#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2duq h GLU 52 N 0.00 0.00 -0.54 1.43 4.11 -2.04 -3.34 114.58 114.20 2duq h GLU 52 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2duq h GLU 52 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2duq h GLU 52 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 179.01 179.80 2duq n HIS 53 N -2.76 0.72 -2.01 2.06 8.25 -1.26 -4.95 115.22 115.27 2duq n HIS 53 Ca 0.02 -0.41 -0.42 0.00 -0.26 0.00 0.00 57.72 56.64 2duq n HIS 53 Cb 0.53 -0.01 -0.03 0.00 1.12 0.00 0.00 29.99 31.60 2duq n HIS 53 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2duq s LEU 54 N -1.13 4.35 -0.59 2.41 2.96 -1.26 -0.86 118.68 124.58 2duq s LEU 54 Ca 0.40 2.40 -0.19 0.00 -0.22 0.00 0.00 54.13 56.52 2duq s LEU 54 Cb 0.22 -3.57 0.10 0.00 0.50 0.00 0.00 46.19 43.44 2duq s LEU 54 CO 0.29 -0.83 0.69 -0.54 -1.32 0.00 0.00 176.35 174.64 2duq s LYS 55 N 2.41 3.04 0.43 1.98 -0.14 0.29 -4.93 119.74 122.82 2duq s LYS 55 Ca 0.71 -1.32 0.11 0.00 -1.36 0.00 0.00 55.97 54.11 2duq s LYS 55 Cb -0.38 -4.26 0.92 0.00 -1.68 0.00 0.00 37.83 32.43 2duq s LYS 55 CO 0.31 -1.52 2.00 -0.09 -0.76 0.00 0.00 175.35 175.29 2duq h ARG 56 N 9.17 0.22 0.00 1.68 9.65 -1.93 -2.15 114.38 131.01 2duq h ARG 56 Ca -0.29 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.55 2duq h ARG 56 Cb 1.09 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.63 2duq h ARG 56 CO 1.09 0.27 0.00 1.05 2.80 0.00 0.00 179.97 185.19 2duq h GLU 57 N 0.22 0.00 -0.09 0.20 9.09 -1.96 -2.25 114.58 119.79 2duq h GLU 57 Ca 0.05 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.46 2duq h GLU 57 Cb 0.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.31 2duq h GLU 57 CO 0.01 0.00 0.00 0.72 0.05 0.00 0.00 179.01 179.79 2duq n HIS 58 N -2.47 0.25 -4.46 2.06 8.25 -0.82 -4.78 115.22 113.25 2duq n HIS 58 Ca 0.01 -0.81 -0.29 0.00 -0.26 0.00 0.00 57.72 56.36 2duq n HIS 58 Cb 0.20 -0.15 -0.13 0.00 1.12 0.00 0.00 29.99 31.03 2duq n HIS 58 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2duq s SER 59 N -2.07 3.48 -0.27 0.41 0.01 -0.85 -4.18 113.70 110.23 2duq s SER 59 Ca 0.26 -0.65 -0.00 0.00 1.31 0.00 0.00 55.95 56.86 2duq s SER 59 Cb 0.21 -0.34 0.05 0.00 0.21 0.00 0.00 66.02 66.15 2duq s SER 59 CO 0.05 0.20 -0.05 -0.22 0.41 0.00 0.00 173.24 173.62 2duq s LEU 60 N -1.92 3.54 -0.02 2.44 2.96 0.84 -4.96 118.68 121.56 2duq s LEU 60 Ca 0.15 -1.18 0.01 0.00 -0.22 0.00 0.00 54.13 52.89 2duq s LEU 60 Cb -0.10 -1.65 0.01 0.00 0.50 0.00 0.00 46.19 44.95 2duq s LEU 60 CO 0.06 -0.20 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.22 