.00 -1.26 -3.99 120.51 127.54 2qj0 n ALA 144 Ca 0.42 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.82 2qj0 n ALA 144 Cb 0.22 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.75 2qj0 n ALA 144 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2qj0 h LEU 145 N 0.00 1.13 -0.96 0.00 5.85 -1.94 -1.03 115.31 118.36 2qj0 h LEU 145 Ca 0.00 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.58 2qj0 h LEU 145 Cb 0.00 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 2qj0 h LEU 145 CO 0.00 0.91 0.32 0.44 -0.34 0.00 0.00 178.44 179.77 2qj0 h ASP 146 N 1.26 0.98 -0.20 1.25 3.45 -1.95 0.30 116.42 121.51 2qj0 h ASP 146 Ca 0.31 -0.13 -0.00 0.00 0.43 0.00 0.00 57.03 57.64 2qj0 h ASP 146 Cb 0.04 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.55 2qj0 h ASP 146 CO -0.05 0.85 0.12 0.25 -1.57 0.00 0.00 179.24 178.84 2qj0 h LEU 147 N 1.06 0.24 -0.17 1.55 6.46 -1.47 -2.78 115.31 120.19 2qj0 h LEU 147 Ca 0.25 -0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.95 2qj0 h LEU 147 Cb 0.16 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.02 2qj0 h LEU 147 CO -0.03 0.23 0.07 -0.07 -0.62 0.00 0.00 178.44 178.02 2qj0 h LEU 148 N 0.23 0.23 0.00 2.25 3.38 -0.60 -2.18 115.31 118.63 2qj0 h LEU 148 Ca 0.07 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2qj0 h LEU 148 Cb 0.03 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.72 2qj0 h LEU 148 CO -0.01 0.32 0.00 0.59 0.09 0.00 0.00 178.44 179.43 2qj0 n ASN 149 N -4.86 0.00 -0.11 -0.43 3.02 0.99 -1.11 115.26 112.75 2qj0 n ASN 149 Ca -0.04 0.34 -0.18 0.00 -0.03 0.00 0.00 54.58 54.67 2qj0 n ASN 149 Cb 0.11 -0.35 -0.10 0.00 -0.61 0.00 0.00 39.78 38.83 2qj0 n ASN 149 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qj0 n ALA 150 N -1.35 1.52 0.02 5.41 0.00 -0.94 -4.41 120.51 120.75 2qj0 n ALA 150 Ca 0.01 -0.94 -0.08 0.00 0.00 0.00 0.00 53.44 52.43 2qj0 n ALA 150 Cb 0.02 0.05 -0.13 0.00 0.00 0.00 0.00 19.45 19.38 2qj0 n ALA 150 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 2qj0 h VAL 151 N -0.22 1.26 0.13 0.00 3.04 -0.99 -3.35 116.25 116.13 2qj0 h VAL 151 Ca -0.52 -3.05 -0.32 0.00 -1.01 0.00 0.00 66.70 61.80 2qj0 h VAL 151 Cb 1.70 2.63 -0.01 0.00 -2.01 0.00 0.00 31.29 33.60 2qj0 h VAL 151 CO -0.15 0.72 -1.66 -0.26 -1.01 0.00 0.00 177.57 175.21 2qj0 h PHE 152 N 0.00 0.49 0.00 3.17 0.04 -1.38 -0.71 116.94 118.55 2qj0 h PHE 152 Ca -0.15 -0.36 -0.03 0.00 2.80 0.00 0.00 57.97 60.22 2qj0 h PHE 152 Cb 1.90 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 40.02 2qj0 h PHE 152 CO 0.00 1.65 -0.16 -1.35 -0.60 0.00 0.00 178.31 177.85 2qj0 h PRO 153 N -0.14 0.00 -0.05 1.51 0.11 -1.77 -1.70 132.00 129.96 2qj0 h PRO 153 Ca -0.35 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.72 2qj0 h PRO 153 Cb 1.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 33.00 2qj0 h PRO 153 CO 0.08 0.16 -0.10 1.15 -0.21 0.00 0.00 178.00 179.08 2qj0 h THR 154 N 0.00 1.42 -0.70 -1.15 2.02 -1.69 -1.38 112.91 111.42 2qj0 h THR 154 Ca -0.00 -1.40 0.20 0.00 0.77 0.00 0.00 66.41 65.98 2qj0 h THR 154 Cb 0.34 2.23 -0.03 0.00 -1.74 0.00 0.00 68.15 68.95 2qj0 h THR 154 CO 0.02 0.39 0.53 0.25 0.37 0.00 0.00 175.52 177.07 2qj0 h LEU 155 N -0.34 0.00 0.00 2.58 7.12 -0.44 0.51 115.31 124.74 2qj0 h LEU 155 Ca 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 58.01 2qj0 h LEU 155 Cb 0.67 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.80 2qj0 h LEU 155 CO 0.02 0.00 -0.00 0.25 -0.13 0.00 0.00 178.44 178.58 2qj0 h LEU 156 N 0.00 -0.00 -1.33 2.25 5.85 -1.02 -0.40 115.31 120.67 2qj0 h LEU 156 Ca 0.33 -0.65 -0.02 0.00 0.84 0.00 0.00 57.88 58.38 2qj0 h LEU 156 Cb 1.38 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.39 2qj0 h LEU 156 CO -0.00 0.65 0.17 -0.08 -0.34 0.00 0.00 178.44 178.84 2qj0 h GLU 157 N -0.66 0.63 -0.20 1.25 4.81 0.28 -0.88 114.58 119.81 2qj0 h GLU 157 Ca -0.00 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 59.09 2qj0 h GLU 157 Cb 0.65 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 2qj0 h GLU 157 CO 0.00 0.53 -0.07 -0.92 -0.73 0.00 0.00 179.01 177.81 2qj0 h TYR 158 N 0.62 0.45 -0.42 0.92 3.20 -0.08 0.69 116.97 122.35 2qj0 h TYR 158 Ca 0.15 -0.11 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 2qj0 h TYR 158 Cb 0.14 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 2qj0 h TYR 158 CO 0.01 0.67 0.17 0.00 -1.64 0.00 0.00 178.16 177.37 2qj0 h ASN 160 N 0.59 0.00 0.66 0.00 2.35 -1.07 -3.39 115.58 114.73 2qj0 h ASN 160 Ca 0.15 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 2qj0 h ASN 160 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.49 2qj0 h ASN 160 CO -0.02 0.57 -1.20 0.29 -1.65 0.00 0.00 177.43 175.42 2qj0 n LYS 161 N -4.74 0.53 -0.52 0.81 5.02 0.22 -4.40 118.16 115.09 2qj0 n LYS 161 Ca -0.02 0.03 0.09 0.00 -2.02 0.00 0.00 58.31 56.38 2qj0 n LYS 161 Cb 0.07 -1.70 0.31 0.00 -0.02 0.00 0.00 35.03 33.69 2qj0 n LYS 161 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2qj0 n HIS 162 N -2.41 1.25 -4.18 2.13 8.25 -0.73 -4.91 115.22 114.62 2qj0 n HIS 162 Ca -0.00 -0.64 -0.12 0.00 -0.26 0.00 0.00 57.72 56.70 2qj0 n HIS 162 Cb 0.52 -0.22 -0.10 0.00 1.12 0.00 0.00 29.99 31.31 2qj0 n HIS 162 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2qj0 s VAL 163 N -1.88 0.79 0.00 1.59 1.01 -1.22 -4.99 120.40 115.71 2qj0 s VAL 163 Ca 0.45 -1.90 -0.20 0.00 0.00 0.00 0.00 61.98 60.33 2qj0 s VAL 163 Cb 0.30 -1.65 -0.24 0.00 0.00 0.00 0.00 36.38 34.79 2qj0 s VAL 163 CO 0.21 -0.81 1.09 -1.28 0.00 0.00 0.00 175.10 174.30 2qj0 h SER 164 N 3.04 0.54 -2.56 3.32 0.87 -1.90 -3.46 113.55 113.39 2qj0 h SER 164 Ca -0.36 -0.77 -0.05 0.00 -1.23 0.00 0.00 61.79 59.38 2qj0 h SER 164 Cb 1.17 -0.17 -0.25 0.00 -0.44 0.00 0.00 62.40 62.72 2qj0 h SER 164 CO 0.63 1.24 -0.27 -1.00 -0.53 0.00 0.00 176.83 176.90 2qj0 s HIS 165 N -3.16 -0.91 -0.80 2.24 0.09 -1.26 -5.09 115.29 106.41 2qj0 s HIS 165 Ca -0.13 1.72 -0.23 0.00 -0.00 0.00 0.00 55.06 56.42 2qj0 s HIS 165 Cb 0.03 0.44 0.07 0.00 -0.00 0.00 0.00 32.58 33.12 2qj0 s HIS 165 CO 0.83 -0.50 1.15 0.12 -0.00 0.00 0.00 174.74 176.34 2qj0 s PHE 166 N 2.39 2.66 0.34 1.40 5.36 -1.26 -4.71 117.98 124.16 2qj0 s PHE 166 Ca -0.05 -0.68 -0.07 0.00 -0.96 0.00 0.00 56.93 55.17 2qj0 s PHE 166 Cb -0.11 -4.44 0.02 0.00 -0.34 0.00 0.00 43.02 38.15 2qj0 s PHE 166 CO -0.15 -1.76 0.56 0.16 -1.46 0.00 0.00 175.22 172.58 2qj0 s ASP 167 N 3.92 0.56 0.00 6.13 3.84 -1.26 -4.85 116.67 125.00 2qj0 s ASP 167 Ca 0.31 -1.33 0.00 0.00 -0.00 0.00 0.00 52.55 51.54 2qj0 s ASP 167 Cb -0.09 0.71 0.00 0.00 -1.38 0.00 0.00 42.92 42.16 2qj0 s ASP 167 CO 0.03 -1.39 0.61 -0.11 -0.00 0.00 0.00 175.17 174.31 2qj0 n LEU 168 N -0.54 0.00 0.01 2.11 7.94 -1.26 -1.27 117.00 123.99 2qj0 n LEU 168 Ca -0.02 0.18 -0.06 0.00 -1.11 0.00 0.00 56.01 55.00 2qj0 n LEU 168 Cb 0.61 -0.18 -0.12 0.00 0.53 0.00 0.00 43.42 44.26 2qj0 n LEU 168 CO 0.28 -0.18 -0.32 0.78 -1.11 0.00 0.00 177.39 176.84 2qj0 h ASN 169 N 0.00 0.00 -0.70 1.96 2.35 -1.95 -3.36 115.58 113.88 2qj0 h ASN 169 Ca 0.00 0.00 -0.73 0.00 -0.55 0.00 0.00 56.30 55.02 2qj0 h ASN 169 Cb 0.17 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 38.45 2qj0 h ASN 169 CO 0.00 0.90 2.69 -0.62 -1.65 0.00 0.00 177.43 178.74 2qj0 n GLU 170 N -3.08 3.47 -0.30 0.81 -0.58 -0.40 -4.78 120.64 115.79 2qj0 n GLU 170 Ca -0.12 -3.03 0.11 0.00 -0.42 0.00 0.00 57.16 53.70 2qj0 n GLU 170 Cb 0.98 -3.01 0.28 0.00 -0.57 0.00 0.00 31.44 29.12 2qj0 n GLU 170 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2qj0 h SER 171 N 5.61 0.39 0.00 1.62 0.87 -1.80 -1.00 113.55 119.24 2qj0 h SER 171 Ca 0.55 0.13 -0.00 0.00 -1.23 0.00 0.00 61.79 61.24 2qj0 h SER 171 Cb 0.55 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2qj0 h SER 171 CO 1.72 0.07 -0.00 0.58 -0.53 0.00 0.00 176.83 178.67 2qj0 h VAL 172 N 0.47 1.58 -0.02 2.23 2.07 -1.96 -2.88 116.25 117.73 2qj0 h VAL 172 Ca 0.52 -1.71 0.00 0.00 0.82 0.00 0.00 66.70 66.33 2qj0 h VAL 172 Cb 0.92 2.75 -0.00 0.00 -1.52 0.00 0.00 31.29 33.43 2qj0 h VAL 172 CO -0.47 0.44 0.02 0.40 0.02 0.00 0.00 177.57 177.98 2qj0 h ILE 173 N -0.73 1.01 -0.31 4.57 5.03 -1.81 -0.09 117.51 125.17 2qj0 h ILE 173 Ca -0.00 -0.01 -0.06 0.00 -0.12 0.00 0.00 64.86 64.67 2qj0 h ILE 173 Cb 0.73 0.97 -0.01 0.00 -3.03 0.00 0.00 36.82 35.48 2qj0 h ILE 173 CO 0.00 0.01 -0.03 0.10 -0.68 0.00 0.00 178.15 177.55 2qj0 h TYR 174 N 0.03 0.63 -0.74 1.37 -0.00 -1.35 0.13 116.97 117.04 2qj0 h TYR 174 Ca 0.01 -0.12 0.09 0.00 -0.00 0.00 0.00 58.73 58.71 2qj0 h TYR 174 Cb -0.00 -0.16 -0.05 0.00 -0.00 0.00 0.00 36.73 36.52 2qj0 h TYR 174 CO -0.08 0.72 0.49 -0.97 -0.00 0.00 0.00 178.16 178.32 2qj0 h ASN 175 N 0.36 0.61 0.64 0.10 -1.24 -1.41 0.64 115.58 115.28 2qj0 h ASN 175 Ca 0.09 0.01 -0.26 0.00 0.71 0.00 0.00 56.30 56.85 2qj0 h ASN 175 Cb 0.49 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 39.42 2qj0 h ASN 175 CO 0.02 0.37 -1.17 0.78 -1.29 0.00 0.00 177.43 176.14 2qj0 h ASN 176 N 0.68 0.39 -0.06 1.15 2.35 -0.71 -2.74 115.58 116.64 2qj0 h ASN 176 Ca 0.34 -0.40 -0.08 0.00 -0.55 0.00 0.00 56.30 55.61 2qj0 h ASN 176 Cb 0.41 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 2qj0 h ASN 176 CO -0.12 1.29 -0.19 0.58 -1.65 0.00 0.00 177.43 177.34 2qj0 h VAL 177 N 0.08 1.24 -0.28 2.81 2.07 0.41 -2.11 116.25 120.47 2qj0 h VAL 177 Ca -0.11 -1.11 -0.07 0.00 0.82 0.00 0.00 66.70 66.23 2qj0 h VAL 177 Cb 1.89 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.92 2qj0 h VAL 177 CO 0.19 0.35 -0.08 -0.07 0.02 0.00 0.00 177.57 177.98 2qj0 h LEU 178 N 0.40 0.56 -1.06 2.57 3.38 -0.93 -2.83 115.31 117.40 2qj0 h LEU 178 Ca 0.07 -0.37 0.18 0.00 0.09 0.00 0.00 57.88 57.84 2qj0 h LEU 178 Cb 0.56 -0.15 -0.10 0.00 0.09 0.00 0.00 40.66 41.06 2qj0 h LEU 178 CO 0.04 0.80 0.62 0.74 0.09 0.00 0.00 178.44 180.73 2qj0 h THR 179 N 0.30 0.75 0.00 0.22 2.02 -1.12 0.57 112.91 115.66 2qj0 h THR 179 Ca 0.07 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.98 2qj0 h THR 179 Cb 0.57 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.88 2qj0 h THR 179 CO 0.03 0.14 0.00 0.16 0.37 0.00 0.00 175.52 176.22 2qj0 h ILE 180 N 0.78 0.00 0.06 3.11 -0.00 -1.24 -1.56 117.51 118.66 2qj0 h ILE 180 Ca 0.55 -0.51 -0.08 0.00 -0.00 0.00 0.00 64.86 64.83 2qj0 h ILE 180 Cb 0.83 1.43 0.01 0.00 -0.00 0.00 0.00 36.82 39.10 2qj0 h ILE 180 CO -0.34 0.00 -0.34 -0.26 -0.00 0.00 0.00 178.15 177.22 2qj0 h PHE 181 N 0.00 0.23 0.31 0.16 0.04 0.29 -2.83 116.94 115.14 2qj0 h PHE 181 Ca 0.00 -0.17 -0.02 0.00 2.80 0.00 0.00 57.97 60.59 2qj0 h PHE 181 Cb 0.66 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.80 2qj0 h PHE 181 CO 0.00 1.12 -0.15 0.93 -0.60 0.00 0.00 178.31 179.61 2qj0 h GLU 182 N -0.73 -0.40 -0.87 1.51 5.08 -0.96 0.12 114.58 118.33 2qj0 h GLU 182 Ca -0.06 0.03 0.16 0.00 -1.00 0.00 0.00 59.36 58.49 2qj0 h GLU 182 Cb 1.26 0.09 -0.16 0.00 0.50 0.00 0.00 28.75 30.44 2qj0 h GLU 182 CO 0.06 -0.27 -0.24 -0.11 -1.00 0.00 0.00 179.01 177.45 2qj0 n LEU 183 N -3.12 -0.36 0.05 1.33 -0.00 -0.59 0.11 117.00 114.41 2qj0 n LEU 183 Ca -0.05 1.49 -0.06 0.00 -0.00 0.00 0.00 56.01 57.40 2qj0 n LEU 183 Cb 0.16 -0.43 0.13 0.00 -0.00 0.00 0.00 43.42 43.29 2qj0 n LEU 183 CO 0.12 -1.41 0.56 0.15 -0.00 0.00 0.00 177.39 176.81 2qj0 h PHE 184 N 0.00 0.48 -0.00 1.96 3.04 -1.41 -3.29 116.94 117.72 2qj0 h PHE 184 Ca 0.39 -0.15 0.00 0.00 3.98 0.00 0.00 57.97 62.19 2qj0 h PHE 184 Cb 0.61 -0.10 0.00 0.00 2.56 0.00 0.00 35.95 39.02 2qj0 h PHE 184 CO -0.69 0.80 -0.68 1.55 -2.02 0.00 0.00 178.31 177.28 2qj0 n VAL 185 N -3.98 0.00 0.65 1.41 3.14 0.12 -3.90 118.33 115.77 2qj0 n VAL 185 Ca -0.02 -0.01 0.09 0.00 -2.96 0.00 0.00 64.34 61.43 2qj0 n VAL 185 Cb 0.54 0.56 0.39 0.00 -1.06 0.00 0.00 33.84 34.27 2qj0 n VAL 185 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 2qj0 n THR 186 N -1.44 0.73 -3.03 1.55 -1.04 0.53 -4.41 114.28 107.18 2qj0 n THR 186 Ca 0.05 0.18 -0.43 0.00 -2.04 0.00 0.00 64.05 61.81 2qj0 n THR 186 Cb 0.34 -0.88 -0.06 0.00 -1.82 0.00 0.00 70.33 67.91 2qj0 n THR 186 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2qj0 s PHE 187 N -2.92 2.97 0.35 -1.42 0.40 -1.25 -4.95 117.98 111.16 2qj0 s PHE 187 Ca 0.10 -0.19 0.10 0.00 -0.60 0.00 0.00 56.93 56.34 2qj0 s PHE 187 Cb 0.12 -3.67 0.86 0.00 0.51 0.00 0.00 43.02 40.84 2qj0 s PHE 187 CO 0.31 -1.08 1.83 -0.22 0.70 0.00 0.00 175.22 176.76 2qj0 h LYS 188 N 9.06 0.63 0.00 0.44 3.64 -1.92 0.17 116.57 128.59 2qj0 h LYS 188 Ca -0.26 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 2qj0 h LYS 188 Cb 1.09 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 2qj0 h LYS 188 CO 0.98 0.42 0.00 -1.35 -2.27 0.00 0.00 179.45 177.23 2qj0 h PRO 189 N 0.65 0.00 0.00 1.90 0.11 -1.94 -2.15 132.00 130.57 2qj0 h PRO 189 Ca 0.50 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.57 2qj0 h PRO 189 Cb 0.91 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 2qj0 h PRO 189 CO -0.26 0.00 -0.37 0.82 -0.21 0.00 0.00 178.00 177.99 2qj0 h ILE 190 N 0.00 0.64 -0.89 4.15 5.03 -1.29 -3.38 117.51 121.78 2qj0 h ILE 190 Ca 0.00 -1.58 0.16 0.00 -0.12 0.00 0.00 64.86 63.32 2qj0 h ILE 190 Cb 0.08 1.31 -0.16 0.00 -3.03 0.00 0.00 36.82 35.02 2qj0 h ILE 190 CO 0.00 0.22 -0.31 0.00 -0.68 0.00 0.00 178.15 177.37 2qj0 h ALA 191 N -0.64 0.30 0.00 1.87 0.00 -1.12 0.76 119.26 120.43 2qj0 h ALA 191 Ca -0.07 0.29 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2qj0 h ALA 191 Cb 0.63 0.84 0.00 0.00 0.00 0.00 0.00 17.79 19.26 2qj0 h ALA 191 CO -0.04 -0.54 0.00 -0.85 0.00 0.00 0.00 179.25 177.82 2qj0 n GLU 192 N -5.51 0.18 0.00 0.00 0.28 -0.91 -2.44 120.64 112.25 2qj0 n GLU 192 Ca 0.11 0.05 0.00 0.00 -0.16 0.00 0.00 57.16 57.16 2qj0 n GLU 192 Cb 0.42 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.79 2qj0 n GLU 192 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2qj0 n ILE 193 N -1.07 0.00 -0.34 3.84 5.41 0.23 -4.77 119.36 122.66 2qj0 n ILE 193 Ca 0.05 0.00 0.05 0.00 1.00 0.00 0.00 62.75 63.84 2qj0 n ILE 193 Cb 0.03 0.31 0.12 0.00 -0.71 0.00 0.00 39.64 39.38 2qj0 n ILE 193 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 2qj0 n PHE 194 N -0.95 0.29 0.21 1.39 7.35 0.97 -0.22 117.46 126.50 2qj0 n PHE 194 Ca 0.00 1.15 0.01 0.00 -0.76 0.00 0.00 57.45 57.85 2qj0 n PHE 194 Cb 0.00 -1.01 0.06 0.00 0.35 0.00 0.00 39.48 38.88 2qj0 n PHE 194 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 2qj0 n THR 195 N -5.51 0.00 0.51 -2.13 -2.24 -1.26 -1.48 114.28 102.17 2qj0 n THR 195 Ca 0.14 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.03 2qj0 n THR 195 Cb 0.45 -0.77 -0.09 0.00 -2.10 0.00 0.00 70.33 67.82 2qj0 n THR 195 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2qj0 n LYS 196 N -0.82 0.32 -1.59 -0.78 4.76 0.70 -4.84 118.16 115.91 2qj0 n LYS 196 Ca 0.02 -0.07 -0.50 0.00 -2.87 0.00 0.00 58.31 54.88 2qj0 n LYS 196 Cb 0.01 -1.54 -0.05 0.00 -1.84 0.00 0.00 35.03 31.61 2qj0 n LYS 196 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 2qj0 n ILE 197 N -1.92 0.35 -1.64 -0.18 5.41 -0.55 -4.79 119.36 116.04 2qj0 n ILE 197 Ca 0.01 -0.09 -0.52 0.00 1.00 0.00 0.00 62.75 63.14 2qj0 n ILE 197 Cb 0.45 -0.87 -0.06 0.00 -0.71 0.00 0.00 39.64 38.45 2qj0 n ILE 197 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 2qj0 n ASP 198 N 2.36 2.15 0.00 4.38 8.00 -1.26 -1.52 116.55 130.65 2qj0 n ASP 198 Ca 0.17 1.09 0.00 0.00 0.71 0.00 0.00 54.79 56.76 2qj0 n ASP 198 Cb 0.22 -1.22 0.00 0.00 -0.02 0.00 0.00 41.12 40.10 2qj0 n ASP 198 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qj0 n GLY 199 N 3.20 0.40 0.17 0.44 0.00 -1.26 -4.74 105.19 103.40 2qj0 n GLY 199 Ca 0.21 -0.95 0.03 0.00 0.00 0.00 0.00 46.02 45.31 2qj0 n GLY 199 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2qj0 h PHE 200 N 0.00 0.00 -1.57 1.61 3.04 -1.60 -2.67 116.94 115.75 2qj0 h PHE 200 Ca 0.00 0.00 -0.46 0.00 3.98 0.00 0.00 57.97 61.49 2qj0 h PHE 200 Cb 0.00 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.50 2qj0 h PHE 200 CO 0.00 0.46 -0.33 -0.06 -2.02 0.00 0.00 178.31 176.35 2qj0 s PHE 201 N -3.70 2.84 0.52 0.41 0.08 -1.26 -4.22 117.98 112.65 2qj0 s PHE 201 Ca -0.01 -0.39 -0.20 0.00 0.12 0.00 0.00 56.93 56.45 2qj0 s PHE 201 Cb 0.12 -2.18 -0.06 0.00 -0.57 0.00 0.00 43.02 40.32 2qj0 s PHE 201 CO 0.72 -0.19 1.11 0.00 -0.10 0.00 0.00 175.22 176.76 2qj0 s ALA 202 N -2.36 2.75 -1.75 5.36 0.00 -1.26 -4.83 121.76 119.68 2qj0 s ALA 202 Ca 0.49 0.79 0.00 0.00 0.00 0.00 0.00 51.96 53.25 2qj0 s ALA 202 Cb -0.07 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.71 2qj0 s ALA 202 CO 0.30 -0.67 0.60 -3.47 0.00 0.00 0.00 175.76 172.53 2qj0 n ASP 203 N -1.16 0.17 0.00 0.00 2.03 -1.26 -4.83 116.55 111.51 2qj0 n ASP 203 Ca 0.11 -1.38 0.00 0.00 0.52 0.00 0.00 54.79 54.04 2qj0 n ASP 203 Cb 0.51 -0.09 0.00 0.00 -0.72 0.00 0.00 41.12 40.82 2qj0 n ASP 203 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qj0 n TYR 204 N -0.34 0.00 -0.85 -0.67 9.36 -1.26 -4.14 117.16 119.26 2qj0 n TYR 204 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2qj0 n TYR 204 Cb 0.04 -1.69 0.00 0.00 -0.63 0.00 0.00 39.34 37.06 2qj0 n TYR 204 CO 0.00 0.00 0.00 -1.13 0.22 0.00 0.00 176.86 175.95 2qj0 n SER 205 N -0.38 0.00 -4.69 2.98 3.41 -1.26 -5.08 113.62 108.60 2qj0 n SER 205 Ca 0.00 -0.53 -0.42 0.00 -0.26 0.00 0.00 58.87 57.66 2qj0 n SER 205 Cb 0.19 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.12 2qj0 n SER 205 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qj0 s LYS 207 N 2.23 4.34 0.56 0.00 1.02 -1.26 -4.86 119.74 121.77 2qj0 s LYS 207 Ca 0.65 1.56 0.19 0.00 0.02 0.00 0.00 55.97 58.39 2qj0 s LYS 207 Cb -0.33 -2.74 1.04 0.00 -0.52 0.00 0.00 37.83 35.28 2qj0 s LYS 207 CO 0.27 0.00 1.55 -1.00 -0.92 0.00 0.00 175.35 175.25 2qj0 h PRO 208 N 2.92 0.00 0.00 -1.68 0.13 -1.89 0.33 132.00 131.81 2qj0 h PRO 208 Ca -0.48 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.56 2qj0 h PRO 208 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2qj0 h PRO 208 CO 0.64 0.00 -0.45 1.96 -0.23 0.00 0.00 178.00 179.92 2qj0 h GLN 209 N 0.00 0.00 -0.02 0.86 7.50 -1.75 -3.05 115.11 118.66 2qj0 h GLN 209 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2qj0 h GLN 209 Cb 0.92 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.45 2qj0 h GLN 209 CO 0.00 0.45 -0.03 -0.25 -1.50 0.00 0.00 178.83 177.50 2qj0 n ASP 210 N -3.22 1.90 -0.15 1.46 8.00 0.11 -4.28 116.55 120.37 2qj0 n ASP 210 Ca 0.02 -1.60 -0.04 0.00 0.71 0.00 0.00 54.79 53.88 2qj0 n ASP 210 Cb 0.71 0.02 0.05 0.00 -0.02 0.00 0.00 41.12 41.88 2qj0 n ASP 210 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 2qj0 h PHE 211 N 2.93 0.33 -0.00 1.24 0.05 -1.61 0.26 116.94 120.13 2qj0 h PHE 211 Ca 0.00 0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.81 2qj0 h PHE 211 Cb 0.64 -0.08 0.00 0.00 2.00 0.00 0.00 35.95 38.52 2qj0 h PHE 211 CO 0.00 0.12 0.00 -0.85 -0.18 0.00 0.00 178.31 177.40 2qj0 n GLU 212 N -4.98 1.00 -0.00 1.51 0.28 -1.26 -3.33 120.64 113.86 2qj0 n GLU 212 Ca 0.04 -0.00 -0.01 0.00 -0.16 0.00 0.00 57.16 57.03 2qj0 n GLU 212 Cb 0.18 -1.06 -0.00 0.00 1.43 0.00 0.00 31.44 31.98 2qj0 n GLU 212 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2qj0 n ARG 213 N -0.56 0.01 -0.85 3.44 1.74 0.04 -2.58 116.66 117.91 2qj0 n ARG 213 Ca 0.03 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.09 2qj0 n ARG 213 Cb 0.01 -0.73 0.27 0.00 -1.02 0.00 0.00 32.46 30.99 2qj0 n ARG 213 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2qj0 n LYS 214 N -2.81 3.13 -4.84 5.56 5.02 0.69 -4.78 118.16 120.13 2qj0 n LYS 214 Ca -0.01 -3.05 -0.26 0.00 -2.02 0.00 0.00 58.31 52.97 2qj0 n LYS 214 Cb 0.51 -2.05 -0.15 0.00 -0.02 0.00 0.00 35.03 33.32 2qj0 n LYS 214 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2qj0 s THR 215 N -3.02 1.57 0.13 -0.18 -1.32 -1.21 -4.87 115.64 106.75 2qj0 s THR 215 Ca 0.50 -0.95 -0.30 0.00 -1.21 0.00 0.00 61.69 59.72 2qj0 s THR 215 Cb 0.41 -1.33 -0.07 0.00 -1.51 0.00 0.00 72.50 70.00 2qj0 s THR 215 CO 0.10 0.35 1.57 0.40 -2.21 0.00 0.00 174.62 174.83 2qj0 h ILE 216 N 4.56 0.08 0.00 5.08 1.08 -1.64 0.80 117.51 127.46 2qj0 h ILE 216 Ca -0.40 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.07 2qj0 h ILE 216 Cb 1.15 0.08 0.00 0.00 -3.07 0.00 0.00 36.82 34.98 2qj0 h ILE 216 CO 0.47 0.00 0.00 0.18 -0.69 0.00 0.00 178.15 178.11 2qj0 n LEU 217 N -5.43 0.00 0.00 1.44 7.99 -1.26 -4.38 117.00 115.36 2qj0 n LEU 217 Ca -0.04 0.19 0.00 0.00 -0.01 0.00 0.00 56.01 56.15 2qj0 n LEU 217 Cb 0.36 -0.19 0.00 0.00 -0.11 0.00 0.00 43.42 43.48 2qj0 n LEU 217 CO 0.08 -0.05 0.35 0.61 -1.51 0.00 0.00 177.39 176.87 2qj0 n GLY 218 N 0.54 -3.39 0.25 -0.72 0.00 0.27 -1.91 105.19 100.24 2qj0 n GLY 218 Ca 0.13 0.63 0.03 0.00 0.00 0.00 0.00 46.02 46.81 2qj0 n GLY 218 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2qj0 h PRO 219 N 0.00 0.13 -0.00 1.61 0.11 -1.68 -2.57 132.00 129.60 2qj0 h PRO 219 Ca 0.00 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.96 2qj0 h PRO 219 Cb 0.00 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.06 2qj0 h PRO 219 CO 0.00 0.09 -0.66 -0.84 -0.21 0.00 0.00 178.00 176.38 2qj0 h ILE 220 N 0.13 1.47 0.00 4.15 3.07 -1.84 -2.66 117.51 121.83 2qj0 h ILE 220 Ca 0.36 -2.24 0.00 0.00 1.55 0.00 0.00 64.86 64.53 2qj0 h ILE 220 Cb 0.61 2.21 0.00 0.00 -0.27 0.00 0.00 36.82 39.37 2qj0 h ILE 220 CO -0.57 0.64 0.00 -0.07 -1.05 0.00 0.00 178.15 177.10 2qj0 h LEU 221 N 0.01 0.00 0.00 0.16 3.38 -0.97 -2.75 115.31 115.14 2qj0 h LEU 221 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2qj0 h LEU 221 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2qj0 h LEU 221 CO 0.09 0.00 -0.82 -1.54 0.09 0.00 0.00 178.44 176.25 2qj0 n SER 222 N -2.35 0.63 -4.64 -0.43 3.41 -1.00 -4.46 113.62 104.77 2qj0 n SER 222 Ca 0.01 -0.15 -0.50 0.00 -0.26 0.00 0.00 58.87 57.97 2qj0 n SER 222 Cb 0.17 0.53 -0.05 0.00 -0.26 0.00 0.00 64.21 64.60 2qj0 n SER 222 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2qj0 n LEU 223 N -1.91 3.08 -3.57 1.04 7.99 -1.04 -4.52 117.00 118.07 2qj0 n LEU 223 Ca 0.03 0.84 -0.08 0.00 -0.01 0.00 0.00 56.01 56.79 2qj0 n LEU 223 Cb 0.42 -1.33 -0.03 0.00 -0.11 0.00 0.00 43.42 42.36 2qj0 n LEU 223 CO 0.38 -0.26 0.84 -0.55 -1.51 0.00 0.00 177.39 176.29 2qj0 s SER 224 N 4.86 -0.29 0.00 -1.43 0.15 -1.26 -4.95 113.70 110.78 2qj0 s SER 224 Ca 0.97 0.16 0.30 0.00 0.70 0.00 0.00 55.95 58.08 2qj0 s SER 224 Cb -0.75 0.27 1.49 0.00 -1.71 0.00 0.00 66.02 65.32 2qj0 s SER 224 CO 0.52 -0.37 2.04 -0.81 1.20 0.00 0.00 173.24 175.82 2qj0 n PRO 225 N 0.24 0.41 -1.29 5.44 -0.04 -1.26 -3.65 135.00 134.86 2qj0 n PRO 225 Ca -0.06 -0.01 -0.31 0.00 -0.04 0.00 0.00 63.50 63.07 2qj0 n PRO 225 Cb 0.59 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.66 2qj0 n PRO 225 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 2qj0 n ILE 226 N -1.28 3.48 -4.07 0.52 -5.35 -1.26 -4.22 119.36 107.18 2qj0 n ILE 226 Ca 0.14 -2.59 -0.34 0.00 -0.27 0.00 0.00 62.75 59.68 2qj0 n ILE 226 Cb 0.25 -0.96 -0.10 0.00 -1.74 0.00 0.00 39.64 37.09 2qj0 n ILE 226 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2qj0 s GLU 227 N -3.61 3.93 0.25 6.28 2.56 -1.24 -4.34 118.70 122.53 2qj0 s GLU 227 Ca 0.62 -0.37 -0.09 0.00 0.00 0.00 0.00 54.97 55.12 2qj0 s GLU 227 Cb 0.49 -3.17 0.40 0.00 2.00 0.00 0.00 34.13 33.85 2qj0 s GLU 227 CO 0.03 0.27 1.59 0.00 -0.56 0.00 0.00 175.26 176.59 2qj0 h ALA 228 N 6.69 0.62 -0.58 6.30 0.00 -1.94 -0.09 119.26 130.25 2qj0 h ALA 228 Ca -0.36 0.32 0.10 0.00 0.00 0.00 0.00 54.91 54.98 2qj0 h ALA 228 Cb 1.17 0.62 -0.08 0.00 0.00 0.00 0.00 17.79 19.50 2qj0 h ALA 228 CO 0.69 -0.41 0.14 0.00 0.00 0.00 0.00 179.25 179.67 2qj0 h ALA 229 N 1.84 0.69 -0.37 0.00 0.00 -1.97 -1.64 119.26 117.81 2qj0 h ALA 229 Ca 0.42 0.12 -0.09 0.00 0.00 0.00 0.00 54.91 55.36 2qj0 h ALA 229 Cb 0.67 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2qj0 h ALA 229 CO -0.85 -0.29 -0.11 0.28 0.00 0.00 0.00 179.25 178.28 2qj0 h VAL 230 N 0.27 1.28 -0.51 0.00 2.07 -1.41 -2.67 116.25 115.28 2qj0 h VAL 230 Ca 0.30 -1.19 0.06 0.00 0.82 0.00 0.00 66.70 66.68 2qj0 h VAL 230 Cb 0.43 1.28 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 2qj0 h VAL 230 CO -0.37 0.39 0.23 0.00 0.02 0.00 0.00 177.57 177.84 2qj0 h ALA 231 N 0.82 0.65 0.00 1.67 0.00 -0.24 -0.13 119.26 122.03 2qj0 h ALA 231 Ca 0.09 0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.86 2qj0 h ALA 231 Cb 0.63 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2qj0 h ALA 231 CO 0.04 -0.14 -0.88 -0.84 0.00 0.00 0.00 179.25 177.43 2qj0 h ILE 232 N 0.44 1.61 -0.30 0.00 3.07 -1.36 0.65 117.51 121.63 2qj0 h ILE 232 Ca 0.24 -2.95 -0.03 0.00 1.55 0.00 0.00 64.86 63.66 2qj0 h ILE 232 Cb 0.19 2.60 -0.01 0.00 -0.27 0.00 0.00 36.82 39.34 2qj0 h ILE 232 CO -0.20 0.85 0.06 -0.09 -1.05 0.00 0.00 178.15 177.72 2qj0 h ARG 233 N 0.01 0.48 0.17 0.16 9.65 -1.10 -1.09 114.38 122.66 2qj0 h ARG 233 Ca -0.02 -0.12 -0.25 0.00 -1.10 0.00 0.00 59.98 58.49 2qj0 h ARG 233 Cb 1.55 -0.06 0.02 0.00 -1.39 0.00 0.00 29.97 30.09 2qj0 h ARG 233 CO 0.12 0.57 -1.14 -0.91 2.80 0.00 0.00 179.97 181.41 2qj0 h ASN 234 N 0.31 0.56 0.00 -3.80 4.21 -1.04 -3.39 115.58 112.43 2qj0 h ASN 234 Ca 0.09 -0.93 -0.21 0.00 1.21 0.00 0.00 56.30 56.47 2qj0 h ASN 234 Cb 0.31 -0.18 -0.04 0.00 -1.12 0.00 0.00 38.32 37.29 2qj0 h ASN 234 CO 0.00 1.54 -1.78 -1.22 -1.29 0.00 0.00 177.43 174.68 2qj0 n TYR 235 N -3.96 0.00 0.19 1.19 4.01 0.21 -4.43 117.16 114.37 2qj0 n TYR 235 Ca -0.17 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.61 2qj0 n TYR 235 Cb 0.92 -0.55 0.18 0.00 -0.31 0.00 0.00 39.34 39.59 2qj0 n TYR 235 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qj0 n GLY 236 N 2.51 -0.73 0.16 2.72 0.00 -0.46 -1.90 105.19 107.49 2qj0 n GLY 236 Ca -0.21 0.01 -0.05 0.00 0.00 0.00 0.00 46.02 45.77 2qj0 n GLY 236 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2qj0 h ASP 237 N 0.00 -0.31 -1.13 1.61 3.58 -1.65 -3.39 116.42 115.13 2qj0 h ASP 237 Ca 0.00 0.11 -0.05 0.00 0.42 0.00 0.00 57.03 57.51 2qj0 h ASP 237 Cb 0.10 0.22 -0.22 0.00 1.72 0.00 0.00 39.33 41.15 2qj0 h ASP 237 CO 0.00 -0.11 -0.44 0.21 -2.88 0.00 0.00 179.24 176.02 2qj0 s ASN 238 N -5.22 -1.23 0.00 2.28 3.04 -0.80 -5.02 114.94 107.99 2qj0 s ASN 238 Ca -0.14 -0.35 0.27 0.00 0.04 0.00 0.00 52.86 52.68 2qj0 s ASN 238 Cb 0.14 1.83 1.46 0.00 -1.54 0.00 0.00 41.25 43.14 2qj0 s ASN 238 CO 0.70 -0.25 1.95 0.18 -3.04 0.00 0.00 177.10 176.65 2qj0 n LEU 239 N 4.95 0.00 -0.97 3.21 4.77 -1.20 -3.02 117.00 124.74 2qj0 n LEU 239 Ca 0.07 0.20 0.12 0.00 -0.03 0.00 0.00 56.01 56.37 2qj0 n LEU 239 Cb 0.54 -0.20 0.15 0.00 -2.33 0.00 0.00 43.42 41.58 2qj0 n LEU 239 CO -0.02 -0.02 0.66 0.18 -1.33 0.00 0.00 177.39 176.86 2qj0 n LEU 240 N -1.20 3.00 -4.66 2.23 4.77 -1.26 -5.00 117.00 114.87 2qj0 n LEU 240 Ca 0.15 -1.07 -0.31 0.00 -0.03 0.00 0.00 56.01 54.76 2qj0 n LEU 240 Cb 0.18 -0.05 0.17 0.00 -2.33 0.00 0.00 43.42 41.38 2qj0 n LEU 240 CO 0.19 0.53 0.66 0.00 -1.33 0.00 0.00 177.39 177.45 2qj0 s ARG 241 N -1.90 0.94 0.72 3.23 1.70 -1.17 -4.99 118.95 117.48 2qj0 s ARG 241 Ca 0.31 1.37 -0.11 0.00 -0.47 0.00 0.00 55.73 56.83 2qj0 s ARG 241 Cb 0.21 -1.73 0.03 0.00 -0.57 0.00 0.00 34.95 32.88 2qj0 s ARG 241 CO 0.31 -2.63 1.08 -1.54 -1.08 0.00 0.00 175.30 171.44 2qj0 s SER 242 N -2.78 4.93 0.33 -2.89 1.04 -1.26 -4.77 113.70 108.30 2qj0 s SER 242 Ca 0.66 1.78 0.08 0.00 0.48 0.00 0.00 55.95 58.95 2qj0 s SER 242 Cb -0.22 -2.52 0.78 0.00 0.10 0.00 0.00 66.02 64.16 2qj0 s SER 242 CO 0.59 -1.75 1.81 0.11 0.98 0.00 0.00 173.24 174.98 2qj0 h LYS 243 N -0.76 0.71 0.59 4.02 1.79 -1.97 0.35 116.57 