2duq s ILE 61 N 1.23 0.38 0.55 6.68 1.01 -1.26 -1.22 121.20 128.57 2duq s ILE 61 Ca -0.05 -0.14 -0.22 0.00 0.00 0.00 0.00 60.65 60.25 2duq s ILE 61 Cb -0.19 -0.37 -0.05 0.00 0.01 0.00 0.00 42.46 41.86 2duq s ILE 61 CO -0.03 0.14 1.34 2.29 0.00 0.00 0.00 174.94 178.67 2duq n LYS 62 N 3.37 1.64 -0.57 2.79 2.85 -1.26 -1.08 118.16 125.91 2duq n LYS 62 Ca -0.18 0.61 -0.07 0.00 -1.05 0.00 0.00 58.31 57.62 2duq n LYS 62 Cb 0.55 -2.55 0.13 0.00 -0.65 0.00 0.00 35.03 32.51 2duq n LYS 62 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 2duq n PRO 63 N -1.01 2.11 -3.30 -1.58 -0.04 -1.26 -4.93 135.00 124.98 2duq n PRO 63 Ca 0.11 -1.55 -0.18 0.00 -0.04 0.00 0.00 63.50 61.84 2duq n PRO 63 Cb 0.45 -1.70 0.06 0.00 -0.04 0.00 0.00 33.50 32.27 2duq n PRO 63 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2duq n TYR 64 N -0.11 -2.12 0.03 0.54 4.02 -0.24 -4.87 117.16 114.40 2duq n TYR 64 Ca 0.25 0.76 0.04 0.00 -0.01 0.00 0.00 57.90 58.94 2duq n TYR 64 Cb 0.97 -4.05 0.09 0.00 -0.02 0.00 0.00 39.34 36.33 2duq n TYR 64 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2duq n GLN 65 N -3.83 1.98 -1.65 -0.72 1.13 -1.26 -5.03 117.38 107.99 2duq n GLN 65 Ca -0.01 -1.60 -0.47 0.00 -1.94 0.00 0.00 57.00 52.97 2duq n GLN 65 Cb 0.55 -1.19 -0.04 0.00 0.11 0.00 0.00 30.24 29.67 2duq n GLN 65 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2duq n GLY 66 N 0.33 0.87 3.43 1.08 0.00 -1.26 -4.92 105.19 104.72 2duq n GLY 66 Ca 0.07 0.63 -0.23 0.00 0.00 0.00 0.00 46.02 46.49 2duq n GLY 66 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2duq s VAL 67 N 0.57 2.27 0.35 1.61 -7.23 -1.26 -0.96 120.40 115.75 2duq s VAL 67 Ca 0.77 -2.34 -0.04 0.00 -1.81 0.00 0.00 61.98 58.56 2duq s VAL 67 Cb -0.74 -2.22 0.08 0.00 0.56 0.00 0.00 36.38 34.06 2duq s VAL 67 CO 0.43 -0.45 0.48 0.61 -0.31 0.00 0.00 175.10 175.86 2duq n GLY 68 N -0.53 -0.65 0.32 2.32 0.00 0.35 -4.76 105.19 102.25 2duq n GLY 68 Ca -0.06 -1.78 0.06 0.00 0.00 0.00 0.00 46.02 44.24 2duq n GLY 68 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2duq h SER 69 N -0.54 0.45 -0.32 1.61 4.64 -2.01 -0.67 113.55 116.72 2duq h SER 69 Ca -0.15 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2duq h SER 69 Cb 0.46 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2duq h SER 69 CO 0.12 0.31 0.00 -1.20 -0.87 0.00 0.00 176.83 175.19 2duq n SER 70 N -4.48 2.77 -1.09 4.97 7.64 -1.26 -4.92 113.62 117.26 2duq n SER 70 Ca 0.05 -2.27 -0.14 0.00 1.01 0.00 0.00 58.87 57.52 2duq n SER 70 Cb 0.14 -0.45 -0.06 0.00 -1.01 0.00 0.00 64.21 62.84 2duq n SER 70 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2duq n SER 71 N 0.41 -4.63 -4.87 6.43 7.64 -0.26 -5.01 113.62 113.33 2duq n SER 71 Ca 0.13 0.32 -0.35 0.00 1.01 0.00 0.00 58.87 59.98 2duq n SER 71 Cb 0.55 -3.38 -0.05 0.00 -1.01 0.00 0.00 64.21 60.32 2duq n SER 71 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2duq s MET 72 N -3.27 3.68 0.33 1.43 1.00 -1.26 -4.77 119.30 116.43 2duq s MET 72 Ca 0.00 0.06 -0.27 0.00 0.00 0.00 0.00 55.69 55.49 2duq s MET 72 Cb 0.00 -3.06 -0.13 0.00 0.00 0.00 0.00 34.83 31.64 2duq s MET 72 CO 0.00 0.62 0.93 -2.30 0.00 0.00 0.00 175.02 174.27 2duq n PRO 73 N 1.12 1.19 0.25 2.03 -0.02 -1.26 -0.49 135.00 137.81 2duq n PRO 73 Ca -0.10 0.42 0.14 0.00 -2.02 0.00 0.00 63.50 61.94 2duq n PRO 73 Cb 0.53 -1.80 0.56 0.00 -0.02 0.00 0.00 33.50 32.76 2duq n PRO 73 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2duq h LEU 74 N 1.70 0.00 -7.92 2.45 3.38 -1.35 -3.43 115.31 110.14 2duq h LEU 74 Ca -0.40 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.22 2duq h LEU 74 Cb 1.35 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 41.81 2duq h LEU 74 CO 0.58 0.07 -0.76 0.26 0.09 0.00 0.00 178.44 178.68 2duq s TRP 75 N -3.61 0.56 -0.04 1.13 0.52 -1.26 0.08 118.94 116.33 2duq s TRP 75 Ca 0.02 -0.11 0.02 0.00 0.02 0.00 0.00 56.10 56.05 2duq s TRP 75 Cb 0.09 -0.38 -0.03 0.00 -1.15 0.00 0.00 33.47 32.00 2duq s TRP 75 CO 0.59 -0.02 -0.09 -0.51 0.02 0.00 0.00 176.95 176.94 2duq s ASP 76 N -0.07 4.49 0.27 2.95 1.01 0.14 -4.89 116.67 120.57 2duq s ASP 76 Ca 0.01 -0.11 0.10 0.00 0.71 0.00 0.00 52.55 53.26 2duq s ASP 76 Cb -0.03 -1.06 -0.05 0.00 1.01 0.00 0.00 42.92 42.79 2duq s ASP 76 CO -0.00 0.33 -0.15 0.72 0.21 0.00 0.00 175.17 176.28 2duq s PHE 77 N -0.86 2.09 0.06 4.23 -0.12 -1.26 -0.35 117.98 121.76 2duq s PHE 77 Ca 0.14 -0.47 -0.20 0.00 -0.05 0.00 0.00 56.93 56.34 2duq s PHE 77 Cb -0.11 -1.00 0.05 0.00 -0.63 0.00 0.00 43.02 41.32 2duq s PHE 77 CO 0.03 0.54 0.47 -1.14 -0.05 0.00 0.00 175.22 175.07 2duq s GLN 78 N -3.59 1.01 3.40 1.99 -0.44 -0.65 -5.00 119.66 116.38 2duq s GLN 78 Ca 0.28 -0.33 0.00 0.00 -2.50 0.00 0.00 55.36 52.81 2duq s GLN 78 Cb -0.02 0.45 0.00 0.00 -1.64 0.00 0.00 33.01 31.81 2duq s GLN 78 CO 0.12 -0.36 0.00 0.41 0.50 0.00 0.00 175.29 175.96 2duq n GLY 79 N 0.36 0.43 0.02 2.59 0.00 -1.26 -0.51 105.19 106.83 2duq n GLY 79 Ca -0.18 -1.04 0.10 0.00 0.00 0.00 0.00 46.02 44.90 2duq n GLY 79 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2duq n SER 80 N 3.37 0.13 -4.62 1.61 7.64 0.14 -4.94 113.62 116.96 2duq n