121.30 2qj0 h LYS 243 Ca -0.44 -0.04 -0.03 0.00 -2.18 0.00 0.00 60.65 57.96 2qj0 h LYS 243 Cb 1.23 -0.16 0.01 0.00 -1.58 0.00 0.00 32.23 31.72 2qj0 h LYS 243 CO 0.54 0.47 -0.29 1.96 -1.08 0.00 0.00 179.45 181.05 2qj0 h GLN 244 N 0.74 -0.77 -0.57 3.15 7.50 -1.98 0.47 115.11 123.65 2qj0 h GLN 244 Ca 0.53 0.05 -0.05 0.00 0.50 0.00 0.00 58.65 59.68 2qj0 h GLN 244 Cb 0.85 0.17 -0.03 0.00 0.05 0.00 0.00 27.48 28.53 2qj0 h GLN 244 CO -0.30 -0.48 0.14 1.96 -1.50 0.00 0.00 178.83 178.65 2qj0 h GLN 245 N -0.89 0.87 -0.03 1.46 4.20 -1.77 -2.81 115.11 116.15 2qj0 h GLN 245 Ca -0.08 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.45 2qj0 h GLN 245 Cb 0.64 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.29 2qj0 h GLN 245 CO 0.13 0.78 0.01 1.15 -0.67 0.00 0.00 178.83 180.24 2qj0 h THR 246 N 0.84 1.14 0.00 -0.54 2.02 -0.19 -2.76 112.91 113.42 2qj0 h THR 246 Ca 0.19 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 66.94 2qj0 h THR 246 Cb 0.30 1.38 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 2qj0 h THR 246 CO -0.00 0.11 0.00 0.00 0.37 0.00 0.00 175.52 176.00 2qj0 n ALA 247 N -2.19 1.49 0.00 6.16 0.00 0.17 -2.12 120.51 124.01 2qj0 n ALA 247 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2qj0 n ALA 247 Cb 0.11 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.27 2qj0 n ALA 247 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 2qj0 n ILE 249 N 1.30 0.00 0.04 0.00 3.06 -1.04 -1.67 119.36 121.05 2qj0 n ILE 249 Ca 0.00 0.00 -0.13 0.00 -2.50 0.00 0.00 62.75 60.12 2qj0 n ILE 249 Cb 0.00 0.00 -0.09 0.00 0.54 0.00 0.00 39.64 40.09 2qj0 n ILE 249 CO 0.00 0.00 0.00 0.45 -2.50 0.00 0.00 176.55 174.50 2qj0 h HIS 250 N 0.00 -0.10 -0.88 9.51 3.86 -1.71 -1.15 115.15 124.68 2qj0 h HIS 250 Ca 0.00 -0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.30 2qj0 h HIS 250 Cb 0.00 0.03 -0.07 0.00 1.06 0.00 0.00 27.41 28.43 2qj0 h HIS 250 CO 0.00 0.25 0.52 0.93 0.86 0.00 0.00 177.93 180.49 2qj0 h GLU 251 N -0.47 0.86 0.58 2.45 5.08 -1.61 0.78 114.58 122.25 2qj0 h GLU 251 Ca -0.01 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 2qj0 h GLU 251 Cb 0.40 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 29.46 2qj0 h GLU 251 CO 0.02 0.57 -0.28 1.03 -1.00 0.00 0.00 179.01 179.35 2qj0 h SER 252 N 0.88 -0.66 -0.56 1.42 0.87 -1.81 -1.39 113.55 112.30 2qj0 h SER 252 Ca 0.41 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.97 2qj0 h SER 252 Cb 0.34 0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.45 2qj0 h SER 252 CO -0.23 -0.44 0.32 -0.07 -0.53 0.00 0.00 176.83 175.88 2qj0 h LEU 253 N -0.82 0.70 -0.01 2.23 -0.00 -0.84 -1.92 115.31 114.65 2qj0 h LEU 253 Ca -0.08 -0.05 -0.00 0.00 -0.00 0.00 0.00 57.88 57.75 2qj0 h LEU 253 Cb 0.62 -0.18 -0.00 0.00 -0.00 0.00 0.00 40.66 41.10 2qj0 h LEU 253 CO 0.13 0.56 0.01 1.56 -0.00 0.00 0.00 178.44 180.70 2qj0 h GLN 254 N 0.80 0.02 -0.32 1.13 4.20 -0.74 -0.28 115.11 119.92 2qj0 h GLN 254 Ca 0.21 -0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.98 2qj0 h GLN 254 Cb 0.01 -0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.72 2qj0 h GLN 254 CO -0.04 0.07 -0.11 0.00 -0.67 0.00 0.00 178.83 178.08 2qj0 h ALA 255 N 0.95 0.16 -0.90 3.87 0.00 -0.71 0.16 119.26 122.80 2qj0 h ALA 255 Ca 0.00 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2qj0 h ALA 255 Cb 0.05 0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 2qj0 h ALA 255 CO -0.00 -0.49 0.53 1.49 0.00 0.00 0.00 179.25 180.78 2qj0 h GLU 256 N -0.05 1.23 -0.34 0.00 4.81 -1.15 -2.65 114.58 116.44 2qj0 h GLU 256 Ca 0.16 -0.12 -0.14 0.00 -0.13 0.00 0.00 59.36 59.13 2qj0 h GLU 256 Cb 0.29 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 2qj0 h GLU 256 CO -0.35 0.87 -0.33 1.25 -0.73 0.00 0.00 179.01 179.71 2qj0 h HIS 257 N 1.24 0.98 -0.63 0.92 2.76 -0.03 -2.18 115.15 118.22 2qj0 h HIS 257 Ca 0.32 -0.29 0.08 0.00 -2.20 0.00 0.00 60.37 58.28 2qj0 h HIS 257 Cb -0.04 -0.21 -0.06 0.00 1.55 0.00 0.00 27.41 28.65 2qj0 h HIS 257 CO 0.01 1.08 0.29 -0.22 -1.30 0.00 0.00 177.93 177.79 2qj0 h LYS 258 N 0.60 0.51 -0.26 5.26 3.64 -0.48 -0.41 116.57 125.43 2qj0 h LYS 258 Ca 0.05 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2qj0 h LYS 258 Cb 0.92 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.61 2qj0 h LYS 258 CO 0.08 0.34 0.10 0.28 -2.27 0.00 0.00 179.45 177.98 2qj0 h VAL 259 N 0.52 1.18 -0.33 2.00 2.07 -1.35 -1.79 116.25 118.55 2qj0 h VAL 259 Ca 0.31 -0.54 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 2qj0 h VAL 259 Cb 0.31 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 2qj0 h VAL 259 CO -0.25 0.18 0.01 1.62 0.02 0.00 0.00 177.57 179.15 2qj0 h VAL 260 N 0.27 1.19 0.00 2.57 3.04 -0.71 0.12 116.25 122.74 2qj0 h VAL 260 Ca 0.09 -0.73 -0.14 0.00 -1.01 0.00 0.00 66.70 64.91 2qj0 h VAL 260 Cb 0.19 0.92 -0.02 0.00 -2.01 0.00 0.00 31.29 30.37 2qj0 h VAL 260 CO -0.01 0.25 -0.68 0.16 -1.01 0.00 0.00 177.57 176.29 2qj0 h ILE 261 N 0.49 1.13 -0.60 3.17 -0.00 -1.02 0.12 117.51 120.79 2qj0 h ILE 261 Ca 0.11 -2.60 -0.10 0.00 -0.00 0.00 0.00 64.86 62.27 2qj0 h ILE 261 Cb 0.30 2.55 -0.02 0.00 -0.00 0.00 0.00 36.82 39.65 2qj0 h ILE 261 CO 0.01 0.64 -0.00 0.44 -0.00 0.00 0.00 178.15 179.24 2qj0 h ASP 262 N 0.00 1.04 0.60 2.16 5.19 -0.71 0.42 116.42 125.13 2qj0 h ASP 262 Ca -0.01 -0.31 -0.20 0.00 -0.62 0.00 0.00 57.03 55.89 2qj0 h ASP 262 Cb 1.51 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 40.73 2qj0 h ASP 262 CO 0.09 1.10 -0.89 0.03 -3.12 0.00 0.00 179.24 176.45 2qj0 h ARG 263 N 0.96 0.19 -0.40 3.56 3.08 -0.92 -1.75 114.38 119.10 2qj0 h ARG 263 Ca 0.17 -0.21 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 2qj0 h ARG 263 Cb 0.56 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.66 2qj0 h ARG 263 CO 0.03 0.96 0.13 1.25 -1.07 0.00 0.00 179.97 181.27 2qj0 h LEU 264 N 0.10 0.57 0.37 3.04 7.12 -0.39 -1.95 115.31 124.17 2qj0 h LEU 264 Ca -0.04 -0.20 -0.02 0.00 0.13 0.00 0.00 57.88 57.75 2qj0 h LEU 264 Cb 1.52 -0.15 0.00 0.00 -0.53 0.00 0.00 40.66 41.51 2qj0 h LEU 264 CO 0.13 0.62 -0.18 0.15 -0.13 0.00 0.00 178.44 179.03 2qj0 h PHE 265 N 0.50 -0.46 -0.90 1.25 3.57 -0.07 -2.29 116.94 118.54 2qj0 h PHE 265 Ca 0.13 -0.01 0.21 0.00 3.53 0.00 0.00 57.97 61.83 2qj0 h PHE 265 Cb 0.24 0.15 -0.17 0.00 2.79 0.00 0.00 35.95 38.97 2qj0 h PHE 265 CO 0.01 -0.24 -0.07 0.35 -2.23 0.00 0.00 178.31 176.12 2qj0 h PHE 266 N -0.57 -0.21 -0.19 0.41 3.57 -1.17 0.33 116.94 119.12 2qj0 h PHE 266 Ca -0.05 0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 2qj0 h PHE 266 Cb 0.42 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.39 2qj0 h PHE 266 CO -0.03 -0.37 -0.00 0.82 -2.23 0.00 0.00 178.31 176.50 2qj0 h ILE 267 N 0.03 1.26 0.00 1.41 2.04 -1.10 -2.74 117.51 118.41 2qj0 h ILE 267 Ca 0.49 -0.87 -0.07 0.00 1.00 0.00 0.00 64.86 65.41 2qj0 h ILE 267 Cb 0.89 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 2qj0 h ILE 267 CO -0.86 0.26 -0.34 0.58 0.00 0.00 0.00 178.15 177.79 2qj0 h VAL 268 N 0.08 0.72 -0.36 1.67 2.07 -0.53 -3.02 116.25 116.87 2qj0 h VAL 268 Ca 0.05 -1.57 -0.05 0.00 0.82 0.00 0.00 66.70 65.96 2qj0 h VAL 268 Cb 0.39 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 2qj0 h VAL 268 CO 0.01 0.34 0.04 -0.78 0.02 0.00 0.00 177.57 177.19 2qj0 h ASP 269 N 0.00 0.59 -0.71 0.57 3.58 -0.40 -0.62 116.42 119.43 2qj0 h ASP 269 Ca -0.00 -0.28 0.04 0.00 0.42 0.00 0.00 57.03 57.21 2qj0 h ASP 269 Cb 1.00 -0.16 -0.04 0.00 1.72 0.00 0.00 39.33 41.85 2qj0 h ASP 269 CO 0.04 0.72 0.47 0.11 -2.88 0.00 0.00 179.24 177.71 2qj0 h LYS 270 N 0.44 0.83 -0.09 0.28 6.56 -1.38 -0.08 116.57 123.13 2qj0 h LYS 270 Ca 0.11 -0.05 -0.15 0.00 -1.06 0.00 0.00 60.65 59.50 2qj0 h LYS 270 Cb 0.40 -0.19 -0.01 0.00 -0.57 0.00 0.00 32.23 31.86 2qj0 h LYS 270 CO 0.01 0.55 -0.61 -0.07 -2.06 0.00 0.00 179.45 177.27 2qj0 h LEU 271 N 0.85 0.36 -0.42 2.94 3.38 -1.35 -1.86 115.31 119.21 2qj0 h LEU 271 Ca 0.29 -0.20 -0.18 0.00 0.09 0.00 0.00 57.88 57.87 2qj0 h LEU 271 Cb 0.08 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2qj0 h LEU 271 CO -0.08 0.88 -0.70 1.62 0.09 0.00 0.00 178.44 180.24 2qj0 h VAL 272 N 0.23 1.37 0.00 1.22 3.04 -0.15 -3.02 116.25 118.94 2qj0 h VAL 272 Ca -0.01 -2.07 0.00 0.00 -1.01 0.00 0.00 66.70 63.61 2qj0 h VAL 272 Cb 1.12 2.05 0.00 0.00 -2.01 0.00 0.00 31.29 32.46 2qj0 h VAL 272 CO 0.10 0.63 0.00 0.03 -1.01 0.00 0.00 177.57 177.32 2qj0 h ARG 273 N 0.30 0.00 -0.68 4.17 3.08 -0.99 -3.36 114.38 116.90 2qj0 h ARG 273 Ca -0.03 0.00 0.14 0.00 0.07 0.00 0.00 59.98 60.16 2qj0 h ARG 273 Cb 1.27 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.22 2qj0 h ARG 273 CO 0.12 0.00 0.19 0.78 -1.07 0.00 0.00 179.97 179.99 2qj0 h GLY 274 N 4.15 0.95 0.00 0.04 0.00 -1.20 -3.46 103.07 103.55 2qj0 h GLY 274 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2qj0 h GLY 274 CO 0.00 -0.14 0.00 -1.14 0.00 0.00 0.00 176.54 175.26 2qj0 n SER 275 N -5.11 0.00 -0.26 0.19 3.41 -1.26 -4.30 113.62 106.30 2qj0 n SER 275 Ca 0.12 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.82 2qj0 n SER 275 Cb 0.39 0.00 0.35 0.00 -0.26 0.00 0.00 64.21 64.69 2qj0 n SER 275 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2qj0 h LEU 276 N 0.00 0.70 -1.34 1.04 5.85 -1.90 0.15 115.31 119.82 2qj0 h LEU 276 Ca 0.00 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 2qj0 h LEU 276 Cb 0.00 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 2qj0 h LEU 276 CO 0.00 0.40 -0.28 -1.13 -0.34 0.00 0.00 178.44 177.08 2qj0 h ASN 277 N 0.77 0.00 0.09 1.25 -1.24 -1.94 -2.33 115.58 112.17 2qj0 h ASN 277 Ca 0.41 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 57.42 2qj0 h ASN 277 Cb 0.53 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.58 2qj0 h ASN 277 CO -0.18 0.28 -0.04 -1.28 -1.29 0.00 0.00 177.43 174.92 2qj0 h SER 278 N 0.00 -0.11 -0.46 1.15 0.87 -1.03 -3.02 113.55 110.97 2qj0 h SER 278 Ca -0.00 0.00 0.13 0.00 -1.23 0.00 0.00 61.79 60.69 2qj0 h SER 278 Cb 0.64 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.61 2qj0 h SER 278 CO 0.04 0.29 0.33 0.08 -0.53 0.00 0.00 176.83 177.03 2qj0 h ARG 279 N -0.86 0.03 -0.50 2.24 0.11 -1.38 0.47 114.38 114.49 2qj0 h ARG 279 Ca -0.01 -0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.01 2qj0 h ARG 279 Cb 0.10 -0.01 -0.02 0.00 1.11 0.00 0.00 29.97 31.15 2qj0 h ARG 279 CO 0.02 0.02 0.09 1.15 0.10 0.00 0.00 179.97 181.35 2qj0 h THR 280 N 0.03 1.25 0.00 0.08 2.02 -1.53 -1.79 112.91 112.96 2qj0 h THR 280 Ca 0.22 -0.91 0.00 0.00 0.77 0.00 0.00 66.41 66.49 2qj0 h THR 280 Cb 0.82 0.87 0.00 0.00 -1.74 0.00 0.00 68.15 68.11 2qj0 h THR 280 CO -0.01 0.33 0.00 0.47 0.37 0.00 0.00 175.52 176.68 2qj0 n ASP 281 N -4.42 1.24 0.00 4.18 9.92 0.16 -1.65 116.55 125.99 2qj0 n ASP 281 Ca 0.01 -0.92 0.00 0.00 -0.53 0.00 0.00 54.79 53.35 2qj0 n ASP 281 Cb 0.25 -0.23 0.00 0.00 -0.64 0.00 0.00 41.12 40.49 2qj0 n ASP 281 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 2qj0 n ILE 283 N 1.16 0.00 -0.22 0.53 2.08 -0.68 -1.55 119.36 120.68 2qj0 n ILE 283 Ca 0.00 0.00 -0.04 0.00 0.56 0.00 0.00 62.75 63.27 2qj0 n ILE 283 Cb 0.17 0.00 0.06 0.00 -0.75 0.00 0.00 39.64 39.12 2qj0 n ILE 283 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 2qj0 h SER 284 N 0.00 0.66 0.17 4.38 0.02 -1.59 0.26 113.55 117.45 2qj0 h SER 284 Ca 0.00 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2qj0 h SER 284 Cb 0.00 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 2qj0 h SER 284 CO 0.00 0.46 -0.23 0.22 -1.14 0.00 0.00 176.83 176.14 2qj0 h TYR 285 N 0.79 -0.61 -0.47 3.45 3.20 -1.56 -0.87 116.97 120.89 2qj0 h TYR 285 Ca 0.26 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 62.05 2qj0 h TYR 285 Cb 0.01 0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 2qj0 h TYR 285 CO -0.05 -0.33 -0.03 0.74 -1.64 0.00 0.00 178.16 176.85 2qj0 h PHE 286 N -0.46 0.87 0.16 -3.82 0.04 -1.77 -2.51 116.94 109.44 2qj0 h PHE 286 Ca 0.01 -0.13 -0.01 0.00 2.80 0.00 0.00 57.97 60.64 2qj0 h PHE 286 Cb 0.45 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.37 2qj0 h PHE 286 CO -0.19 0.82 -0.08 0.00 -0.60 0.00 0.00 178.31 178.26 2qj0 h ALA 287 N 1.22 -0.22 -0.84 2.45 0.00 -0.22 -2.17 119.26 119.48 2qj0 h ALA 287 Ca 0.14 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.05 2qj0 h ALA 287 Cb 0.50 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 2qj0 h ALA 287 CO 0.03 -0.62 0.53 1.25 0.00 0.00 0.00 179.25 180.44 2qj0 h HIS 288 N -0.22 1.00 -0.30 0.00 -0.00 -1.06 0.32 115.15 114.89 2qj0 h HIS 288 Ca -0.02 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.39 2qj0 h HIS 288 Cb 0.17 -0.33 -0.02 0.00 -0.00 0.00 0.00 27.41 27.24 2qj0 h HIS 288 CO -0.07 0.55 0.17 0.82 -0.00 0.00 0.00 177.93 179.40 2qj0 h ILE 289 N 1.01 1.03 0.41 6.26 2.04 -1.25 -2.71 117.51 124.31 2qj0 h ILE 289 Ca 0.35 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 66.07 2qj0 h ILE 289 Cb 0.07 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 2qj0 h ILE 289 CO -0.14 0.07 -0.20 0.00 0.00 0.00 0.00 178.15 177.88 2qj0 h ALA 290 N 1.13 -0.56 -0.93 1.87 0.00 -0.83 -3.06 119.26 116.89 2qj0 h ALA 290 Ca 0.12 -0.18 0.27 0.00 0.00 0.00 0.00 54.91 55.12 2qj0 h ALA 290 Cb -0.00 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2qj0 h ALA 290 CO -0.05 -0.69 0.97 -0.91 0.00 0.00 0.00 179.25 178.56 2qj0 h ASN 291 N -0.80 0.00 -0.35 0.00 2.35 -0.26 0.21 115.58 116.72 2qj0 h ASN 291 Ca -0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 2qj0 h ASN 291 Cb 0.54 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.91 2qj0 h ASN 291 CO 0.09 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 176.16 2qj0 n LYS 292 N -3.52 2.93 -0.19 0.81 4.01 -1.03 -4.52 118.16 116.65 2qj0 n LYS 292 Ca 0.20 -2.30 0.09 0.00 -0.51 0.00 0.00 58.31 55.79 2qj0 n LYS 292 Cb 1.27 -1.45 0.16 0.00 -0.51 0.00 0.00 35.03 34.49 2qj0 n LYS 292 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2qj0 n ASN 293 N 0.32 2.23 -0.35 4.39 4.13 0.73 -4.79 115.26 121.91 2qj0 n ASN 293 Ca 0.15 -3.27 0.02 0.00 1.68 0.00 0.00 54.58 53.15 2qj0 n ASN 293 Cb 0.57 -0.45 0.18 0.00 -1.54 0.00 0.00 39.78 38.53 2qj0 n ASN 293 CO 0.00 0.00 0.00 0.45 0.28 0.00 0.00 177.26 177.99 2qj0 h HIS 294 N 0.24 1.17 0.00 3.10 3.86 -1.79 -1.35 115.15 120.37 2qj0 h HIS 294 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2qj0 h HIS 294 Cb 1.01 -0.39 0.00 0.00 1.06 0.00 0.00 27.41 29.09 2qj0 h HIS 294 CO 0.18 0.65 0.00 1.28 0.86 0.00 0.00 177.93 180.90 2qj0 n LEU 295 N -4.46 0.00 0.28 2.43 4.77 -1.26 -1.03 117.00 117.74 2qj0 n LEU 295 Ca 0.14 0.11 0.17 0.00 -0.03 0.00 0.00 56.01 56.40 2qj0 n LEU 295 Cb 0.13 -0.11 0.80 0.00 -2.33 0.00 0.00 43.42 41.91 2qj0 n LEU 295 CO 0.34 -0.10 1.02 0.03 -1.33 0.00 0.00 177.39 177.35 2qj0 h ARG 296 N 0.00 0.00 -0.57 3.23 3.08 -1.56 -1.77 114.38 116.79 2qj0 h ARG 296 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qj0 h ARG 296 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 2qj0 h ARG 296 CO 0.00 0.05 0.00 -2.13 -1.07 0.00 0.00 179.97 176.82 2qj0 n ARG 297 N -3.23 2.81 -1.50 0.04 3.00 -0.20 -4.61 116.66 112.96 2qj0 n ARG 297 Ca -0.01 -2.41 -0.29 0.00 -0.00 0.00 0.00 57.85 55.14 2qj0 n ARG 297 Cb 0.25 -1.45 0.12 0.00 0.00 0.00 0.00 32.46 31.38 2qj0 n ARG 297 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2qj0 s ALA 298 N -1.02 1.89 0.17 5.13 0.00 -0.67 -4.99 121.76 122.29 2qj0 s ALA 298 Ca 0.38 -0.37 -0.10 0.00 0.00 0.00 0.00 51.96 51.87 2qj0 s ALA 298 Cb 0.20 -3.07 0.05 0.00 0.00 0.00 0.00 23.12 20.29 2qj0 s ALA 298 CO 0.26 -2.11 1.62 -0.44 0.00 0.00 0.00 175.76 175.08 2qj0 h ASP 299 N -1.37 1.03 -2.45 0.00 3.32 -1.94 -3.33 116.42 111.68 2qj0 h ASP 299 Ca -0.49 -0.33 -0.59 0.00 0.02 0.00 0.00 57.03 55.64 2qj0 h ASP 299 Cb 1.31 -0.28 -0.40 0.00 0.22 0.00 0.00 39.33 40.18 2qj0 h ASP 299 CO 0.60 1.11 -0.85 1.41 -1.72 0.00 0.00 179.24 179.80 2qj0 n HIS 300 N -4.18 0.90 -1.69 4.55 8.25 -1.26 -5.11 115.22 116.69 2qj0 n HIS 300 Ca 0.02 -3.74 -0.43 0.00 -0.26 0.00 0.00 57.72 53.31 2qj0 n HIS 300 Cb 0.37 -0.21 -0.01 0.00 1.12 0.00 0.00 29.99 31.26 2qj0 n HIS 300 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2qj0 n PRO 301 N 2.03 2.05 -1.66 -0.41 -0.02 -1.25 -4.86 135.00 130.87 2qj0 n PRO 301 Ca 0.26 0.72 -0.40 0.00 -2.02 0.00 0.00 63.50 62.05 2qj0 n PRO 301 Cb 0.45 -2.30 -0.01 0.00 -0.02 0.00 0.00 33.50 31.62 2qj0 n PRO 301 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2qj0 n PRO 302 N 0.81 3.61 -0.25 0.52 -0.04 -1.26 -4.85 135.00 133.53 2qj0 n PRO 302 Ca 0.06 -2.68 -0.02 0.00 -0.04 0.00 0.00 63.50 60.82 2qj0 n PRO 302 Cb 0.35 -2.92 0.00 0.00 -0.04 0.00 0.00 33.50 30.89 2qj0 n PRO 302 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2qj0 n PHE 303 N 4.00 -0.06 0.68 0.54 3.72 -1.26 0.66 117.46 125.74 2qj0 n PHE 303 Ca 0.64 0.78 0.06 0.00 -0.05 0.00 0.00 57.45 58.88 2qj0 n PHE 303 Cb 0.29 -0.69 0.33 0.00 -0.94 0.00 0.00 39.48 38.47 2qj0 n PHE 303 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2qj0 n LYS 304 N -4.90 0.33 -0.16 -1.08 5.02 -1.26 -1.31 118.16 114.81 2qj0 n LYS 304 Ca 0.05 0.02 0.05 0.00 -2.02 0.00 0.00 58.31 56.40 2qj0 n LYS 304 Cb 0.23 -1.50 0.12 0.00 -0.02 0.00 0.00 35.03 33.86 2qj0 n LYS 304 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2qj0 n GLU 305 N -1.03 2.80 -4.29 1.97 -0.58 0.21 -4.76 120.64 114.98 2qj0 n GLU 305 Ca 0.08 -2.04 -0.16 0.00 -0.42 0.00 0.00 57.16 54.62 2qj0 n GLU 305 Cb 0.04 -1.29 -0.10 0.00 -0.57 0.00 0.00 31.44 29.52 2qj0 n GLU 305 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2qj0 s LEU 306 N -1.38 2.44 0.66 -4.62 1.43 -0.43 -4.19 118.68 112.58 2qj0 s LEU 306 Ca 0.20 -1.07 -0.16 0.00 -1.03 0.00 0.00 54.13 52.06 2qj0 s LEU 306 Cb 0.13 -0.38 -0.00 0.00 0.03 0.00 0.00 46.19 45.97 2qj0 s LEU 306 CO 0.09 -0.36 1.17 -0.44 0.23 0.00 0.00 176.35 177.05 2qj0 s SER 307 N -3.23 4.84 0.62 2.29 0.01 -1.15 -4.30 113.70 112.78 2qj0 s SER 307 Ca 0.21 2.25 -0.16 0.00 1.31 0.00 0.00 55.95 59.56 2qj0 s SER 307 Cb 0.03 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.66 2qj0 s SER 307 CO 0.04 -1.82 1.11 -0.94 0.41 0.00 0.00 173.24 172.04 2qj0 s SER 308 N -2.04 5.36 0.38 2.44 1.04 -1.26 -4.94 113.70 114.69 2qj0 s SER 308 Ca 0.73 2.03 0.08 0.00 0.48 0.00 0.00 55.95 59.27 2qj0 s SER 308 Cb -0.27 -2.56 0.77 0.00 0.10 0.00 0.00 66.02 64.07 2qj0 s SER 308 CO 0.39 -1.46 1.94 0.78 0.98 0.00 0.00 173.24 175.87 2qj0 h ASN 309 N 0.42 0.32 0.09 7.02 2.35 -1.94 -2.54 115.58 121.30 2qj0 h ASN 309 Ca -0.48 -0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.22 2qj0 h ASN 309 Cb 1.25 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.54 2qj0 h ASN 309 CO 0.55 0.40 -0.04 1.23 -1.65 0.00 0.00 177.43 177.92 2qj0 h GLY 310 N 0.69 -0.13 -0.13 2.83 0.00 -1.90 0.42 103.07 104.85 2qj0 h GLY 310 Ca 0.07 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2qj0 h GLY 310 CO 0.01 -0.05 0.00 0.33 0.00 0.00 0.00 176.54 176.83 2qj0 n PHE 311 N -5.06 0.00 0.00 5.60 7.35 -0.96 -1.08 117.46 123.31 2qj0 n PHE 311 Ca -0.08 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.61 2qj0 n PHE 311 Cb 0.15 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.98 2qj0 n PHE 311 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 2qj0 n SER 313 N -0.29 0.00 -0.01 -2.13 7.64 0.14 -2.27 113.62 116.69 2qj0 n SER 313 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.75 2qj0 n SER 313 Cb 0.00 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.11 2qj0 n SER 313 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 2qj0 h ASN 314 N 0.00 0.06 -0.67 6.43 2.35 -1.33 -2.27 115.58 120.16 2qj0 h ASN 314 Ca 0.00 -0.37 0.15 0.00 -0.55 0.00 0.00 56.30 55.53 2qj0 h ASN 314 Cb 0.00 -0.02 -0.04 0.00 0.05 0.00 0.00 38.32 38.31 2qj0 h ASN 314 CO 0.00 0.42 0.46 0.40 -1.65 0.00 0.00 177.43 177.05 2qj0 h ILE 315 N -0.29 0.77 0.28 2.81 2.04 -1.71 0.22 117.51 121.63 2qj0 h ILE 315 Ca 0.01 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 2qj0 h ILE 315 Cb 0.39 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 2qj0 h ILE 315 CO 0.00 0.05 -0.13 0.74 0.00 0.00 0.00 178.15 178.81 2qj0 h THR 316 N 0.25 0.74 -0.87 -0.27 2.02 -1.76 -1.02 112.91 112.00 2qj0 h THR 316 Ca 0.32 -0.62 0.16 0.00 0.77 0.00 0.00 66.41 67.05 2qj0 h THR 316 Cb 0.91 1.07 -0.07 0.00 -1.74 0.00 0.00 68.15 68.32 2qj0 h THR 316 CO -0.07 0.12 0.57 -0.07 0.37 0.00 0.00 175.52 176.44 2qj0 h LEU 317 N -0.72 0.52 0.62 2.58 -0.00 -0.65 0.92 115.31 118.58 2qj0 h LEU 317 Ca -0.04 0.04 -0.03 0.00 -0.00 0.00 0.00 57.88 57.85 2qj0 h LEU 317 Cb 0.49 -0.06 0.01 0.00 -0.00 0.00 0.00 40.66 41.09 2qj0 h LEU 317 CO 0.06 0.25 -0.30 -0.07 -0.00 0.00 0.00 178.44 178.38 2qj0 h LEU 318 N 0.54 -0.70 -1.78 1.67 4.07 -0.80 -2.63 115.31 115.68 2qj0 h LEU 318 Ca 0.44 -0.02 0.11 0.00 0.08 0.00 0.00 57.88 58.49 2qj0 h LEU 318 Cb 0.89 0.18 -0.03 0.00 1.08 0.00 0.00 40.66 42.78 2qj0 h LEU 318 CO -0.18 -0.34 0.37 -0.07 -1.08 0.00 0.00 178.44 177.13 2qj0 h LEU 319 N -1.10 0.22 -1.87 1.67 4.07 -0.57 0.36 115.31 118.10 2qj0 h LEU 319 Ca -0.08 0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.86 2qj0 h LEU 319 Cb 0.68 -0.04 -0.00 0.00 1.08 0.00 0.00 40.66 42.38 2qj0 h LEU 319 CO 0.14 0.13 -0.10 0.58 -1.08 0.00 0.00 178.44 178.11 2qj0 h VAL 320 N 0.25 0.39 0.10 1.22 2.07 -0.70 -2.68 116.25 116.89 2qj0 h VAL 320 Ca 0.25 -0.54 -0.32 0.00 0.82 0.00 0.00 66.70 66.92 2qj0 h VAL 320 Cb 0.67 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 2qj0 h VAL 320 CO -0.05 0.09 -1.66 0.03 0.02 0.00 0.00 177.57 176.00 2qj0 h ARG 321 N 0.00 0.22 0.00 1.57 3.08 0.07 -2.65 114.38 116.67 2qj0 h ARG 321 Ca -0.00 -0.38 0.00 0.00 0.07 0.00 0.00 59.98 59.67 2qj0 h ARG 321 Cb 0.38 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2qj0 h ARG 321 CO 0.01 1.05 0.00 1.19 -1.07 0.00 0.00 179.97 181.15 2qj0 n PHE 322 N -3.40 0.00 -0.07 3.04 3.01 -0.86 -2.68 117.46 116.49 2qj0 n PHE 322 Ca -0.20 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.21 2qj0 n PHE 322 Cb 1.05 -0.45 -0.14 0.00 -0.01 0.00 0.00 39.48 39.93 2qj0 n PHE 322 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2qj0 n SER 323 N -1.45 0.79 -0.32 4.37 7.64 -1.03 -4.58 113.62 119.03 2qj0 n SER 323 Ca 0.05 0.00 0.31 0.00 1.01 0.00 0.00 58.87 60.23 2qj0 n SER 323 Cb 0.17 1.10 0.57 0.00 -1.01 0.00 0.00 64.21 65.04 2qj0 n SER 323 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 2qj0 h GLN 324 N 0.00 0.05 -0.39 1.43 4.15 -1.25 -1.74 115.11 117.36 2qj0 h GLN 324 Ca -0.37 -0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.06 2qj0 h GLN 324 Cb 1.82 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 29.47 2qj0 h GLN 324 CO 0.02 0.03 0.22 -1.35 -1.93 0.00 0.00 178.83 175.83 2qj0 h PRO 325 N 0.05 0.44 -0.06 -2.39 0.11 -1.81 -3.15 132.00 125.19 2qj0 h PRO 325 Ca 0.83 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 66.78 2qj0 h PRO 325 Cb 2.16 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 33.16 2qj0 h PRO 325 CO -0.75 0.29 -0.58 0.74 -0.21 0.00 0.00 178.00 177.50 2qj0 h PHE 326 N 0.45 0.24 -0.89 0.65 0.04 -1.63 -3.32 116.94 112.48 2qj0 h PHE 326 Ca 0.16 -0.09 -0.59 0.00 2.80 0.00 0.00 57.97 60.25 2qj0 h PHE 326 Cb 0.02 -0.04 -0.30 0.00 2.20 0.00 0.00 35.95 37.82 2qj0 h PHE 326 CO -0.08 0.72 0.43 1.28 -0.60 0.00 0.00 178.31 180.06 2qj0 n LEU 327 N -3.88 6.72 -4.87 1.54 4.32 -1.18 -3.81 117.00 115.83 2qj0 n LEU 327 Ca -0.02 -4.24 -0.31 0.00 -0.02 0.00 0.00 56.01 51.42 2qj0 n LEU 327 Cb 0.59 -0.80 0.01 0.00 -1.62 0.00 0.00 43.42 41.60 2qj0 n LEU 327 CO 0.44 1.52 0.71 1.51 -1.22 0.00 0.00 177.39 180.35 2qj0 s ASP 328 N -2.17 6.21 0.33 -1.43 3.84 -1.20 -4.69 116.67 117.57 2qj0 s ASP 328 Ca 0.59 1.40 0.14 0.00 -0.00 0.00 0.00 52.55 54.68 2qj0 s ASP 328 Cb 0.48 -2.45 0.76 0.00 -1.38 0.00 0.00 42.92 40.33 2qj0 s ASP 328 CO 0.02 -0.87 1.34 0.16 -0.00 0.00 0.00 175.17 175.81 2qj0 h ILE 329 N -0.31 0.00 0.00 2.11 3.07 -1.94 0.25 117.51 120.69 2qj0 h ILE 329 Ca -0.44 0.00 -0.05 0.00 1.55 0.00 0.00 64.86 65.92 2qj0 h ILE 329 Cb 1.19 0.31 -0.01 0.00 -0.27 0.00 0.00 36.82 38.05 2qj0 h ILE 329 CO 0.62 0.00 -0.25 0.77 -1.05 0.00 0.00 178.15 178.24 2qj0 h SER 330 N 0.00 0.00 -1.03 2.16 4.64 -1.95 -3.46 113.55 113.90 2qj0 h SER 330 Ca 0.00 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.08 2qj0 h SER 330 Cb 0.57 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.56 2qj0 h SER 330 CO 0.00 0.25 -0.22 -1.22 -0.87 0.00 0.00 176.83 174.77 2qj0 n TYR 331 N -3.18 -0.24 -0.21 4.77 4.01 0.07 -4.83 117.16 117.55 2qj0 n TYR 331 Ca 0.03 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.73 2qj0 n TYR 331 Cb 0.61 -2.50 0.14 0.00 -0.31 0.00 0.00 39.34 37.27 2qj0 n TYR 331 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 2qj0 h LYS 332 N 0.00 1.01 -0.01 -0.72 1.57 -1.85 -2.90 116.57 113.68 2qj0 h LYS 332 Ca -0.24 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 2qj0 h LYS 332 Cb 0.91 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.05 2qj0 h LYS 332 CO 0.35 0.85 -0.04 1.63 -0.57 0.00 0.00 179.45 181.67 2qj0 n LYS 333 N -4.28 1.25 0.00 3.15 5.02 -1.26 -4.35 118.16 117.68 2qj0 n LYS 333 Ca 0.06 -0.53 0.00 0.00 -2.02 0.00 0.00 58.31 55.81 2qj0 n LYS 333 Cb 0.20 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.72 2qj0 n LYS 333 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 2qj0 n ILE 334 N -0.41 0.56 0.20 -0.18 3.06 -1.10 -0.86 119.36 120.63 2qj0 n ILE 334 Ca 0.19 0.22 0.12 0.00 -2.50 0.00 0.00 62.75 60.77 2qj0 n ILE 334 Cb 0.27 -1.22 0.01 0.00 0.54 0.00 0.00 39.64 39.25 2qj0 n ILE 334 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 2qj0 n ASP 335 N -1.04 0.76 0.08 9.51 8.00 -1.26 -3.90 116.55 128.70 2qj0 n ASP 335 Ca 0.00 0.24 0.09 0.00 0.71 0.00 0.00 54.79 55.83 2qj0 n ASP 335 Cb 0.08 0.53 0.40 0.00 -0.02 0.00 0.00 41.12 42.10 2qj0 n ASP 335 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2qj0 n LYS 336 N -2.52 0.11 -3.20 -1.24 4.76 -0.04 -4.42 118.16 111.60 2qj0 n LYS 336 Ca 0.00 0.39 -0.43 0.00 -2.87 0.00 0.00 58.31 55.41 2qj0 n LYS 336 Cb 0.53 -1.72 -0.08 0.00 -1.84 0.00 0.00 35.03 31.92 2qj0 n LYS 336 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2qj0 s ILE 337 N -3.20 4.94 -0.31 -0.18 1.01 -1.25 -4.24 121.20 117.96 2qj0 s ILE 337 Ca 0.04 -0.14 -0.29 0.00 0.00 0.00 0.00 60.65 60.26 2qj0 s ILE 337 Cb 0.08 -4.14 -0.01 0.00 0.01 0.00 0.00 42.46 38.40 2qj0 s ILE 337 CO 0.29 -0.54 1.59 -0.62 0.00 0.00 0.00 174.94 175.66 2qj0 s ASP 338 N 1.98 6.25 0.43 3.58 2.15 -1.26 -4.88 116.67 124.90 2qj0 s ASP 338 Ca 0.17 1.27 0.11 0.00 0.43 0.00 0.00 52.55 54.53 2qj0 s ASP 338 Cb -0.16 -2.53 0.92 0.00 -0.30 0.00 0.00 42.92 40.85 2qj0 s ASP 338 CO 0.16 -1.43 1.99 0.00 -0.17 0.00 0.00 175.17 175.73 2qj0 h ALA 339 N 11.24 1.66 -0.05 3.66 0.00 -1.95 -1.12 119.26 132.70 2qj0 h ALA 339 Ca -0.31 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2qj0 h ALA 339 Cb 1.14 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2qj0 h ALA 339 CO 1.04 0.25 0.00 0.09 0.00 0.00 0.00 179.25 180.63 2qj0 n ASN 340 N -4.36 0.47 -0.33 0.00 3.02 -1.26 -4.35 115.26 108.45 2qj0 n ASN 340 Ca -0.01 -2.01 0.23 0.00 -0.03 0.00 0.00 54.58 52.76 2qj0 n ASN 340 Cb 0.20 -0.12 0.43 0.00 -0.61 0.00 0.00 39.78 39.68 2qj0 n ASN 340 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qj0 n TYR 341 N -0.28 0.88 1.39 3.10 9.36 -0.42 0.11 117.16 131.29 2qj0 n TYR 341 Ca 0.02 1.17 0.09 0.00 3.32 0.00 0.00 57.90 62.49 2qj0 n TYR 341 Cb 0.09 -1.39 0.36 0.00 -0.63 0.00 0.00 39.34 37.77 2qj0 n TYR 341 CO 0.00 0.00 0.00 1.19 0.22 0.00 0.00 176.86 178.27 2qj0 n PHE 342 N -5.34 0.19 -0.01 2.98 3.72 -1.26 -4.20 117.46 113.54 2qj0 n PHE 342 Ca 0.30 -0.09 -0.02 0.00 -0.05 0.00 0.00 57.45 57.58 2qj0 n PHE 342 Cb 1.01 0.00 0.23 0.00 -0.94 0.00 0.00 39.48 39.77 2qj0 n PHE 342 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 2qj0 h ASN 343 N 1.58 0.52 -1.98 4.37 4.21 0.39 -3.44 115.58 121.23 2qj0 h ASN 343 Ca 0.00 -0.14 -0.56 0.00 1.21 0.00 0.00 56.30 56.81 2qj0 h ASN 343 Cb 0.35 -0.14 -0.09 0.00 -1.12 0.00 0.00 38.32 37.32 2qj0 h ASN 343 CO 0.00 0.68 -0.59 0.20 -1.29 0.00 0.00 177.43 176.43 2qj0 s ASN 344 N -6.76 4.49 0.30 5.81 0.01 -1.26 -4.40 114.94 113.12 2qj0 s ASN 344 Ca -0.07 -0.81 -0.29 0.00 -0.71 0.00 0.00 52.86 50.98 2qj0 s ASN 344 Cb 0.14 -0.70 -0.13 0.00 0.41 0.00 0.00 41.25 40.98 2qj0 s ASN 344 CO 0.78 -0.20 1.24 -2.65 -1.51 0.00 0.00 177.10 174.76 2qj0 n PRO 345 N -1.02 1.86 -1.71 -0.60 -0.02 -1.26 -4.91 135.00 127.34 2qj0 n PRO 345 Ca -0.04 0.66 -0.33 0.00 -2.02 0.00 0.00 63.50 61.76 2qj0 n PRO 345 Cb 0.61 -2.19 0.05 0.00 -0.02 0.00 0.00 33.50 31.95 2qj0 n PRO 345 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2qj0 s SER 346 N -0.23 4.98 -0.01 2.55 0.15 -1.26 -4.97 113.70 114.90 2qj0 s SER 346 Ca 0.60 2.05 0.10 0.00 0.70 0.00 0.00 55.95 59.40 2qj0 s SER 346 Cb -0.63 -2.56 -0.13 0.00 -1.71 0.00 0.00 66.02 60.99 2qj0 s SER 346 CO 0.59 -1.72 0.36 0.18 1.20 0.00 0.00 173.24 173.85 2qj0 n LEU 347 N -2.46 0.31 0.00 3.45 4.77 -1.26 -4.93 117.00 116.88 2qj0 n LEU 347 Ca 0.11 -0.31 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 2qj0 n LEU 347 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2qj0 n LEU 347 CO 0.48 0.08 0.00 0.49 -1.33 0.00 0.00 177.39 177.10 2qj0 n PHE 348 N -1.48 0.00 -1.70 -1.77 3.72 -1.26 -5.04 117.46 109.93 2qj0 n PHE 348 Ca 0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 2qj0 n PHE 348 Cb 0.21 0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 38.79 2qj0 n PHE 348 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2qj0 s ILE 349 N -0.37 2.77 -0.68 4.37 1.01 -1.26 -4.83 121.20 122.21 2qj0 s ILE 349 Ca 0.00 0.04 -0.24 0.00 0.00 0.00 0.00 60.65 60.46 2qj0 s ILE 349 Cb 0.00 -3.03 0.06 0.00 0.01 0.00 0.00 42.46 39.50 2qj0 s ILE 349 CO 0.00 -0.00 1.04 -0.62 0.00 0.00 0.00 174.94 175.36 2qj0 s ASP 350 N 3.55 6.18 0.00 3.58 2.15 -1.26 -4.78 116.67 126.08 2qj0 s ASP 350 Ca 0.84 -0.88 0.07 0.00 0.43 0.00 0.00 52.55 53.02 2qj0 s ASP 350 Cb -0.44 -2.45 0.37 0.00 -0.30 0.00 0.00 42.92 40.10 2qj0 s ASP 350 CO 0.39 -1.53 1.25 0.18 -0.17 0.00 0.00 175.17 175.29 2qj0 n LEU 351 N 8.09 0.26 -4.77 -1.34 4.77 -1.26 -4.88 117.00 117.87 2qj0 n LEU 351 Ca -0.02 -0.12 -0.40 0.00 -0.03 0.00 0.00 56.01 55.44 2qj0 n LEU 351 Cb 0.46 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.51 2qj0 n LEU 351 CO 0.66 0.06 0.99 -0.94 -1.33 0.00 0.00 177.39 176.83 2qj0 s SER 352 N -1.19 6.61 -1.33 -1.43 1.04 -1.26 -2.03 113.70 114.11 2qj0 s SER 352 Ca 0.12 2.72 0.00 0.00 0.48 0.00 0.00 55.95 59.26 2qj0 s SER 352 Cb 0.06 -2.65 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2qj0 s SER 352 CO 0.09 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.26 2qj0 n GLY 353 N 0.72 1.33 3.41 7.32 0.00 -1.26 -4.98 105.19 111.74 2qj0 n GLY 353 Ca 0.01 -0.37 -0.40 0.00 0.00 0.00 0.00 46.02 45.26 2qj0 n GLY 353 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qj0 s GLU 354 N -3.01 3.01 0.30 1.61 0.41 -0.86 -5.05 118.70 115.11 2qj0 s GLU 354 Ca 0.00 -0.96 -0.30 0.00 -0.41 0.00 0.00 54.97 53.30 2qj0 s GLU 354 Cb 0.00 -3.73 -0.12 0.00 -1.78 0.00 0.00 34.13 28.50 2qj0 s GLU 354 CO 0.00 -0.63 1.47 2.41 -0.49 0.00 0.00 175.26 178.03 2qj0 n THR 355 N 5.02 1.36 -3.99 3.63 -1.04 -1.26 -4.83 114.28 113.17 2qj0 n THR 355 Ca -0.12 -0.34 -0.22 0.00 -2.04 0.00 0.00 64.05 61.33 2qj0 n THR 355 Cb 0.47 -1.77 -0.03 0.00 -1.82 0.00 0.00 70.33 67.19 2qj0 n THR 355 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2qj0 s ARG 356 N -1.02 3.34 0.15 -2.82 3.00 -1.26 -0.99 118.95 119.34 2qj0 s ARG 356 Ca 0.61 -0.79 -0.28 0.00 0.00 0.00 0.00 55.73 55.28 2qj0 s ARG 356 Cb -0.54 -2.84 -0.02 0.00 0.00 0.00 0.00 34.95 31.54 2qj0 s ARG 356 CO 0.54 0.44 1.57 -0.07 0.00 0.00 0.00 175.30 177.79 2qj0 h LEU 357 N 1.40 -1.43 -5.55 2.53 4.07 -1.12 -3.36 115.31 111.86 2qj0 h LEU 357 Ca -0.51 0.21 -0.39 0.00 0.08 0.00 0.00 57.88 57.27 2qj0 h LEU 357 Cb 1.23 0.61 -0.27 0.00 1.08 0.00 0.00 40.66 43.31 2qj0 h LEU 357 CO 0.62 -0.39 -0.80 -3.20 -1.08 0.00 0.00 178.44 173.59 2qj0 n ASN 358 N -5.42 -1.39 -3.81 -0.43 2.85 -1.06 -1.49 115.26 104.51 2qj0 n ASN 358 Ca -0.02 -2.94 0.03 0.00 -0.11 0.00 0.00 54.58 51.54 2qj0 n ASN 358 Cb 0.35 0.55 0.01 0.00 1.24 0.00 0.00 39.78 41.94 2qj0 n ASN 358 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 2qj0 n SER 359 N 1.71 -1.16 -3.66 1.20 3.41 -1.25 -4.76 113.62 109.11 2qj0 n SER 359 Ca 0.16 -1.22 -0.17 0.00 -0.26 0.00 0.00 58.87 57.39 2qj0 n SER 359 Cb 0.57 1.79 -0.09 0.00 -0.26 0.00 0.00 64.21 66.22 2qj0 n SER 359 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2qj0 s ASP 360 N -3.80 1.09 0.14 4.04 3.84 -1.26 -4.33 116.67 116.39 2qj0 s ASP 360 Ca 0.30 -1.61 -0.30 0.00 -0.00 0.00 0.00 52.55 50.93 2qj0 s ASP 360 Cb -0.01 0.50 -0.06 0.00 -1.38 0.00 0.00 42.92 41.97 2qj0 s ASP 360 CO -0.01 -0.99 1.56 -0.26 -0.00 0.00 0.00 175.17 175.47 2qj0 h PHE 361 N 2.31 -1.51 -0.75 2.11 0.04 -1.98 0.28 116.94 117.44 2qj0 h PHE 361 Ca -0.29 0.08 0.12 0.00 2.80 0.00 0.00 57.97 60.68 2qj0 h PHE 361 Cb 1.24 0.72 -0.09 0.00 2.20 0.00 0.00 35.95 40.02 2qj0 h PHE 361 CO 1.21 -0.47 0.33 0.87 -0.60 0.00 0.00 178.31 179.64 2qj0 h LYS 362 N -0.37 0.50 -0.40 1.51 1.57 -1.98 0.28 116.57 117.68 2qj0 h LYS 362 Ca 0.10 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 2qj0 h LYS 362 Cb 0.60 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 2qj0 h LYS 362 CO -0.59 0.33 -0.02 0.93 -0.57 0.00 0.00 179.45 179.52 2qj0 h GLU 363 N 0.51 0.72 -0.25 3.15 5.08 -1.60 -0.48 114.58 121.72 2qj0 h GLU 363 Ca 0.40 -0.24 -0.07 0.00 -1.00 0.00 0.00 59.36 58.44 2qj0 h GLU 363 Cb 0.54 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2qj0 h GLU 363 CO -0.35 0.82 -0.12 0.00 -1.00 0.00 0.00 179.01 178.37 2qj0 h ALA 364 N 0.87 0.36 -0.84 3.43 0.00 0.12 0.68 119.26 123.88 2qj0 h ALA 364 Ca 0.11 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 2qj0 h ALA 364 Cb 0.51 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 2qj0 h ALA 364 CO 0.03 0.22 0.42 0.22 0.00 0.00 0.00 179.25 180.13 2qj0 h ASP 365 N 0.26 1.09 -0.27 0.00 1.82 -0.46 -2.16 116.42 116.70 2qj0 h ASP 365 Ca 0.06 -0.13 -0.11 0.00 -0.39 0.00 0.00 57.03 56.46 2qj0 h ASP 365 Cb 0.62 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 40.34 2qj0 h ASP 365 CO 0.04 0.91 -0.22 0.00 -1.61 0.00 0.00 179.24 178.35 2qj0 h ALA 366 N 1.22 0.91 0.00 -0.78 0.00 -0.97 -2.36 119.26 117.28 2qj0 h ALA 366 Ca 0.29 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2qj0 h ALA 366 Cb 0.10 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2qj0 h ALA 366 CO -0.04 0.62 0.00 0.35 0.00 0.00 0.00 179.25 180.18 2qj0 h PHE 367 N 0.65 0.00 -0.19 0.00 3.04 -0.25 -1.81 116.94 118.37 2qj0 h PHE 367 Ca 0.09 0.00 -0.18 0.00 3.98 0.00 0.00 57.97 61.86 2qj0 h PHE 367 Cb 0.72 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.24 2qj0 h PHE 367 CO 0.04 0.00 -0.57 1.88 -2.02 0.00 0.00 178.31 177.63 2qj0 h TYR 368 N 0.00 0.94 -0.54 0.41 0.99 -0.88 -3.23 116.97 114.66 2qj0 h TYR 368 Ca 0.00 -0.38 -0.05 0.00 2.00 0.00 0.00 58.73 60.30 2qj0 h TYR 368 Cb 0.33 -0.16 -0.02 0.00 1.00 0.00 0.00 36.73 37.87 2qj0 h TYR 368 CO 0.00 1.18 0.13 -0.44 -0.00 0.00 0.00 178.16 179.04 2qj0 h ASP 369 N 0.43 0.82 0.00 3.88 5.19 -1.32 -1.68 116.42 123.75 2qj0 h ASP 369 Ca -0.02 -0.23 0.00 0.00 -0.62 0.00 0.00 57.03 56.16 2qj0 h ASP 369 Cb 1.19 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 40.49 2qj0 h ASP 369 CO 0.12 0.84 0.00 1.17 -3.12 0.00 0.00 179.24 178.25 2qj0 n LYS 370 N -4.41 0.24 -1.94 3.56 4.81 -1.01 -1.55 118.16 117.85 2qj0 n LYS 370 Ca 0.02 0.00 0.01 0.00 -0.87 0.00 0.00 58.31 57.47 2qj0 n LYS 370 Cb 0.23 -1.11 0.05 0.00 0.02 0.00 0.00 35.03 34.22 2qj0 n LYS 370 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2qj0 n ASN 371 N -0.61 1.54 -0.03 3.14 3.02 -0.63 -4.89 115.26 116.80 2qj0 n ASN 371 Ca 0.01 -2.30 -0.11 0.00 -0.03 0.00 0.00 54.58 52.15 2qj0 n ASN 371 Cb 0.01 -0.39 -0.05 0.00 -0.61 0.00 0.00 39.78 38.74 2qj0 n ASN 371 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2qj0 h ARG 372 N 1.67 0.22 -0.30 3.52 3.08 -1.31 -3.19 114.38 118.06 2qj0 h ARG 372 Ca -0.14 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.89 2qj0 h ARG 372 Cb 1.56 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.57 2qj0 h ARG 372 CO 0.17 0.25 0.00 1.63 -1.07 0.00 0.00 179.97 180.94 2qj0 n LYS 373 N -4.92 0.32 -4.46 0.04 4.76 -1.26 -4.74 118.16 107.90 2qj0 n LYS 373 Ca -0.04 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.16 2qj0 n LYS 373 Cb 0.08 -1.15 -0.10 0.00 -1.84 0.00 0.00 35.03 32.02 2qj0 n LYS 373 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2qj0 s THR 374 N -1.06 2.24 0.09 -0.18 -4.23 -1.21 -5.10 115.64 106.19 2qj0 s THR 374 Ca 0.00 -2.31 -0.31 0.00 -1.18 0.00 0.00 61.69 57.89 2qj0 s THR 374 Cb 0.00 -2.33 -0.07 0.00 1.34 0.00 0.00 72.50 71.44 2qj0 s THR 374 CO 0.00 -0.39 1.27 0.00 -0.54 0.00 0.00 174.62 174.96 2qj0 s ALA 375 N -2.65 3.47 -0.00 3.99 0.00 -1.26 -4.96 121.76 120.35 2qj0 s ALA 375 Ca 0.29 0.95 -0.24 0.00 0.00 0.00 0.00 51.96 52.97 2qj0 s ALA 375 Cb -0.02 -3.48 -0.16 0.00 0.00 0.00 0.00 23.12 19.47 2qj0 s ALA 375 CO 0.14 -0.50 1.11 -0.44 0.00 0.00 0.00 175.76 176.07 2qj0 h ASP 376 N 6.71 -0.39 -3.08 0.00 3.32 -1.95 -3.40 116.42 117.62 2qj0 h ASP 376 Ca -0.42 -0.16 -0.75 0.00 0.02 0.00 0.00 57.03 55.72 2qj0 h ASP 376 Cb 1.21 0.10 -0.23 0.00 0.22 0.00 0.00 39.33 40.63 2qj0 h ASP 376 CO 0.83 0.01 -0.16 -0.94 -1.72 0.00 0.00 179.24 177.26 2qj0 s SER 377 N -5.04 6.21 -0.35 6.45 1.04 -1.26 -4.83 113.70 115.91 2qj0 s SER 377 Ca -0.13 -1.76 0.15 0.00 0.48 0.00 0.00 55.95 54.68 2qj0 s SER 377 Cb 0.02 -2.22 0.42 0.00 0.10 0.00 0.00 66.02 64.34 2qj0 s SER 377 CO 0.49 -0.89 1.00 0.29 0.98 0.00 0.00 173.24 175.11 2qj0 n LYS 378 N 5.39 1.12 -0.66 4.02 5.02 -1.26 -5.07 118.16 126.71 2qj0 n LYS 378 Ca -0.12 -2.94 -0.34 0.00 -2.02 0.00 0.00 58.31 52.89 2qj0 n LYS 378 Cb 0.41 -1.08 -0.09 0.00 -0.02 0.00 0.00 35.03 34.25 2qj0 n LYS 378 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2qj0 n PRO 379 N -0.09 0.00 -1.66 1.97 -0.04 -1.26 -4.91 135.00 129.02 2qj0 n PRO 379 Ca 0.09 -0.82 -0.44 0.00 -0.04 0.00 0.00 63.50 62.29 2qj0 n PRO 379 Cb 0.80 -2.25 -0.03 0.00 -0.04 0.00 0.00 33.50 31.97 2qj0 n PRO 379 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2qj0 n ASN 380 N 8.40 3.98 0.25 3.54 5.15 -1.26 -4.86 115.26 130.45 2qj0 n ASN 380 Ca 0.37 0.89 -0.16 0.00 -0.60 0.00 0.00 54.58 55.07 2qj0 n ASN 380 Cb 0.39 -1.49 -0.08 0.00 -0.53 0.00 0.00 39.78 38.07 2qj0 n ASN 380 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 2qj0 h PHE 381 N 10.51 -0.89 -0.94 1.20 3.57 -1.96 -2.26 116.94 126.17 2qj0 h PHE 381 Ca -0.49 0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.25 2qj0 h PHE 381 Cb 1.25 0.34 -0.18 0.00 2.79 0.00 0.00 35.95 40.15 2qj0 h PHE 381 CO 0.94 -0.49 -0.03 -0.89 -2.23 0.00 0.00 178.31 175.61 2qj0 n ILE 382 N -5.45 -0.39 0.51 1.41 -0.00 -1.26 -0.51 119.36 113.66 2qj0 n ILE 382 Ca -0.10 2.08 0.12 0.00 -0.00 0.00 0.00 62.75 64.84 2qj0 n ILE 382 Cb 0.35 -3.00 0.18 0.00 -0.00 0.00 0.00 39.64 37.18 2qj0 n ILE 382 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.55 177.32 2qj0 h SER 383 N 0.00 0.00 -0.06 4.38 4.64 -1.70 -2.65 113.55 118.16 2qj0 h SER 383 Ca 0.54 -0.15 -0.23 0.00 -0.47 0.00 0.00 61.79 61.48 2qj0 h SER 383 Cb 1.07 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.17 2qj0 h SER 383 CO -0.90 0.08 -0.86 0.44 -0.87 0.00 0.00 176.83 174.72 2qj0 h ASP 384 N 0.00 0.87 -0.13 4.97 3.32 -0.19 -2.74 116.42 122.52 2qj0 h ASP 384 Ca 0.00 -0.69 0.02 0.00 0.02 0.00 0.00 57.03 56.38 2qj0 h ASP 384 Cb 0.78 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 2qj0 h ASP 384 CO 0.00 1.44 -0.02 0.00 -1.72 0.00 0.00 179.24 178.94 2qj0 h PHE 386 N 0.02 -0.91 0.00 0.00 3.57 -1.46 -0.20 116.94 117.96 2qj0 h PHE 386 Ca 0.06 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.52 2qj0 h PHE 386 Cb 0.08 0.36 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 2qj0 h PHE 386 CO -0.15 -0.47 -0.26 0.74 -2.23 0.00 0.00 178.31 175.94 2qj0 h PHE 387 N -0.67 0.00 -0.12 0.41 0.04 -1.44 -2.15 116.94 113.02 2qj0 h PHE 387 Ca -0.01 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.59 2qj0 h PHE 387 Cb 0.63 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.77 2qj0 h PHE 387 CO -0.22 0.26 -0.65 1.25 -0.60 0.00 0.00 178.31 178.34 2qj0 h LEU 388 N 0.00 0.53 -0.41 1.54 6.46 -0.72 -0.61 115.31 122.09 2qj0 h LEU 388 Ca -0.00 -0.32 -0.00 0.00 -0.12 0.00 0.00 57.88 57.44 2qj0 h LEU 388 Cb 0.66 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.41 2qj0 h LEU 388 CO 0.03 1.04 0.25 0.74 -0.62 0.00 0.00 178.44 179.88 2qj0 h THR 389 N 0.33 1.14 -0.46 1.05 2.02 -0.43 0.86 112.91 117.41 2qj0 h THR 389 Ca -0.02 -0.32 -0.05 0.00 0.77 0.00 0.00 66.41 66.80 2qj0 h THR 389 Cb 1.21 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 68.20 2qj0 h THR 389 CO 0.12 0.14 0.11 -0.07 0.37 0.00 0.00 175.52 176.19 2qj0 h LEU 390 N 0.54 0.70 -1.55 2.58 3.38 -1.20 0.28 115.31 120.04 2qj0 h LEU 390 Ca 0.15 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 2qj0 h LEU 390 Cb 0.01 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2qj0 h LEU 390 CO -0.03 0.75 -0.23 0.71 0.09 0.00 0.00 178.44 179.73 2qj0 h THR 391 N 0.62 0.93 0.07 0.22 1.35 -0.61 -2.30 112.91 113.19 2qj0 h THR 391 Ca 0.15 -0.87 -0.25 0.00 -0.55 0.00 0.00 66.41 64.89 2qj0 h THR 391 Cb 0.32 1.50 -0.00 0.00 -1.73 0.00 0.00 68.15 68.25 2qj0 h THR 391 CO 0.00 0.23 -1.09 1.88 -0.25 0.00 0.00 175.52 176.29 2qj0 h TYR 392 N 0.00 0.46 -0.49 4.73 -1.99 -0.22 -1.89 116.97 117.58 2qj0 h TYR 392 Ca -0.00 -0.30 0.10 0.00 2.00 0.00 0.00 58.73 60.53 2qj0 h TYR 392 Cb 0.48 -0.03 -0.03 0.00 2.00 0.00 0.00 36.73 39.15 2qj0 h TYR 392 CO 0.00 1.18 0.34 1.25 -0.00 0.00 0.00 178.16 180.93 2qj0 h LEU 393 N 0.12 0.20 0.00 3.88 6.46 0.10 0.41 115.31 126.48 2qj0 h LEU 393 Ca -0.10 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.67 2qj0 h LEU 393 Cb 1.78 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 41.67 2qj0 h LEU 393 CO 0.18 0.12 -0.06 -0.74 -0.62 0.00 0.00 178.44 177.32 2qj0 h HIS 394 N 0.22 0.00 0.00 1.25 2.76 -1.43 -0.57 115.15 117.38 2qj0 h HIS 394 Ca 0.23 0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.34 2qj0 h HIS 394 Cb 0.62 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.57 2qj0 h HIS 394 CO -0.00 0.00 -0.29 1.88 -1.30 0.00 0.00 177.93 178.21 2qj0 h TYR 395 N -0.21 0.00 0.00 5.26 0.05 -1.37 -2.05 116.97 118.65 2qj0 h TYR 395 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2qj0 h TYR 395 Cb 0.06 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.80 2qj0 h TYR 395 CO -0.03 0.29 0.00 0.41 -1.05 0.00 0.00 178.16 177.79 2qj0 n GLY 396 N 0.10 0.36 0.36 3.88 0.00 0.14 -3.66 105.19 106.36 2qj0 n GLY 396 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.04 2qj0 n GLY 396 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2qj0 h LEU 397 N 0.00 1.01 -0.87 0.99 3.38 -1.45 -0.85 115.31 117.53 2qj0 h LEU 397 Ca 0.00 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2qj0 h LEU 397 Cb 0.00 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 2qj0 h LEU 397 CO 0.00 0.64 0.31 1.23 0.09 0.00 0.00 178.44 180.71 2qj0 h GLY 398 N 1.15 1.22 1.16 0.83 0.00 -0.40 0.12 103.07 107.14 2qj0 h GLY 398 Ca 0.43 -0.65 -0.09 0.00 0.00 0.00 0.00 47.33 47.02 2qj0 h GLY 398 CO -0.18 0.61 0.02 -1.33 0.00 0.00 0.00 176.54 175.66 2qj0 h GLY 399 N 1.14 1.10 0.63 4.60 0.00 -0.82 -2.22 103.07 107.50 2qj0 h GLY 399 Ca 0.26 -0.78 -0.00 0.00 0.00 0.00 0.00 47.33 46.81 2qj0 h GLY 399 CO -0.02 0.72 -0.02 -0.84 0.00 0.00 0.00 176.54 176.38 2qj0 h THR 400 N 0.93 1.22 -0.54 4.70 2.02 -0.69 -2.52 112.91 118.03 2qj0 h THR 400 Ca 0.17 -0.84 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 2qj0 h THR 400 Cb 0.52 1.77 -0.03 0.00 -1.74 0.00 0.00 68.15 68.68 2qj0 h THR 400 CO 0.03 0.21 0.31 0.17 0.37 0.00 0.00 175.52 176.61 2qj0 h LEU 401 N -0.42 0.65 -0.66 2.58 8.10 -0.96 -1.66 115.31 122.94 2qj0 h LEU 401 Ca -0.01 -0.04 -0.14 0.00 0.11 0.00 0.00 57.88 57.81 2qj0 h LEU 401 Cb 0.38 -0.16 -0.01 0.00 -0.44 0.00 0.00 40.66 40.43 2qj0 h LEU 401 CO 0.01 0.51 -0.48 0.77 -4.11 0.00 0.00 178.44 175.14 2qj0 h SER 402 N 0.74 0.50 -0.95 0.17 4.64 -1.41 -2.23 113.55 115.01 2qj0 h SER 402 Ca 0.19 -0.24 0.08 0.00 -0.47 0.00 0.00 61.79 61.35 2qj0 h SER 402 Cb -0.00 -0.14 -0.07 0.00 -0.31 0.00 0.00 62.40 61.88 2qj0 h SER 402 CO -0.03 0.90 0.62 0.15 -0.87 0.00 0.00 176.83 177.59 2qj0 h PHE 403 N 0.37 1.10 0.03 4.77 3.57 -0.85 -2.72 116.94 123.20 2qj0 h PHE 403 Ca 0.02 0.03 -0.26 0.00 3.53 0.00 0.00 57.97 61.29 2qj0 h PHE 403 Cb 0.98 -0.36 -0.03 0.00 2.79 0.00 0.00 35.95 39.33 2qj0 h PHE 403 CO 0.03 0.53 -1.36 1.05 -2.23 0.00 0.00 178.31 176.33 2qj0 h GLU 404 N 1.04 0.06 -0.72 1.11 -0.00 -1.28 -3.31 114.58 111.48 2qj0 h GLU 404 Ca 0.43 -0.10 0.11 0.00 -0.00 0.00 0.00 59.36 59.80 2qj0 h GLU 404 Cb 0.29 0.04 -0.05 0.00 -0.00 0.00 0.00 28.75 29.03 2qj0 h GLU 404 CO -0.18 0.86 0.48 1.49 -0.00 0.00 0.00 179.01 181.65 2qj0 h GLU 405 N 0.02 0.53 -3.00 1.06 4.57 -1.10 -3.38 114.58 113.28 2qj0 h GLU 405 Ca -0.16 -0.03 -0.68 0.00 -1.18 0.00 0.00 59.36 57.31 2qj0 h GLU 405 Cb 1.91 -0.12 0.01 0.00 -0.16 0.00 0.00 28.75 30.39 2qj0 h GLU 405 CO 0.12 0.35 3.65 1.63 -1.18 0.00 0.00 179.01 183.58 2qj0 n LYS 406 N -4.49 3.79 0.00 1.92 5.02 -1.13 -4.72 118.16 118.55 2qj0 n LYS 406 Ca 0.12 -2.38 0.00 0.00 -2.02 0.00 0.00 58.31 54.03 2qj0 n LYS 406 Cb 0.40 -2.80 0.00 0.00 -0.02 0.00 0.00 35.03 32.61 2qj0 n LYS 406 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qj0 n GLY 408 N 3.36 0.00 0.25 0.72 0.00 -1.26 -2.22 105.19 106.04 2qj0 n GLY 408 Ca 0.76 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.88 2qj0 n GLY 408 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2qj0 h SER 409 N 0.00 0.00 -0.05 1.61 0.87 -1.95 -1.52 113.55 112.51 2qj0 h SER 409 Ca 0.00 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.46 2qj0 h SER 409 Cb 0.00 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 61.97 2qj0 h SER 409 CO 0.00 0.16 -0.34 -0.33 -0.53 0.00 0.00 176.83 175.78 2qj0 h GLU 410 N 0.00 0.32 -0.66 2.24 5.08 -1.84 -2.96 114.58 116.76 2qj0 h GLU 410 Ca -0.00 -0.28 0.01 0.00 -1.00 0.00 0.00 59.36 58.09 2qj0 h GLU 410 Cb 0.40 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 2qj0 h GLU 410 CO 0.02 0.94 0.44 0.82 -1.00 0.00 0.00 179.01 180.22 2qj0 h ILE 411 N -0.20 1.17 -0.18 3.13 2.04 -1.76 -0.53 117.51 121.17 2qj0 h ILE 411 Ca -0.03 -0.31 0.04 0.00 1.00 0.00 0.00 64.86 65.56 2qj0 h ILE 411 Cb 1.02 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 2qj0 h ILE 411 CO 0.07 0.16 -0.04 0.50 0.00 0.00 0.00 178.15 178.84 2qj0 h LYS 412 N 0.89 0.00 -0.82 2.37 3.64 -1.35 -1.03 116.57 120.28 2qj0 h LYS 412 Ca 0.24 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.61 2qj0 h LYS 412 Cb -0.10 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.68 2qj0 h LYS 412 CO -0.05 0.00 0.48 0.00 -2.27 0.00 0.00 179.45 177.61 2qj0 h ALA 413 N 1.18 1.04 -0.16 5.00 0.00 -1.26 -2.47 119.26 122.60 2qj0 h ALA 413 Ca 0.09 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2qj0 h ALA 413 Cb 0.13 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2qj0 h ALA 413 CO -0.19 0.53 0.02 -0.07 0.00 0.00 0.00 179.25 179.54 2qj0 h LEU 414 N 1.13 0.25 -1.27 0.00 3.38 -0.66 -1.05 115.31 117.09 2qj0 h LEU 414 Ca 0.29 -0.27 0.06 0.00 0.09 0.00 0.00 57.88 58.05 2qj0 h LEU 414 Cb -0.01 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.62 2qj0 h LEU 414 CO -0.05 0.46 0.53 0.11 0.09 0.00 0.00 178.44 179.58 2qj0 h LYS 415 N 0.04 0.86 -0.33 1.13 1.57 -1.08 0.67 116.57 119.42 2qj0 h LYS 415 Ca 0.05 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.65 2qj0 h LYS 415 Cb 0.32 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2qj0 h LYS 415 CO 0.00 0.57 -0.27 0.93 -0.57 0.00 0.00 179.45 180.11 2qj0 h GLU 416 N 0.88 0.76 -0.41 3.15 5.08 -1.29 -2.10 114.58 120.64 2qj0 h GLU 416 Ca 0.34 -0.38 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 2qj0 h GLU 416 Cb 0.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2qj0 h GLU 416 CO -0.12 1.00 0.09 0.93 -1.00 0.00 0.00 179.01 179.91 2qj0 h GLU 417 N 0.53 0.67 -0.11 2.33 4.39 -0.11 -2.09 114.58 120.19 2qj0 h GLU 417 Ca 0.06 -0.17 -0.09 0.00 0.34 0.00 0.00 59.36 59.50 2qj0 h GLU 417 Cb 0.84 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.39 2qj0 h GLU 417 CO 0.07 0.70 -0.33 -0.84 -1.16 0.00 0.00 179.01 177.45 2qj0 h ILE 418 N 0.53 1.27 0.00 3.13 3.07 -0.91 -1.91 117.51 122.69 2qj0 h ILE 418 Ca 0.13 -1.30 -0.08 0.00 1.55 0.00 0.00 64.86 65.16 2qj0 h ILE 418 Cb 0.34 1.55 -0.01 0.00 -0.27 0.00 0.00 36.82 38.43 2qj0 h ILE 418 CO 0.00 0.39 -0.37 -0.33 -1.05 0.00 0.00 178.15 176.80 2qj0 h GLU 419 N 0.19 0.00 0.14 0.16 4.39 -1.07 0.15 114.58 118.53 2qj0 h GLU 419 Ca 0.02 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 2qj0 h GLU 419 Cb 0.68 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 2qj0 h GLU 419 CO 0.05 0.37 -0.07 -0.22 -1.16 0.00 0.00 179.01 177.98 2qj0 h LYS 420 N 0.00 -0.18 -0.90 2.33 3.64 -0.85 -3.18 116.57 117.43 2qj0 h LYS 420 Ca -0.00 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.50 2qj0 h LYS 420 Cb 0.68 0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 32.46 2qj0 h LYS 420 CO 0.05 0.26 0.53 0.28 -2.27 0.00 0.00 179.45 178.30 2qj0 h VAL 421 N -0.74 0.90 0.00 2.00 2.07 -1.16 -1.21 116.25 118.11 2qj0 h VAL 421 Ca -0.02 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2qj0 h VAL 421 Cb 0.53 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 2qj0 h VAL 421 CO 0.03 0.16 0.11 0.11 0.02 0.00 0.00 177.57 178.00 2qj0 h LYS 422 N 0.85 0.00 0.00 1.57 1.57 -0.69 -1.69 116.57 118.18 2qj0 h LYS 422 Ca 0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 2qj0 h LYS 422 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2qj0 h LYS 422 CO -0.26 0.00 -0.60 1.63 -0.57 0.00 0.00 179.45 179.65 2qj0 n LYS 423 N -2.85 0.05 -2.20 3.15 5.02 -0.46 -4.91 118.16 115.97 2qj0 n LYS 423 Ca -0.02 0.01 -0.41 0.00 -2.02 0.00 0.00 58.31 55.86 2qj0 n LYS 423 Cb 0.17 -1.52 -0.03 0.00 -0.02 0.00 0.00 35.03 33.63 2qj0 n LYS 423 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2qj0 s ILE 424 N -3.03 3.08 -0.39 -0.18 1.01 -0.64 -4.99 121.20 116.07 2qj0 s ILE 424 Ca 0.10 0.94 -0.08 0.00 0.00 0.00 0.00 60.65 61.60 2qj0 s ILE 424 Cb 0.17 -3.60 0.06 0.00 0.01 0.00 0.00 42.46 39.10 2qj0 s ILE 424 CO 0.72 0.16 0.20 0.00 0.00 0.00 0.00 174.94 176.03 2qj0 s ALA 425 N -0.20 3.21 -0.45 9.38 0.00 -1.26 -5.05 121.76 127.38 2qj0 s ALA 425 Ca 0.55 -2.00 -0.19 0.00 0.00 0.00 0.00 51.96 50.32 2qj0 s ALA 425 Cb -0.37 -2.52 0.03 0.00 0.00 0.00 0.00 23.12 20.26 2qj0 s ALA 425 CO 0.41 -1.53 0.54 0.00 0.00 0.00 0.00 175.76 175.18 2qj0 s ALA 426 N 1.42 3.40 -0.04 0.00 0.00 -1.26 -4.95 121.76 120.33 2qj0 s ALA 426 Ca 0.02 -1.50 -0.16 0.00 0.00 0.00 0.00 51.96 50.32 2qj0 s ALA 426 Cb -0.21 -3.20 -0.09 0.00 0.00 0.00 0.00 23.12 19.61 2qj0 s ALA 426 CO 0.03 -1.75 0.68 -0.91 0.00 0.00 0.00 175.76 173.80 2qj0 h ASN 427 N 8.84 -0.44 -2.81 0.00 2.35 -1.97 -3.41 115.58 118.14 2qj0 h ASN 427 Ca -0.26 -0.03 -0.53 0.00 -0.55 0.00 0.00 56.30 54.93 2qj0 h ASN 427 Cb 1.10 0.11 0.03 0.00 0.05 0.00 0.00 38.32 39.62 2qj0 h ASN 427 CO 0.87 0.00 0.89 -2.28 -1.65 0.00 0.00 177.43 175.26 2qj0 s HIS 428 N -3.39 2.90 0.31 1.19 2.46 -1.26 -4.88 115.29 112.62 2qj0 s HIS 428 Ca -0.09 0.60 0.08 0.00 0.47 0.00 0.00 55.06 56.12 2qj0 s HIS 428 Cb 0.01 -3.89 0.84 0.00 -0.13 0.00 0.00 32.58 29.41 2qj0 s HIS 428 CO 0.27 -3.35 1.73 0.22 -2.47 0.00 0.00 174.74 171.15 2qj0 h ASP 429 N 7.29 0.66 -0.53 9.88 1.82 -1.99 0.29 116.42 133.85 2qj0 h ASP 429 Ca -0.42 0.13 -0.09 0.00 -0.39 0.00 0.00 57.03 56.26 2qj0 h ASP 429 Cb 1.20 0.03 -0.02 0.00 0.68 0.00 0.00 39.33 41.22 2qj0 h ASP 429 CO 0.91 0.12 -0.01 0.58 -1.61 0.00 0.00 179.24 179.24 2qj0 h VAL 430 N 0.60 1.26 -0.09 2.25 2.07 -1.97 -0.82 116.25 119.55 2qj0 h VAL 430 Ca 0.62 -1.11 -0.16 0.00 0.82 0.00 0.00 66.70 66.87 2qj0 h VAL 430 Cb 1.15 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 2qj0 h VAL 430 CO -0.46 0.40 -0.65 0.15 0.02 0.00 0.00 177.57 177.03 2qj0 h PHE 431 N 0.89 0.45 -0.26 1.57 3.57 -1.56 -1.35 116.94 120.26 2qj0 h PHE 431 Ca 0.16 -0.18 -0.12 0.00 3.53 0.00 0.00 57.97 61.36 2qj0 h PHE 431 Cb 0.53 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 2qj0 h PHE 431 CO 0.03 0.90 -0.34 0.00 -2.23 0.00 0.00 178.31 176.67 2qj0 h ALA 432 N 1.06 0.93 -0.09 2.41 0.00 -0.72 -0.69 119.26 122.17 2qj0 h ALA 432 Ca -0.01 -0.40 -0.17 0.00 0.00 0.00 0.00 54.91 54.32 2qj0 h ALA 432 Cb 1.19 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2qj0 h ALA 432 CO 0.11 0.62 -0.68 -0.09 0.00 0.00 0.00 179.25 179.20 2qj0 h ARG 433 N 0.47 0.39 0.08 0.00 2.43 -1.01 -2.84 114.38 113.90 2qj0 h ARG 433 Ca 0.05 -0.30 -0.00 0.00 -0.81 0.00 0.00 59.98 58.92 2qj0 h ARG 433 Cb 0.81 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.42 2qj0 h ARG 433 CO 0.07 0.93 -0.04 0.35 -1.51 0.00 0.00 179.97 179.77 2qj0 h PHE 434 N 0.27 -0.10 -0.58 2.20 3.57 -0.77 -2.45 116.94 119.08 2qj0 h PHE 434 Ca -0.02 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 2qj0 h PHE 434 Cb 1.24 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.99 2qj0 h PHE 434 CO 0.04 0.15 0.32 0.82 -2.23 0.00 0.00 178.31 177.41 2qj0 h ILE 435 N -0.35 1.18 -0.21 1.41 1.08 -1.18 -0.43 117.51 119.01 2qj0 h ILE 435 Ca -0.01 -0.44 -0.09 0.00 -0.39 0.00 0.00 64.86 63.92 2qj0 h ILE 435 Cb 0.30 0.39 -0.01 0.00 -3.07 0.00 0.00 36.82 34.42 2qj0 h ILE 435 CO 0.02 0.19 -0.28 0.74 -0.69 0.00 0.00 178.15 178.14 2qj0 h THR 436 N 0.81 1.27 -0.16 -0.27 2.02 -1.44 0.01 112.91 115.15 2qj0 h THR 436 Ca 0.21 -1.28 -0.10 0.00 0.77 0.00 0.00 66.41 66.00 2qj0 h THR 436 Cb 0.02 1.