SER 80 Ca 0.00 0.52 -0.50 0.00 1.01 0.00 0.00 58.87 59.91 2duq n SER 80 Cb 0.00 -0.55 -0.05 0.00 -1.01 0.00 0.00 64.21 62.60 2duq n SER 80 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2duq n THR 81 N -1.63 0.05 -4.52 0.44 -1.04 -1.17 -4.81 114.28 101.60 2duq n THR 81 Ca 0.05 -0.01 -0.22 0.00 -2.04 0.00 0.00 64.05 61.83 2duq n THR 81 Cb 0.25 -1.10 -0.14 0.00 -1.82 0.00 0.00 70.33 67.52 2duq n THR 81 CO 0.00 0.00 0.00 0.27 -0.64 0.00 0.00 175.07 174.70 2duq s ILE 82 N 0.61 1.17 -0.19 12.58 -4.36 -0.62 -4.82 121.20 125.57 2duq s ILE 82 Ca 0.82 -0.84 -0.18 0.00 -0.26 0.00 0.00 60.65 60.19 2duq s ILE 82 Cb -0.84 -1.02 -0.04 0.00 1.25 0.00 0.00 42.46 41.81 2duq s ILE 82 CO 0.44 0.16 0.47 -0.76 0.24 0.00 0.00 174.94 175.49 2duq s LEU 83 N -0.78 4.17 0.42 0.37 1.43 -1.26 -0.80 118.68 122.23 2duq s LEU 83 Ca 0.04 0.65 0.07 0.00 -1.03 0.00 0.00 54.13 53.86 2duq s LEU 83 Cb -0.07 -2.64 -0.07 0.00 0.03 0.00 0.00 46.19 43.44 2duq s LEU 83 CO 0.00 -0.11 0.07 0.42 0.23 0.00 0.00 176.35 176.96 2duq s THR 84 N 1.34 2.06 0.39 5.49 -4.23 -0.25 -5.00 115.64 115.44 2duq s THR 84 Ca 0.23 -1.90 0.09 0.00 -1.18 0.00 0.00 61.69 58.93 2duq s THR 84 Cb -0.15 -2.96 0.30 0.00 1.34 0.00 0.00 72.50 71.03 2duq s THR 84 CO 0.09 0.00 1.97 0.77 -0.54 0.00 0.00 174.62 176.92 2duq h SER 85 N 1.63 0.54 0.00 3.99 4.64 -1.98 -3.20 113.55 119.18 2duq h SER 85 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2duq h SER 85 Cb 1.25 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2duq h SER 85 CO 0.77 0.35 -0.81 0.00 -0.87 0.00 0.00 176.83 176.27 2duq n GLN 86 N -4.48 2.17 -3.53 4.77 1.13 -1.26 -4.63 117.38 111.55 2duq n GLN 86 Ca 0.10 -0.02 -0.09 0.00 -1.94 0.00 0.00 57.00 55.04 2duq n GLN 86 Cb 0.26 -1.17 -0.03 0.00 0.11 0.00 0.00 30.24 29.41 2duq n GLN 86 CO 0.00 0.00 0.00 1.52 -1.44 0.00 0.00 177.06 177.14 2duq s TYR 87 N -2.40 -0.36 -0.33 1.08 -0.85 -1.21 -4.81 117.35 108.48 2duq s TYR 87 Ca 0.03 0.37 -0.18 0.00 -0.52 0.00 0.00 57.07 56.78 2duq s TYR 87 Cb 0.10 0.51 -0.01 0.00 0.38 0.00 0.00 41.96 42.94 2duq s TYR 87 CO 0.56 -0.47 0.50 0.08 -1.52 0.00 0.00 175.55 174.69 2duq s VAL 88 N -2.42 5.04 -0.53 -3.49 1.01 0.07 -1.09 120.40 119.00 2duq s VAL 88 Ca 0.02 0.44 -0.19 0.00 0.00 0.00 0.00 61.98 62.26 2duq s VAL 88 Cb -0.01 -3.91 0.07 0.00 0.00 0.00 0.00 36.38 32.53 2duq s VAL 88 CO -0.05 -0.13 0.63 -0.60 0.00 0.00 0.00 175.10 174.95 2duq s ARG 89 N 2.34 3.09 0.10 2.72 3.52 0.02 -0.49 118.95 130.25 2duq s ARG 89 Ca 0.19 -1.04 -0.19 0.00 -0.13 0.00 0.00 55.73 54.55 2duq s ARG 89 Cb -0.16 -4.14 -0.07 