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 2qj0 h THR 436 CO -0.03 0.40 -0.31 0.00 0.37 0.00 0.00 175.52 175.94 2qj0 h ALA 437 N 1.36 0.25 -0.17 6.16 0.00 -0.88 0.16 119.26 126.14 2qj0 h ALA 437 Ca 0.05 -0.42 0.04 0.00 0.00 0.00 0.00 54.91 54.58 2qj0 h ALA 437 Cb 0.67 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2qj0 h ALA 437 CO 0.05 0.28 -0.06 0.37 0.00 0.00 0.00 179.25 179.89 2qj0 h GLN 438 N 0.11 -0.02 -0.36 0.00 4.15 -0.84 -0.45 115.11 117.69 2qj0 h GLN 438 Ca 0.01 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.42 2qj0 h GLN 438 Cb 0.90 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.58 2qj0 h GLN 438 CO 0.07 -0.01 0.19 1.25 -1.93 0.00 0.00 178.83 178.40 2qj0 h LEU 439 N -0.02 0.45 -0.38 -2.39 5.85 -0.96 -3.03 115.31 114.84 2qj0 h LEU 439 Ca 0.09 -0.09 0.06 0.00 0.84 0.00 0.00 57.88 58.77 2qj0 h LEU 439 Cb 0.16 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.02 2qj0 h LEU 439 CO -0.19 0.42 0.08 -1.28 -0.34 0.00 0.00 178.44 177.13 2qj0 h SER 440 N 0.45 0.03 0.00 1.25 0.87 -0.04 -1.52 113.55 114.59 2qj0 h SER 440 Ca 0.13 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 2qj0 h SER 440 Cb 0.07 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.10 2qj0 h SER 440 CO -0.02 0.05 0.00 1.17 -0.53 0.00 0.00 176.83 177.50 2qj0 n LYS 441 N -5.08 0.15 0.00 2.24 4.81 -0.24 -1.67 118.16 118.37 2qj0 n LYS 441 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 2qj0 n LYS 441 Cb 0.16 -1.39 0.00 0.00 0.02 0.00 0.00 35.03 33.83 2qj0 n LYS 441 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2qj0 n GLU 443 N 0.87 0.00 -0.13 1.64 -0.58 -0.57 -1.86 120.64 120.01 2qj0 n GLU 443 Ca 0.00 0.00 -0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2qj0 n GLU 443 Cb 0.07 0.00 0.26 0.00 -0.57 0.00 0.00 31.44 31.21 2qj0 n GLU 443 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2qj0 h LYS 444 N 0.00 0.82 -0.10 3.49 3.64 -1.59 -0.26 116.57 122.57 2qj0 h LYS 444 Ca 0.00 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 2qj0 h LYS 444 Cb 0.00 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.66 2qj0 h LYS 444 CO 0.00 0.62 -0.00 0.00 -2.27 0.00 0.00 179.45 177.80 2qj0 h ALA 445 N 1.50 0.13 -0.53 5.00 0.00 -1.64 -1.95 119.26 121.78 2qj0 h ALA 445 Ca 0.21 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 55.00 2qj0 h ALA 445 Cb 0.06 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 2qj0 h ALA 445 CO -0.03 -0.18 0.23 1.25 0.00 0.00 0.00 179.25 180.52 2qj0 h LEU 446 N -0.10 0.28 0.11 0.00 5.85 -1.70 -0.74 115.31 119.00 2qj0 h LEU 446 Ca 0.03 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2qj0 h LEU 446 Cb 0.36 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 2qj0 h LEU 446 CO 0.01 0.19 -0.09 0.50 -0.34 0.00 0.00 178.44 178.70 2qj0 h LYS 447 N 0.43 -0.20 -0.86 1.25 3.64 -0.99 -0.69 116.57 119.15 2qj0 h LYS 447 Ca 0.25 0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.79 2qj0 h LYS 447 Cb 0.23 0.05 -0.09 0.00 -0.41 0.00 0.00 32.23 32.00 2qj0 h LYS 447 CO -0.22 -0.14 0.45 1.15 -2.27 0.00 0.00 179.45 178.43 2qj0 h THR 448 N -0.21 0.74 -0.08 1.00 2.02 -0.73 0.32 112.91 115.98 2qj0 h THR 448 Ca 0.00 -0.22 -0.06 0.00 0.77 0.00 0.00 66.41 66.90 2qj0 h THR 448 Cb 0.20 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.65 2qj0 h THR 448 CO -0.02 0.12 -0.18 0.74 0.37 0.00 0.00 175.52 176.55 2qj0 h THR 449 N 0.65 1.41 -0.62 3.16 2.02 -0.62 -1.22 112.91 117.69 2qj0 h THR 449 Ca 0.46 -1.50 -0.04 0.00 0.77 0.00 0.00 66.41 66.10 2qj0 h THR 449 Cb 0.64 2.19 -0.03 0.00 -1.74 0.00 0.00 68.15 69.21 2qj0 h THR 449 CO -0.35 0.43 0.22 -0.33 0.37 0.00 0.00 175.52 175.85 2qj0 h GLU 450 N -0.21 0.92 -0.22 6.66 5.08 -0.82 0.41 114.58 126.40 2qj0 h GLU 450 Ca -0.00 -0.16 -0.04 0.00 -1.00 0.00 0.00 59.36 58.16 2qj0 h GLU 450 Cb 0.78 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 2qj0 h GLU 450 CO 0.04 0.77 -0.02 0.77 -1.00 0.00 0.00 179.01 179.57 2qj0 h SER 451 N 0.90 0.40 -0.79 1.42 0.02 -0.97 -2.62 113.55 111.92 2qj0 h SER 451 Ca 0.21 -0.33 -0.05 0.00 -0.84 0.00 0.00 61.79 60.78 2qj0 h SER 451 Cb 0.22 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 2qj0 h SER 451 CO -0.01 0.64 0.31 0.25 -1.14 0.00 0.00 176.83 176.88 2qj0 h LEU 452 N 0.16 1.09 -0.43 5.07 5.85 -0.74 -1.30 115.31 125.01 2qj0 h LEU 452 Ca 0.06 -0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.65 2qj0 h LEU 452 Cb 0.45 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 2qj0 h LEU 452 CO 0.02 0.97 0.19 -0.09 -0.34 0.00 0.00 178.44 179.18 2qj0 h ARG 453 N 1.15 0.37 -0.20 1.25 2.43 -0.03 0.33 114.38 119.68 2qj0 h ARG 453 Ca 0.26 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.40 2qj0 h ARG 453 Cb 0.22 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 2qj0 h ARG 453 CO -0.02 0.24 0.09 0.74 -1.51 0.00 0.00 179.97 179.51 2qj0 h PHE 454 N 0.38 0.31 -0.01 2.20 0.05 -1.15 0.16 116.94 118.87 2qj0 h PHE 454 Ca 0.19 -0.02 0.03 0.00 3.82 0.00 0.00 57.97 61.99 2qj0 h PHE 454 Cb 0.14 -0.09 -0.04 0.00 2.00 0.00 0.00 35.95 37.96 2qj0 h PHE 454 CO -0.13 0.34 -0.19 0.00 -0.18 0.00 0.00 178.31 178.15 2qj0 h ALA 455 N 0.94 -0.22 -0.74 2.45 0.00 -0.64 -0.05 119.26 121.00 2qj0 h ALA 455 Ca 0.07 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2qj0 h ALA 455 Cb 0.16 0.34 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 2qj0 h ALA 455 CO -0.01 -0.68 0.41 -0.07 0.00 0.00 0.00 179.25 178.90 2qj0 h LEU 456 N -0.30 0.91 -0.77 0.00 3.38 -0.24 -2.25 115.31 116.04 2qj0 h LEU 456 Ca 0.06 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 2qj0 h LEU 456 Cb 0.38 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2qj0 h LEU 456 CO -0.19 0.73 0.27 -0.61 0.09 0.00 0.00 178.44 178.73 2qj0 h GLN 457 N 1.03 1.18 0.00 1.13 4.15 -0.12 -1.26 115.11 121.21 2qj0 h GLN 457 Ca 0.26 -0.24 0.00 0.00 0.77 0.00 0.00 58.65 59.44 2qj0 h GLN 457 Cb 0.02 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.53 2qj0 h GLN 457 CO -0.04 0.98 0.00 0.41 -1.93 0.00 0.00 178.83 178.25 2qj0 n GLY 458 N -0.81 -1.26 0.14 2.39 0.00 -0.08 -2.00 105.19 103.57 2qj0 n GLY 458 Ca 0.07 0.07 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 2qj0 n GLY 458 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2qj0 h PHE 459 N 0.00 0.54 0.00 1.61 3.04 -0.86 -3.15 116.94 118.12 2qj0 h PHE 459 Ca 0.00 -0.40 0.00 0.00 3.98 0.00 0.00 57.97 61.55 2qj0 h PHE 459 Cb 0.36 -0.02 0.00 0.00 2.56 0.00 0.00 35.95 38.85 2qj0 h PHE 459 CO 0.00 1.67 -0.14 1.19 -2.02 0.00 0.00 178.31 179.02 2qj0 n PHE 460 N -3.50 0.87 1.22 0.41 3.01 -0.89 -2.50 117.46 116.09 2qj0 n PHE 460 Ca -0.27 0.25 0.13 0.00 1.01 0.00 0.00 57.45 58.57 2qj0 n PHE 460 Cb 1.06 -0.89 0.38 0.00 -0.01 0.00 0.00 39.48 40.02 2qj0 n PHE 460 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2qj0 n ALA 461 N -1.80 2.52 -2.66 4.37 0.00 -0.85 -4.65 120.51 117.45 2qj0 n ALA 461 Ca 0.05 -0.56 -0.43 0.00 0.00 0.00 0.00 53.44 52.50 2qj0 n ALA 461 Cb 0.43 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 18.82 2qj0 n ALA 461 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2qj0 s HIS 462 N -1.90 2.84 0.07 0.00 5.04 -1.04 -4.86 115.29 115.44 2qj0 s HIS 462 Ca 0.35 -1.43 -0.14 0.00 -1.54 0.00 0.00 55.06 52.30 2qj0 s HIS 462 Cb 0.20 -4.63 -0.03 0.00 0.04 0.00 0.00 32.58 28.16 2qj0 s HIS 462 CO 0.31 -1.76 1.17 -2.13 -2.34 0.00 0.00 174.74 170.00 2qj0 n ARG 463 N 7.96 -0.19 -0.32 2.88 0.00 -1.26 -1.80 116.66 123.92 2qj0 n ARG 463 Ca 0.40 1.16 0.05 0.00 -0.00 0.00 0.00 57.85 59.46 2qj0 n ARG 463 Cb 0.47 -1.72 0.14 0.00 0.00 0.00 0.00 32.46 31.35 2qj0 n ARG 463 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2qj0 h SER 464 N 0.00 -0.79 -0.16 6.15 0.87 -1.95 0.20 113.55 117.86 2qj0 h SER 464 Ca 0.07 0.27 -0.09 0.00 -1.23 0.00 0.00 61.79 60.81 2qj0 h SER 464 Cb 0.18 0.55 -0.00 0.00 -0.44 0.00 0.00 62.40 62.69 2qj0 h SER 464 CO -0.41 -0.30 -0.24 -0.07 -0.53 0.00 0.00 176.83 175.28 2qj0 h LEU 465 N 0.01 0.49 -1.47 2.23 3.38 -1.82 -3.17 115.31 114.95 2qj0 h LEU 465 Ca 0.45 -0.52 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 2qj0 h LEU 465 Cb 0.72 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2qj0 h LEU 465 CO -0.93 0.92 -0.22 1.56 0.09 0.00 0.00 178.44 179.87 2qj0 h GLN 466 N 0.08 0.07 -0.62 1.13 1.08 -0.49 -2.30 115.11 114.06 2qj0 h GLN 466 Ca 0.02 -0.02 -0.05 0.00 -1.45 0.00 0.00 58.65 57.14 2qj0 h GLN 466 Cb 0.81 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.21 2qj0 h GLN 466 CO 0.06 0.29 0.17 1.25 -0.95 0.00 0.00 178.83 179.64 2qj0 h LEU 467 N 0.07 0.89 -1.59 1.46 6.46 -0.63 -1.43 115.31 120.53 2qj0 h LEU 467 Ca 0.01 -0.16 -0.02 0.00 -0.12 0.00 0.00 57.88 57.59 2qj0 h LEU 467 Cb 0.42 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 40.11 2qj0 h LEU 467 CO 0.03 0.85 0.06 -0.33 -0.62 0.00 0.00 178.44 178.43 2qj0 h GLU 468 N 0.92 0.32 0.18 1.25 5.08 -1.41 -1.74 114.58 119.18 2qj0 h GLU 468 Ca 0.20 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2qj0 h GLU 468 Cb 0.30 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2qj0 h GLU 468 CO -0.00 0.30 -0.09 0.28 -1.00 0.00 0.00 179.01 178.50 2qj0 h VAL 469 N 0.32 0.87 -0.68 3.13 2.07 -1.24 -2.73 116.25 117.99 2qj0 h VAL 469 Ca 0.08 -1.02 -0.03 0.00 0.82 0.00 0.00 66.70 66.56 2qj0 h VAL 469 Cb 0.13 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 2qj0 h VAL 469 CO -0.00 0.21 0.32 0.15 0.02 0.00 0.00 177.57 178.26 2qj0 h PHE 470 N -0.81 0.97 -0.93 1.57 3.57 -1.24 -1.12 116.94 118.96 2qj0 h PHE 470 Ca -0.02 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.46 2qj0 h PHE 470 Cb 0.52 -0.30 -0.05 0.00 2.79 0.00 0.00 35.95 38.91 2qj0 h PHE 470 CO 0.07 0.71 0.61 -0.44 -2.23 0.00 0.00 178.31 177.04 2qj0 h ASP 471 N 0.97 1.03 -0.84 0.41 5.19 -1.39 0.98 116.42 122.77 2qj0 h ASP 471 Ca 0.24 -0.02 0.03 0.00 -0.62 0.00 0.00 57.03 56.66 2qj0 h ASP 471 Cb 0.11 -0.25 -0.05 0.00 0.18 0.00 0.00 39.33 39.33 2qj0 h ASP 471 CO -0.03 0.73 0.55 0.15 -3.12 0.00 0.00 179.24 177.52 2qj0 h PHE 472 N 1.21 1.03 0.49 4.55 3.57 -0.90 -0.26 116.94 126.62 2qj0 h PHE 472 Ca 0.36 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.86 2qj0 h PHE 472 Cb -0.07 -0.34 -0.00 0.00 2.79 0.00 0.00 35.95 38.33 2qj0 h PHE 472 CO -0.01 0.60 -0.27 0.82 -2.23 0.00 0.00 178.31 177.22 2qj0 h ILE 473 N 1.07 0.45 -0.96 1.41 2.04 -0.32 0.14 117.51 121.34 2qj0 h ILE 473 Ca 0.33 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.31 2qj0 h ILE 473 Cb -0.02 0.45 -0.08 0.00 -0.74 0.00 0.00 36.82 36.43 2qj0 h ILE 473 CO -0.11 0.00 0.61 0.00 0.00 0.00 0.00 178.15 178.66 2qj0 h GLY 475 N 0.94 0.85 1.72 0.00 0.00 -0.73 -2.83 103.07 103.03 2qj0 h GLY 475 Ca 0.47 -0.75 -0.05 0.00 0.00 0.00 0.00 47.33 47.00 2qj0 h GLY 475 CO -0.23 0.69 -0.06 0.00 0.00 0.00 0.00 176.54 176.93 2qj0 h ALA 476 N 0.81 1.48 0.68 3.60 0.00 0.61 -2.34 119.26 124.10 2qj0 h ALA 476 Ca 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2qj0 h ALA 476 Cb 0.71 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 2qj0 h ALA 476 CO 0.05 0.37 -0.39 0.77 0.00 0.00 0.00 179.25 180.05 2qj0 h SER 477 N 0.33 -0.96 -0.76 0.00 0.02 -0.56 -0.41 113.55 111.21 2qj0 h SER 477 Ca 0.07 0.05 0.17 0.00 -0.84 0.00 0.00 61.79 61.24 2qj0 h SER 477 Cb 0.33 0.27 -0.11 0.00 0.14 0.00 0.00 62.40 63.03 2qj0 h SER 477 CO 0.01 -0.62 0.22 0.74 -1.14 0.00 0.00 176.83 176.05 2qj0 h THR 478 N -0.99 0.52 -0.32 -2.27 2.02 -1.29 0.17 112.91 110.74 2qj0 h THR 478 Ca -0.09 -0.11 0.01 0.00 0.77 0.00 0.00 66.41 67.00 2qj0 h THR 478 Cb 0.79 0.19 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 2qj0 h THR 478 CO 0.11 0.06 0.20 0.15 0.37 0.00 0.00 175.52 176.40 2qj0 h PHE 479 N 0.31 0.37 -0.84 3.16 3.57 -0.88 -2.28 116.94 120.35 2qj0 h PHE 479 Ca 0.44 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.92 2qj0 h PHE 479 Cb 0.75 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.33 2qj0 h PHE 479 CO -0.24 0.22 0.42 -0.07 -2.23 0.00 0.00 178.31 176.42 2qj0 h LEU 480 N 0.40 1.09 -0.57 0.59 3.38 0.67 -2.06 115.31 118.80 2qj0 h LEU 480 Ca 0.13 -0.13 0.08 0.00 0.09 0.00 0.00 57.88 58.05 2qj0 h LEU 480 Cb -0.02 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.39 2qj0 h LEU 480 CO -0.05 0.90 0.23 0.40 0.09 0.00 0.00 178.44 180.02 2qj0 h ILE 481 N 1.19 0.83 0.00 1.22 2.04 -0.81 0.20 117.51 122.18 2qj0 h ILE 481 Ca 0.29 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.99 2qj0 h ILE 481 Cb 0.09 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 36.53 2qj0 h ILE 481 CO -0.04 0.08 -0.04 -0.09 0.00 0.00 0.00 178.15 178.06 2qj0 h ARG 482 N 0.43 0.00 0.00 2.37 2.43 -0.82 0.77 114.38 119.56 2qj0 h ARG 482 Ca 0.28 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.35 2qj0 h ARG 482 Cb 0.30 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 2qj0 h ARG 482 CO -0.26 0.04 -0.47 0.28 -1.51 0.00 0.00 179.97 178.05 2qj0 h VAL 483 N 0.00 0.94 0.00 0.20 2.07 -0.00 -3.29 116.25 116.16 2qj0 h VAL 483 Ca -0.00 -1.95 -0.02 0.00 0.82 0.00 0.00 66.70 65.55 2qj0 h VAL 483 Cb 0.09 2.20 -0.00 0.00 -1.52 0.00 0.00 31.29 32.06 2qj0 h VAL 483 CO 0.01 0.47 -0.20 0.58 0.02 0.00 0.00 177.57 178.44 2qj0 h VAL 484 N 0.00 0.43 0.00 2.57 2.07 -0.50 -3.40 116.25 117.42 2qj0 h VAL 484 Ca -0.00 -1.37 -0.43 0.00 0.82 0.00 0.00 66.70 65.72 2qj0 h VAL 484 Cb 1.16 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.77 2qj0 h VAL 484 CO 0.06 0.15 0.82 -0.67 0.02 0.00 0.00 177.57 177.95 2qj0 n ASP 485 N -4.69 0.40 -0.37 0.57 -0.08 0.16 -4.78 116.55 107.78 2qj0 n ASP 485 Ca -0.06 0.36 -0.03 0.00 -1.51 0.00 0.00 54.79 53.55 2qj0 n ASP 485 Cb 0.20 -0.54 0.00 0.00 2.34 0.00 0.00 41.12 43.13 2qj0 n ASP 485 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 2qj0 n PRO 486 N 4.54 -0.27 -3.17 -0.67 -0.02 -1.26 -2.16 135.00 131.99 2qj0 n PRO 486 Ca 0.34 1.43 -0.45 0.00 -2.02 0.00 0.00 63.50 62.80 2qj0 n PRO 486 Cb -0.02 -2.11 -0.05 0.00 -0.02 0.00 0.00 33.50 31.30 2qj0 n PRO 486 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2qj0 s GLU 487 N -5.77 3.04 -0.76 -0.52 2.02 -1.26 -4.98 118.70 110.47 2qj0 s GLU 487 Ca -0.12 -1.36 -0.26 0.00 0.02 0.00 0.00 54.97 53.25 2qj0 s GLU 487 Cb 0.17 -4.25 -0.10 0.00 0.10 0.00 0.00 34.13 30.05 2qj0 s GLU 487 CO 0.64 -1.44 2.28 -1.01 0.02 0.00 0.00 175.26 175.75 2qj0 s HIS 488 N 2.40 1.30 0.00 1.61 3.76 -0.92 -4.48 115.29 118.97 2qj0 s HIS 488 Ca 0.10 1.56 0.00 0.00 -0.15 0.00 0.00 55.06 56.57 2qj0 s HIS 488 Cb -0.25 -3.63 0.00 0.00 1.11 0.00 0.00 32.58 29.81 2qj0 s HIS 488 CO 0.06 -1.81 0.04 0.39 -0.85 0.00 0.00 174.74 172.57 2qj0 n GLU 489 N 8.88 0.00 -2.15 1.40 1.02 -1.26 -5.08 120.64 123.45 2qj0 n GLU 489 Ca 0.42 -0.04 -0.36 0.00 -0.02 0.00 0.00 57.16 57.17 2qj0 n GLU 489 Cb 0.46 -0.47 0.01 0.00 -0.02 0.00 0.00 31.44 31.43 2qj0 n GLU 489 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 2qj0 s PHE 490 N 0.00 2.57 -0.73 -0.32 5.36 -1.24 -0.61 117.98 123.02 2qj0 s PHE 490 Ca 0.00 1.53 0.11 0.00 -0.96 0.00 0.00 56.93 57.60 2qj0 s PHE 490 Cb 0.00 -3.39 0.56 0.00 -0.34 0.00 0.00 43.02 39.85 2qj0 s PHE 490 CO 0.00 -1.86 1.38 -0.35 -1.46 0.00 0.00 175.22 172.93 2qj0 n PRO 491 N -1.30 3.51 0.18 10.12 -0.04 -1.26 -4.69 135.00 141.52 2qj0 n PRO 491 Ca 0.12 -2.17 -0.08 0.00 -0.04 0.00 0.00 63.50 61.33 2qj0 n PRO 491 Cb 0.50 -1.94 -0.04 0.00 -0.04 0.00 0.00 33.50 31.98 2qj0 n PRO 491 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2qj0 h PHE 492 N 2.87 -0.48 -3.61 0.54 0.04 -1.29 -3.42 116.94 111.59 2qj0 h PHE 492 Ca 0.00 -0.01 -0.63 0.00 2.80 0.00 0.00 57.97 60.13 2qj0 h PHE 492 Cb 1.41 0.16 -0.16 0.00 2.20 0.00 0.00 35.95 39.55 2qj0 h PHE 492 CO 0.71 -0.30 -0.54 0.21 -0.60 0.00 0.00 178.31 177.79 2qj0 s LYS 493 N -3.27 3.97 1.06 1.51 2.20 -0.64 -5.08 119.74 119.48 2qj0 s LYS 493 Ca -0.08 -0.32 -0.22 0.00 -0.36 0.00 0.00 55.97 54.99 2qj0 s LYS 493 Cb 0.01 -3.48 -0.02 0.00 -1.51 0.00 0.00 37.83 32.84 2qj0 s LYS 493 CO 0.23 0.01 -0.63 1.04 -0.36 0.00 0.00 175.35 175.64 2qj0 n GLN 494 N 4.41 -0.98 -4.96 4.03 1.13 -1.26 -3.61 117.38 116.13 2qj0 n GLN 494 Ca -0.15 -0.28 -0.31 0.00 -1.94 0.00 0.00 57.00 54.32 2qj0 n GLN 494 Cb 0.52 -1.39 -0.14 0.00 0.11 0.00 0.00 30.24 29.34 2qj0 n GLN 494 CO 0.00 0.00 0.00 -1.50 -1.44 0.00 0.00 177.06 174.12 2qj0 s ILE 495 N -2.12 2.44 -0.25 5.09 2.07 -1.26 -4.83 121.20 122.33 2qj0 s ILE 495 Ca 0.46 -1.14 -0.10 0.00 -1.41 0.00 0.00 60.65 58.46 2qj0 s ILE 495 Cb -0.02 -1.94 -0.05 0.00 0.13 0.00 0.00 42.46 40.58 2qj0 s ILE 495 CO 0.63 0.46 0.16 -0.75 -1.91 0.00 0.00 174.94 173.53 2qj0 s LYS 496 N -1.01 3.99 0.06 3.50 2.36 -1.26 -5.01 119.74 122.36 2qj0 s LYS 496 Ca 0.12 -0.31 0.08 0.00 -2.55 0.00 0.00 55.97 53.31 2qj0 s LYS 496 Cb -0.10 -3.54 -0.03 0.00 -1.05 0.00 0.00 37.83 33.11 2qj0 s LYS 496 CO 0.02 -0.03 -0.21 -0.51 1.55 0.00 0.00 175.35 176.17 2qj0 s LEU 497 N 1.30 2.46 0.60 5.43 1.02 -1.26 -4.26 118.68 123.96 2qj0 s LEU 497 Ca 0.07 -0.51 -0.16 0.00 0.02 0.00 0.00 54.13 53.55 2qj0 s LEU 497 Cb -0.14 -1.43 -0.03 0.00 0.02 0.00 0.00 46.19 44.60 2qj0 s LEU 497 CO 0.06 0.24 1.06 -2.84 0.02 0.00 0.00 176.35 174.90 2qj0 s PRO 498 N -1.49 3.28 0.06 1.29 0.02 -1.26 -5.08 135.00 131.83 2qj0 s PRO 498 Ca 0.14 1.24 -0.17 0.00 0.02 0.00 0.00 61.00 62.23 2qj0 s PRO 498 Cb -0.10 -2.03 -0.14 0.00 0.02 0.00 0.00 34.50 32.25 2qj0 s PRO 498 CO 0.05 -0.85 1.31 -0.07 -0.33 0.00 0.00 177.00 177.11 2qj0 h LEU 499 N 0.44 0.66 -8.60 -5.54 3.38 -1.97 -3.42 115.31 100.25 2qj0 h LEU 499 Ca -0.47 -0.57 -0.68 0.00 0.09 0.00 0.00 57.88 56.25 2qj0 h LEU 499 Cb 1.22 -0.19 -0.29 0.00 0.09 0.00 0.00 40.66 41.49 2qj0 h LEU 499 CO 0.57 1.10 -0.88 0.27 0.09 0.00 0.00 178.44 179.59 2qj0 s ILE 500 N -3.98 1.99 0.29 1.22 -4.36 -1.26 -5.09 121.20 110.01 2qj0 s ILE 500 Ca -0.13 -1.12 -0.26 0.00 -0.26 0.00 0.00 60.65 58.88 2qj0 s ILE 500 Cb 0.07 -1.66 -0.15 0.00 1.25 0.00 0.00 42.46 41.97 2qj0 s ILE 500 CO 0.82 0.52 0.62 -0.81 0.24 0.00 0.00 174.94 176.34 2qj0 n PRO 501 N 2.35 0.50 -2.14 0.37 -0.04 -1.26 -4.89 135.00 129.89 2qj0 n PRO 501 Ca -0.16 0.18 -0.37 0.00 -0.04 0.00 0.00 63.50 63.11 2qj0 n PRO 501 Cb 0.51 -1.34 0.01 0.00 -0.04 0.00 0.00 33.50 32.64 2qj0 n PRO 501 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2qj0 s ASP 502 N -0.87 5.87 -0.81 3.54 -0.00 -1.26 -4.91 116.67 118.23 2qj0 s ASP 502 Ca 0.62 2.39 -0.25 0.00 -0.00 0.00 0.00 52.55 55.31 2qj0 s ASP 502 Cb -0.77 -2.61 -0.01 0.00 -0.00 0.00 0.00 42.92 39.53 2qj0 s ASP 502 CO 0.58 -1.13 1.74 -1.10 -0.00 0.00 0.00 175.17 175.26 2qj0 s GLN 503 N -2.85 2.85 0.18 8.23 1.11 -1.26 -4.71 119.66 123.21 2qj0 s GLN 503 Ca 0.67 -0.16 -0.10 0.00 0.01 0.00 0.00 55.36 55.78 2qj0 s GLN 503 Cb -0.31 -4.79 0.06 0.00 -1.01 0.00 0.00 33.01 26.97 2qj0 s GLN 503 CO 0.36 -2.81 1.64 0.82 0.01 0.00 0.00 175.29 175.32 2qj0 h ILE 504 N 6.90 1.26 -2.77 1.08 2.04 -2.03 -2.14 117.51 121.85 2qj0 h ILE 504 Ca -0.04 -1.11 -0.79 0.00 1.00 0.00 0.00 64.86 63.92 2qj0 h ILE 504 Cb 1.06 0.79 -0.25 0.00 -0.74 0.00 0.00 36.82 37.68 2qj0 h ILE 504 CO 1.26 0.40 0.95 0.61 0.00 0.00 0.00 178.15 181.37 2qj0 n GLY 505 N -0.45 4.71 0.02 5.37 0.00 -1.26 -4.58 105.19 109.00 2qj0 n GLY 505 Ca 0.03 -2.50 0.11 0.00 0.00 0.00 0.00 46.02 43.66 2qj0 n GLY 505 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2qj0 n VAL 506 N 2.27 0.00 -1.73 1.61 3.14 -0.81 -4.50 118.33 118.31 2qj0 n VAL 506 Ca 0.29 -0.01 -0.40 0.00 -2.96 0.00 0.00 64.34 61.25 2qj0 n VAL 506 Cb 0.36 0.67 -0.01 0.00 -1.06 0.00 0.00 33.84 33.79 2qj0 n VAL 506 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2qj0 n GLU 507 N -1.43 4.01 -2.67 1.45 -0.58 -1.26 -4.89 120.64 115.27 2qj0 n GLU 507 Ca 0.05 -2.89 -0.07 0.00 -0.42 0.00 0.00 57.16 53.83 2qj0 n GLU 507 Cb 0.34 -2.78 -0.02 0.00 -0.57 0.00 0.00 31.44 28.41 2qj0 n GLU 507 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2qj0 n ASN 508 N 3.03 1.32 -4.73 1.62 3.02 -1.26 -5.11 115.26 113.14 2qj0 n ASN 508 Ca 0.66 -1.59 -0.42 0.00 -0.03 0.00 0.00 54.58 53.20 2qj0 n ASN 508 Cb 0.26 0.24 -0.03 0.00 -0.61 0.00 0.00 39.78 39.65 2qj0 n ASN 508 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2qj0 s VAL 509 N -1.85 2.80 0.00 2.41 1.01 -1.26 -4.67 120.40 118.84 2qj0 s VAL 509 Ca 0.04 0.60 0.00 0.00 0.00 0.00 0.00 61.98 62.63 2qj0 s VAL 509 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 33.00 2qj0 s VAL 509 CO 0.03 0.06 0.00 -0.90 0.00 0.00 0.00 175.10 174.29 2qj0 n ASP 510 N 3.42 0.00 0.27 3.32 5.75 -1.26 -4.66 116.55 123.38 2qj0 n ASP 510 Ca 0.11 0.00 0.17 0.00 -0.01 0.00 0.00 54.79 55.06 2qj0 n ASP 510 Cb 0.40 0.00 0.93 0.00 -1.03 0.00 0.00 41.12 41.42 2qj0 n ASP 510 CO 0.00 0.00 0.00 0.78 -0.11 0.00 0.00 177.20 177.87 2qj0 h ASN 511 N 0.00 0.00 -0.44 -1.12 2.35 -1.93 -3.24 115.58 111.19 2qj0 h ASN 511 Ca 0.00 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.81 2qj0 h ASN 511 Cb 0.00 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.31 2qj0 h ASN 511 CO 0.00 0.00 -0.21 0.00 -1.65 0.00 0.00 177.43 175.57 2qj0 n ALA 512 N -1.94 -0.16 -0.04 -0.83 0.00 -1.26 0.15 120.51 116.44 2qj0 n ALA 512 Ca -0.02 0.41 -0.17 0.00 0.00 0.00 0.00 53.44 53.66 2qj0 n ALA 512 Cb 0.08 -0.14 -0.07 0.00 0.00 0.00 0.00 19.45 19.33 2qj0 n ALA 512 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2qj0 h ASP 513 N 0.00 0.93 -0.16 0.00 3.45 -1.91 -2.24 116.42 116.48 2qj0 h ASP 513 Ca 0.12 -0.60 -0.01 0.00 0.43 0.00 0.00 57.03 56.96 2qj0 h ASP 513 Cb 0.23 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.72 2qj0 h ASP 513 CO -0.43 1.37 0.06 0.15 -1.57 0.00 0.00 179.24 178.82 2qj0 h PHE 514 N 0.54 0.25 0.04 4.55 3.57 0.33 -2.25 116.94 123.97 2qj0 h PHE 514 Ca -0.03 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.44 2qj0 h PHE 514 Cb 1.31 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.98 2qj0 h PHE 514 CO 0.09 0.35 -0.02 -0.07 -2.23 0.00 0.00 178.31 176.42 2qj0 h LEU 515 N 0.09 -0.05 -1.51 0.59 3.38 0.14 -1.90 115.31 116.04 2qj0 h LEU 515 Ca 0.05 -0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.12 2qj0 h LEU 515 Cb 0.21 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 2qj0 h LEU 515 CO -0.00 -0.03 0.46 -0.09 0.09 0.00 0.00 178.44 178.87 2qj0 h ARG 516 N -0.06 0.52 0.00 1.13 2.43 -1.38 0.09 114.38 117.11 2qj0 h ARG 516 Ca -0.01 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.02 2qj0 h ARG 516 Cb 0.05 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 2qj0 h ARG 516 CO 0.01 0.35 -0.53 0.00 -1.51 0.00 0.00 179.97 178.29 2qj0 h ALA 517 N 1.65 0.98 -0.57 2.80 0.00 -0.88 -3.18 119.26 120.06 2qj0 h ALA 517 Ca 0.32 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2qj0 h ALA 517 Cb 0.54 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2qj0 h ALA 517 CO -0.11 0.66 0.00 0.72 0.00 0.00 0.00 179.25 180.53 2qj0 n HIS 518 N -3.71 1.30 -2.69 0.00 8.25 -0.11 -4.98 115.22 113.29 2qj0 n HIS 518 Ca -0.01 -0.63 -0.37 0.00 -0.26 0.00 0.00 57.72 56.46 2qj0 n HIS 518 Cb 0.58 -0.22 -0.06 0.00 1.12 0.00 0.00 29.99 31.41 2qj0 n HIS 518 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qj0 s ALA 519 N -1.84 3.17 -0.31 -1.41 0.00 -0.46 -4.93 121.76 115.98 2qj0 s ALA 519 Ca 0.47 0.59 -0.42 0.00 0.00 0.00 0.00 51.96 52.60 2qj0 s ALA 519 Cb 0.31 -3.22 -0.17 0.00 0.00 0.00 0.00 23.12 20.04 2qj0 s ALA 519 CO 0.22 0.03 1.66 -0.35 0.00 0.00 0.00 175.76 177.32 2qj0 n PRO 520 N 0.31 0.79 -0.32 0.00 -0.04 -1.26 -4.83 135.00 129.66 2qj0 n PRO 520 Ca 0.03 0.29 0.23 0.00 -0.04 0.00 0.00 63.50 64.01 2qj0 n PRO 520 Cb 0.50 -1.91 0.43 0.00 -0.04 0.00 0.00 33.50 32.47 2qj0 n PRO 520 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qj0 n VAL 521 N 4.19 -0.41 -0.08 0.52 0.31 -1.26 -1.78 118.33 119.82 2qj0 n VAL 521 Ca 0.27 2.04 -0.13 0.00 -0.01 0.00 0.00 64.34 66.52 2qj0 n VAL 521 Cb 0.08 -3.15 -0.06 0.00 -0.91 0.00 0.00 33.84 29.80 2qj0 n VAL 521 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2qj0 h PRO 522 N 0.00 0.00 -1.05 5.55 0.13 -1.89 -3.41 132.00 131.33 2qj0 h PRO 522 Ca 0.70 0.00 0.29 0.00 -0.87 0.00 0.00 66.00 66.12 2qj0 h PRO 522 Cb 1.70 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.71 2qj0 h PRO 522 CO -0.82 0.49 0.64 0.35 -0.23 0.00 0.00 178.00 178.43 2qj0 h PHE 523 N -1.00 0.83 0.00 1.56 3.04 -1.74 -1.74 116.94 117.89 2qj0 h PHE 523 Ca -0.16 0.03 -0.00 0.00 3.98 0.00 0.00 57.97 61.82 2qj0 h PHE 523 Cb 0.86 -0.23 -0.00 0.00 2.56 0.00 0.00 35.95 39.14 2qj0 h PHE 523 CO -0.05 -0.01 -0.01 1.57 -2.02 0.00 0.00 178.31 177.80 2qj0 h LYS 524 N 0.42 0.00 -0.14 1.11 2.10 -1.58 -2.22 116.57 116.26 2qj0 h LYS 524 Ca 0.66 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.31 2qj0 h LYS 524 Cb 1.54 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.87 2qj0 h LYS 524 CO -0.44 0.01 0.00 0.66 -2.00 0.00 0.00 179.45 177.68 2qj0 n TYR 525 N -3.24 0.15 -2.23 0.07 4.01 -0.65 -2.56 117.16 112.71 2qj0 n TYR 525 Ca -0.03 -0.08 -0.40 0.00 -0.16 0.00 0.00 57.90 57.24 2qj0 n TYR 525 Cb 0.10 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.11 2qj0 n TYR 525 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2qj0 s TYR 526 N -1.85 3.12 0.45 -0.72 1.51 -0.84 -4.80 117.35 114.21 2qj0 s TYR 526 Ca 0.32 1.51 -0.25 0.00 -1.01 0.00 0.00 57.07 57.65 2qj0 s TYR 526 Cb 0.21 -3.52 -0.08 0.00 -0.11 0.00 0.00 41.96 38.46 2qj0 s TYR 526 CO 0.31 -1.49 1.31 -1.25 -1.11 0.00 0.00 175.55 173.32 2qj0 s PRO 527 N -1.96 3.72 0.43 -1.71 0.04 -1.26 -0.84 135.00 133.43 2qj0 s PRO 527 Ca 0.52 2.15 0.09 0.00 0.04 0.00 0.00 61.00 63.80 2qj0 s PRO 527 Cb -0.35 -2.58 0.94 0.00 0.04 0.00 0.00 34.50 32.54 2qj0 s PRO 527 CO 0.46 -0.69 2.07 1.49 0.04 0.00 0.00 177.00 180.37 2qj0 h GLU 528 N 2.28 0.43 -0.05 4.56 4.81 -1.33 -2.62 114.58 122.66 2qj0 h GLU 528 Ca -0.50 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 58.72 2qj0 h GLU 528 Cb 1.26 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 2qj0 h GLU 528 CO 0.61 0.29 0.06 0.27 -0.73 0.00 0.00 179.01 179.51 2qj0 h PHE 529 N 0.44 0.00 -0.66 0.92 -0.00 -1.91 -0.11 116.94 115.63 2qj0 h PHE 529 Ca 0.12 0.00 0.18 0.00 -0.00 0.00 0.00 57.97 58.26 2qj0 h PHE 529 Cb -0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 35.95 35.88 2qj0 h PHE 529 CO 0.00 0.00 0.47 0.28 -0.00 0.00 0.00 178.31 179.06 2qj0 h VAL 530 N 0.00 0.71 0.00 0.88 2.07 -1.81 0.81 116.25 118.91 2qj0 h VAL 530 Ca 0.02 -0.03 -0.32 0.00 0.82 0.00 0.00 66.70 67.19 2qj0 h VAL 530 Cb 0.14 0.61 -0.06 0.00 -1.52 0.00 0.00 31.29 30.46 2qj0 h VAL 530 CO -0.00 0.02 -2.19 0.52 0.02 0.00 0.00 177.57 175.94 2qj0 n VAL 531 N -4.38 1.19 -0.10 2.57 0.31 -0.12 -4.44 118.33 113.36 2qj0 n VAL 531 Ca 0.13 -0.70 -0.13 0.00 -0.01 0.00 0.00 64.34 63.62 2qj0 n VAL 531 Cb 0.67 -0.63 -0.03 0.00 -0.91 0.00 0.00 33.84 32.93 2qj0 n VAL 531 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2qj0 h GLU 532 N 0.00 0.80 0.08 5.55 4.81 -0.85 -2.95 114.58 122.02 2qj0 h GLU 532 Ca -0.47 -0.42 0.02 0.00 -0.13 0.00 0.00 59.36 58.36 2qj0 h GLU 532 Cb 2.02 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 31.37 2qj0 h GLU 532 CO 0.01 1.05 -0.49 0.78 -0.73 0.00 0.00 179.01 179.64 2qj0 h GLY 533 N 0.57 -1.02 0.66 1.92 0.00 -1.09 0.12 103.07 104.22 2qj0 h GLY 533 Ca 0.05 0.60 0.06 0.00 0.00 0.00 0.00 47.33 48.04 2qj0 h GLY 533 CO 0.08 -0.26 0.32 -2.55 0.00 0.00 0.00 176.54 174.13 2qj0 h PRO 534 N -0.70 0.58 -0.08 4.80 0.11 -1.77 -2.31 132.00 132.64 2qj0 h PRO 534 Ca 0.01 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 2qj0 h PRO 534 Cb 0.73 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.70 2qj0 h PRO 534 CO -0.30 0.38 0.01 0.28 -0.21 0.00 0.00 178.00 178.17 2qj0 h VAL 535 N 0.60 1.22 -0.08 3.15 2.07 -1.29 -0.98 116.25 120.94 2qj0 h VAL 535 Ca 0.28 -0.67 0.03 0.00 0.82 0.00 0.00 66.70 67.15 2qj0 h VAL 535 Cb 0.20 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2qj0 h VAL 535 CO -0.19 0.19 -0.09 0.78 0.02 0.00 0.00 177.57 178.28 2qj0 h ASN 536 N -0.11 -0.27 0.29 0.57 2.35 -0.67 0.71 115.58 118.45 2qj0 h ASN 536 Ca 0.02 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2qj0 h ASN 536 Cb 0.29 0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.77 2qj0 h ASN 536 CO 0.00 -0.12 -0.33 0.22 -1.65 0.00 0.00 177.43 175.55 2qj0 h TYR 537 N -0.12 -0.88 -0.39 1.19 3.20 -1.42 -0.71 116.97 117.85 2qj0 h TYR 537 Ca 0.06 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.02 2qj0 h TYR 537 Cb 0.20 0.35 -0.07 0.00 1.54 0.00 0.00 36.73 38.75 2qj0 h TYR 537 CO -0.19 -0.46 -0.03 0.77 -1.64 0.00 0.00 178.16 176.61 2qj0 h SER 538 N -0.66 -0.23 -0.28 -2.11 0.02 -0.80 0.18 113.55 109.68 2qj0 h SER 538 Ca -0.01 0.10 -0.03 0.00 -0.84 0.00 0.00 61.79 61.01 2qj0 h SER 538 Cb 0.61 0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.32 2qj0 h SER 538 CO -0.08 -0.07 0.09 -0.07 -1.14 0.00 0.00 176.83 175.56 2qj0 h LEU 539 N 0.07 0.46 0.19 5.07 3.38 -0.77 -2.95 115.31 120.76 2qj0 h LEU 539 Ca 0.19 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2qj0 h LEU 539 Cb 0.28 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2qj0 h LEU 539 CO -0.35 0.46 -0.09 0.22 0.09 0.00 0.00 178.44 178.77 2qj0 h TYR 540 N 0.50 -0.24 0.00 1.13 3.20 0.86 -3.23 116.97 119.20 2qj0 h TYR 540 Ca 0.12 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.98 2qj0 h TYR 540 Cb 0.18 0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.53 2qj0 h TYR 540 CO 0.01 -0.15 0.00 0.44 -1.64 0.00 0.00 178.16 176.82 2qj0 n ILE 541 N -2.92 1.29 0.31 1.81 -6.64 -0.18 -2.20 119.36 110.83 2qj0 n ILE 541 Ca -0.03 0.32 0.19 0.00 -1.77 0.00 0.00 62.75 61.46 2qj0 n ILE 541 Cb 0.10 -1.26 0.95 0.00 -1.44 0.00 0.00 39.64 37.98 2qj0 n ILE 541 CO 0.00 0.00 0.00 0.28 -1.77 0.00 0.00 176.55 175.06 2qj0 h SER 542 N 0.00 0.00 0.33 7.28 0.02 -1.53 -1.04 113.55 118.61 2qj0 h SER 542 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2qj0 h SER 542 Cb 0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.58 2qj0 h SER 542 CO 0.00 0.00 -0.05 2.29 -1.14 0.00 0.00 176.83 177.93 2qj0 n LYS 543 N -2.95 0.72 -3.43 3.45 2.85 -0.93 -4.84 118.16 113.03 2qj0 n LYS 543 Ca -0.01 -0.15 -0.38 0.00 -1.05 0.00 0.00 58.31 56.72 2qj0 n LYS 543 Cb 0.15 -1.50 -0.06 0.00 -0.65 0.00 0.00 35.03 32.97 2qj0 n LYS 543 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2qj0 s TYR 544 N -2.38 3.74 0.43 5.58 2.02 -0.40 -4.96 117.35 121.39 2qj0 s TYR 544 Ca 0.33 1.08 0.14 0.00 -0.37 0.00 0.00 57.07 58.24 2qj0 s TYR 544 Cb 0.21 -2.35 1.02 0.00 -0.40 0.00 0.00 41.96 40.44 2qj0 s TYR 544 CO 0.44 0.61 1.98 0.37 -1.57 0.00 0.00 175.55 177.39 2qj0 h GLN 545 N 4.55 0.40 -0.74 -0.62 5.75 -1.88 -1.36 115.11 121.22 2qj0 h GLN 545 Ca -0.51 -0.02 -0.29 0.00 -0.15 0.00 0.00 58.65 57.68 2qj0 h GLN 545 Cb 1.22 -0.09 -0.17 0.00 1.07 0.00 0.00 27.48 29.50 2qj0 h GLN 545 CO 0.62 0.27 0.33 0.25 -2.65 0.00 0.00 178.83 177.64 2qj0 n THR 546 N -4.47 2.93 -1.53 2.39 -2.24 -1.26 -5.02 114.28 105.07 2qj0 n THR 546 Ca 0.10 -1.90 -0.51 0.00 -2.27 0.00 0.00 64.05 59.47 2qj0 n THR 546 Cb 0.36 -0.38 -0.05 0.00 -2.10 0.00 0.00 70.33 68.16 2qj0 n THR 546 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2qj0 n SER 547 N -0.62 0.66 0.03 3.42 2.88 -0.51 -4.72 113.62 114.76 2qj0 n SER 547 Ca 0.45 1.14 -0.05 0.00 -1.33 0.00 0.00 58.87 59.08 2qj0 n SER 547 Cb 1.40 -1.12 0.16 0.00 -0.75 0.00 0.00 64.21 63.91 2qj0 n SER 547 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2qj0 h PRO 548 N 2.90 0.44 -0.67 -1.46 0.11 -1.89 -3.03 132.00 128.40 2qj0 h PRO 548 Ca -0.42 -0.21 0.10 0.00 0.11 0.00 0.00 66.00 65.59 2qj0 h PRO 548 Cb 1.38 -0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.44 2qj0 h PRO 548 CO 0.67 0.75 0.44 0.82 -0.21 0.00 0.00 178.00 180.48 2qj0 h ILE 549 N 0.37 0.89 -2.11 4.15 2.04 -1.93 -3.36 117.51 117.57 2qj0 h ILE 549 Ca 0.04 -0.17 -0.57 0.00 1.00 0.00 0.00 64.86 65.16 2qj0 h ILE 549 Cb 0.83 0.37 0.01 0.00 -0.74 0.00 0.00 36.82 37.29 2qj0 h ILE 549 CO 0.07 0.09 1.33 0.33 0.00 0.00 0.00 178.15 179.97 2qj0 n PHE 550 N -4.48 2.23 -1.97 1.37 7.35 -1.15 -2.61 117.46 118.20 2qj0 n PHE 550 Ca 0.11 -0.21 -0.10 0.00 -0.76 0.00 0.00 57.45 56.49 2qj0 n PHE 550 Cb 0.38 -2.75 -0.02 0.00 0.35 0.00 0.00 39.48 37.45 2qj0 n PHE 550 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 2qj0 n ARG 551 N 7.95 -1.88 -2.28 -4.13 0.63 -1.26 -4.90 116.66 110.78 2qj0 n ARG 551 Ca 0.25 0.54 -0.42 0.00 -0.92 0.00 0.00 57.85 57.31 2qj0 n ARG 551 Cb 0.40 -4.96 -0.03 0.00 0.45 0.00 0.00 32.46 28.32 2qj0 n ARG 551 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 2qj0 s ASN 552 N -1.96 6.94 0.00 6.15 3.84 -1.07 -4.88 114.94 123.95 2qj0 s ASN 552 Ca 0.00 2.20 0.01 0.00 0.21 0.00 0.00 52.86 55.27 2qj0 s ASN 552 Cb 0.00 -2.58 0.04 0.00 -0.55 0.00 0.00 41.25 38.16 2qj0 s ASN 552 CO 0.00 -0.57 0.52 -0.81 -2.79 0.00 0.00 177.10 173.45 2qj0 n PRO 553 N 3.87 0.02 -0.03 0.43 -0.04 -1.26 -2.30 135.00 135.70 2qj0 n PRO 553 Ca 0.10 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.58 2qj0 n PRO 553 Cb 0.44 -1.47 0.04 0.00 -0.04 0.00 0.00 33.50 32.46 2qj0 n PRO 553 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2qj0 n ARG 554 N -0.97 1.16 -0.29 0.54 1.74 -1.26 -4.74 116.66 112.83 2qj0 n ARG 554 Ca 0.01 -1.20 0.11 0.00 -0.77 0.00 0.00 57.85 56.00 2qj0 n ARG 554 Cb 0.00 -1.09 0.27 0.00 -1.02 0.00 0.00 32.46 30.62 2qj0 n ARG 554 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2qj0 h LEU 555 N 0.79 0.10 -0.91 0.55 6.46 -1.80 -1.17 115.31 119.33 2qj0 h LEU 555 Ca 0.00 0.17 0.26 0.00 -0.12 0.00 0.00 57.88 58.19 2qj0 h LEU 555 Cb 0.37 0.21 -0.15 0.00 -0.73 0.00 0.00 40.66 40.36 2qj0 h LEU 555 CO 0.00 -0.09 0.21 1.23 -0.62 0.00 0.00 178.44 179.17 2qj0 h GLY 556 N 0.28 1.40 0.92 3.75 0.00 -1.86 0.31 103.07 107.86 2qj0 h GLY 556 Ca 0.53 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.97 2qj0 h GLY 556 CO -0.59 -0.43 0.45 1.76 0.00 0.00 0.00 176.54 177.73 2qj0 h SER 557 N 0.15 0.44 0.04 0.19 0.02 -1.52 0.22 113.55 113.09 2qj0 h SER 557 Ca 0.58 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 61.43 2qj0 h SER 557 Cb 1.22 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.67 2qj0 h SER 557 CO -0.72 0.26 -0.59 0.15 -1.14 0.00 0.00 176.83 174.79 2qj0 h PHE 558 N 0.49 0.15 -0.39 3.45 3.57 -0.61 -2.99 116.94 120.61 2qj0 h PHE 558 Ca 0.32 -0.11 0.11 0.00 3.53 0.00 0.00 57.97 61.82 2qj0 h PHE 558 Cb 0.58 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 2qj0 h PHE 558 CO -0.00 1.23 0.30 0.28 -2.23 0.00 0.00 178.31 177.89 2qj0 h VAL 559 N -0.80 0.72 0.03 1.41 2.07 -0.61 0.22 116.25 119.29 2qj0 h VAL 559 Ca -0.14 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.38 2qj0 h VAL 559 Cb 1.27 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 2qj0 h VAL 559 CO -0.01 0.00 -0.01 -0.33 0.02 0.00 0.00 177.57 177.23 2qj0 h GLU 560 N 0.00 -0.04 -0.56 1.57 5.08 -0.66 -1.54 114.58 118.42 2qj0 h GLU 560 Ca 0.19 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.60 2qj0 h GLU 560 Cb 0.78 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.99 2qj0 h GLU 560 CO -0.00 0.55 0.29 0.35 -1.00 0.00 0.00 179.01 179.20 2qj0 h PHE 561 N -0.67 0.53 0.47 4.33 3.57 -1.03 -2.49 116.94 121.65 2qj0 h PHE 561 Ca -0.00 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 2qj0 h PHE 561 Cb 0.61 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 2qj0 h PHE 561 CO 0.13 0.26 -0.30 1.15 -2.23 0.00 0.00 178.31 177.32 2qj0 h THR 562 N 0.55 0.38 0.00 4.41 2.02 -0.66 -2.02 112.91 117.59 2qj0 h THR 562 Ca 0.25 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.43 2qj0 h THR 562 Cb 0.15 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2qj0 h THR 562 CO -0.17 0.00 0.00 0.41 0.37 0.00 0.00 175.52 176.13 2qj0 n THR 563 N -5.43 0.00 0.00 3.16 -1.04 -0.58 -1.57 114.28 108.82 2qj0 n THR 563 Ca -0.11 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 2qj0 n THR 563 Cb 0.33 -0.38 0.00 0.00 -1.82 0.00 0.00 70.33 68.46 2qj0 n THR 563 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2qj0 n VAL 565 N 0.90 0.00 1.32 12.58 0.31 -0.76 -1.30 118.33 131.38 2qj0 n VAL 565 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.47 2qj0 n VAL 565 Cb 0.00 0.00 0.72 0.00 -0.91 0.00 0.00 33.84 33.65 2qj0 n VAL 565 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2qj0 n LEU 566 N 0.00 0.00 -0.11 7.52 4.32 -0.61 -3.80 117.00 124.32 2qj0 n LEU 566 Ca 0.00 0.32 -0.15 0.00 -0.02 0.00 0.00 56.01 56.17 2qj0 n LEU 566 Cb 0.00 -0.32 -0.12 0.00 -1.62 0.00 0.00 43.42 41.36 2qj0 n LEU 566 CO 0.00 -0.01 -1.24 -1.14 -1.22 0.00 0.00 177.39 173.78 2qj0 n ARG 567 N -1.32 0.69 -3.79 3.23 0.00 -0.42 -4.52 116.66 110.53 2qj0 n ARG 567 Ca 0.13 0.10 -0.35 0.00 -0.00 0.00 0.00 57.85 57.72 2qj0 n ARG 567 Cb 0.25 -1.48 -0.12 0.00 0.00 0.00 0.00 32.46 31.11 2qj0 n ARG 567 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2qj0 h PRO 569 N 7.77 0.00 0.00 0.00 0.11 -1.88 -1.51 132.00 136.48 2qj0 h PRO 569 Ca -0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 2qj0 h PRO 569 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2qj0 h PRO 569 CO 0.68 0.00 -0.58 0.93 -0.21 0.00 0.00 178.00 178.83 2qj0 h GLU 570 N 0.00 0.00 0.22 1.05 3.07 -1.91 -3.40 114.58 113.61 2qj0 h GLU 570 Ca 0.00 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 2qj0 h GLU 570 Cb 0.96 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.87 2qj0 h GLU 570 CO 0.00 0.00 -0.11 -0.07 -1.40 0.00 0.00 179.01 177.43 2qj0 h LEU 571 N 0.00 -0.25 -8.06 1.33 3.38 -1.60 -3.43 115.31 106.67 2qj0 h LEU 571 Ca 0.00 0.01 -0.67 0.00 0.09 0.00 0.00 57.88 57.31 2qj0 h LEU 571 Cb 0.86 0.07 -0.35 0.00 0.09 0.00 0.00 40.66 41.33 2qj0 h LEU 571 CO 0.00 -0.18 -0.84 0.54 0.09 0.00 0.00 178.44 178.05 2qj0 s VAL 572 N -3.60 2.17 0.20 1.22 0.11 -1.26 -4.10 120.40 115.14 2qj0 s VAL 572 Ca -0.04 -0.98 -0.04 0.00 -2.93 0.00 0.00 61.98 57.98 2qj0 s VAL 572 Cb 0.00 -1.96 -0.02 0.00 -1.53 0.00 0.00 36.38 32.87 2qj0 s VAL 572 CO 0.13 0.47 1.54 0.77 -3.33 0.00 0.00 175.10 174.68 2qj0 h SER 573 N 7.94 0.69 -1.95 3.54 4.64 -1.51 -3.44 113.55 123.46 2qj0 h SER 573 Ca -0.43 -0.33 -0.59 0.00 -0.47 0.00 0.00 61.79 59.98 2qj0 h SER 573 Cb 1.13 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 2qj0 h SER 573 CO 0.62 1.04 1.46 -3.20 -0.87 0.00 0.00 176.83 175.88 2qj0 n ASN 574 N -4.02 3.26 0.18 4.97 2.85 -1.26 -4.87 115.26 116.38 2qj0 n ASN 574 Ca -0.02 0.28 0.07 0.00 -0.11 0.00 0.00 54.58 54.80 2qj0 n ASN 574 Cb 0.54 -1.53 0.23 0.00 1.24 0.00 0.00 39.78 40.26 2qj0 n ASN 574 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2qj0 h PRO 575 N 14.46 0.00 -0.34 1.20 0.13 -1.99 -2.43 132.00 143.03 2qj0 h PRO 575 Ca -0.41 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.63 2qj0 h PRO 575 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2qj0 h PRO 575 CO 0.96 0.33 -0.15 1.25 -0.23 0.00 0.00 178.00 180.17 2qj0 h HIS 576 N 0.00 0.80 0.69 1.56 6.17 -1.98 0.04 115.15 122.43 2qj0 h HIS 576 Ca -0.00 -0.19 -0.03 0.00 0.71 0.00 0.00 60.37 60.85 2qj0 h HIS 576 Cb 1.07 -0.19 0.01 0.00 2.52 0.00 0.00 27.41 30.82 2qj0 h HIS 576 CO 0.00 0.90 -0.33 1.25 0.71 0.00 0.00 177.93 180.45 2qj0 h LEU 577 N 0.47 -0.79 -2.42 0.26 5.85 -1.94 -1.09 115.31 115.66 2qj0 h LEU 577 Ca 0.08 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.84 2qj0 h LEU 577 Cb 0.68 0.20 -0.00 0.00 0.37 0.00 0.00 40.66 41.91 2qj0 h LEU 577 CO 0.05 -0.56 0.16 0.11 -0.34 0.00 0.00 178.44 177.86 2qj0 h LYS 578 N -0.95 0.00 -0.60 1.25 1.57 -1.39 0.30 116.57 116.75 2qj0 h LYS 578 Ca -0.10 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.61 2qj0 h LYS 578 Cb 0.72 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 2qj0 h LYS 578 CO 0.16 0.00 0.08 0.78 -0.57 0.00 0.00 179.45 179.89 2qj0 h GLY 579 N 0.00 1.06 0.89 3.86 0.00 0.31 -1.70 103.07 107.49 2qj0 h GLY 579 Ca 0.04 -0.69 -0.06 0.00 0.00 0.00 0.00 47.33 46.61 2qj0 h GLY 579 CO -0.00 0.64 -0.07 0.50 0.00 0.00 0.00 176.54 177.62 2qj0 h LYS 580 N 0.92 0.57 -0.54 4.80 1.57 0.05 -2.61 116.57 121.34 2qj0 h LYS 580 Ca 0.18 -0.22 0.07 0.00 -1.87 0.00 0.00 60.65 58.82 2qj0 h LYS 580 Cb 0.43 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.65 2qj0 h LYS 580 CO 0.01 0.76 0.22 -0.07 -0.57 0.00 0.00 179.45 179.80 2qj0 h LEU 581 N 0.34 0.25 -1.56 2.94 3.38 -1.17 0.16 115.31 119.65 2qj0 h LEU 581 Ca 0.08 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2qj0 h LEU 581 Cb 0.55 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 2qj0 h LEU 581 CO 0.03 0.17 -0.16 1.62 0.09 0.00 0.00 178.44 180.19 2qj0 h VAL 582 N 0.42 0.50 0.00 1.22 3.04 -1.26 -2.21 116.25 117.96 2qj0 h VAL 582 Ca 0.26 -0.78 -0.18 0.00 -1.01 0.00 0.00 66.70 64.98 2qj0 h VAL 582 Cb 0.26 1.53 -0.02 0.00 -2.01 0.00 0.00 31.29 31.05 2qj0 h VAL 582 CO -0.24 0.15 -0.84 -0.61 -1.01 0.00 0.00 177.57 175.02 2qj0 h GLN 583 N 0.00 0.09 0.25 4.17 4.15 -0.63 -2.74 115.11 120.40 2qj0 h GLN 583 Ca -0.00 -0.10 -0.01 0.00 0.77 0.00 0.00 58.65 59.30 2qj0 h GLN 583 Cb 0.52 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.24 2qj0 h GLN 583 CO 0.02 0.88 -0.12 1.25 -1.93 0.00 0.00 178.83 178.93 2qj0 h LEU 584 N 0.05 -0.29 -1.42 -2.39 5.85 -0.58 -2.65 115.31 113.88 2qj0 h LEU 584 Ca -0.03 -0.19 0.26 0.00 0.84 0.00 0.00 57.88 58.77 2qj0 h LEU 584 Cb 1.47 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 42.49 2qj0 h LEU 584 CO 0.12 0.05 0.67 -0.07 -0.34 0.00 0.00 178.44 178.88 2qj0 h LEU 585 N -0.65 0.41 -1.11 2.25 4.07 -1.51 0.73 115.31 119.50 2qj0 h LEU 585 Ca -0.03 0.07 -0.09 0.00 0.08 0.00 0.00 57.88 57.91 2qj0 h LEU 585 Cb 0.46 0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.19 2qj0 h LEU 585 CO 0.06 0.09 -0.43 0.77 -1.08 0.00 0.00 178.44 177.85 2qj0 h SER 586 N 0.37 0.00 0.25 -0.43 4.64 -1.20 -2.53 113.55 114.65 2qj0 h SER 586 Ca 0.58 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.79 2qj0 h SER 586 Cb 1.52 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.60 2qj0 h SER 586 CO -0.26 0.43 -0.42 0.58 -0.87 0.00 0.00 176.83 176.28 2qj0 h VAL 587 N 0.00 1.31 -0.15 0.95 2.07 0.81 -2.30 116.25 118.94 2qj0 h VAL 587 Ca -0.00 -1.54 0.00 0.00 0.82 0.00 0.00 66.70 65.98 2qj0 h VAL 587 Cb 0.80 1.70 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 2qj0 h VAL 587 CO 0.06 0.46 0.00 0.61 0.02 0.00 0.00 177.57 178.71 2qj0 n GLY 588 N -0.17 0.01 3.16 2.17 0.00 -0.97 -4.79 105.19 104.60 2qj0 n GLY 588 Ca -0.02 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.29 2qj0 n GLY 588 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qj0 s ALA 589 N -1.81 4.26 -0.02 4.61 0.00 -0.87 -3.46 121.76 124.48 2qj0 s ALA 589 Ca 0.29 -3.76 0.07 0.00 0.00 0.00 0.00 51.96 48.55 2qj0 s ALA 589 Cb 0.15 -2.97 -0.02 0.00 0.00 0.00 0.00 23.12 20.28 2qj0 s ALA 589 CO 0.23 -2.16 -0.24 -2.14 0.00 0.00 0.00 175.76 171.45 2qj0 s PRO 591 N -1.14 1.97 1.07 0.00 0.02 -1.26 -3.84 135.00 131.82 2qj0 s PRO 591 Ca 0.27 -0.85 -0.12 0.00 0.02 0.00 0.00 61.00 60.32 2qj0 s PRO 591 Cb -0.09 -1.88 0.23 0.00 0.02 0.00 0.00 34.50 32.77 2qj0 s PRO 591 CO -0.11 0.50 1.05 1.28 -0.33 0.00 0.00 177.00 179.39 2qj0 n LEU 592 N 2.54 0.52 0.00 -5.54 7.99 -0.63 -4.76 117.00 117.12 2qj0 n LEU 592 Ca -0.16 0.08 0.06 0.00 -0.01 0.00 0.00 56.01 55.98 2qj0 n LEU 592 Cb 0.52 -1.35 0.26 0.00 -0.11 0.00 0.00 43.42 42.74 2qj0 n LEU 592 CO 0.23 -2.83 0.68 1.07 -1.51 0.00 0.00 177.39 175.04 2qj0 n THR 593 N -4.67 1.14 1.52 -5.08 5.66 -1.26 0.07 114.28 111.66 2qj0 n THR 593 Ca 0.07 0.28 0.07 0.00 -3.05 0.00 0.00 64.05 61.42 2qj0 n THR 593 Cb 0.53 -1.08 0.31 0.00 -1.55 0.00 0.00 70.33 68.54 2qj0 n THR 593 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2qj0 n ASP 594 N -1.48 0.91 -1.10 1.09 10.43 -1.26 -4.85 116.55 120.30 2qj0 n ASP 594 Ca 0.03 -1.74 -0.14 0.00 2.57 0.00 0.00 54.79 55.52 2qj0 n ASP 594 Cb 0.13 -0.08 -0.06 0.00 1.84 0.00 0.00 41.12 42.95 2qj0 n ASP 594 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 2qj0 n ASN 595 N -0.11 -5.34 -4.88 -2.24 4.13 0.11 -4.95 115.26 101.98 2qj0 n ASN 595 Ca 0.12 0.34 -0.30 0.00 1.68 0.00 0.00 54.58 56.42 2qj0 n ASN 595 Cb 0.18 -4.23 -0.03 0.00 -1.54 0.00 0.00 39.78 34.16 2qj0 n ASN 595 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2qj0 s SER 596 N -2.44 6.49 0.47 6.41 1.04 -1.25 -4.82 113.70 119.60 2qj0 s SER 596 Ca 0.00 1.05 -0.20 0.00 0.48 0.00 0.00 55.95 57.28 2qj0 s SER 596 Cb 0.00 -2.29 -0.12 0.00 0.10 0.00 0.00 66.02 63.70 2qj0 s SER 596 CO 0.00 -0.39 0.35 -2.65 0.98 0.00 0.00 173.24 171.53 2qj0 n PRO 597 N -1.34 0.37 -0.65 4.02 -0.02 -1.26 -1.61 135.00 134.50 2qj0 n PRO 597 Ca 0.02 0.14 -0.31 0.00 -2.02 0.00 0.00 63.50 61.32 2qj0 n PRO 597 Cb 0.54 -1.39 0.18 0.00 -0.02 0.00 0.00 33.50 32.81 2qj0 n PRO 597 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qj0 n GLY 598 N 2.00 -1.40 3.41 -1.23 0.00 -1.25 -4.37 105.19 102.35 2qj0 n GLY 598 Ca 0.11 -0.84 -0.34 0.00 0.00 0.00 0.00 46.02 44.95 2qj0 n GLY 598 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2qj0 n PHE 599 N -4.31 2.29 0.00 1.61 -1.74 -1.22 -4.90 117.46 109.19 2qj0 n PHE 599 Ca 0.07 -1.52 0.00 0.00 -0.56 0.00 0.00 57.45 55.44 2qj0 n PHE 599 Cb 0.54 -2.23 0.00 0.00 1.52 0.00 0.00 39.48 39.31 2qj0 n PHE 599 CO 0.00 0.00 0.00 -3.47 -0.56 0.00 0.00 176.76 172.73 2qj0 n ASP 602 N 11.92 0.00 -0.19 5.98 2.03 -1.26 -4.76 116.55 130.26 2qj0 n ASP 602 Ca 0.47 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.70 2qj0 n ASP 602 Cb 0.44 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.86 2qj0 n ASP 602 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2qj0 h ILE 603 N 0.00 1.23 -0.79 5.18 2.04 -1.98 -2.07 117.51 121.12 2qj0 h ILE 603 Ca 0.00 -0.72 0.14 0.00 1.00 0.00 0.00 64.86 65.29 2qj0 h ILE 603 Cb 0.00 0.66 -0.09 0.00 -0.74 0.00 0.00 36.82 36.65 2qj0 h ILE 603 CO 0.00 0.27 0.36 -0.26 0.00 0.00 0.00 178.15 178.52 2qj0 h PHE 604 N 0.75 0.62 0.07 1.37 0.04 -1.96 0.08 116.94 117.91 2qj0 h PHE 604 Ca 0.18 0.04 -0.00 0.00 2.80 0.00 0.00 57.97 60.98 2qj0 h PHE 604 Cb 0.22 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.22 2qj0 h PHE 604 CO 0.01 0.11 -0.03 1.49 -0.60 0.00 0.00 178.31 179.29 2qj0 h GLU 605 N 0.52 -0.09 0.00 1.51 4.81 -1.91 -3.24 114.58 116.18 2qj0 h GLU 605 Ca 0.43 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.67 2qj0 h GLU 605 Cb 0.63 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.03 2qj0 h GLU 605 CO -0.38 0.45 -0.87 0.72 -0.73 0.00 0.00 179.01 178.20 2qj0 n HIS 606 N -4.85 0.04 -2.40 0.92 8.25 -0.81 -4.71 115.22 111.66 2qj0 n HIS 606 Ca -0.08 0.01 -0.42 0.00 -0.26 0.00 0.00 57.72 56.96 2qj0 n HIS 606 Cb 0.29 -0.16 -0.02 0.00 1.12 0.00 0.00 29.99 31.21 2qj0 n HIS 606 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2qj0 s ASP 607 N -3.19 6.28 0.00 0.41 -1.08 0.00 -4.90 116.67 114.20 2qj0 s ASP 607 Ca 0.08 0.53 0.00 0.00 -0.52 0.00 0.00 52.55 52.64 2qj0 s ASP 607 Cb 0.16 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 39.08 2qj0 s ASP 607 CO 0.80 -1.53 0.48 -0.62 0.52 0.00 0.00 175.17 174.82 2qj0 n GLU 608 N 8.31 0.00 -0.17 4.34 -0.58 -1.26 -0.74 120.64 130.53 2qj0 n GLU 608 Ca 0.14 0.48 -0.02 0.00 -0.42 0.00 0.00 57.16 57.34 2qj0 n GLU 608 Cb 0.49 -0.73 0.06 0.00 -0.57 0.00 0.00 31.44 30.69 2qj0 n GLU 608 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2qj0 h LEU 609 N 0.00 -0.29 0.76 -4.62 5.85 -1.95 -2.78 115.31 112.29 2qj0 h LEU 609 Ca 0.00 0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 2qj0 h LEU 609 Cb 0.00 0.25 0.01 0.00 0.37 0.00 0.00 40.66 41.28 2qj0 h LEU 609 CO 0.00 -0.10 -0.37 0.58 -0.34 0.00 0.00 178.44 178.20 2qj0 h VAL 610 N 0.09 0.00 0.00 1.05 2.07 -1.28 -3.03 116.25 115.15 2qj0 h VAL 610 Ca 0.26 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.78 2qj0 h VAL 610 Cb 0.41 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 2qj0 h VAL 610 CO -0.46 0.00 0.00 -0.46 0.02 0.00 0.00 177.57 176.67 2qj0 n ASN 611 N -4.80 0.00 -0.01 0.57 0.23 -0.43 -0.26 115.26 110.56 2qj0 n ASN 611 Ca -0.13 0.50 -0.06 0.00 -0.53 0.00 0.00 54.58 54.37 2qj0 n ASN 611 Cb 0.41 -0.50 -0.12 0.00 -2.08 0.00 0.00 39.78 37.49 2qj0 n ASN 611 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2qj0 n LYS 612 N -1.51 0.63 0.00 -3.83 5.02 -1.06 -4.57 118.16 112.85 2qj0 n LYS 612 Ca 0.00 0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 2qj0 n LYS 612 Cb 0.02 -1.78 0.00 0.00 -0.02 0.00 0.00 35.03 33.24 2qj0 n LYS 612 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2qj0 n ASN 613 N -2.97 0.22 0.40 4.39 5.03 -0.53 -4.84 115.26 116.97 2qj0 n ASN 613 Ca -0.15 -0.59 -0.17 0.00 0.87 0.00 0.00 54.58 54.54 2qj0 n ASN 613 Cb 0.98 0.69 -0.08 0.00 -1.02 0.00 0.00 39.78 40.35 2qj0 n ASN 613 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 2qj0 h LEU 614 N 0.00 -0.97 -0.53 3.41 6.46 -0.87 -1.94 115.31 120.87 2qj0 h LEU 614 Ca 0.00 0.04 0.11 0.00 -0.12 0.00 0.00 57.88 57.91 2qj0 h LEU 614 Cb 0.01 0.26 -0.10 0.00 -0.73 0.00 0.00 40.66 40.11 2qj0 h LEU 614 CO 0.00 -0.65 -0.08 0.25 -0.62 0.00 0.00 178.44 177.34 2qj0 h LEU 615 N -1.06 -0.40 -0.36 2.25 7.12 -1.88 -0.59 115.31 120.40 2qj0 h LEU 615 Ca -0.10 0.15 -0.00 0.00 0.13 0.00 0.00 57.88 58.05 2qj0 h LEU 615 Cb 0.82 0.29 -0.02 0.00 -0.53 0.00 0.00 40.66 41.23 2qj0 h LEU 615 CO 0.15 -0.14 0.22 0.22 -0.13 0.00 0.00 178.44 178.75 2qj0 h TYR 616 N 0.04 0.47 -0.41 1.25 5.03 -1.88 -2.28 116.97 119.19 2qj0 h TYR 616 Ca 0.26 0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.62 2qj0 h TYR 616 Cb 0.41 -0.15 -0.05 0.00 1.55 0.00 0.00 36.73 38.49 2qj0 h TYR 616 CO -0.40 0.32 0.14 0.00 -1.32 0.00 0.00 178.16 176.90 2qj0 h ALA 617 N 1.10 0.48 -0.19 1.82 0.00 -0.48 -0.38 119.26 121.61 2qj0 h ALA 617 Ca 0.13 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.10 2qj0 h ALA 617 Cb -0.01 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2qj0 h ALA 617 CO -0.03 -0.25 0.10 -0.07 0.00 0.00 0.00 179.25 179.00 2qj0 h LEU 618 N 0.30 0.15 -1.03 0.00 3.38 -0.89 -0.42 115.31 116.79 2qj0 h LEU 618 Ca 0.19 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.10 2qj0 h LEU 618 Cb 0.18 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2qj0 h LEU 618 CO -0.20 0.12 0.01 -0.07 0.09 0.00 0.00 178.44 178.39 2qj0 h LEU 619 N 0.21 0.66 -0.29 1.67 3.38 -1.09 -0.83 115.31 119.02 2qj0 h LEU 619 Ca 0.08 -0.14 -0.20 0.00 0.09 0.00 0.00 57.88 57.70 2qj0 h LEU 619 Cb 0.01 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2qj0 h LEU 619 CO -0.05 0.73 -0.70 -0.78 0.09 0.00 0.00 178.44 177.72 2qj0 h ASP 620 N 0.66 0.78 0.66 -0.43 1.82 -0.84 -3.14 116.42 115.94 2qj0 h ASP 620 Ca 0.14 -0.49 -0.11 0.00 -0.39 0.00 0.00 57.03 56.18 2qj0 h ASP 620 Cb 0.40 -0.23 -0.02 0.00 0.68 0.00 0.00 39.33 40.16 2qj0 h ASP 620 CO 0.01 1.26 -0.54 0.15 -1.61 0.00 0.00 179.24 178.52 2qj0 h PHE 621 N 0.47 0.00 -0.96 0.28 3.57 -0.84 -0.87 116.94 118.58 2qj0 h PHE 621 Ca -0.03 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.52 2qj0 h PHE 621 Cb 1.30 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.98 2qj0 h PHE 621 CO 0.07 0.54 0.62 -0.92 -2.23 0.00 0.00 178.31 176.39 2qj0 h TYR 622 N 0.00 1.17 0.05 0.41 3.20 -1.10 -2.41 116.97 118.29 2qj0 h TYR 622 Ca -0.01 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.81 2qj0 h TYR 622 Cb 1.01 -0.39 0.01 0.00 1.54 0.00 0.00 36.73 38.91 2qj0 h TYR 622 CO 0.00 0.65 -0.36 0.28 -1.64 0.00 0.00 178.16 177.09 2qj0 h VAL 623 N 1.18 1.64 -0.19 1.81 2.07 -1.51 -3.37 116.25 117.89 2qj0 h VAL 623 Ca 0.39 -2.34 0.06 0.00 0.82 0.00 0.00 66.70 65.63 2qj0 h VAL 623 Cb 0.06 3.20 -0.01 0.00 -1.52 0.00 0.00 31.29 33.02 2qj0 h VAL 623 CO -0.14 0.64 0.14 0.40 0.02 0.00 0.00 177.57 178.63 2qj0 h ILE 624 N -0.66 0.85 0.00 4.57 2.04 -0.94 -2.60 117.51 120.77 2qj0 h ILE 624 Ca -0.06 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.76 2qj0 h ILE 624 Cb 1.25 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 2qj0 h ILE 624 CO 0.07 0.00 -0.18 -0.37 0.00 0.00 0.00 178.15 177.67 2qj0 h VAL 625 N 0.00 0.70 0.16 1.67 -1.51 -1.59 -3.13 116.25 112.55 2qj0 h VAL 625 Ca 0.09 -0.74 0.02 0.00 -1.23 0.00 0.00 66.70 64.83 2qj0 h VAL 625 Cb 0.37 1.46 -0.04 0.00 -2.13 0.00 0.00 31.29 30.96 2qj0 h VAL 625 CO -0.00 0.17 -0.32 -0.08 -1.23 0.00 0.00 177.57 176.11 2qj0 h GLU 626 N 0.00 -0.55 -0.85 5.19 4.57 -1.67 -2.04 114.58 119.22 2qj0 h GLU 626 Ca -0.00 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2qj0 h GLU 626 Cb 0.45 0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 2qj0 h GLU 626 CO 0.02 -0.37 0.00 0.36 -1.18 0.00 0.00 179.01 177.84 2qj0 n LYS 627 N -5.42 0.10 0.00 1.92 2.85 -1.18 -4.65 118.16 111.77 2qj0 n LYS 627 Ca -0.07 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.19 2qj0 n LYS 627 Cb 0.33 -1.22 0.00 0.00 -0.65 0.00 0.00 35.03 33.50 2qj0 n LYS 627 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 2qj0 n THR 628 N 0.66 0.00 0.00 0.58 -1.04 -0.77 -5.13 114.28 108.58 2qj0 n THR 628 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2qj0 n THR 628 Cb 0.03 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.54 2qj0 n THR 628 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2qj0 n GLY 629 N 2.30 2.25 3.01 3.41 0.00 -1.26 -4.99 105.19 109.91 2qj0 n GLY 629 Ca 0.00 -1.91 -0.02 0.00 0.00 0.00 0.00 46.02 44.09 2qj0 n GLY 629 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qj0 s SER 630 N 0.00 -1.44 -0.52 1.61 0.01 -1.25 -4.92 113.70 107.19 2qj0 s SER 630 Ca 0.00 -1.21 -0.01 0.00 1.31 0.00 0.00 55.95 56.04 2qj0 s SER 630 Cb 0.00 1.90 -0.01 0.00 0.21 0.00 0.00 66.02 68.12 2qj0 s SER 630 CO 0.00 -0.12 0.47 -0.24 0.41 0.00 0.00 173.24 173.76 2qj0 n SER 631 N 3.79 -5.34 -1.01 2.44 2.88 -1.26 -3.81 113.62 111.32 2qj0 n SER 631 Ca 0.14 -0.17 -0.12 0.00 -1.33 0.00 0.00 58.87 57.39 2qj0 n SER 631 Cb 0.56 -3.57 -0.05 0.00 -0.75 0.00 0.00 64.21 60.41 2qj0 n SER 631 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2qj0 n SER 632 N -1.83 -4.38 -2.43 -3.46 3.41 -1.26 -4.83 113.62 98.85 2qj0 n SER 632 Ca -0.01 0.25 -0.30 0.00 -0.26 0.00 0.00 58.87 58.55 2qj0 n SER 632 Cb 0.52 -3.05 0.02 0.00 -0.26 0.00 0.00 64.21 61.44 2qj0 n SER 632 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2qj0 n GLN 633 N -2.57 2.43 0.01 4.33 7.27 -1.25 -4.47 117.38 123.13 2qj0 n GLN 633 Ca -0.13 -2.71 -0.18 0.00 0.07 0.00 0.00 57.00 54.05 2qj0 n GLN 633 Cb 0.43 -2.10 -0.10 0.00 2.41 0.00 0.00 30.24 30.89 2qj0 n GLN 633 CO 0.00 0.00 0.00 0.35 0.07 0.00 0.00 177.06 177.48 2qj0 h PHE 634 N 2.41 0.85 0.00 3.69 3.57 -1.91 -3.32 116.94 122.23 2qj0 h PHE 634 Ca 0.47 -0.44 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2qj0 h PHE 634 Cb 0.61 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.24 2qj0 h PHE 634 CO 1.24 1.26 0.00 0.66 -2.23 0.00 0.00 178.31 179.24 2qj0 n TYR 635 N -4.05 0.00 -0.01 0.41 4.02 -1.26 -3.61 117.16 112.66 2qj0 n TYR 635 Ca -0.10 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.62 2qj0 n TYR 635 Cb 0.75 -0.02 -0.12 0.00 -0.02 0.00 0.00 39.34 39.93 2qj0 n TYR 635 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 2qj0 h ASP 636 N 0.00 0.33 -0.65 7.72 3.32 -1.93 -2.33 116.42 122.88 2qj0 h ASP 636 Ca 0.00 -0.84 0.17 0.00 0.02 0.00 0.00 57.03 56.38 2qj0 h ASP 636 Cb 0.11 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 2qj0 h ASP 636 CO 0.00 1.13 0.46 0.07 -1.72 0.00 0.00 179.24 179.18 2qj0 h LYS 637 N -0.43 0.10 0.14 3.56 2.10 -1.82 0.62 116.57 120.85 2qj0 h LYS 637 Ca -0.06 -0.01 -0.30 0.00 -2.00 0.00 0.00 60.65 58.28 2qj0 h LYS 637 Cb 1.23 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 2qj0 h LYS 637 CO 0.08 0.07 -1.42 0.74 -2.00 0.00 0.00 179.45 176.92 2qj0 h PHE 638 N 0.11 0.54 -0.11 0.07 0.04 -1.77 -2.52 116.94 113.30 2qj0 h PHE 638 Ca 0.31 -0.39 -0.17 0.00 2.80 0.00 0.00 57.97 60.52 2qj0 h PHE 638 Cb 1.09 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 39.21 2qj0 h PHE 638 CO -0.00 1.37 -0.67 -0.91 -0.60 0.00 0.00 178.31 177.51 2qj0 h ASN 639 N 0.08 0.51 -0.60 2.17 2.35 -0.51 0.28 115.58 119.87 2qj0 h ASN 639 Ca -0.21 -0.31 -0.06 0.00 -0.55 0.00 0.00 56.30 55.17 2qj0 h ASN 639 Cb 2.02 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 40.21 2qj0 h ASN 639 CO 0.19 1.03 0.16 0.28 -1.65 0.00 0.00 177.43 177.44 2qj0 h SER 640 N 0.31 0.93 0.11 5.81 0.02 0.09 -1.99 113.55 118.83 2qj0 h SER 640 Ca -0.02 -0.18 -0.17 0.00 -0.84 0.00 0.00 61.79 60.59 2qj0 h SER 640 Cb 1.23 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.52 2qj0 h SER 640 CO 0.12 0.89 -0.60 0.03 -1.14 0.00 0.00 