0.00 -1.56 0.00 0.00 34.95 29.02 2duq s ARG 89 CO 0.12 -1.29 1.67 -0.07 -0.81 0.00 0.00 175.30 174.92 2duq h LEU 90 N 9.70 0.30 -8.08 -0.88 3.38 -1.16 -1.64 115.31 116.92 2duq h LEU 90 Ca -0.28 -0.13 -0.31 0.00 0.09 0.00 0.00 57.88 57.25 2duq h LEU 90 Cb 1.09 -0.08 -0.24 0.00 0.09 0.00 0.00 40.66 41.53 2duq h LEU 90 CO 0.99 0.35 -0.75 0.42 0.09 0.00 0.00 178.44 179.54 2duq s THR 91 N -5.68 0.54 1.04 0.22 -4.23 -1.21 -3.06 115.64 103.25 2duq s THR 91 Ca -0.13 -0.75 -0.17 0.00 -1.18 0.00 0.00 61.69 59.46 2duq s THR 91 Cb 0.08 -0.54 0.22 0.00 1.34 0.00 0.00 72.50 73.60 2duq s THR 91 CO 0.71 -0.16 1.22 -2.16 -0.54 0.00 0.00 174.62 173.68 2duq s PRO 92 N -1.00 0.04 -1.46 3.99 0.04 -1.26 -1.80 135.00 133.55 2duq s PRO 92 Ca -0.05 -0.18 -0.08 0.00 0.04 0.00 0.00 61.00 60.73 2duq s PRO 92 Cb -0.07 -1.76 0.03 0.00 0.04 0.00 0.00 34.50 32.75 2duq s PRO 92 CO 0.00 -2.85 2.60 -3.47 0.04 0.00 0.00 177.00 173.33 2duq n ASP 93 N -4.12 8.06 -4.17 6.66 2.03 -1.25 -4.27 116.55 119.48 2duq n ASP 93 Ca 0.13 -2.88 -0.15 0.00 0.52 0.00 0.00 54.79 52.41 2duq n ASP 93 Cb 0.59 -1.46 -0.11 0.00 -0.72 0.00 0.00 41.12 39.42 2duq n ASP 93 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2duq s GLU 94 N 0.52 0.83 0.56 -0.67 2.02 -1.26 -4.80 118.70 115.90 2duq s GLU 94 Ca 0.60 -1.09 -0.19 0.00 0.02 0.00 0.00 54.97 54.31 2duq s GLU 94 Cb 0.18 -0.60 -0.05 0.00 0.10 0.00 0.00 34.13 33.75 2duq s GLU 94 CO -0.07 0.11 1.13 1.03 0.02 0.00 0.00 175.26 177.47 2duq s ARG 95 N -2.48 3.28 -1.22 1.61 0.52 -1.26 -4.30 118.95 115.10 2duq s ARG 95 Ca 0.03 1.58 -0.01 0.00 -0.52 0.00 0.00 55.73 56.81 2duq s ARG 95 Cb -0.05 -2.00 0.00 0.00 0.52 0.00 0.00 34.95 33.42 2duq s ARG 95 CO 0.01 -0.90 0.99 0.43 0.02 0.00 0.00 175.30 175.85 2duq n SER 96 N -1.46 -2.30 -4.46 0.23 7.64 0.19 -4.92 113.62 108.55 2duq n SER 96 Ca 0.11 -0.63 -0.27 0.00 1.01 0.00 0.00 58.87 59.09 2duq n SER 96 Cb 0.51 -5.05 -0.11 0.00 -1.01 0.00 0.00 64.21 58.55 2duq n SER 96 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2duq s LYS 97 N -5.47 1.65 0.02 1.43 -0.14 -1.13 -4.97 119.74 111.13 2duq s LYS 97 Ca 0.04 -1.42 0.00 0.00 -1.36 0.00 0.00 55.97 53.24 2duq s LYS 97 Cb -0.02 -1.95 -0.02 0.00 -1.68 0.00 0.00 37.83 34.16 2duq s LYS 97 CO 0.74 0.42 -0.03 -1.83 -0.76 0.00 0.00 175.35 173.89 2duq s GLU 98 N -2.59 0.30 -0.15 1.68 -1.05 -1.26 -1.01 118.70 114.62 2duq s GLU 98 Ca 0.21 -0.59 -0.18 0.00 -0.15 0.00 0.00 54.97 54.26 2duq s GLU 98 Cb -0.09 0.10 0.05 0.00 -0.44 0.00 0.00 34.13 33.75 2duq s GLU 98 CO 0.11 -0.05 0.48 0.20 0.95 0.00 0.00 175.26 