176.83 176.13 2qj0 h ARG 641 N 0.94 0.49 -0.84 3.45 3.08 -1.14 -0.86 114.38 119.51 2qj0 h ARG 641 Ca 0.20 -0.33 0.04 0.00 0.07 0.00 0.00 59.98 59.96 2qj0 h ARG 641 Cb 0.33 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.38 2qj0 h ARG 641 CO -0.00 0.94 0.54 -0.92 -1.07 0.00 0.00 179.97 179.46 2qj0 h TYR 642 N 0.36 1.00 0.12 3.04 3.20 -0.55 0.12 116.97 124.26 2qj0 h TYR 642 Ca -0.00 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 2qj0 h TYR 642 Cb 1.15 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 39.09 2qj0 h TYR 642 CO 0.04 0.57 -0.06 0.77 -1.64 0.00 0.00 178.16 177.85 2qj0 h SER 643 N 1.04 -0.13 -0.85 -2.11 0.02 -1.11 -2.38 113.55 108.02 2qj0 h SER 643 Ca 0.34 -0.22 0.11 0.00 -0.84 0.00 0.00 61.79 61.17 2qj0 h SER 643 Cb 0.03 0.03 -0.06 0.00 0.14 0.00 0.00 62.40 62.54 2qj0 h SER 643 CO -0.12 0.16 0.55 0.40 -1.14 0.00 0.00 176.83 176.68 2qj0 h ILE 644 N -0.43 0.93 -0.00 3.27 2.04 -0.81 -1.55 117.51 120.96 2qj0 h ILE 644 Ca -0.02 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.58 2qj0 h ILE 644 Cb 0.35 0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2qj0 h ILE 644 CO 0.03 0.14 0.00 0.28 0.00 0.00 0.00 178.15 178.60 2qj0 h SER 645 N 0.78 0.00 -0.19 1.72 0.02 -0.52 -0.87 113.55 114.48 2qj0 h SER 645 Ca 0.40 -0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.39 2qj0 h SER 645 Cb 0.49 -0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.97 2qj0 h SER 645 CO -0.17 0.02 -0.22 0.40 -1.14 0.00 0.00 176.83 175.72 2qj0 h ILE 646 N -0.01 0.44 -0.39 3.27 2.04 -0.78 0.21 117.51 122.29 2qj0 h ILE 646 Ca 0.00 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.91 2qj0 h ILE 646 Cb 0.01 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.49 2qj0 h ILE 646 CO -0.00 0.00 0.14 0.40 0.00 0.00 0.00 178.15 178.69 2qj0 h ILE 647 N -0.25 0.89 -0.36 -0.67 2.04 -1.34 -1.74 117.51 116.08 2qj0 h ILE 647 Ca 0.12 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.88 2qj0 h ILE 647 Cb 0.43 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 2qj0 h ILE 647 CO -0.34 0.05 0.23 -0.07 0.00 0.00 0.00 178.15 178.03 2qj0 h LEU 648 N 0.30 0.42 -0.19 1.44 4.07 -0.33 0.29 115.31 121.31 2qj0 h LEU 648 Ca 0.18 -0.02 0.01 0.00 0.08 0.00 0.00 57.88 58.13 2qj0 h LEU 648 Cb 0.16 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 41.78 2qj0 h LEU 648 CO -0.18 0.32 0.10 -0.08 -1.08 0.00 0.00 178.44 177.51 2qj0 h GLU 649 N 0.48 0.20 0.15 1.13 4.81 -0.34 -2.55 114.58 118.47 2qj0 h GLU 649 Ca 0.13 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2qj0 h GLU 649 Cb -0.04 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.30 2qj0 h GLU 649 CO -0.03 0.13 -0.07 0.93 -0.73 0.00 0.00 179.01 179.24 2qj0 h GLU 650 N 0.21 -0.20 -1.00 1.92 4.39 -1.10 -2.59 114.58 116.21 2qj0 h GLU 650 Ca 0.08 0.01 0.29 0.00 0.34 0.00 0.00 59.36 60.08 2qj0 h GLU 650 Cb 0.01 0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.67 2qj0 h GLU 650 CO -0.05 0.16 0.79 -0.07 -1.16 0.00 0.00 179.01 178.68 2qj0 h LEU 651 N -0.59 0.00 0.08 1.33 3.38 -0.42 0.11 115.31 119.20 2qj0 h LEU 651 Ca -0.02 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.69 2qj0 h LEU 651 Cb 0.45 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2qj0 h LEU 651 CO 0.03 0.00 -1.21 0.22 0.09 0.00 0.00 178.44 177.57 2qj0 h TYR 652 N 0.00 0.31 0.00 1.13 3.20 -1.24 -2.88 116.97 117.50 2qj0 h TYR 652 Ca 0.47 -0.23 -0.02 0.00 3.14 0.00 0.00 58.73 62.10 2qj0 h TYR 652 Cb 2.05 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 40.31 2qj0 h TYR 652 CO 0.00 1.19 -0.07 1.88 -1.64 0.00 0.00 178.16 179.52 2qj0 h TYR 653 N 0.05 0.06 -0.01 -3.82 0.05 -0.44 -3.40 116.97 109.45 2qj0 h TYR 653 Ca -0.11 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.63 2qj0 h TYR 653 Cb 1.91 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 39.65 2qj0 h TYR 653 CO 0.04 0.89 -0.38 1.63 -1.05 0.00 0.00 178.16 179.30 2qj0 n LYS 654 N -4.63 1.04 -3.51 4.88 5.02 -0.58 -4.80 118.16 115.57 2qj0 n LYS 654 Ca -0.10 -0.76 -0.29 0.00 -2.02 0.00 0.00 58.31 55.14 2qj0 n LYS 654 Cb 0.45 -1.48 -0.12 0.00 -0.02 0.00 0.00 35.03 33.85 2qj0 n LYS 654 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2qj0 s ILE 655 N -2.49 0.49 0.32 -0.18 1.01 -1.09 -4.98 121.20 114.29 2qj0 s ILE 655 Ca 0.21 -2.07 0.13 0.00 0.00 0.00 0.00 60.65 58.93 2qj0 s ILE 655 Cb 0.19 -1.36 0.34 0.00 0.01 0.00 0.00 42.46 41.64 2qj0 s ILE 655 CO 0.55 -1.00 1.42 -0.81 0.00 0.00 0.00 174.94 175.10 2qj0 n PRO 656 N 3.73 -0.06 -0.28 2.79 -0.04 -1.26 0.26 135.00 140.14 2qj0 n PRO 656 Ca 0.14 1.28 0.05 0.00 -0.04 0.00 0.00 63.50 64.93 2qj0 n PRO 656 Cb 0.38 -2.21 0.14 0.00 -0.04 0.00 0.00 33.50 31.77 2qj0 n PRO 656 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2qj0 h SER 657 N 0.00 -0.59 -0.07 3.54 0.87 -1.93 -0.96 113.55 114.42 2qj0 h SER 657 Ca 0.69 0.23 -0.13 0.00 -1.23 0.00 0.00 61.79 61.35 2qj0 h SER 657 Cb 1.73 0.45 0.01 0.00 -0.44 0.00 0.00 62.40 64.15 2qj0 h SER 657 CO -0.75 -0.25 -0.48 1.88 -0.53 0.00 0.00 176.83 176.70 2qj0 h TYR 658 N 0.03 0.61 -0.89 2.24 -1.99 -0.45 -3.00 116.97 113.53 2qj0 h TYR 658 Ca 0.42 -0.29 0.22 0.00 2.00 0.00 0.00 58.73 61.09 2qj0 h TYR 658 Cb 0.71 -0.09 -0.06 0.00 2.00 0.00 0.00 36.73 39.30 2qj0 h TYR 658 CO -0.55 1.07 0.61 -0.22 -0.00 0.00 0.00 178.16 179.06 2qj0 h LYS 659 N -0.01 0.25 -0.05 4.88 3.64 -1.15 0.27 116.57 124.40 2qj0 h LYS 659 Ca -0.04 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 2qj0 h LYS 659 Cb 1.15 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.91 2qj0 h LYS 659 CO 0.10 0.17 -0.07 -0.91 -2.27 0.00 0.00 179.45 176.47 2qj0 h ASN 660 N 0.26 0.15 -0.89 4.20 4.21 -1.17 -2.91 115.58 119.44 2qj0 h ASN 660 Ca 0.45 -0.52 0.06 0.00 1.21 0.00 0.00 56.30 57.50 2qj0 h ASN 660 Cb 1.35 -0.04 -0.06 0.00 -1.12 0.00 0.00 38.32 38.45 2qj0 h ASN 660 CO -0.12 0.64 0.58 1.56 -1.29 0.00 0.00 177.43 178.80 2qj0 h GLN 661 N -0.33 1.01 0.43 0.81 4.20 -0.87 0.13 115.11 120.49 2qj0 h GLN 661 Ca 0.01 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 2qj0 h GLN 661 Cb 0.61 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 2qj0 h GLN 661 CO 0.02 0.67 -0.27 1.25 -0.67 0.00 0.00 178.83 179.83 2qj0 h LEU 662 N 1.04 -0.68 -0.76 1.46 5.85 -1.16 0.23 115.31 121.29 2qj0 h LEU 662 Ca 0.38 0.04 0.17 0.00 0.84 0.00 0.00 57.88 59.31 2qj0 h LEU 662 Cb 0.15 0.20 -0.13 0.00 0.37 0.00 0.00 40.66 41.25 2qj0 h LEU 662 CO -0.13 -0.41 0.04 0.40 -0.34 0.00 0.00 178.44 178.00 2qj0 h ILE 663 N -0.65 0.36 0.43 4.05 2.04 -1.28 -0.19 117.51 122.27 2qj0 h ILE 663 Ca -0.06 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 2qj0 h ILE 663 Cb 0.53 0.22 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 2qj0 h ILE 663 CO 0.05 0.02 -0.38 -0.25 0.00 0.00 0.00 178.15 177.59 2qj0 h TRP 664 N 0.13 -1.04 -0.86 1.37 7.01 -0.53 -2.44 115.95 119.58 2qj0 h TRP 664 Ca 0.42 0.00 0.22 0.00 2.11 0.00 0.00 58.89 61.65 2qj0 h TRP 664 Cb 0.75 0.40 -0.14 0.00 -2.10 0.00 0.00 29.16 28.07 2qj0 h TRP 664 CO -0.39 -0.54 0.24 0.37 -2.79 0.00 0.00 178.44 175.32 2qj0 h GLN 665 N -0.82 0.23 0.00 2.65 5.75 0.11 0.50 115.11 123.53 2qj0 h GLN 665 Ca -0.04 -0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.41 2qj0 h GLN 665 Cb 0.72 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 29.21 2qj0 h GLN 665 CO -0.04 0.15 -0.16 0.66 -2.65 0.00 0.00 178.83 176.79 2qj0 h SER 666 N 0.23 0.00 0.00 -0.69 4.64 -0.71 0.48 113.55 117.52 2qj0 h SER 666 Ca 0.53 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 61.45 2qj0 h SER 666 Cb 1.04 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.07 2qj0 h SER 666 CO -0.62 0.16 -2.48 0.00 -0.87 0.00 0.00 176.83 173.02 2qj0 n GLN 667 N -3.58 0.64 0.00 4.77 6.02 0.33 -3.85 117.38 121.71 2qj0 n GLN 667 Ca -0.01 0.17 0.13 0.00 -0.01 0.00 0.00 57.00 57.28 2qj0 n GLN 667 Cb 0.30 -1.52 0.28 0.00 1.02 0.00 0.00 30.24 30.33 2qj0 n GLN 667 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2qj0 n ASN 668 N -3.43 1.53 -2.72 1.08 4.13 0.15 -4.43 115.26 111.58 2qj0 n ASN 668 Ca -0.47 -1.25 -0.02 0.00 1.68 0.00 0.00 54.58 54.52 2qj0 n ASN 668 Cb 0.97 0.19 0.11 0.00 -1.54 0.00 0.00 39.78 39.51 2qj0 n ASN 668 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2qj0 n ASN 669 N -0.17 -0.65 -0.34 6.41 5.15 0.15 -4.99 115.26 120.81 2qj0 n ASN 669 Ca 0.13 -2.17 0.24 0.00 -0.60 0.00 0.00 54.58 52.18 2qj0 n ASN 669 Cb 0.40 0.38 0.49 0.00 -0.53 0.00 0.00 39.78 40.51 2qj0 n ASN 669 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2qj0 h ALA 670 N 1.45 2.03 -0.92 5.20 0.00 -1.63 0.23 119.26 125.61 2qj0 h ALA 670 Ca -0.36 0.17 0.10 0.00 0.00 0.00 0.00 54.91 54.82 2qj0 h ALA 670 Cb 1.29 0.14 -0.07 0.00 0.00 0.00 0.00 17.79 19.15 2qj0 h ALA 670 CO -0.09 -0.62 0.59 -0.44 0.00 0.00 0.00 179.25 178.70 2qj0 h ASP 671 N 0.33 0.84 0.29 0.00 3.32 -1.91 1.04 116.42 120.33 2qj0 h ASP 671 Ca 0.73 0.03 -0.30 0.00 0.02 0.00 0.00 57.03 57.50 2qj0 h ASP 671 Cb 1.70 -0.15 0.03 0.00 0.22 0.00 0.00 39.33 41.13 2qj0 h ASP 671 CO -0.56 0.49 -1.31 0.15 -1.72 0.00 0.00 179.24 176.28 2qj0 h PHE 672 N 0.93 0.88 -0.10 4.55 3.57 -0.94 -2.68 116.94 123.15 2qj0 h PHE 672 Ca 0.43 -0.60 -0.14 0.00 3.53 0.00 0.00 57.97 61.19 2qj0 h PHE 672 Cb 0.42 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 2qj0 h PHE 672 CO -0.00 1.45 -0.57 0.35 -2.23 0.00 0.00 178.31 177.31 2qj0 h PHE 673 N 0.19 0.38 -0.17 0.41 3.57 -0.56 -2.99 116.94 117.77 2qj0 h PHE 673 Ca -0.20 -0.14 -0.17 0.00 3.53 0.00 0.00 57.97 60.99 2qj0 h PHE 673 Cb 2.00 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 40.67 2qj0 h PHE 673 CO 0.11 0.80 -0.60 0.28 -2.23 0.00 0.00 178.31 176.66 2qj0 h VAL 674 N 0.23 1.32 -0.82 1.41 2.07 0.10 -1.66 116.25 118.90 2qj0 h VAL 674 Ca -0.00 -1.87 0.08 0.00 0.82 0.00 0.00 66.70 65.73 2qj0 h VAL 674 Cb 1.07 1.84 -0.07 0.00 -1.52 0.00 0.00 31.29 32.61 2qj0 h VAL 674 CO 0.09 0.58 0.49 -0.09 0.02 0.00 0.00 177.57 178.66 2qj0 h ARG 675 N 0.43 0.83 0.62 1.57 2.43 -1.38 0.19 114.38 119.08 2qj0 h ARG 675 Ca -0.00 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 2qj0 h ARG 675 Cb 1.17 -0.19 0.01 0.00 -0.42 0.00 0.00 29.97 30.53 2qj0 h ARG 675 CO 0.11 0.55 -0.30 0.35 -1.51 0.00 0.00 179.97 179.18 2qj0 h PHE 676 N 0.86 -0.77 0.00 2.20 3.57 -1.36 -3.06 116.94 118.37 2qj0 h PHE 676 Ca 0.38 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.85 2qj0 h PHE 676 Cb 0.26 0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.26 2qj0 h PHE 676 CO -0.05 -0.45 -0.03 -0.24 -2.23 0.00 0.00 178.31 175.31 2qj0 h VAL 677 N -1.16 0.57 -0.32 1.41 3.04 -1.06 -2.15 116.25 116.58 2qj0 h VAL 677 Ca -0.09 -0.12 -0.03 0.00 -1.01 0.00 0.00 66.70 65.46 2qj0 h VAL 677 Cb 0.67 1.07 -0.01 0.00 -2.01 0.00 0.00 31.29 31.01 2qj0 h VAL 677 CO 0.14 0.03 0.10 0.00 -1.01 0.00 0.00 177.57 176.83 2qj0 h ALA 678 N 1.97 0.42 0.00 3.17 0.00 -0.62 0.76 119.26 124.96 2qj0 h ALA 678 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2qj0 h ALA 678 Cb 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2qj0 h ALA 678 CO 0.00 0.06 0.00 0.54 0.00 0.00 0.00 179.25 179.85 2qj0 n ARG 679 N -4.68 0.27 0.00 0.00 5.12 -0.81 -1.03 116.66 115.54 2qj0 n ARG 679 Ca -0.02 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.90 2qj0 n ARG 679 Cb 0.17 -1.37 0.00 0.00 -1.16 0.00 0.00 32.46 30.10 2qj0 n ARG 679 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 2qj0 n LEU 681 N 0.88 0.00 -0.01 0.55 -0.00 0.26 -1.87 117.00 116.82 2qj0 n LEU 681 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 56.01 55.90 2qj0 n LEU 681 Cb 0.13 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.50 2qj0 n LEU 681 CO 0.00 0.00 0.61 0.78 -0.00 0.00 0.00 177.39 178.78 2qj0 h ASN 682 N 0.00 -1.21 -1.00 1.96 2.35 -1.34 -0.63 115.58 115.72 2qj0 h ASN 682 Ca 0.00 0.17 0.23 0.00 -0.55 0.00 0.00 56.30 56.14 2qj0 h ASN 682 Cb 0.00 0.50 -0.10 0.00 0.05 0.00 0.00 38.32 38.77 2qj0 h ASN 682 CO 0.00 -0.40 0.63 0.44 -1.65 0.00 0.00 177.43 176.45 2qj0 h ASP 683 N -0.45 0.58 0.52 5.81 5.19 -1.64 0.14 116.42 126.57 2qj0 h ASP 683 Ca 0.09 0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 2qj0 h ASP 683 Cb 0.60 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.09 2qj0 h ASP 683 CO -0.39 0.17 0.00 -0.11 -3.12 0.00 0.00 179.24 175.79 2qj0 n LEU 684 N -4.68 0.33 0.08 1.55 -0.00 -0.26 -1.17 117.00 112.85 2qj0 n LEU 684 Ca 0.24 0.59 -0.08 0.00 -0.00 0.00 0.00 56.01 56.76 2qj0 n LEU 684 Cb 0.72 -0.56 0.04 0.00 -0.00 0.00 0.00 43.42 43.62 2qj0 n LEU 684 CO 0.24 -0.46 0.34 0.71 -0.00 0.00 0.00 177.39 178.22 2qj0 h THR 685 N 0.00 1.44 0.00 1.96 1.35 -0.57 -3.38 112.91 113.70 2qj0 h THR 685 Ca 0.00 -2.32 -0.07 0.00 -0.55 0.00 0.00 66.41 63.47 2qj0 h THR 685 Cb 0.26 2.25 -0.01 0.00 -1.73 0.00 0.00 68.15 68.92 2qj0 h THR 685 CO 0.00 0.68 -1.53 2.22 -0.25 0.00 0.00 175.52 176.65 2qj0 n PHE 686 N -3.76 0.00 -0.11 4.73 1.16 -0.92 -4.69 117.46 113.86 2qj0 n PHE 686 Ca -0.03 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.45 2qj0 n PHE 686 Cb 0.73 -0.32 -0.07 0.00 -1.61 0.00 0.00 39.48 38.21 2qj0 n PHE 686 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 2qj0 h LEU 687 N 0.00 -1.31 -1.90 5.98 3.38 -1.33 0.16 115.31 120.29 2qj0 h LEU 687 Ca -0.11 0.17 0.09 0.00 0.09 0.00 0.00 57.88 58.13 2qj0 h LEU 687 Cb 0.94 0.54 -0.02 0.00 0.09 0.00 0.00 40.66 42.21 2qj0 h LEU 687 CO 0.01 -0.27 0.28 0.25 0.09 0.00 0.00 178.44 178.80 2qj0 h LEU 688 N -0.25 0.11 -0.10 1.67 5.85 -1.83 0.01 115.31 120.76 2qj0 h LEU 688 Ca 0.05 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 2qj0 h LEU 688 Cb 0.40 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.41 2qj0 h LEU 688 CO -0.43 0.07 0.02 0.44 -0.34 0.00 0.00 178.44 178.19 2qj0 h ASP 689 N 0.12 0.15 0.97 1.25 5.19 -1.04 -1.30 116.42 121.76 2qj0 h ASP 689 Ca 0.19 -0.25 -0.22 0.00 -0.62 0.00 0.00 57.03 56.13 2qj0 h ASP 689 Cb 0.59 -0.04 -0.03 0.00 0.18 0.00 0.00 39.33 40.03 2qj0 h ASP 689 CO -0.02 0.36 -1.03 1.05 -3.12 0.00 0.00 179.24 176.48 2qj0 h GLU 690 N -0.06 0.01 -0.77 3.56 4.11 -0.63 -1.75 114.58 119.06 2qj0 h GLU 690 Ca 0.03 -0.02 0.01 0.00 0.07 0.00 0.00 59.36 59.45 2qj0 h GLU 690 Cb 0.28 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 2qj0 h GLU 690 CO 0.00 0.99 0.50 0.78 0.07 0.00 0.00 179.01 181.36 2qj0 h GLY 691 N 2.96 1.08 1.94 1.06 0.00 -1.02 0.39 103.07 109.48 2qj0 h GLY 691 Ca -0.02 -0.41 -0.11 0.00 0.00 0.00 0.00 47.33 46.78 2qj0 h GLY 691 CO 0.13 0.40 -0.52 1.41 0.00 0.00 0.00 176.54 177.96 2qj0 h LEU 692 N 1.04 0.07 0.20 3.11 3.38 -0.99 -2.33 115.31 119.79 2qj0 h LEU 692 Ca 0.28 -0.03 -0.33 0.00 0.09 0.00 0.00 57.88 57.89 2qj0 h LEU 692 Cb -0.11 -0.02 0.02 0.00 0.09 0.00 0.00 40.66 40.64 2qj0 h LEU 692 CO -0.06 0.58 -1.53 -1.28 0.09 0.00 0.00 178.44 176.24 2qj0 h SER 693 N 0.05 0.68 0.36 -0.43 0.87 -0.32 -2.59 113.55 112.17 2qj0 h SER 693 Ca -0.00 -0.81 -0.07 0.00 -1.23 0.00 0.00 61.79 59.68 2qj0 h SER 693 Cb 0.94 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.67 2qj0 h SER 693 CO 0.07 1.65 -0.33 0.78 -0.53 0.00 0.00 176.83 178.48 2qj0 h ASN 694 N 0.12 0.00 0.40 6.23 2.35 -0.30 -2.42 115.58 121.96 2qj0 h ASN 694 Ca -0.26 0.00 -0.16 0.00 -0.55 0.00 0.00 56.30 55.33 2qj0 h ASN 694 Cb 2.11 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 40.47 2qj0 h ASN 694 CO 0.23 0.33 -0.68 0.25 -1.65 0.00 0.00 177.43 175.90 2qj0 h LEU 695 N 0.00 0.29 -1.07 1.61 5.85 -1.42 -2.25 115.31 118.31 2qj0 h LEU 695 Ca -0.00 -0.19 -0.08 0.00 0.84 0.00 0.00 57.88 58.45 2qj0 h LEU 695 Cb 0.60 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 2qj0 h LEU 695 CO 0.04 0.89 -0.26 0.00 -0.34 0.00 0.00 178.44 178.77 2qj0 h ALA 696 N 1.11 1.22 -0.07 1.25 0.00 -1.03 -3.11 119.26 118.64 2qj0 h ALA 696 Ca -0.02 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 2qj0 h ALA 696 Cb 1.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2qj0 h ALA 696 CO 0.11 0.51 -0.14 1.49 0.00 0.00 0.00 179.25 181.21 2qj0 h GLU 697 N 0.30 0.21 0.00 0.00 4.57 -1.32 -2.03 114.58 116.31 2qj0 h GLU 697 Ca 0.05 -0.14 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 2qj0 h GLU 697 Cb 0.62 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.23 2qj0 h GLU 697 CO 0.04 0.73 0.00 0.28 -1.18 0.00 0.00 179.01 178.89 2qj0 n VAL 698 N -4.61 0.00 0.00 0.32 0.31 -0.86 0.20 118.33 113.68 2qj0 n VAL 698 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 2qj0 n VAL 698 Cb 0.38 -0.25 0.00 0.00 -0.91 0.00 0.00 33.84 33.06 2qj0 n VAL 698 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 2qj0 n HIS 699 N -0.00 0.00 0.30 3.52 -0.00 -1.12 -4.29 115.22 113.63 2qj0 n HIS 699 Ca 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.85 2qj0 n HIS 699 Cb 0.00 0.02 0.61 0.00 -0.00 0.00 0.00 29.99 30.62 2qj0 n HIS 699 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 176.34 175.43 2qj0 h ASN 700 N 0.00 0.00 0.04 0.26 2.35 0.50 0.35 115.58 119.07 2qj0 h ASN 700 Ca 0.00 0.00 -0.38 0.00 -0.55 0.00 0.00 56.30 55.37 2qj0 h ASN 700 Cb 0.47 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.79 2qj0 h ASN 700 CO 0.00 0.00 -2.22 -0.38 -1.65 0.00 0.00 177.43 173.18 2qj0 n ILE 701 N -2.42 1.59 0.40 2.81 5.41 -0.06 -3.78 119.36 123.32 2qj0 n ILE 701 Ca 0.00 -0.51 0.08 0.00 1.00 0.00 0.00 62.75 63.32 2qj0 n ILE 701 Cb 0.16 -1.65 0.33 0.00 -0.71 0.00 0.00 39.64 37.76 2qj0 n ILE 701 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2qj0 n GLN 702 N -3.61 0.05 0.03 0.38 1.13 -1.02 -2.97 117.38 111.37 2qj0 n GLN 702 Ca -0.42 0.34 -0.06 0.00 -1.94 0.00 0.00 57.00 54.92 2qj0 n GLN 702 Cb 0.96 -1.61 -0.05 0.00 0.11 0.00 0.00 30.24 29.65 2qj0 n GLN 702 CO 0.00 0.00 0.00 -0.97 -1.44 0.00 0.00 177.06 174.65 2qj0 h ASN 703 N 0.00 -0.16 0.00 1.08 -0.73 -1.07 -3.21 115.58 111.49 2qj0 h ASN 703 Ca 0.00 -0.21 0.00 0.00 1.87 0.00 0.00 56.30 57.96 2qj0 h ASN 703 Cb 0.24 0.04 0.00 0.00 0.27 0.00 0.00 38.32 38.87 2qj0 h ASN 703 CO 0.00 0.40 0.00 -0.62 -0.37 0.00 0.00 177.43 176.85 2qj0 n GLU 704 N -4.88 0.00 -0.93 6.67 -0.58 -1.16 -2.69 120.64 117.08 2qj0 n GLU 704 Ca -0.05 0.41 -0.11 0.00 -0.42 0.00 0.00 57.16 56.99 2qj0 n GLU 704 Cb 0.18 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.46 2qj0 n GLU 704 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2qj0 n LEU 705 N -1.41 5.60 0.00 -4.62 7.99 -1.21 -5.14 117.00 118.21 2qj0 n LEU 705 Ca 0.00 -3.12 0.00 0.00 -0.01 0.00 0.00 56.01 52.88 2qj0 n LEU 705 Cb 0.00 -1.27 0.00 0.00 -0.11 0.00 0.00 43.42 42.04 2qj0 n LEU 705 CO 0.00 1.46 0.00 0.47 -1.51 0.00 0.00 177.39 177.81 2qj0 n ASP 706 N 1.73 -0.62 -4.57 -1.43 9.92 -1.09 -5.06 116.55 115.43 2qj0 n ASP 706 Ca 0.30 0.00 -0.39 0.00 -0.53 0.00 0.00 54.79 54.18 2qj0 n ASP 706 Cb 0.71 -0.79 -0.03 0.00 -0.64 0.00 0.00 41.12 40.36 2qj0 n ASP 706 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 2qj0 n GLU 719 N 0.30 1.37 -0.37 -1.24 1.02 -1.26 -4.90 120.64 115.55 2qj0 n GLU 719 Ca 0.00 0.19 -0.04 0.00 -0.02 0.00 0.00 57.16 57.29 2qj0 n GLU 719 Cb 0.05 -3.36 -0.01 0.00 -0.02 0.00 0.00 31.44 28.10 2qj0 n GLU 719 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2qj0 n ASP 720 N 14.36 -0.75 -0.33 1.62 9.92 -1.26 0.00 116.55 140.11 2qj0 n ASP 720 Ca 0.35 1.65 0.14 0.00 -0.53 0.00 0.00 54.79 56.40 2qj0 n ASP 720 Cb 0.51 -0.32 0.28 0.00 -0.64 0.00 0.00 41.12 40.95 2qj0 n ASP 720 CO 0.00 0.00 0.00 0.07 0.13 0.00 0.00 177.20 177.40 2qj0 h LYS 721 N 0.00 0.02 0.00 -1.24 2.10 -2.06 0.34 116.57 115.73 2qj0 h LYS 721 Ca 0.26 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.91 2qj0 h LYS 721 Cb 0.50 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.82 2qj0 h LYS 721 CO -0.92 0.02 -1.29 -1.91 -2.00 0.00 0.00 179.45 173.35 2qj0 n GLU 722 N -5.47 0.27 0.18 0.07 2.13 -0.85 -3.63 120.64 113.34 2qj0 n GLU 722 Ca 0.22 -0.06 0.05 0.00 0.66 0.00 0.00 57.16 58.04 2qj0 n GLU 722 Cb 0.73 -1.53 0.26 0.00 0.27 0.00 0.00 31.44 31.18 2qj0 n GLU 722 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 2qj0 h LEU 723 N 0.00 0.00 0.00 4.31 7.12 0.25 -2.26 115.31 124.74 2qj0 h LEU 723 Ca 0.00 0.00 -0.30 0.00 0.13 0.00 0.00 57.88 57.71 2qj0 h LEU 723 Cb 0.71 0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 40.78 2qj0 h LEU 723 CO 0.00 0.40 -1.82 0.00 -0.13 0.00 0.00 178.44 176.89 2qj0 n GLN 724 N -3.43 0.64 0.11 1.25 3.00 0.88 -3.02 117.38 116.80 2qj0 n GLN 724 Ca 0.00 0.25 0.13 0.00 -0.01 0.00 0.00 57.00 57.37 2qj0 n GLN 724 Cb 0.56 -1.75 0.43 0.00 0.00 0.00 0.00 30.24 29.48 2qj0 n GLN 724 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2qj0 n THR 725 N -3.00 0.63 0.05 5.09 -2.24 -1.19 -2.06 114.28 111.56 2qj0 n THR 725 Ca -0.19 -0.18 -0.21 0.00 -2.27 0.00 0.00 64.05 61.20 2qj0 n THR 725 Cb 1.07 -0.70 -0.15 0.00 -2.10 0.00 0.00 70.33 68.45 2qj0 n THR 725 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2qj0 h ARG 726 N 0.00 0.32 0.00 -0.78 9.65 -1.50 -3.03 114.38 119.04 2qj0 h ARG 726 Ca 0.00 -0.54 -0.06 0.00 -1.10 0.00 0.00 59.98 58.28 2qj0 h ARG 726 Cb 0.66 0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 29.43 2qj0 h ARG 726 CO 0.00 1.26 -0.30 1.25 2.80 0.00 0.00 179.97 184.98 2qj0 h LEU 727 N -0.29 0.00 -0.18 3.80 6.46 -1.44 -0.43 115.31 123.22 2qj0 h LEU 727 Ca -0.20 0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.54 2qj0 h LEU 727 Cb 1.74 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.67 2qj0 h LEU 727 CO 0.14 0.30 -0.10 0.00 -0.62 0.00 0.00 178.44 178.16 2qj0 h ALA 728 N 1.70 0.94 0.03 1.25 0.00 -1.49 -2.04 119.26 119.65 2qj0 h ALA 728 Ca -0.00 -0.09 -0.28 0.00 0.00 0.00 0.00 54.91 54.53 2qj0 h ALA 728 Cb 0.57 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2qj0 h ALA 728 CO 0.04 0.13 -1.53 1.03 0.00 0.00 0.00 179.25 178.91 2qj0 h SER 729 N 0.00 0.12 0.30 0.00 0.87 -1.26 -3.14 113.55 110.43 2qj0 h SER 729 Ca -0.00 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.35 2qj0 h SER 729 Cb 1.01 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 2qj0 h SER 729 CO 0.01 1.16 -0.14 0.00 -0.53 0.00 0.00 176.83 177.33 2qj0 h ALA 730 N 0.82 -0.40 -0.35 6.23 0.00 -1.00 -2.52 119.26 122.04 2qj0 h ALA 730 Ca -0.22 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2qj0 h ALA 730 Cb 1.96 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.89 2qj0 h ALA 730 CO 0.11 -0.51 0.23 0.66 0.00 0.00 0.00 179.25 179.73 2qj0 h SER 731 N -0.84 0.40 -0.44 0.00 4.64 -1.54 -1.04 113.55 114.74 2qj0 h SER 731 Ca -0.04 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.17 2qj0 h SER 731 Cb 0.52 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.49 2qj0 h SER 731 CO 0.07 0.29 -0.10 -0.09 -0.87 0.00 0.00 176.83 176.13 2qj0 h ARG 732 N 0.47 0.90 0.00 4.77 2.43 -1.53 -1.57 114.38 119.86 2qj0 h ARG 732 Ca 0.13 -0.31 -0.02 0.00 -0.81 0.00 0.00 59.98 58.97 2qj0 h ARG 732 Cb -0.05 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.43 2qj0 h ARG 732 CO -0.03 0.95 -0.08 1.96 -1.51 0.00 0.00 179.97 181.26 2qj0 h GLN 733 N 0.81 0.00 0.11 0.20 4.20 -0.89 -1.70 115.11 117.84 2qj0 h GLN 733 Ca 0.13 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.84 2qj0 h GLN 733 Cb 0.62 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.40 2qj0 h GLN 733 CO 0.04 0.08 -0.05 0.00 -0.67 0.00 0.00 178.83 178.23 2qj0 h ALA 734 N 1.92 -0.30 -0.79 3.87 0.00 -0.84 -1.95 119.26 121.17 2qj0 h ALA 734 Ca -0.00 -0.03 0.23 0.00 0.00 0.00 0.00 54.91 55.11 2qj0 h ALA 734 Cb 0.81 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 2qj0 h ALA 734 CO 0.01 -0.29 0.63 -0.22 0.00 0.00 0.00 179.25 179.38 2qj0 h LYS 735 N -0.45 0.00 0.02 0.00 3.64 -1.35 0.72 116.57 119.15 2qj0 h LYS 735 Ca -0.01 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.15 2qj0 h LYS 735 Cb 0.11 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 2qj0 h LYS 735 CO 0.02 0.00 -1.01 1.03 -2.27 0.00 0.00 179.45 177.22 2qj0 h SER 736 N 0.00 0.08 0.00 4.20 0.87 -1.36 -2.75 113.55 114.59 2qj0 h SER 736 Ca 0.38 -0.09 -0.05 0.00 -1.23 0.00 0.00 61.79 60.80 2qj0 h SER 736 Cb 1.64 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.56 2qj0 h SER 736 CO -0.00 1.04 -0.29 0.28 -0.53 0.00 0.00 176.83 177.32 2qj0 h SER 737 N 0.02 0.00 0.12 6.23 0.02 0.11 -3.03 113.55 117.02 2qj0 h SER 737 Ca -0.03 -0.77 -0.02 0.00 -0.84 0.00 0.00 61.79 60.13 2qj0 h SER 737 Cb 1.75 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.29 2qj0 h SER 737 CO 0.14 1.05 -0.07 0.00 -1.14 0.00 0.00 176.83 176.81 2qj0 h GLY 739 N 0.31 -0.54 0.86 0.00 0.00 -1.59 -2.21 103.07 99.91 2qj0 h GLY 739 Ca -0.00 0.20 0.15 0.00 0.00 0.00 0.00 47.33 47.68 2qj0 h GLY 739 CO 0.01 -0.20 0.42 -2.00 0.00 0.00 0.00 176.54 174.77 2qj0 h LEU 740 N -0.59 0.09 0.80 3.11 6.46 -1.39 -2.02 115.31 121.77 2qj0 h LEU 740 Ca -0.05 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.68 2qj0 h LEU 740 Cb 0.39 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.31 2qj0 h LEU 740 CO 0.09 0.05 -0.45 0.00 -0.62 0.00 0.00 178.44 177.51 2qj0 h ALA 741 N 1.71 -1.28 -0.54 1.25 0.00 -1.22 -0.53 119.26 118.65 2qj0 h ALA 741 Ca 0.28 -0.25 0.09 0.00 0.00 0.00 0.00 54.91 55.04 2qj0 h ALA 741 Cb 0.99 0.54 -0.07 0.00 0.00 0.00 0.00 17.79 19.24 2qj0 h ALA 741 CO -0.03 -1.22 0.13 0.22 0.00 0.00 0.00 179.25 178.35 2qj0 h ASP 742 N -1.15 0.05 0.83 0.00 3.58 -0.74 -2.11 116.42 116.87 2qj0 h ASP 742 Ca -0.11 0.09 -0.03 0.00 0.42 0.00 0.00 57.03 57.40 2qj0 h ASP 742 Cb 0.91 0.12 -0.00 0.00 1.72 0.00 0.00 39.33 42.07 2qj0 h ASP 742 CO 0.14 0.05 -0.14 0.11 -2.88 0.00 0.00 179.24 176.51 2qj0 h LYS 743 N 0.28 0.00 -1.12 0.28 1.79 -1.33 -2.51 116.57 113.97 2qj0 h LYS 743 Ca 0.27 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.60 2qj0 h LYS 743 Cb 0.37 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 30.94 2qj0 h LYS 743 CO -0.34 0.14 0.18 0.43 -1.08 0.00 0.00 179.45 178.79 2qj0 n SER 744 N -3.34 3.64 0.00 0.86 7.64 -0.21 -3.05 113.62 119.15 2qj0 n SER 744 Ca -0.00 -2.48 0.00 0.00 1.01 0.00 0.00 58.87 57.39 2qj0 n SER 744 Cb 0.36 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 62.89 2qj0 n SER 744 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2qj0 n LYS 746 N 0.19 0.00 -0.18 1.43 3.00 -0.95 -2.19 118.16 119.46 2qj0 n LYS 746 Ca 0.16 0.00 -0.10 0.00 -0.00 0.00 0.00 58.31 58.37 2qj0 n LYS 746 Cb 0.77 0.00 0.01 0.00 0.00 0.00 0.00 35.03 35.81 2qj0 n LYS 746 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 2qj0 h LEU 747 N 0.00 1.02 -0.73 3.14 3.38 -1.83 0.14 115.31 120.43 2qj0 h LEU 747 Ca 0.00 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.56 2qj0 h LEU 747 Cb 0.00 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 2qj0 h LEU 747 CO 0.00 1.13 0.21 -0.26 0.09 0.00 0.00 178.44 179.60 2qj0 h PHE 748 N 0.89 1.19 0.38 1.13 0.04 -1.76 0.11 116.94 118.92 2qj0 h PHE 748 Ca 0.14 -0.13 -0.02 0.00 2.80 0.00 0.00 57.97 60.76 2qj0 h PHE 748 Cb 0.67 -0.34 0.00 0.00 2.20 0.00 0.00 35.95 38.48 2qj0 h PHE 748 CO 0.05 0.95 -0.18 1.49 -0.60 0.00 0.00 178.31 180.01 2qj0 h GLU 749 N 1.08 -0.49 -0.72 1.51 4.81 -1.77 -0.88 114.58 118.13 2qj0 h GLU 749 Ca 0.23 0.03 0.14 0.00 -0.13 0.00 0.00 59.36 59.64 2qj0 h GLU 749 Cb 0.34 0.11 -0.14 0.00 0.63 0.00 0.00 28.75 29.69 2qj0 h GLU 749 CO -0.00 -0.33 -0.18 0.82 -0.73 0.00 0.00 179.01 178.59 2qj0 h ILE 750 N -0.52 0.28 -0.22 2.32 2.04 -0.66 -2.45 117.51 118.30 2qj0 h ILE 750 Ca -0.05 0.00 -0.20 0.00 1.00 0.00 0.00 64.86 65.61 2qj0 h ILE 750 Cb 0.39 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.76 2qj0 h ILE 750 CO 0.09 0.00 -0.66 1.88 0.00 0.00 0.00 178.15 179.46 2qj0 h TYR 751 N -0.00 1.05 -0.04 1.37 -1.99 -0.81 -3.21 116.97 113.34 2qj0 h TYR 751 Ca 0.34 -0.42 -0.04 0.00 2.00 0.00 0.00 58.73 60.62 2qj0 h TYR 751 Cb 0.52 -0.18 -0.01 0.00 2.00 0.00 0.00 36.73 39.07 2qj0 h TYR 751 CO -0.58 1.24 -0.16 0.66 -0.00 0.00 0.00 178.16 179.33 2qj0 h SER 752 N 0.59 0.06 -0.93 3.88 4.64 -0.79 -1.73 113.55 119.28 2qj0 h SER 752 Ca -0.02 -0.01 0.08 0.00 -0.47 0.00 0.00 61.79 61.37 2qj0 h SER 752 Cb 1.27 -0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 63.28 2qj0 h SER 752 CO 0.14 0.23 0.60 0.50 -0.87 0.00 0.00 176.83 177.43 2qj0 h LYS 753 N 0.06 0.99 0.00 4.77 1.63 -1.45 -2.54 116.57 120.04 2qj0 h LYS 753 Ca 0.01 -0.06 -0.36 0.00 -0.85 0.00 0.00 60.65 59.40 2qj0 h LYS 753 Cb 0.33 -0.22 -0.07 0.00 -0.60 0.00 0.00 32.23 31.66 2qj0 h LYS 753 CO 0.02 0.66 -2.31 -0.25 -3.45 0.00 0.00 179.45 174.12 2qj0 n ASP 754 N -4.51 0.10 -2.98 4.20 8.00 -0.98 -4.69 116.55 115.69 2qj0 n ASP 754 Ca 0.15 0.05 -0.22 0.00 0.71 0.00 0.00 54.79 55.48 2qj0 n ASP 754 Cb 0.23 0.89 -0.03 0.00 -0.02 0.00 0.00 41.12 42.19 2qj0 n ASP 754 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 2qj0 n ILE 755 N -2.78 1.55 -0.16 0.53 -5.35 -0.69 -4.92 119.36 107.55 2qj0 n ILE 755 Ca -0.31 -4.93 0.22 0.00 -0.27 0.00 0.00 62.75 57.47 2qj0 n ILE 755 Cb 1.14 -0.77 0.63 0.00 -1.74 0.00 0.00 39.64 38.90 2qj0 n ILE 755 CO 0.00 0.00 0.00 -0.65 -1.76 0.00 0.00 176.55 174.14 2qj0 h PRO 756 N 2.96 0.16 -0.94 6.28 0.11 -1.67 -1.91 132.00 136.99 2qj0 h PRO 756 Ca 0.11 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.31 2qj0 h PRO 756 Cb 0.78 -0.04 -0.07 0.00 0.11 0.00 0.00 31.00 31.78 2qj0 h PRO 756 CO 0.67 0.11 0.59 0.00 -0.21 0.00 0.00 178.00 179.15 2qj0 h ALA 757 N 1.62 1.36 -0.05 -0.75 0.00 -1.91 -1.99 119.26 117.54 2qj0 h ALA 757 Ca 0.39 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.31 2qj0 h ALA 757 Cb 1.30 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2qj0 h ALA 757 CO -0.07 0.26 0.01 0.00 0.00 0.00 0.00 179.25 179.45 2qj0 h ALA 758 N 1.48 1.93 -0.11 0.00 0.00 -1.71 -2.18 119.26 118.66 2qj0 h ALA 758 Ca 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.33 2qj0 h ALA 758 Cb 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2qj0 h ALA 758 CO -0.23 0.06 0.00 1.19 0.00 0.00 0.00 179.25 180.27 2qj0 n PHE 759 N -4.51 0.14 -0.04 0.00 3.72 -0.75 -3.81 117.46 112.21 2qj0 n PHE 759 Ca -0.02 -0.07 0.03 0.00 -0.05 0.00 0.00 57.45 57.34 2qj0 n PHE 759 Cb 0.11 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 38.72 2qj0 n PHE 759 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 2qj0 n VAL 760 N 0.08 0.85 -1.95 -4.37 0.24 -0.82 -3.77 118.33 108.59 2qj0 n VAL 760 Ca 0.16 -0.92 -0.40 0.00 -2.04 0.00 0.00 64.34 61.14 2qj0 n VAL 760 Cb 0.28 0.60 -0.01 0.00 -1.47 0.00 0.00 33.84 33.24 2qj0 n VAL 760 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2qj0 s THR 761 N -0.92 2.36 0.31 3.34 -1.32 -1.24 -4.57 115.64 113.61 2qj0 s THR 761 Ca 0.11 0.35 0.09 0.00 -1.21 0.00 0.00 61.69 61.03 2qj0 s THR 761 Cb 0.06 -3.22 0.37 0.00 -1.51 0.00 0.00 72.50 68.20 2qj0 s THR 761 CO 0.08 0.07 1.46 -0.81 -2.21 0.00 0.00 174.62 173.22 2qj0 n PRO 762 N 0.41 -0.07 0.00 7.08 -0.04 -1.26 -0.67 135.00 140.45 2qj0 n PRO 762 Ca 0.02 1.35 0.11 0.00 -0.04 0.00 0.00 63.50 64.94 2qj0 n PRO 762 Cb 0.41 -2.25 0.51 0.00 -0.04 0.00 0.00 33.50 32.13 2qj0 n PRO 762 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2qj0 n GLU 763 N -5.27 0.12 -0.04 0.54 0.28 -1.26 -3.87 120.64 111.15 2qj0 n GLU 763 Ca 0.27 0.10 -0.05 0.00 -0.16 0.00 0.00 57.16 57.32 2qj0 n GLU 763 Cb 0.91 -1.50 -0.04 0.00 1.43 0.00 0.00 31.44 32.24 2qj0 n GLU 763 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2qj0 n ILE 764 N -1.42 0.44 0.01 3.84 2.08 0.16 -4.74 119.36 119.73 2qj0 n ILE 764 Ca 0.07 -0.18 -0.11 0.00 0.56 0.00 0.00 62.75 63.10 2qj0 n ILE 764 Cb 0.23 -0.78 -0.04 0.00 -0.75 0.00 0.00 39.64 38.29 2qj0 n ILE 764 CO 0.00 0.00 0.00 1.62 0.56 0.00 0.00 176.55 178.73 2qj0 h VAL 765 N 0.00 0.32 -0.45 1.39 3.04 -1.29 0.40 116.25 119.67 2qj0 h VAL 765 Ca -0.17 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.48 2qj0 h VAL 765 Cb 1.28 0.32 -0.02 0.00 -2.01 0.00 0.00 31.29 30.87 2qj0 h VAL 765 CO -0.02 0.00 0.13 1.88 -1.01 0.00 0.00 177.57 178.55 2qj0 h TYR 766 N -0.38 0.73 -0.43 3.17 0.05 -1.85 -0.32 116.97 117.94 2qj0 h TYR 766 Ca 0.09 -0.08 -0.10 0.00 0.05 0.00 0.00 58.73 58.69 2qj0 h TYR 766 Cb 0.52 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 38.04 2qj0 h TYR 766 CO -0.38 0.66 -0.14 0.00 -1.05 0.00 0.00 178.16 177.25 2qj0 h ARG 767 N 0.59 0.79 -0.49 4.88 2.47 -1.81 -2.31 114.38 118.49 2qj0 h ARG 767 Ca 0.14 -0.28 -0.04 0.00 -1.26 0.00 0.00 59.98 58.54 2qj0 h ARG 767 Cb 0.28 -0.06 -0.02 0.00 -1.65 0.00 0.00 29.97 28.52 2qj0 h ARG 767 CO -0.00 0.89 0.13 1.25 0.56 0.00 0.00 179.97 182.80 2qj0 h LEU 768 N 0.71 0.74 -0.46 3.04 5.85 0.06 -2.98 115.31 122.27 2qj0 h LEU 768 Ca 0.11 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 2qj0 h LEU 768 Cb 0.64 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 2qj0 h LEU 768 CO 0.04 0.77 0.19 0.00 -0.34 0.00 0.00 178.44 179.10 2qj0 h ALA 769 N 1.00 0.60 0.00 1.25 0.00 -0.96 -1.83 119.26 119.33 2qj0 h ALA 769 Ca 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2qj0 h ALA 769 Cb 0.31 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2qj0 h ALA 769 CO -0.00 0.20 0.00 0.45 0.00 0.00 0.00 179.25 179.89 2qj0 n SER 770 N -4.60 0.59 0.00 0.00 2.88 -0.88 -1.54 113.62 110.07 2qj0 n SER 770 Ca 0.01 -0.55 0.00 0.00 -1.33 0.00 0.00 58.87 57.00 2qj0 n SER 770 Cb 0.14 -0.14 0.00 0.00 -0.75 0.00 0.00 64.21 63.47 2qj0 n SER 770 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2qj0 n LEU 772 N 0.65 0.00 0.00 2.46 4.77 -0.69 -1.66 117.00 122.53 2qj0 n LEU 772 Ca 0.00 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.03 2qj0 n LEU 772 Cb 0.11 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 41.65 2qj0 n LEU 772 CO 0.00 0.00 1.16 0.78 -1.33 0.00 0.00 177.39 178.00 2qj0 h ASN 773 N 0.00 0.43 -0.18 -1.43 -0.26 -1.54 0.13 115.58 112.73 2qj0 h ASN 773 Ca 0.00 -0.01 -0.04 0.00 -0.56 0.00 0.00 56.30 55.69 2qj0 h ASN 773 Cb 0.00 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 37.15 2qj0 h ASN 773 CO 0.00 0.30 -0.04 0.22 -1.06 0.00 0.00 177.43 176.85 2qj0 h TYR 774 N 0.50 0.38 -0.35 1.19 3.20 -1.56 -1.33 116.97 119.00 2qj0 h TYR 774 Ca 0.16 -0.08 -0.17 0.00 3.14 0.00 0.00 58.73 61.78 2qj0 h TYR 774 Cb 0.03 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 38.21 2qj0 h TYR 774 CO -0.00 0.60 -0.44 -0.91 -1.64 0.00 0.00 178.16 175.77 2qj0 h ASN 775 N 0.05 1.00 -0.75 -2.11 4.21 -1.75 -2.71 115.58 113.52 2qj0 h ASN 775 Ca 0.04 -0.49 0.10 0.00 1.21 0.00 0.00 56.30 57.17 2qj0 h ASN 775 Cb 0.48 -0.28 -0.08 0.00 -1.12 0.00 0.00 38.32 37.32 2qj0 h ASN 775 CO 0.02 1.29 0.38 0.25 -1.29 0.00 0.00 177.43 178.08 2qj0 h LEU 776 N 0.74 0.50 -1.28 1.61 5.85 -0.69 0.32 115.31 122.36 2qj0 h LEU 776 Ca 0.04 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.84 2qj0 h LEU 776 Cb 1.05 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.02 2qj0 h LEU 776 CO 0.11 0.27 0.50 -0.08 -0.34 0.00 0.00 178.44 178.89 2qj0 h GLU 777 N 0.63 0.95 0.49 1.25 4.81 -0.98 -0.99 114.58 120.75 2qj0 h GLU 777 Ca 0.38 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.52 2qj0 h GLU 777 Cb 0.42 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.58 2qj0 h GLU 777 CO -0.28 0.63 -0.24 0.77 -0.73 0.00 0.00 179.01 179.16 2qj0 h SER 778 N 0.98 -0.56 -0.72 1.04 0.02 -0.70 -2.79 113.55 110.82 2qj0 h SER 778 Ca 0.28 -0.05 0.11 0.00 -0.84 0.00 0.00 61.79 61.29 2qj0 h SER 778 Cb -0.07 0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.57 2qj0 h SER 778 CO -0.07 -0.16 0.48 -0.07 -1.14 0.00 0.00 176.83 175.87 2qj0 h LEU 779 N -1.08 0.49 0.00 5.07 3.38 -0.97 -2.42 115.31 119.78 2qj0 h LEU 779 Ca -0.07 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2qj0 h LEU 779 Cb 0.58 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2qj0 h LEU 779 CO 0.11 0.28 -0.57 0.52 0.09 0.00 0.00 178.44 178.87 2qj0 n VAL 780 N -4.49 0.09 -3.61 1.22 0.31 -0.39 -4.74 118.33 106.72 2qj0 n VAL 780 Ca 0.13 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 2qj0 n VAL 780 Cb 0.40 0.17 0.00 0.00 -0.91 0.00 0.00 33.84 33.50 2qj0 n VAL 780 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2qj0 n GLY 781 N 1.46 5.54 0.42 2.92 0.00 -0.92 -4.95 105.19 109.65 2qj0 n GLY 781 Ca 0.05 -2.09 0.23 0.00 0.00 0.00 0.00 46.02 44.21 2qj0 n GLY 781 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qj0 h PRO 782 N 0.00 0.33 -0.82 1.61 0.13 -1.85 0.32 132.00 131.71 2qj0 h PRO 782 Ca 0.00 -0.02 0.19 0.00 -0.87 0.00 0.00 66.00 65.30 2qj0 h PRO 782 Cb 0.00 -0.07 -0.12 0.00 0.13 0.00 0.00 31.00 30.94 2qj0 h PRO 782 CO 0.00 0.22 0.28 0.87 -0.23 0.00 0.00 178.00 179.14 2qj0 h LYS 783 N 0.34 0.33 0.00 0.86 1.57 -1.87 -0.46 116.57 117.33 2qj0 h LYS 783 Ca 0.53 -0.02 -0.37 0.00 -1.87 0.00 0.00 60.65 58.92 2qj0 h LYS 783 Cb 1.46 -0.07 -0.07 0.00 0.08 0.00 0.00 32.23 33.63 2qj0 h LYS 783 CO -0.20 0.22 -2.39 0.00 -0.57 0.00 0.00 179.45 176.50 2qj0 n GLY 785 N 1.77 -0.85 0.00 0.00 0.00 0.11 -2.59 105.19 103.63 2qj0 n GLY 785 Ca -0.33 -0.03 0.03 0.00 0.00 0.00 0.00 46.02 45.69 2qj0 n GLY 785 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qj0 n GLU 786 N -1.51 4.11 -1.88 1.61 1.02 -0.25 -4.90 120.64 118.83 2qj0 n GLU 786 Ca 0.02 -0.01 -0.42 0.00 -0.02 0.00 0.00 57.16 56.74 2qj0 n GLU 786 Cb 0.12 -0.87 -0.02 0.00 -0.02 0.00 0.00 31.44 30.65 2qj0 n GLU 786 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2qj0 s LEU 787 N -2.49 4.37 -0.56 -4.62 2.96 -1.07 -4.96 118.68 112.31 2qj0 s LEU 787 Ca 0.02 2.77 0.05 0.00 -0.22 0.00 0.00 54.13 56.75 2qj0 s LEU 787 Cb 0.05 -3.61 0.20 0.00 0.50 0.00 0.00 46.19 43.32 2qj0 s LEU 787 CO 0.28 -0.84 0.50 2.29 -1.32 0.00 0.00 176.35 177.25 2qj0 n LYS 788 N 2.98 1.28 -3.29 1.98 0.00 -1.26 -5.07 118.16 114.78 2qj0 n LYS 788 Ca 0.10 -3.93 -0.33 0.00 -0.00 0.00 0.00 58.31 54.15 2qj0 n LYS 788 Cb 0.38 -1.94 -0.06 0.00 -0.00 0.00 0.00 35.03 33.42 2qj0 n LYS 788 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 2qj0 s VAL 789 N -1.13 4.81 0.00 0.58 -7.23 -1.26 -5.01 120.40 111.15 2qj0 s VAL 789 Ca 0.31 0.77 0.00 0.00 -1.81 0.00 0.00 61.98 61.25 2qj0 s VAL 789 Cb 0.05 -3.67 0.00 0.00 0.56 0.00 0.00 36.38 33.32 2qj0 s VAL 789 CO -0.14 0.00 0.40 0.29 -0.31 0.00 0.00 175.10 175.34 2qj0 n LYS 790 N 0.12 0.00 -3.76 4.82 5.02 -1.26 -4.25 118.16 118.85 2qj0 n LYS 790 Ca -0.00 0.36 -0.28 0.00 -2.02 0.00 0.00 58.31 56.36 2qj0 n LYS 790 Cb 0.52 -0.90 -0.12 0.00 -0.02 0.00 0.00 35.03 34.51 2qj0 n LYS 790 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2qj0 s ASP 791 N -2.91 3.78 0.00 4.39 2.15 -1.26 -5.04 116.67 117.78 2qj0 s ASP 791 Ca 0.00 -3.28 0.00 0.00 0.43 0.00 0.00 52.55 49.70 2qj0 s ASP 791 Cb 0.00 -1.24 0.00 0.00 -0.30 0.00 0.00 42.92 41.38 2qj0 s ASP 791 CO 0.00 -0.17 0.01 -2.65 -0.17 0.00 0.00 175.17 172.19 2qj0 n PRO 792 N 2.69 0.00 -0.35 4.34 -0.02 -1.26 -0.53 135.00 139.87 2qj0 n PRO 792 Ca 0.17 0.01 0.29 0.00 -2.02 0.00 0.00 63.50 61.95 2qj0 n PRO 792 Cb 0.37 -0.01 0.55 0.00 -0.02 0.00 0.00 33.50 34.39 2qj0 n PRO 792 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2qj0 h GLN 793 N 0.00 0.16 -0.92 -0.52 1.08 -1.97 -1.08 115.11 111.86 2qj0 h GLN 793 Ca 0.00 -0.01 0.23 0.00 -1.45 0.00 0.00 58.65 57.42 2qj0 h GLN 793 Cb 0.00 -0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 27.34 2qj0 h GLN 793 CO 0.00 0.11 0.63 0.66 -0.95 0.00 0.00 178.83 179.28 2qj0 h SER 794 N 0.17 0.25 -0.65 1.46 4.64 -1.20 -0.27 113.55 117.95 2qj0 h SER 794 Ca 0.79 0.03 -0.18 0.00 -0.47 0.00 0.00 61.79 61.96 2qj0 h SER 794 Cb 2.05 -0.01 -0.11 0.00 -0.31 0.00 0.00 62.40 64.01 2qj0 h SER 794 CO -0.62 0.09 0.20 -1.22 -0.87 0.00 0.00 176.83 174.41 2qj0 n TYR 795 N -4.43 2.18 -3.84 4.77 4.01 -0.41 -4.93 117.16 114.52 2qj0 n TYR 795 Ca 0.20 -1.18 -0.27 0.00 -0.16 0.00 0.00 57.90 56.49 2qj0 n TYR 795 Cb 0.83 -0.63 0.03 0.00 -0.31 0.00 0.00 39.34 39.26 2qj0 n TYR 795 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2qj0 n SER 796 N -0.23 -3.63 -4.02 7.72 7.64 -0.11 -3.59 113.62 117.40 2qj0 n SER 796 Ca 0.38 -0.79 -0.33 0.00 1.01 0.00 0.00 58.87 59.14 2qj0 n SER 796 Cb 1.30 -3.97 -0.12 0.00 -1.01 0.00 0.00 64.21 60.42 2qj0 n SER 796 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 2qj0 s PHE 797 N -3.43 3.31 -0.81 1.43 5.36 -1.23 -3.88 117.98 118.73 2qj0 s PHE 797 Ca 0.44 -2.97 -0.00 0.00 -0.96 0.00 0.00 56.93 53.43 2qj0 s PHE 797 Cb -0.22 -3.00 0.20 0.00 -0.34 0.00 0.00 43.02 39.66 2qj0 s PHE 797 CO 0.82 -0.78 0.67 -0.80 -1.46 0.00 0.00 175.22 173.67 2qj0 s ASN 798 N 0.10 5.61 0.20 6.13 0.01 -1.26 -4.30 114.94 121.43 2qj0 s ASN 798 Ca 0.18 -3.65 -0.16 0.00 -0.71 0.00 0.00 52.86 48.52 2qj0 s ASN 798 Cb -0.22 -1.83 0.19 0.00 0.41 0.00 0.00 41.25 39.80 2qj0 s ASN 798 CO -0.02 -0.18 1.62 1.55 -1.51 0.00 0.00 177.10 178.56 2qj0 h PRO 799 N 5.97 -0.04 -0.50 -0.60 0.13 -1.99 -1.45 132.00 133.52 2qj0 h PRO 799 Ca 0.13 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.25 2qj0 h PRO 799 Cb 0.81 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.93 2qj0 h PRO 799 CO 0.80 -0.03 0.24 0.87 -0.23 0.00 0.00 178.00 179.65 2qj0 h LYS 800 N -0.05 0.70 0.00 0.86 1.57 -1.96 -0.46 116.57 117.23 2qj0 h LYS 800 Ca 0.27 -0.08 -0.11 0.00 -1.87 0.00 0.00 60.65 58.86 2qj0 h LYS 800 Cb 0.46 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 2qj0 h LYS 800 CO -0.62 0.55 -0.52 -0.44 -0.57 0.00 0.00 179.45 177.85 2qj0 h ASP 801 N 0.70 0.00 0.43 0.86 5.19 -1.72 -2.73 116.42 119.15 2qj0 h ASP 801 Ca 0.17 0.00 -0.27 0.00 -0.62 0.00 0.00 57.03 56.31 2qj0 h ASP 801 Cb 0.08 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.60 2qj0 h ASP 801 CO -0.02 0.52 -1.18 0.25 -3.12 0.00 0.00 179.24 175.68 2qj0 h LEU 802 N 0.00 0.58 -1.51 1.55 5.85 -0.63 -2.83 115.31 118.32 2qj0 h LEU 802 Ca -0.01 -0.55 -0.05 0.00 0.84 0.00 0.00 57.88 58.11 2qj0 h LEU 802 Cb 1.04 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 2qj0 h LEU 802 CO 0.07 1.40 -0.20 0.25 -0.34 0.00 0.00 178.44 179.61 2qj0 h LEU 803 N 0.16 0.05 -0.19 2.25 5.85 -1.04 -1.43 115.31 120.97 2qj0 h LEU 803 Ca -0.14 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.45 2qj0 h LEU 803 Cb 1.87 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.89 2qj0 h LEU 803 CO 0.21 0.26 -0.33 0.50 -0.34 0.00 0.00 178.44 178.74 2qj0 h LYS 804 N 0.05 0.56 -0.30 1.25 1.63 -1.41 -1.94 116.57 116.41 2qj0 h LYS 804 Ca 0.01 -0.35 -0.06 0.00 -0.85 0.00 0.00 60.65 59.40 2qj0 h LYS 804 Cb 0.39 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.05 2qj0 h LYS 804 CO 0.03 0.96 -0.09 0.00 -3.45 0.00 0.00 179.45 176.90 2qj0 h ALA 805 N 0.60 1.29 0.40 5.00 0.00 -1.22 -1.54 119.26 123.79 2qj0 h ALA 805 Ca 0.01 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2qj0 h ALA 805 Cb 0.92 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2qj0 h ALA 805 CO 0.08 0.47 -0.19 1.25 0.00 0.00 0.00 179.25 180.86 2qj0 h LEU 806 N 0.47 -0.46 -1.28 0.00 5.85 -1.18 -2.51 115.31 116.19 2qj0 h LEU 806 Ca 0.09 0.02 0.17 0.00 0.84 0.00 0.00 57.88 58.99 2qj0 h LEU 806 Cb 0.44 0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.51 2qj0 h LEU 806 CO 0.02 -0.32 0.59 0.71 -0.34 0.00 0.00 178.44 179.11 2qj0 h THR 807 N -0.57 0.77 -0.08 1.05 1.35 -1.35 0.25 112.91 114.33 2qj0 h THR 807 Ca -0.06 -0.22 -0.03 0.00 -0.55 0.00 0.00 66.41 65.55 2qj0 h THR 807 Cb 0.42 0.07 -0.01 0.00 -1.73 0.00 0.00 68.15 66.90 2qj0 h THR 807 CO 0.09 0.12 -0.09 0.74 -0.25 0.00 0.00 175.52 176.12 2qj0 h THR 808 N 0.64 1.12 -0.32 6.82 2.02 -1.24 -1.67 112.91 120.28 2qj0 h THR 808 Ca 0.48 -0.52 -0.06 0.00 0.77 0.00 0.00 66.41 67.08 2qj0 h THR 808 Cb 0.87 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 68.43 2qj0 h THR 808 CO -0.23 0.16 -0.05 0.58 0.37 0.00 0.00 175.52 176.34 2qj0 h VAL 809 N 0.12 1.27 -0.31 3.16 2.07 -0.05 -1.00 116.25 121.51 2qj0 h VAL 809 Ca 0.03 -1.07 0.07 0.00 0.82 0.00 0.00 66.70 66.54 2qj0 h VAL 809 Cb 0.25 1.32 -0.07 0.00 -1.52 0.00 0.00 31.29 31.27 2qj0 h VAL 809 CO 0.01 0.35 -0.12 1.88 0.02 0.00 0.00 177.57 179.71 2qj0 h TYR 810 N 0.38 -0.27 -0.63 1.57 0.05 -1.05 -2.00 116.97 115.03 2qj0 h TYR 810 Ca 0.08 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.89 2qj0 h TYR 810 Cb 0.53 0.17 -0.03 0.00 1.01 0.00 0.00 36.73 38.41 2qj0 h TYR 810 CO 0.05 -0.18 0.37 0.82 -1.05 0.00 0.00 178.16 178.16 2qj0 h ILE 811 N -0.06 1.18 0.00 -2.88 2.04 -1.19 0.19 117.51 116.79 2qj0 h ILE 811 Ca 0.16 -0.41 0.00 0.00 1.00 0.00 0.00 64.86 65.61 2qj0 h ILE 811 Cb 0.29 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2qj0 h ILE 811 CO -0.35 0.19 0.00 0.59 0.00 0.00 0.00 178.15 178.58 2qj0 n ASN 812 N -4.40 0.00 -0.00 1.72 5.03 -0.39 -3.03 115.26 114.18 2qj0 n ASN 812 Ca 0.06 0.29 0.00 0.00 0.87 0.00 0.00 54.58 55.80 2qj0 n ASN 812 Cb 0.08 -0.41 -0.00 0.00 -1.02 0.00 0.00 39.78 38.43 2qj0 n ASN 812 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2qj0 n LEU 813 N -1.41 0.02 0.30 3.41 4.77 -0.58 -4.73 117.00 118.77 2qj0 n LEU 813 Ca 0.06 -0.49 0.11 0.00 -0.03 0.00 0.00 56.01 55.67 2qj0 n LEU 813 Cb 0.19 0.00 0.54 0.00 -2.33 0.00 0.00 43.42 41.82 2qj0 n LEU 813 CO 0.16 0.01 1.10 0.77 -1.33 0.00 0.00 177.39 178.09 2qj0 h SER 814 N 0.00 0.00 -0.67 -1.43 4.64 -0.58 0.79 113.55 116.30 2qj0 h SER 814 Ca 0.00 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.98 2qj0 h SER 814 Cb 0.01 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 61.90 2qj0 h SER 814 CO 0.00 0.00 0.28 -1.84 -0.87 0.00 0.00 176.83 174.40 2qj0 n GLU 815 N -2.84 2.12 -3.85 4.77 0.28 -1.26 -4.83 120.64 115.03 2qj0 n GLU 815 Ca 0.00 -3.10 -0.35 0.00 -0.16 0.00 0.00 57.16 53.55 2qj0 n GLU 815 Cb 0.64 -2.00 -0.13 0.00 1.43 0.00 0.00 31.44 31.37 2qj0 n GLU 815 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 2qj0 s GLN 816 N -3.26 2.28 0.22 3.44 -1.52 0.27 -5.01 119.66 116.08 2qj0 s GLN 816 Ca 0.51 -1.45 -0.10 0.00 -1.95 0.00 0.00 55.36 52.36 2qj0 s GLN 816 Cb 0.44 -3.34 0.31 0.00 -0.22 0.00 0.00 33.01 30.20 2qj0 s GLN 816 CO 0.06 -0.78 1.66 0.66 -0.25 0.00 0.00 175.29 176.64 2qj0 h SER 817 N 8.03 -0.27 -0.99 5.90 4.64 -1.88 -1.14 113.55 127.84 2qj0 h SER 817 Ca -0.18 0.16 0.03 0.00 -0.47 0.00 0.00 61.79 61.32 2qj0 h SER 817 Cb 1.06 0.27 -0.05 0.00 -0.31 0.00 0.00 62.40 63.37 2qj0 h SER 817 CO 0.59 -0.12 0.65 -0.33 -0.87 0.00 0.00 176.83 176.76 2qj0 h GLU 818 N 0.12 1.24 -0.02 4.77 3.07 -1.95 -0.22 114.58 121.60 2qj0 h GLU 818 Ca 0.33 -0.07 -0.00 0.00 -0.50 0.00 0.00 59.36 59.11 2qj0 h GLU 818 Cb 0.54 -0.28 -0.00 0.00 -0.84 0.00 0.00 28.75 28.17 2qj0 h GLU 818 CO -0.54 0.82 -0.00 0.35 -1.40 0.00 0.00 179.01 178.24 2qj0 h PHE 819 N 1.28 0.04 -0.65 4.33 3.57 -1.56 -1.22 116.94 122.73 2qj0 h PHE 819 Ca 0.38 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.85 2qj0 h PHE 819 Cb -0.05 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 2qj0 h PHE 819 CO -0.00 0.39 0.29 -0.84 -2.23 0.00 0.00 178.31 175.92 2qj0 h ILE 820 N -0.32 1.22 0.15 1.41 -0.00 -1.20 -1.19 117.51 117.57 2qj0 h ILE 820 Ca 0.00 -0.63 0.00 0.00 -0.00 0.00 0.00 64.86 64.23 2qj0 h ILE 820 Cb 0.37 0.41 -0.01 0.00 -0.00 0.00 0.00 36.82 37.59 2qj0 h ILE 820 CO 0.00 0.26 -0.12 -1.28 -0.00 0.00 0.00 178.15 177.01 2qj0 h SER 821 N 0.92 -0.32 -0.32 2.16 0.87 -0.91 -1.47 113.55 114.47 2qj0 h SER 821 Ca 0.22 0.03 0.04 0.00 -1.23 0.00 0.00 61.79 60.85 2qj0 h SER 821 Cb 0.12 0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.16 2qj0 h SER 821 CO -0.03 -0.20 0.11 0.00 -0.53 0.00 0.00 176.83 176.19 2qj0 h ALA 822 N 0.54 0.36 -0.46 6.23 0.00 -0.72 -0.62 119.26 124.60 2qj0 h ALA 822 Ca -0.00 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2qj0 h ALA 822 Cb 0.26 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2qj0 h ALA 822 CO -0.02 -0.29 0.30 0.28 0.00 0.00 0.00 179.25 179.53 2qj0 h VAL 823 N 0.25 1.11 -0.12 0.00 2.07 -1.14 -1.09 116.25 117.32 2qj0 h VAL 823 Ca 0.14 -0.21 -0.17 0.00 0.82 0.00 0.00 66.70 67.28 2qj0 h VAL 823 Cb 0.12 0.45 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2qj0 h VAL 823 CO -0.15 0.11 -0.65 0.00 0.02 0.00 0.00 177.57 176.90 2qj0 h ALA 824 N 1.72 0.63 -0.01 1.67 0.00 -0.44 -3.23 119.26 119.61 2qj0 h ALA 824 Ca 0.17 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2qj0 h ALA 824 Cb -0.04 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2qj0 h ALA 824 CO -0.04 0.72 -0.15 1.63 0.00 0.00 0.00 179.25 181.41 2qj0 n LYS 825 N -3.90 0.87 -2.19 0.00 5.02 -0.32 -4.73 118.16 112.92 2qj0 n LYS 825 Ca -0.04 -0.42 -0.33 0.00 -2.02 0.00 0.00 58.31 55.50 2qj0 n LYS 825 Cb 0.66 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 34.14 2qj0 n LYS 825 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2qj0 s ASP 826 N -2.41 5.53 0.11 4.39 2.15 -0.51 -4.83 116.67 121.09 2qj0 s ASP 826 Ca 0.29 -0.60 -0.26 0.00 0.43 0.00 0.00 52.55 52.41 2qj0 s ASP 826 Cb 0.20 -2.56 -0.09 0.00 -0.30 0.00 0.00 42.92 40.17 2qj0 s ASP 826 CO 0.47 -2.34 1.66 -0.33 -0.17 0.00 0.00 175.17 174.47 2qj0 h GLU 827 N 11.66 -0.37 -0.91 4.34 5.08 -1.91 -2.98 114.58 129.49 2qj0 h GLU 827 Ca 0.01 0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.53 2qj0 h GLU 827 Cb 1.04 0.08 -0.14 0.00 0.50 0.00 0.00 28.75 30.23 2qj0 h GLU 827 CO 1.26 -0.24 -0.36 -2.13 -1.00 0.00 0.00 179.01 176.53 2qj0 n ARG 828 N -5.33 -0.22 -0.52 2.33 0.63 -1.26 -3.94 116.66 108.35 2qj0 n ARG 828 Ca -0.07 1.39 0.02 0.00 -0.92 0.00 0.00 57.85 58.28 2qj0 n ARG 828 Cb 0.24 -2.06 0.03 0.00 0.45 0.00 0.00 32.46 31.12 2qj0 n ARG 828 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 2qj0 n SER 829 N -5.32 0.54 -4.75 6.15 3.41 -1.24 -5.08 113.62 107.33 2qj0 n SER 829 Ca 0.09 -2.23 -0.36 0.00 -0.26 0.00 0.00 58.87 56.11 2qj0 n SER 829 Cb 0.36 -0.26 -0.07 0.00 -0.26 0.00 0.00 64.21 63.98 2qj0 n SER 829 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2qj0 s PHE 830 N -0.58 3.46 -0.30 7.33 5.36 -1.13 -4.72 117.98 127.40 2qj0 s PHE 830 Ca 0.10 0.47 -0.09 0.00 -0.96 0.00 0.00 56.93 56.45 2qj0 s PHE 830 Cb 0.09 -2.21 0.14 0.00 -0.34 0.00 0.00 43.02 40.70 2qj0 s PHE 830 CO -0.01 0.33 0.65 1.21 -1.46 0.00 0.00 175.22 175.94 2qj0 s ASN 831 N 0.22 -1.17 0.34 6.13 3.04 -1.26 -4.95 114.94 117.28 2qj0 s ASN 831 Ca 0.12 1.44 0.14 0.00 0.04 0.00 0.00 52.86 54.60 2qj0 s ASN 831 Cb -0.12 2.27 1.03 0.00 -1.54 0.00 0.00 41.25 42.88 2qj0 s ASN 831 CO 0.01 -0.22 1.70 -0.09 -3.04 0.00 0.00 177.10 175.46 2qj0 h ARG 832 N 7.99 0.41 -0.97 0.43 2.43 -1.96 0.52 114.38 123.22 2qj0 h ARG 832 Ca -0.19 -0.02 0.22 0.00 -0.81 0.00 0.00 59.98 59.18 2qj0 h ARG 832 Cb 1.11 -0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 30.49 2qj0 h ARG 832 CO 0.13 0.27 0.63 -0.97 -1.51 0.00 0.00 179.97 178.52 2qj0 h ASN 833 N 0.42 0.49 -0.81 -3.80 -0.00 -1.97 0.69 115.58 110.60 2qj0 h ASN 833 Ca 0.69 0.07 0.11 0.00 -0.00 0.00 0.00 56.30 57.17 2qj0 h ASN 833 Cb 1.53 -0.02 -0.08 0.00 -0.00 0.00 0.00 38.32 39.75 2qj0 h ASN 833 CO -0.51 0.16 0.43 -0.07 -0.00 0.00 0.00 177.43 177.44 2qj0 h LEU 834 N 0.47 0.57 -1.12 0.34 3.38 -1.30 0.15 115.31 117.80 2qj0 h LEU 834 Ca 0.53 0.07 -0.09 0.00 0.09 0.00 0.00 57.88 58.48 2qj0 h LEU 834 Cb 1.25 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2qj0 h LEU 834 CO -0.25 0.30 -0.38 -0.26 0.09 0.00 0.00 178.44 177.94 2qj0 h PHE 835 N 0.69 0.13 0.09 1.13 0.04 -1.01 -2.23 116.94 115.78 2qj0 h PHE 835 Ca 0.41 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 61.15 2qj0 h PHE 835 Cb 0.47 -0.03 -0.00 0.00 2.20 0.00 0.00 35.95 38.59 2qj0 h PHE 835 CO -0.08 0.48 -0.06 0.28 -0.60 0.00 0.00 178.31 178.33 2qj0 h VAL 836 N 0.10 0.00 0.00 -0.55 2.07 -0.39 -2.14 116.25 115.34 2qj0 h VAL 836 Ca 0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.53 2qj0 h VAL 836 Cb 0.72 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2qj0 h VAL 836 CO 0.05 0.00 0.00 -2.11 0.02 0.00 0.00 177.57 175.53 2qj0 n ARG 837 N -2.48 0.19 0.07 1.57 1.85 -0.69 -0.65 116.66 116.51 2qj0 n ARG 837 Ca -0.02 0.11 -0.12 0.00 -1.00 0.00 0.00 57.85 56.82 2qj0 n ARG 837 Cb 0.06 -1.50 -0.13 0.00 -1.05 0.00 0.00 32.46 29.83 2qj0 n ARG 837 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2qj0 h ALA 838 N 2.46 0.30 0.22 2.89 0.00 -0.87 -2.29 119.26 121.97 2qj0 h ALA 838 Ca 0.00 -1.02 -0.01 0.00 0.00 0.00 0.00 54.91 53.88 2qj0 h ALA 838 Cb 0.04 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2qj0 h ALA 838 CO 0.00 1.17 -0.11 0.28 0.00 0.00 0.00 179.25 180.60 2qj0 h VAL 839 N 0.04 0.35 -0.93 0.00 2.07 -0.26 -2.78 116.25 114.74 2qj0 h VAL 839 Ca -0.14 -0.94 0.26 0.00 0.82 0.00 0.00 66.70 66.70 2qj0 h VAL 839 Cb 1.92 0.61 -0.16 0.00 -1.52 0.00 0.00 31.29 32.13 2qj0 h VAL 839 CO 0.16 0.10 0.12 -0.78 0.02 0.00 0.00 177.57 177.18 2qj0 h ASP 840 N -1.02 -0.27 -0.46 0.57 1.82 -1.46 0.83 116.42 116.43 2qj0 h ASP 840 Ca -0.03 0.24 0.00 0.00 -0.39 0.00 0.00 57.03 56.85 2qj0 h ASP 840 Cb 0.39 0.39 0.00 0.00 0.68 0.00 0.00 39.33 40.79 2qj0 h ASP 840 CO 0.05 -0.28 0.00 2.30 -1.61 0.00 0.00 179.24 179.70 2qj0 n ILE 841 N -5.38 1.34 0.52 2.25 -5.35 -0.86 -2.64 119.36 109.24 2qj0 n ILE 841 Ca 0.22 -0.84 0.06 0.00 -0.27 0.00 0.00 62.75 61.92 2qj0 n ILE 841 Cb 0.73 -0.01 -0.07 0.00 -1.74 0.00 0.00 39.64 38.55 2qj0 n ILE 841 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2qj0 n LEU 842 N 0.72 0.52 -2.19 7.28 4.77 0.27 -4.29 117.00 124.08 2qj0 n LEU 842 Ca 0.18 -0.47 -0.27 0.00 -0.03 0.00 0.00 56.01 55.43 2qj0 n LEU 842 Cb 0.69 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.89 2qj0 n LEU 842 CO 0.18 0.13 1.32 0.61 -1.33 0.00 0.00 177.39 178.30 2qj0 n GLY 843 N 1.31 4.93 0.00 -0.72 0.00 0.07 -4.48 105.19 106.30 2qj0 n GLY 843 Ca 0.02 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.48 2qj0 n GLY 843 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qj0 n ARG 844 N -0.85 0.00 -2.54 1.61 3.00 -1.26 -4.98 116.66 111.64 2qj0 n ARG 844 Ca 0.56 0.00 -0.38 0.00 -0.01 0.00 0.00 57.85 58.02 2qj0 n ARG 844 Cb 1.10 0.00 -0.04 0.00 0.00 0.00 0.00 32.46 33.52 2qj0 n ARG 844 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2qj0 s LYS 845 N 0.00 4.32 -1.31 5.56 1.02 -1.26 -4.95 119.74 123.12 2qj0 s LYS 845 Ca 0.00 1.57 -0.09 0.00 0.02 0.00 0.00 55.97 57.47 2qj0 s LYS 845 Cb 0.00 -2.73 0.15 0.00 -0.52 0.00 0.00 37.83 34.72 2qj0 s LYS 845 CO 0.00 -0.02 1.99 2.41 -0.92 0.00 0.00 175.35 178.82 2qj0 n THR 846 N 0.31 4.38 -0.73 2.17 -1.04 -1.26 -4.34 114.28 113.78 2qj0 n THR 846 Ca 0.03 -4.24 0.04 0.00 -2.04 0.00 0.00 64.05 57.85 2qj0 n THR 846 Cb 0.48 -2.35 0.06 0.00 -1.82 0.00 0.00 70.33 66.71 2qj0 n THR 846 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2qj0 n GLY 847 N 2.78 3.14 3.43 3.41 0.00 -1.26 -4.95 105.19 111.73 2qj0 n GLY 847 Ca 0.44 -0.50 -0.44 0.00 0.00 0.00 0.00 46.02 45.52 2qj0 n GLY 847 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2qj0 s LEU 848 N -1.66 4.81 0.00 0.99 2.34 -1.26 -4.89 118.68 119.00 2qj0 s LEU 848 Ca 0.14 -1.33 0.00 0.00 0.06 0.00 0.00 54.13 53.00 2qj0 s LEU 848 Cb 0.12 -2.38 0.00 0.00 -0.56 0.00 0.00 46.19 43.37 2qj0 s LEU 848 CO 0.01 -1.27 0.00 0.00 -1.06 0.00 0.00 176.35 174.03 2qj0 n ALA 849 N 7.08 0.55 -0.40 1.48 0.00 -1.26 -4.66 120.51 123.29 2qj0 n ALA 849 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 2qj0 n ALA 849 Cb 0.45 -0.48 0.24 0.00 0.00 0.00 0.00 19.45 19.66 2qj0 n ALA 849 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2qj0 n SER 850 N 0.10 -3.73 -0.32 0.00 3.41 -1.26 -3.85 113.62 107.97 2qj0 n