176.95 2duq s GLY 99 N -1.41 -0.36 0.09 -3.83 0.00 -0.72 0.29 107.32 101.37 2duq s GLY 99 Ca -0.15 1.23 0.01 0.00 0.00 0.00 0.00 44.72 45.81 2duq s GLY 99 CO -0.01 1.02 -0.06 -0.56 0.00 0.00 0.00 173.10 173.49 2duq s SER 100 N -0.08 1.02 -0.05 1.64 0.01 0.34 -0.96 113.70 115.62 2duq s SER 100 Ca -0.03 -0.96 -0.03 0.00 1.31 0.00 0.00 55.95 56.25 2duq s SER 100 Cb -0.03 0.10 0.03 0.00 0.21 0.00 0.00 66.02 66.33 2duq s SER 100 CO 0.02 -0.46 0.12 -0.51 0.41 0.00 0.00 173.24 172.83 2duq s ILE 101 N -3.43 -0.03 -0.03 1.44 2.07 0.71 -1.63 121.20 120.30 2duq s ILE 101 Ca 0.09 0.12 0.03 0.00 -1.41 0.00 0.00 60.65 59.48 2duq s ILE 101 Cb 0.04 -0.20 0.00 0.00 0.13 0.00 0.00 42.46 42.43 2duq s ILE 101 CO -0.05 0.05 -0.11 0.26 -1.91 0.00 0.00 174.94 173.18 2duq s TRP 102 N 0.78 1.11 0.11 3.50 0.52 0.53 -0.62 118.94 124.87 2duq s TRP 102 Ca -0.06 -0.28 -0.31 0.00 0.02 0.00 0.00 56.10 55.47 2duq s TRP 102 Cb -0.08 -0.77 -0.08 0.00 -1.15 0.00 0.00 33.47 31.38 2duq s TRP 102 CO -0.04 -0.11 1.46 1.21 0.02 0.00 0.00 176.95 179.50 2duq s ASN 103 N 0.12 6.75 0.30 2.95 3.04 0.05 -0.68 114.94 127.47 2duq s ASN 103 Ca -0.03 2.39 0.03 0.00 0.04 0.00 0.00 52.86 55.30 2duq s ASN 103 Cb -0.09 -2.58 0.47 0.00 -1.54 0.00 0.00 41.25 37.51 2duq s ASN 103 CO 0.01 -0.73 1.76 -0.74 -3.04 0.00 0.00 177.10 174.36 2duq h HIS 104 N 7.09 0.50 -3.42 0.43 -0.00 -0.63 -3.43 115.15 115.69 2duq h HIS 104 Ca -0.42 -0.09 -0.67 0.00 -0.00 0.00 0.00 60.37 59.19 2duq h HIS 104 Cb 1.20 -0.13 -0.17 0.00 -0.00 0.00 0.00 27.41 28.31 2duq h HIS 104 CO 0.68 0.64 -0.65 -0.65 -0.00 0.00 0.00 177.93 177.95 2duq s GLN 105 N -4.57 3.07 0.77 5.26 -0.21 -1.26 -5.07 119.66 117.65 2duq s GLN 105 Ca -0.07 -0.47 -0.14 0.00 0.02 0.00 0.00 55.36 54.71 2duq s GLN 105 Cb 0.14 -2.77 0.06 0.00 1.00 0.00 0.00 33.01 31.44 2duq s GLN 105 CO 0.78 0.60 1.21 -2.14 -2.12 0.00 0.00 175.29 173.61 2duq s PRO 106 N -0.60 1.88 -0.20 2.91 0.02 -1.26 -4.81 135.00 132.95 2duq s PRO 106 Ca 0.10 1.75 -0.10 0.00 0.02 0.00 0.00 61.00 62.77 2duq s PRO 106 Cb -0.12 -1.80 -0.05 0.00 0.02 0.00 0.00 34.50 32.55 2duq s PRO 106 CO 0.02 -2.03 0.13 0.00 -0.33 0.00 0.00 177.00 174.79 2duq n PHE 108 N 3.46 0.53 -2.61 0.00 3.01 -1.26 0.37 117.46 120.97 2duq n PHE 108 Ca -0.16 -0.96 -0.40 0.00 1.01 0.00 0.00 57.45 56.94 2duq n PHE 108 Cb 0.52 -0.25 -0.05 0.00 -0.01 0.00 0.00 39.48 39.69 2duq n PHE 108 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2duq s LEU 109 N -2.87 4.59 -0.02 4.37 1.43 -1.26 -4.89 118.68 120.02 2duq s LEU 109 Ca 0.38 2.09 0.12 0.00 -1.03 0.00 0.00 54.13 