SER 850 Ca 0.00 -0.71 0.10 0.00 -0.26 0.00 0.00 58.87 58.00 2qj0 n SER 850 Cb 0.00 -0.80 0.47 0.00 -0.26 0.00 0.00 64.21 63.62 2qj0 n SER 850 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2qj0 n PRO 851 N -5.05 1.43 0.07 4.33 -0.04 -1.26 -4.59 135.00 129.88 2qj0 n PRO 851 Ca 0.11 -0.64 0.12 0.00 -0.04 0.00 0.00 63.50 63.05 2qj0 n PRO 851 Cb 0.48 -1.36 0.47 0.00 -0.04 0.00 0.00 33.50 33.05 2qj0 n PRO 851 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2qj0 n GLU 852 N -0.14 0.15 -0.07 0.54 1.02 -1.26 0.82 120.64 121.70 2qj0 n GLU 852 Ca 0.16 0.20 -0.05 0.00 -0.02 0.00 0.00 57.16 57.44 2qj0 n GLU 852 Cb 0.22 -1.70 -0.02 0.00 -0.02 0.00 0.00 31.44 29.93 2qj0 n GLU 852 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2qj0 n PHE 853 N -1.97 0.50 0.30 -0.32 7.35 -1.25 -2.56 117.46 119.51 2qj0 n PHE 853 Ca 0.05 0.22 0.13 0.00 -0.76 0.00 0.00 57.45 57.09 2qj0 n PHE 853 Cb 0.34 -0.60 0.71 0.00 0.35 0.00 0.00 39.48 40.28 2qj0 n PHE 853 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 2qj0 h ILE 854 N -0.86 0.00 0.07 -2.13 2.04 -1.86 0.30 117.51 115.07 2qj0 h ILE 854 Ca 0.00 0.00 -0.27 0.00 1.00 0.00 0.00 64.86 65.59 2qj0 h ILE 854 Cb 0.60 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 2qj0 h ILE 854 CO 0.00 0.00 -1.43 -0.08 0.00 0.00 0.00 178.15 176.64 2qj0 h GLU 855 N 0.00 0.15 -0.69 2.37 4.57 0.29 -3.14 114.58 118.13 2qj0 h GLU 855 Ca 0.00 -0.26 0.04 0.00 -1.18 0.00 0.00 59.36 57.96 2qj0 h GLU 855 Cb 0.68 0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 29.33 2qj0 h GLU 855 CO 0.00 1.12 0.45 0.87 -1.18 0.00 0.00 179.01 180.27 2qj0 h LYS 856 N -0.50 0.78 -0.22 1.92 1.57 -0.37 -2.30 116.57 117.45 2qj0 h LYS 856 Ca -0.34 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.36 2qj0 h LYS 856 Cb 1.63 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.75 2qj0 h LYS 856 CO -0.04 0.52 -0.02 1.25 -0.57 0.00 0.00 179.45 180.59 2qj0 h LEU 857 N 0.80 0.39 -1.75 2.94 5.85 -0.71 -2.92 115.31 119.91 2qj0 h LEU 857 Ca 0.28 -0.33 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 2qj0 h LEU 857 Cb 0.10 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2qj0 h LEU 857 CO -0.08 0.63 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.41 2qj0 h LEU 858 N 0.14 0.00 0.09 2.25 4.07 -1.39 -0.19 115.31 120.29 2qj0 h LEU 858 Ca 0.06 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.01 2qj0 h LEU 858 Cb 0.44 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.18 2qj0 h LEU 858 CO 0.01 0.17 -0.04 0.78 -1.08 0.00 0.00 178.44 178.28 2qj0 h ASN 859 N 0.00 -0.10 0.52 -0.43 2.35 -1.29 -1.70 115.58 114.92 2qj0 h ASN 859 Ca -0.00 -0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.59 2qj0 h ASN 859 Cb 0.37 0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.75 2qj0 h ASN 859 CO 0.02 0.08 -0.43 0.15 -1.65 0.00 0.00 177.43 175.60 2qj0 h PHE 860 N -0.29 -1.18 -1.21 1.19 3.57 -1.26 0.40 116.94 118.17 2qj0 h PHE 860 Ca -0.01 0.00 0.35 0.00 3.53 0.00 0.00 57.97 61.84 2qj0 h PHE 860 Cb 0.24 0.45 -0.05 0.00 2.79 0.00 0.00 35.95 39.38 2qj0 h PHE 860 CO -0.02 -0.61 0.96 0.00 -2.23 0.00 0.00 178.31 176.41 2qj0 h ALA 861 N -0.67 3.11 0.01 2.41 0.00 -0.95 0.68 119.26 123.84 2qj0 h ALA 861 Ca -0.06 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.62 2qj0 h ALA 861 Cb 0.80 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2qj0 h ALA 861 CO -0.02 -1.59 -1.02 -0.91 0.00 0.00 0.00 179.25 175.72 2qj0 h ASN 862 N 0.00 0.05 -0.93 0.00 2.35 -0.37 -2.88 115.58 113.80 2qj0 h ASN 862 Ca 0.57 -0.66 0.18 0.00 -0.55 0.00 0.00 56.30 55.84 2qj0 h ASN 862 Cb 2.50 -0.01 -0.08 0.00 0.05 0.00 0.00 38.32 40.77 2qj0 h ASN 862 CO -0.01 1.41 0.60 0.11 -1.65 0.00 0.00 177.43 177.89 2qj0 h LYS 863 N -0.91 0.59 -0.07 0.81 1.57 0.39 0.91 116.57 119.86 2qj0 h LYS 863 Ca -0.27 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.46 2qj0 h LYS 863 Cb 1.30 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.47 2qj0 h LYS 863 CO -0.13 0.39 -0.00 0.00 -0.57 0.00 0.00 179.45 179.13 2qj0 h ALA 864 N 1.61 0.09 -0.89 3.86 0.00 -1.05 -1.60 119.26 121.28 2qj0 h ALA 864 Ca 0.49 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.23 2qj0 h ALA 864 Cb 0.94 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 2qj0 h ALA 864 CO -0.24 -0.23 0.59 1.49 0.00 0.00 0.00 179.25 180.87 2qj0 h GLU 865 N -0.18 1.16 0.00 0.00 4.57 -0.57 -0.26 114.58 119.31 2qj0 h GLU 865 Ca 0.02 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2qj0 h GLU 865 Cb 0.35 -0.26 0.00 0.00 -0.16 0.00 0.00 28.75 28.68 2qj0 h GLU 865 CO 0.00 0.77 0.00 0.39 -1.18 0.00 0.00 179.01 178.99 2qj0 n GLU 866 N -4.40 0.00 -0.40 1.92 -0.58 0.29 -1.84 120.64 115.63 2qj0 n GLU 866 Ca 0.10 0.52 0.32 0.00 -0.42 0.00 0.00 57.16 57.69 2qj0 n GLU 866 Cb 0.03 -1.35 0.60 0.00 -0.57 0.00 0.00 31.44 30.14 2qj0 n GLU 866 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 2qj0 h GLN 867 N 0.00 0.17 0.09 3.49 5.75 -1.17 0.23 115.11 123.66 2qj0 h GLN 867 Ca 0.00 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.49 2qj0 h GLN 867 Cb 0.00 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.51 2qj0 h GLN 867 CO 0.00 0.11 -0.04 -0.09 -2.65 0.00 0.00 178.83 176.16 2qj0 h ARG 868 N 0.17 -0.12 -0.03 1.69 1.12 -0.62 -2.03 114.38 114.56 2qj0 h ARG 868 Ca 0.76 0.01 -0.09 0.00 -1.11 0.00 0.00 59.98 59.55 2qj0 h ARG 868 Cb 2.23 0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 32.20 2qj0 h ARG 868 CO -0.43 -0.04 -0.41 0.87 -3.11 0.00 0.00 179.97 176.86 2qj0 h LYS 869 N -0.17 0.07 -0.91 0.20 1.57 0.16 -1.46 116.57 116.03 2qj0 h LYS 869 Ca -0.01 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.78 2qj0 h LYS 869 Cb 0.13 -0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.39 2qj0 h LYS 869 CO 0.02 0.47 0.58 0.00 -0.57 0.00 0.00 179.45 179.95 2qj0 h ALA 870 N 1.53 1.22 0.03 3.86 0.00 -0.84 -1.08 119.26 123.97 2qj0 h ALA 870 Ca 0.00 -0.03 -0.26 0.00 0.00 0.00 0.00 54.91 54.62 2qj0 h ALA 870 Cb 0.75 -0.30 0.02 0.00 0.00 0.00 0.00 17.79 18.26 2qj0 h ALA 870 CO 0.06 0.42 -1.06 -0.44 0.00 0.00 0.00 179.25 178.22 2qj0 h ASP 871 N 1.11 0.79 0.16 0.00 3.32 -0.99 0.12 116.42 120.93 2qj0 h ASP 871 Ca 0.37 -0.66 -0.02 0.00 0.02 0.00 0.00 57.03 56.74 2qj0 h ASP 871 Cb 0.05 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.36 2qj0 h ASP 871 CO -0.14 1.46 -0.12 -0.08 -1.72 0.00 0.00 179.24 178.65 2qj0 h GLU 872 N 0.32 0.00 0.08 3.56 4.81 -0.92 -1.19 114.58 121.24 2qj0 h GLU 872 Ca -0.13 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 58.74 2qj0 h GLU 872 Cb 1.72 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 31.07 2qj0 h GLU 872 CO 0.20 0.12 -2.07 -1.91 -0.73 0.00 0.00 179.01 174.62 2qj0 n GLU 873 N -4.19 0.71 -0.16 1.92 2.13 -0.44 -2.66 120.64 117.95 2qj0 n GLU 873 Ca -0.03 0.26 0.22 0.00 0.66 0.00 0.00 57.16 58.28 2qj0 n GLU 873 Cb 0.20 -1.66 0.62 0.00 0.27 0.00 0.00 31.44 30.86 2qj0 n GLU 873 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2qj0 h GLU 874 N -0.07 0.18 0.08 5.31 4.57 -0.57 -0.79 114.58 123.29 2qj0 h GLU 874 Ca -0.46 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 57.70 2qj0 h GLU 874 Cb 1.93 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 30.48 2qj0 h GLU 874 CO 0.01 0.12 -0.04 0.22 -1.18 0.00 0.00 179.01 178.14 2qj0 h ASP 875 N 0.19 -0.09 -0.98 1.04 1.82 -1.33 -3.11 116.42 113.95 2qj0 h ASP 875 Ca 0.40 0.00 0.34 0.00 -0.39 0.00 0.00 57.03 57.38 2qj0 h ASP 875 Cb 1.29 0.02 -0.17 0.00 0.68 0.00 0.00 39.33 41.15 2qj0 h ASP 875 CO -0.08 0.39 0.41 0.25 -1.61 0.00 0.00 179.24 178.60 2qj0 h LEU 876 N -1.02 0.18 0.00 2.28 5.85 -1.15 -0.47 115.31 120.98 2qj0 h LEU 876 Ca -0.01 0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.94 2qj0 h LEU 876 Cb 0.08 0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.38 2qj0 h LEU 876 CO 0.02 -0.29 0.00 -0.62 -0.34 0.00 0.00 178.44 177.21 2qj0 n GLU 877 N -5.24 0.00 -1.22 1.25 -0.58 -0.37 -4.48 120.64 110.00 2qj0 n GLU 877 Ca 0.31 0.21 -0.23 0.00 -0.42 0.00 0.00 57.16 57.03 2qj0 n GLU 877 Cb 1.01 -0.68 -0.01 0.00 -0.57 0.00 0.00 31.44 31.19 2qj0 n GLU 877 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2qj0 n TYR 878 N -1.38 1.66 -3.30 -0.32 4.01 -1.18 -4.65 117.16 112.00 2qj0 n TYR 878 Ca 0.00 -2.01 -0.25 0.00 -0.16 0.00 0.00 57.90 55.48 2qj0 n TYR 878 Cb 0.00 -1.20 -0.08 0.00 -0.31 0.00 0.00 39.34 37.75 2qj0 n TYR 878 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qj0 n GLY 879 N 0.55 3.20 0.00 2.72 0.00 -0.19 -4.86 105.19 106.61 2qj0 n GLY 879 Ca 0.41 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.62 2qj0 n GLY 879 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qj0 n ASP 880 N 1.53 0.00 -4.52 1.61 8.00 -1.26 -4.81 116.55 117.10 2qj0 n ASP 880 Ca 0.24 0.20 -0.39 0.00 0.71 0.00 0.00 54.79 55.56 2qj0 n ASP 880 Cb 0.49 -0.26 -0.09 0.00 -0.02 0.00 0.00 41.12 41.23 2qj0 n ASP 880 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2qj0 n VAL 881 N -1.47 -0.04 -1.42 2.53 0.31 -1.26 -4.86 118.33 112.12 2qj0 n VAL 881 Ca 0.00 -0.37 -0.52 0.00 -0.01 0.00 0.00 64.34 63.43 2qj0 n VAL 881 Cb 0.00 -1.57 -0.05 0.00 -0.91 0.00 0.00 33.84 31.31 2qj0 n VAL 881 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2qj0 n PRO 882 N 8.73 0.00 -0.22 5.55 -0.02 -1.26 -4.80 135.00 142.99 2qj0 n PRO 882 Ca 0.53 0.00 0.23 0.00 -2.02 0.00 0.00 63.50 62.24 2qj0 n PRO 882 Cb 0.27 -1.21 0.60 0.00 -0.02 0.00 0.00 33.50 33.13 2qj0 n PRO 882 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2qj0 h ASP 883 N 1.89 0.24 0.61 2.55 3.32 -1.97 -1.70 116.42 121.37 2qj0 h ASP 883 Ca -0.38 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.70 2qj0 h ASP 883 Cb 1.41 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.95 2qj0 h ASP 883 CO 0.60 0.09 0.00 -1.84 -1.72 0.00 0.00 179.24 176.37 2qj0 n GLU 884 N -4.43 0.11 0.00 3.56 0.28 -1.26 -1.83 120.64 117.07 2qj0 n GLU 884 Ca 0.19 0.36 0.12 0.00 -0.16 0.00 0.00 57.16 57.67 2qj0 n GLU 884 Cb 0.81 -1.71 0.22 0.00 1.43 0.00 0.00 31.44 32.19 2qj0 n GLU 884 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2qj0 n PHE 885 N -1.92 0.00 -3.80 -1.84 0.99 -0.64 -4.93 117.46 105.32 2qj0 n PHE 885 Ca 0.03 0.00 -0.37 0.00 -0.00 0.00 0.00 57.45 57.11 2qj0 n PHE 885 Cb 0.20 -0.02 -0.06 0.00 -1.00 0.00 0.00 39.48 38.60 2qj0 n PHE 885 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2qj0 s LEU 886 N -2.19 4.40 0.26 4.37 1.43 -0.76 -4.59 118.68 121.60 2qj0 s LEU 886 Ca 0.28 0.56 -0.30 0.00 -1.03 0.00 0.00 54.13 53.64 2qj0 s LEU 886 Cb 0.20 -2.30 -0.10 0.00 0.03 0.00 0.00 46.19 44.02 2qj0 s LEU 886 CO 0.41 0.36 1.41 -0.62 0.23 0.00 0.00 176.35 178.14 2qj0 s ASP 887 N -1.21 6.68 0.53 2.29 -1.08 -0.31 -4.90 116.67 118.66 2qj0 s ASP 887 Ca 0.19 2.67 0.28 0.00 -0.52 0.00 0.00 52.55 55.17 2qj0 s ASP 887 Cb -0.13 -2.63 1.47 0.00 -1.46 0.00 0.00 42.92 40.18 2qj0 s ASP 887 CO 0.09 -0.67 2.07 1.55 0.52 0.00 0.00 175.17 178.73 2qj0 h PRO 888 N 4.72 0.00 -0.20 4.34 0.13 -1.91 -1.42 132.00 137.66 2qj0 h PRO 888 Ca -0.47 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.60 2qj0 h PRO 888 Cb 1.22 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 2qj0 h PRO 888 CO 0.75 0.11 -0.10 1.28 -0.23 0.00 0.00 178.00 179.81 2qj0 n LEU 889 N -3.58 3.47 0.00 1.56 4.77 -1.26 -5.10 117.00 116.86 2qj0 n LEU 889 Ca -0.02 -3.44 0.00 0.00 -0.03 0.00 0.00 56.01 52.52 2qj0 n LEU 889 Cb 0.24 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.78 2qj0 n LEU 889 CO 0.29 1.00 0.00 -1.22 -1.33 0.00 0.00 177.39 176.14 2qj0 n TYR 891 N -1.02 0.00 -2.40 -1.77 4.01 -0.54 -5.22 117.16 110.22 2qj0 n TYR 891 Ca 0.24 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.74 2qj0 n TYR 891 Cb 0.86 0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.99 2qj0 n TYR 891 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2qj0 s THR 892 N 0.00 2.24 0.00 -0.72 -4.23 -1.26 -4.68 115.64 106.99 2qj0 s THR 892 Ca 0.00 -0.44 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 2qj0 s THR 892 Cb 0.00 -2.80 0.00 0.00 1.34 0.00 0.00 72.50 71.04 2qj0 s THR 892 CO 0.00 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.08 2qj0 n ILE 893 N -2.91 0.00 0.13 2.99 0.13 -1.26 -1.17 119.36 117.27 2qj0 n ILE 893 Ca 0.12 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.77 2qj0 n ILE 893 Cb 0.60 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 39.40 2qj0 n ILE 893 CO 0.00 0.00 0.00 0.29 2.80 0.00 0.00 176.55 179.64 2qj0 n LYS 895 N 0.00 0.00 -3.65 9.51 5.02 -1.26 -4.80 118.16 122.98 2qj0 n LYS 895 Ca 0.00 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.94 2qj0 n LYS 895 Cb 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 34.94 2qj0 n LYS 895 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2qj0 n ASP 896 N -3.07 4.13 -4.71 4.39 4.64 -1.26 -4.94 116.55 115.72 2qj0 n ASP 896 Ca 0.00 -3.15 -0.42 0.00 -1.38 0.00 0.00 54.79 49.84 2qj0 n ASP 896 Cb 0.00 -1.02 -0.03 0.00 -1.04 0.00 0.00 41.12 39.03 2qj0 n ASP 896 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 2qj0 s PRO 897 N -1.44 4.18 -0.05 -0.67 0.04 -1.26 -0.09 135.00 135.72 2qj0 s PRO 897 Ca 0.28 2.44 -0.03 0.00 0.04 0.00 0.00 61.00 63.73 2qj0 s PRO 897 Cb -0.06 -3.21 0.02 0.00 0.04 0.00 0.00 34.50 31.29 2qj0 s PRO 897 CO -0.13 -0.67 0.11 0.14 0.04 0.00 0.00 177.00 176.49 2qj0 s VAL 898 N 1.43 -0.02 -0.38 -0.36 -7.23 -0.85 -0.87 120.40 112.12 2qj0 s VAL 898 Ca 0.72 0.08 -0.25 0.00 -1.81 0.00 0.00 61.98 60.73 2qj0 s VAL 898 Cb -0.45 -0.17 0.01 0.00 0.56 0.00 0.00 36.38 36.33 2qj0 s VAL 898 CO 0.32 0.03 0.86 -0.63 -0.31 0.00 0.00 175.10 175.37 2qj0 s ILE 899 N 0.54 4.64 0.55 -0.62 1.01 0.55 -2.39 121.20 125.47 2qj0 s ILE 899 Ca -0.04 1.01 -0.21 0.00 0.00 0.00 0.00 60.65 61.41 2qj0 s ILE 899 Cb -0.06 -4.29 -0.05 0.00 0.01 0.00 0.00 42.46 38.08 2qj0 s ILE 899 CO -0.02 -0.52 1.32 -0.76 0.00 0.00 0.00 174.94 174.95 2qj0 s LEU 900 N 3.33 3.83 -0.05 2.97 1.43 -1.26 -3.14 118.68 125.79 2qj0 s LEU 900 Ca 0.35 2.66 0.15 0.00 -1.03 0.00 0.00 54.13 56.27 2qj0 s LEU 900 Cb -0.12 -4.33 -0.21 0.00 0.03 0.00 0.00 46.19 41.56 2qj0 s LEU 900 CO 0.19 -1.53 0.56 -0.81 0.23 0.00 0.00 176.35 174.99 2qj0 n PRO 901 N -1.08 0.64 0.22 1.29 -0.04 -1.26 -2.11 135.00 132.66 2qj0 n PRO 901 Ca 0.11 0.19 0.14 0.00 -0.04 0.00 0.00 63.50 63.89 2qj0 n PRO 901 Cb 0.46 -1.72 0.36 0.00 -0.04 0.00 0.00 33.50 32.56 2qj0 n PRO 901 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qj0 h ALA 902 N 1.16 1.00 0.00 0.55 0.00 -1.93 -3.35 119.26 116.69 2qj0 h ALA 902 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2qj0 h ALA 902 Cb 1.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.70 2qj0 h ALA 902 CO 0.06 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.18 2qj0 n SER 903 N -2.96 0.14 -2.42 0.00 3.41 -1.26 -4.96 113.62 105.57 2qj0 n SER 903 Ca 0.03 -0.48 -0.01 0.00 -0.26 0.00 0.00 58.87 58.15 2qj0 n SER 903 Cb 0.44 0.26 0.00 0.00 -0.26 0.00 0.00 64.21 64.65 2qj0 n SER 903 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qj0 n LYS 904 N -0.26 -2.39 -4.07 4.33 4.76 -0.90 -5.02 118.16 114.62 2qj0 n LYS 904 Ca 0.00 2.08 -0.13 0.00 -2.87 0.00 0.00 58.31 57.39 2qj0 n LYS 904 Cb 0.05 -4.33 -0.11 0.00 -1.84 0.00 0.00 35.03 28.80 2qj0 n LYS 904 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2qj0 s ASN 906 N -1.45 0.87 -0.17 4.39 -0.87 -1.26 -4.74 114.94 111.71 2qj0 s ASN 906 Ca 0.05 -0.56 -0.30 0.00 -1.57 0.00 0.00 52.86 50.47 2qj0 s ASN 906 Cb -0.01 0.04 0.13 0.00 -0.02 0.00 0.00 41.25 41.39 2qj0 s ASN 906 CO 0.58 -0.21 1.03 -0.51 -2.57 0.00 0.00 177.10 175.42 2qj0 s ILE 907 N -1.44 0.00 0.15 0.60 2.07 -1.01 -4.55 121.20 117.02 2qj0 s ILE 907 Ca -0.09 0.00 -0.31 0.00 -1.41 0.00 0.00 60.65 58.84 2qj0 s ILE 907 Cb -0.10 -1.00 -0.08 0.00 0.13 0.00 0.00 42.46 41.42 2qj0 s ILE 907 CO 0.00 0.00 1.31 -0.62 -1.91 0.00 0.00 174.94 173.72 2qj0 s ASP 908 N -1.06 6.91 0.24 4.50 3.68 -1.26 -2.01 116.67 127.67 2qj0 s ASP 908 Ca -0.01 2.30 -0.08 0.00 2.13 0.00 0.00 52.55 56.89 2qj0 s ASP 908 Cb -0.01 -2.60 0.37 0.00 -1.45 0.00 0.00 42.92 39.23 2qj0 s ASP 908 CO 0.01 -0.55 1.35 0.54 0.13 0.00 0.00 175.17 176.65 2qj0 n ARG 909 N 3.31 -0.10 -0.26 4.34 5.12 0.88 0.79 116.66 130.74 2qj0 n ARG 909 Ca 0.08 1.35 -0.03 0.00 -1.93 0.00 0.00 57.85 57.32 2qj0 n ARG 909 Cb 0.43 -2.02 0.08 0.00 -1.16 0.00 0.00 32.46 29.79 2qj0 n ARG 909 CO 0.00 0.00 0.00 0.77 -1.93 0.00 0.00 177.63 176.47 2qj0 h SER 910 N 0.00 0.76 -0.16 0.55 0.02 -1.91 -0.92 113.55 111.89 2qj0 h SER 910 Ca 0.40 -0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.32 2qj0 h SER 910 Cb 0.61 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 2qj0 h SER 910 CO -0.89 0.53 0.02 0.74 -1.14 0.00 0.00 176.83 176.09 2qj0 h THR 911 N 0.90 1.22 -0.17 -2.27 2.02 0.01 0.15 112.91 114.78 2qj0 h THR 911 Ca 0.29 -0.72 -0.06 0.00 0.77 0.00 0.00 66.41 66.69 2qj0 h THR 911 Cb 0.00 1.40 -0.00 0.00 -1.74 0.00 0.00 68.15 67.81 2qj0 h THR 911 CO -0.10 0.22 -0.12 0.16 0.37 0.00 0.00 175.52 176.04 2qj0 h ILE 912 N 0.05 1.33 -0.62 3.11 3.07 -1.36 0.28 117.51 123.36 2qj0 h ILE 912 Ca 0.05 -1.23 0.12 0.00 1.55 0.00 0.00 64.86 65.35 2qj0 h ILE 912 Cb 0.31 1.76 -0.09 0.00 -0.27 0.00 0.00 36.82 38.53 2qj0 h ILE 912 CO 0.00 0.37 0.14 0.50 -1.05 0.00 0.00 178.15 178.11 2qj0 h LYS 913 N 0.05 0.26 0.00 0.16 3.64 -1.15 1.54 116.57 121.07 2qj0 h LYS 913 Ca 0.03 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.27 2qj0 h LYS 913 Cb 0.63 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 2qj0 h LYS 913 CO 0.03 0.17 -0.59 0.00 -2.27 0.00 0.00 179.45 176.79 2qj0 h ALA 914 N 1.50 0.78 -0.07 5.00 0.00 -0.57 -2.90 119.26 122.99 2qj0 h ALA 914 Ca 0.33 -0.54 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 2qj0 h ALA 914 Cb 0.50 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.20 2qj0 h ALA 914 CO -0.42 0.74 -0.64 1.25 0.00 0.00 0.00 179.25 180.19 2qj0 h HIS 915 N 0.00 0.77 -0.71 0.00 -0.00 0.18 -3.31 115.15 112.09 2qj0 h HIS 915 Ca -0.01 -0.37 0.05 0.00 -0.00 0.00 0.00 60.37 60.04 2qj0 h HIS 915 Cb 1.24 -0.11 -0.05 0.00 -0.00 0.00 0.00 27.41 28.49 2qj0 h HIS 915 CO 0.00 1.18 0.42 -0.07 -0.00 0.00 0.00 177.93 179.46 2qj0 h LEU 916 N 0.15 0.66 -1.77 0.26 3.38 0.21 -2.66 115.31 115.55 2qj0 h LEU 916 Ca -0.06 0.02 0.51 0.00 0.09 0.00 0.00 57.88 58.44 2qj0 h LEU 916 Cb 1.30 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.86 2qj0 h LEU 916 CO 0.13 0.44 1.38 0.18 0.09 0.00 0.00 178.44 180.66 2qj0 n LEU 917 N -4.72 0.00 0.00 1.67 4.77 -1.10 0.83 117.00 118.45 2qj0 n LEU 917 Ca 0.09 0.94 0.00 0.00 -0.03 0.00 0.00 56.01 57.01 2qj0 n LEU 917 Cb 0.14 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 2qj0 n LEU 917 CO 0.31 -0.94 0.36 -1.54 -1.33 0.00 0.00 177.39 174.25 2qj0 n SER 918 N -3.76 1.08 -3.59 -1.43 3.41 -1.15 -5.01 113.62 103.16 2qj0 n SER 918 Ca 0.40 -1.49 -0.02 0.00 -0.26 0.00 0.00 58.87 57.49 2qj0 n SER 918 Cb 1.91 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 65.81 2qj0 n SER 918 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2qj0 s ASP 919 N -0.49 -0.97 -0.24 4.04 -1.08 0.24 -5.03 116.67 113.13 2qj0 s ASP 919 Ca 0.00 1.36 0.07 0.00 -0.52 0.00 0.00 52.55 53.46 2qj0 s ASP 919 Cb 0.00 2.08 0.56 0.00 -1.46 0.00 0.00 42.92 44.10 2qj0 s ASP 919 CO 0.00 -0.23 1.53 -1.20 0.52 0.00 0.00 175.17 175.79 2qj0 n SER 920 N 5.43 4.08 -4.70 -0.34 7.64 -1.26 -3.49 113.62 121.00 2qj0 n SER 920 Ca -0.10 -2.91 -0.24 0.00 1.01 0.00 0.00 58.87 56.64 2qj0 n SER 920 Cb 0.49 -0.69 -0.07 0.00 -1.01 0.00 0.00 64.21 62.93 2qj0 n SER 920 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2qj0 s THR 921 N -2.35 2.71 -0.02 0.44 -4.23 -1.26 0.31 115.64 111.23 2qj0 s THR 921 Ca 0.41 -1.80 -0.29 0.00 -1.18 0.00 0.00 61.69 58.83 2qj0 s THR 921 Cb 0.33 -2.92 -0.03 0.00 1.34 0.00 0.00 72.50 71.22 2qj0 s THR 921 CO 0.10 -0.15 0.95 -0.62 -0.54 0.00 0.00 174.62 174.37 2qj0 s ASP 922 N -3.81 7.31 0.32 3.99 2.15 -1.25 -4.81 116.67 120.57 2qj0 s ASP 922 Ca 0.37 1.59 0.10 0.00 0.43 0.00 0.00 52.55 55.04 2qj0 s ASP 922 Cb -0.00 -2.55 0.89 0.00 -0.30 0.00 0.00 42.92 40.96 2qj0 s ASP 922 CO 0.21 -0.26 1.73 -0.65 -0.17 0.00 0.00 175.17 176.03 2qj0 h PRO 923 N 6.83 0.56 0.00 4.34 0.11 -1.99 -3.29 132.00 138.57 2qj0 h PRO 923 Ca -0.40 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2qj0 h PRO 923 Cb 1.21 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2qj0 h PRO 923 CO 0.76 0.37 -0.44 1.19 -0.21 0.00 0.00 178.00 179.67 2qj0 n PHE 924 N -4.89 0.81 -3.64 0.65 3.01 -1.26 -4.78 117.46 107.37 2qj0 n PHE 924 Ca 0.27 0.35 -0.39 0.00 1.01 0.00 0.00 57.45 58.69 2qj0 n PHE 924 Cb 0.75 -0.70 -0.11 0.00 -0.01 0.00 0.00 39.48 39.40 2qj0 n PHE 924 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2qj0 s ASN 925 N -5.44 5.61 0.01 4.37 2.20 -1.25 -5.17 114.94 115.26 2qj0 s ASN 925 Ca -0.13 -0.71 -0.30 0.00 -0.94 0.00 0.00 52.86 50.78 2qj0 s ASN 925 Cb 0.02 -2.01 -0.07 0.00 -2.00 0.00 0.00 41.25 37.19 2qj0 s ASN 925 CO 0.19 -0.27 1.75 -0.13 -2.94 0.00 0.00 177.10 175.70 2qj0 s ARG 926 N 1.59 4.17 0.11 3.55 3.00 -1.24 -3.96 118.95 126.16 2qj0 s ARG 926 Ca 0.03 2.36 0.04 0.00 0.00 0.00 0.00 55.73 58.17 2qj0 s ARG 926 Cb -0.18 -3.93 -0.04 0.00 0.00 0.00 0.00 34.95 30.80 2qj0 s ARG 926 CO 0.06 -0.85 0.08 -1.25 0.00 0.00 0.00 175.30 173.34 2qj0 s PRO 928 N 3.77 2.82 0.06 3.54 0.04 -1.26 -4.81 135.00 139.16 2qj0 s PRO 928 Ca 0.78 -0.79 -0.28 0.00 0.04 0.00 0.00 61.00 60.76 2qj0 s PRO 928 Cb -0.38 -2.66 0.09 0.00 0.04 0.00 0.00 34.50 31.60 2qj0 s PRO 928 CO 0.34 0.53 1.14 -0.48 0.04 0.00 0.00 177.00 178.57 2qj0 s LEU 929 N -2.63 -0.10 -0.00 -3.56 2.34 0.15 -4.79 118.68 110.09 2qj0 s LEU 929 Ca 0.29 -0.27 0.01 0.00 0.06 0.00 0.00 54.13 54.22 2qj0 s LEU 929 Cb -0.11 1.73 -0.00 0.00 -0.56 0.00 0.00 46.19 47.24 2qj0 s LEU 929 CO 0.22 -0.57 -0.02 -0.54 -1.06 0.00 0.00 176.35 174.37 2qj0 s LYS 930 N -2.78 0.20 0.05 1.48 1.02 -1.26 -4.61 119.74 113.84 2qj0 s LYS 930 Ca 0.14 -0.08 0.00 0.00 0.02 0.00 0.00 55.97 56.05 2qj0 s LYS 930 Cb 0.02 -0.20 0.00 0.00 -0.52 0.00 0.00 37.83 37.13 2qj0 s LYS 930 CO -0.01 0.05 0.52 -0.11 -0.92 0.00 0.00 175.35 174.87 2qj0 n LEU 931 N 3.06 0.00 0.02 3.17 7.94 -1.26 0.38 117.00 130.32 2qj0 n LEU 931 Ca -0.13 0.04 -0.21 0.00 -1.11 0.00 0.00 56.01 54.60 2qj0 n LEU 931 Cb 0.59 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 44.40 2qj0 n LEU 931 CO 0.26 -0.04 -0.29 1.05 -1.11 0.00 0.00 177.39 177.25 2qj0 h GLU 932 N 0.00 0.26 0.00 1.96 4.11 -2.04 -3.32 114.58 115.55 2qj0 h GLU 932 Ca 0.00 -0.45 0.00 0.00 0.07 0.00 0.00 59.36 58.98 2qj0 h GLU 932 Cb 1.03 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2qj0 h GLU 932 CO 0.00 1.21 0.00 -0.25 0.07 0.00 0.00 179.01 180.04 2qj0 n ASP 933 N -3.98 0.43 -4.56 3.06 8.00 0.16 -4.55 116.55 115.12 2qj0 n ASP 933 Ca -0.22 0.66 -0.41 0.00 0.71 0.00 0.00 54.79 55.53 2qj0 n ASP 933 Cb 0.88 -0.73 -0.03 0.00 -0.02 0.00 0.00 41.12 41.22 2qj0 n ASP 933 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2qj0 s VAL 934 N -3.32 3.70 -0.31 2.53 1.01 -1.24 -4.57 120.40 118.20 2qj0 s VAL 934 Ca 0.01 0.51 -0.29 0.00 0.00 0.00 0.00 61.98 62.21 2qj0 s VAL 934 Cb 0.06 -4.57 0.01 0.00 0.00 0.00 0.00 36.38 31.89 2qj0 s VAL 934 CO 0.23 -1.41 1.20 0.28 0.00 0.00 0.00 175.10 175.40 2qj0 s THR 935 N 6.35 4.30 0.79 3.92 -1.32 -1.19 -4.83 115.64 123.66 2qj0 s THR 935 Ca 0.47 1.48 -0.14 0.00 -1.21 0.00 0.00 61.69 62.29 2qj0 s THR 935 Cb -0.10 -4.27 0.06 0.00 -1.51 0.00 0.00 72.50 66.68 2qj0 s THR 935 CO 0.20 -0.48 1.10 -0.81 -2.21 0.00 0.00 174.62 172.43 2qj0 n PRO 936 N 7.12 0.25 -3.88 7.08 -0.04 -1.26 -0.33 135.00 143.94 2qj0 n PRO 936 Ca 0.13 0.16 -0.29 0.00 -0.04 0.00 0.00 63.50 63.46 2qj0 n PRO 936 Cb 0.47 -2.36 -0.13 0.00 -0.04 0.00 0.00 33.50 31.44 2qj0 n PRO 936 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2qj0 s ASN 937 N -1.98 4.28 -0.00 3.54 3.84 -0.05 -4.66 114.94 119.90 2qj0 s ASN 937 Ca 0.73 -3.25 -0.23 0.00 0.21 0.00 0.00 52.86 50.31 2qj0 s ASN 937 Cb -0.30 -1.51 -0.15 0.00 -0.55 0.00 0.00 41.25 38.74 2qj0 s ASN 937 CO 0.51 -0.18 1.05 -0.08 -2.79 0.00 0.00 177.10 175.61 2qj0 h GLU 938 N 6.12 -0.54 -0.60 0.43 4.57 -1.95 -3.16 114.58 119.45 2qj0 h GLU 938 Ca 0.02 0.04 0.23 0.00 -1.18 0.00 0.00 59.36 58.46 2qj0 h GLU 938 Cb 0.85 0.12 -0.11 0.00 -0.16 0.00 0.00 28.75 29.45 2qj0 h GLU 938 CO 0.66 -0.24 0.23 -1.91 -1.18 0.00 0.00 179.01 176.57 2qj0 n GLU 939 N -5.19 -0.04 0.13 1.92 2.13 -1.26 0.33 120.64 118.67 2qj0 n GLU 939 Ca -0.09 0.84 -0.11 0.00 0.66 0.00 0.00 57.16 58.46 2qj0 n GLU 939 Cb 0.29 -1.46 -0.07 0.00 0.27 0.00 0.00 31.44 30.47 2qj0 n GLU 939 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 2qj0 h LEU 940 N 0.00 -0.34 0.00 4.31 5.85 -1.96 -3.03 115.31 120.14 2qj0 h LEU 940 Ca 0.46 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 59.00 2qj0 h LEU 940 Cb 1.17 0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.28 2qj0 h LEU 940 CO -0.49 0.13 0.12 -1.14 -0.34 0.00 0.00 178.44 176.71 2qj0 n ARG 941 N -5.06 0.00 0.27 1.25 0.63 0.15 -1.31 116.66 112.59 2qj0 n ARG 941 Ca -0.08 0.35 -0.12 0.00 -0.92 0.00 0.00 57.85 57.08 2qj0 n ARG 941 Cb 0.26 -1.62 -0.06 0.00 0.45 0.00 0.00 32.46 31.49 2qj0 n ARG 941 CO 0.00 0.00 0.00 0.37 -2.51 0.00 0.00 177.63 175.49 2qj0 h GLN 942 N 0.00 -0.71 -0.19 -0.14 5.75 -1.14 -3.17 115.11 115.51 2qj0 h GLN 942 Ca 0.00 0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.48 2qj0 h GLN 942 Cb 0.23 0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.93 2qj0 h GLN 942 CO 0.00 -0.45 -0.18 0.87 -2.65 0.00 0.00 178.83 176.42 2qj0 h LYS 943 N -1.17 0.33 0.00 1.69 1.57 -1.30 -2.03 116.57 115.66 2qj0 h LYS 943 Ca -0.08 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 2qj0 h LYS 943 Cb 0.58 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.86 2qj0 h LYS 943 CO 0.12 0.50 0.00 -0.89 -0.57 0.00 0.00 179.45 178.62 2qj0 n ILE 944 N -4.20 0.81 -0.01 1.86 5.41 -0.90 -1.80 119.36 120.52 2qj0 n ILE 944 Ca -0.00 0.20 -0.05 0.00 1.00 0.00 0.00 62.75 63.89 2qj0 n ILE 944 Cb 0.33 -1.18 -0.02 0.00 -0.71 0.00 0.00 39.64 38.06 2qj0 n ILE 944 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2qj0 n LEU 945 N -1.21 1.22 0.00 1.39 4.77 -0.78 -3.34 117.00 119.05 2qj0 n LEU 945 Ca 0.01 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 2qj0 n LEU 945 Cb 0.01 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 40.66 2qj0 n LEU 945 CO 0.01 -0.36 0.42 0.00 -1.33 0.00 0.00 177.39 176.13 2qj0 n PHE 947 N -1.33 0.00 0.00 0.00 7.35 -0.75 -2.48 117.46 120.26 2qj0 n PHE 947 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2qj0 n PHE 947 Cb 0.02 -0.50 0.00 0.00 0.35 0.00 0.00 39.48 39.34 2qj0 n PHE 947 CO 0.00 0.00 0.00 1.17 -0.76 0.00 0.00 176.76 177.17 2qj0 n LYS 948 N -4.44 0.00 0.04 -4.13 4.81 -0.41 -2.92 118.16 111.11 2qj0 n LYS 948 Ca -0.15 0.13 0.00 0.00 -0.87 0.00 0.00 58.31 57.42 2qj0 n LYS 948 Cb 0.52 -1.52 0.00 0.00 0.02 0.00 0.00 35.03 34.05 2qj0 n LYS 948 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2qj0 n LYS 949 N -1.07 0.00 0.00 1.64 5.02 0.14 -4.95 118.16 118.94 2qj0 n LYS 949 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2qj0 n LYS 949 Cb 0.02 -0.39 0.00 0.00 -0.02 0.00 0.00 35.03 34.64 2qj0 n LYS 949 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 2qj0 n GLN 950 N -3.31 0.00 0.00 1.97 7.27 -1.03 -5.07 117.38 117.21 2qj0 n GLN 950 Ca 0.00 0.14 0.00 0.00 0.07 0.00 0.00 57.00 57.21 2qj0 n GLN 950 Cb 0.00 -0.62 0.00 0.00 2.41 0.00 0.00 30.24 32.03 2qj0 n GLN 950 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76