55.70 2duq s LEU 109 Cb 0.32 -3.62 -0.22 0.00 0.03 0.00 0.00 46.19 42.70 2duq s LEU 109 CO 0.06 -0.01 0.73 0.11 0.23 0.00 0.00 176.35 177.46 2duq h LYS 110 N 4.16 0.00 -4.16 1.70 1.57 -1.94 -3.46 116.57 114.44 2duq h LYS 110 Ca -0.46 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 57.83 2duq h LYS 110 Cb 1.21 0.00 -0.36 0.00 0.08 0.00 0.00 32.23 33.16 2duq h LYS 110 CO 0.68 0.52 -0.79 -0.51 -0.57 0.00 0.00 179.45 178.78 2duq s ASP 111 N -6.13 1.82 0.10 0.86 1.01 -1.26 -4.62 116.67 108.45 2duq s ASP 111 Ca -0.04 -0.24 -0.16 0.00 0.71 0.00 0.00 52.55 52.82 2duq s ASP 111 Cb 0.08 -0.71 0.03 0.00 1.01 0.00 0.00 42.92 43.34 2duq s ASP 111 CO 0.82 -0.10 0.39 -1.66 0.21 0.00 0.00 175.17 174.84 2duq s TRP 112 N 1.45 -0.20 -0.10 4.23 1.48 -0.34 -2.35 118.94 123.11 2duq s TRP 112 Ca -0.01 -0.06 -0.01 0.00 -1.06 0.00 0.00 56.10 54.96 2duq s TRP 112 Cb -0.13 0.23 0.03 0.00 -1.16 0.00 0.00 33.47 32.44 2duq s TRP 112 CO -0.04 -0.66 -0.05 -2.00 -4.06 0.00 0.00 176.95 170.13 2duq s GLU 113 N -3.51 1.20 -0.26 3.25 2.12 -0.37 -1.15 118.70 119.98 2duq s GLU 113 Ca 0.01 -0.13 -0.09 0.00 0.36 0.00 0.00 54.97 55.12 2duq s GLU 113 Cb 0.01 -1.37 -0.04 0.00 0.26 0.00 0.00 34.13 32.99 2duq s GLU 113 CO -0.10 -0.28 0.14 1.41 -0.54 0.00 0.00 175.26 175.89 2duq s MET 114 N 1.79 3.84 -0.23 4.30 -2.45 0.58 -0.55 119.30 126.59 2duq s MET 114 Ca 0.05 -0.38 -0.09 0.00 -1.25 0.00 0.00 55.69 54.02 2duq s MET 114 Cb -0.12 -3.52 -0.04 0.00 1.25 0.00 0.00 34.83 32.40 2duq s MET 114 CO -0.07 -0.16 0.11 -1.01 1.05 0.00 0.00 175.02 174.94 2duq s HIS 115 N 1.64 3.24 -0.19 4.11 3.76 0.06 -0.45 115.29 127.46 2duq s HIS 115 Ca 0.07 0.04 0.00 0.00 -0.15 0.00 0.00 55.06 55.02 2duq s HIS 115 Cb -0.15 -2.21 0.02 0.00 1.11 0.00 0.00 32.58 31.34 2duq s HIS 115 CO 0.08 -0.01 -0.17 0.08 -0.85 0.00 0.00 174.74 173.87 2duq s VAL 116 N 1.00 2.32 -0.34 -0.90 1.01 0.11 -0.77 120.40 122.83 2duq s VAL 116 Ca 0.06 -0.88 -0.15 0.00 0.00 0.00 0.00 61.98 61.01 2duq s VAL 116 Cb -0.14 -2.01 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 2duq s VAL 116 CO 0.04 0.50 0.38 -2.28 0.00 0.00 0.00 175.10 173.73 2duq s HIS 117 N 1.32 3.21 0.19 5.22 2.46 -0.11 -0.85 115.29 126.72 2duq s HIS 117 Ca 0.05 0.01 0.03 0.00 0.47 0.00 0.00 55.06 55.62 2duq s HIS 117 Cb -0.13 -2.69 -0.05 0.00 -0.13 0.00 0.00 32.58 29.58 2duq s HIS 117 CO -0.11 -0.43 -0.02 -0.59 -2.47 0.00 0.00 174.74 171.12 2duq s PHE 118 N 2.05 1.33 -0.10 3.88 -0.71 -0.93 -0.52 117.98 122.99 2duq s PHE 118 Ca 0.12 -0.93 -0.04 0.00 -1.04 0.00 0.00 56.93 55.04 2duq s PHE 118 Cb -0.16 -0.75 0.05 0.00 -1.21 0.00 0.00 43.02 40.95 2duq s PHE 118 CO 0.12 -0.09 0.20 0.21 -1.34 0.00 0.00 175.22 174.31 2duq s LYS 119 N -3.86 0.11 -0.23 1.99 2.20 -0.06 -4.14 119.74 115.75 2duq s LYS 119 Ca 0.24 0.56 -0.01 0.00 -0.36 0.00 0.00 55.97 56.39 2duq s LYS 119 Cb 0.05 -0.16 0.02 0.00 -1.51 0.00 0.00 37.83 36.23 2duq s LYS 119 CO 0.05 -0.24 -0.09 0.08 -0.36 0.00 0.00 175.35 174.79 2duq s VAL 120 N 1.85 2.78 -0.11 4.02 1.01 -1.26 -0.59 120.40 128.10 2duq s VAL 120 Ca -0.03 -0.89 -0.23 0.00 0.00 0.00 0.00 61.98 60.83 2duq s VAL 120 Cb -0.12 -2.33 0.05 0.00 0.00 0.00 0.00 36.38 33.99 2duq s VAL 120 CO -0.07 0.33 0.55 -1.38 0.00 0.00 0.00 175.10 174.53 2duq s HIS 121 N 1.35 -0.54 0.07 5.22 -0.00 -0.92 -1.54 115.29 118.93 2duq s HIS 121 Ca 0.02 1.10 -0.27 0.00 -0.00 0.00 0.00 55.06 55.92 2duq s HIS 121 Cb -0.15 0.26 0.09 0.00 -0.00 0.00 0.00 32.58 32.78 2duq s HIS 121 CO -0.06 -0.44 1.17 0.20 -0.00 0.00 0.00 174.74 175.61 2duq s GLY 122 N -0.62 -0.15 0.00 -1.38 0.00 -1.26 -0.65 107.32 103.25 2duq s GLY 122 Ca -0.07 0.12 0.27 0.00 0.00 0.00 0.00 44.72 45.03 2duq s GLY 122 CO 0.05 2.42 1.57 -1.30 0.00 0.00 0.00 173.10 175.85 2duq n THR 123 N -0.67 0.00 -1.74 0.90 -2.24 -1.26 -4.94 114.28 104.32 2duq n THR 123 Ca -0.03 -0.31 -0.42 0.00 -2.27 0.00 0.00 64.05 61.02 2duq n THR 123 Cb 0.60 0.80 -0.01 0.00 -2.10 0.00 0.00 70.33 69.62 2duq n THR 123 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2duq n GLY 124 N 1.24 1.16 3.87 3.38 0.00 -1.26 -4.99 105.19 108.60 2duq n GLY 124 Ca 0.17 0.41 -0.33 0.00 0.00 0.00 0.00 46.02 46.27 2duq n GLY 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2duq s LYS 125 N -1.07 3.79 5.99 1.61 1.02 -1.26 -4.85 119.74 124.98 2duq s LYS 125 Ca 0.61 0.23 0.00 0.00 0.02 0.00 0.00 55.97 56.82 2duq s LYS 125 Cb -0.51 -2.83 0.00 0.00 -0.52 0.00 0.00 37.83 33.96 2duq s LYS 125 CO 0.54 0.44 0.00 1.63 -0.92 0.00 0.00 175.35 177.04 2duq n LYS 126 N 0.37 0.00 -0.02 1.68 5.02 -1.26 -1.40 118.16 122.55 2duq n LYS 126 Ca -0.03 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.39 2duq n LYS 126 Cb 0.52 0.00 0.52 0.00 -0.02 0.00 0.00 35.03 36.05 2duq n LYS 126 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2duq n ASN 127 N 5.42 1.40 -3.62 4.39 5.03 -1.26 -4.71 115.26 121.91 2duq n ASN 127 Ca 0.00 -1.51 -0.41 0.00 0.87 0.00 0.00 54.58 53.53 2duq n ASN 127 Cb 0.00 -0.02 -0.01 0.00 -1.02 0.00 0.00 39.78 38.73 2duq n ASN 127 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2duq n LEU 128 N 0.11 7.41 -3.59 3.41 4.77 -0.50 -4.83 117.00 123.78 2duq n LEU 128 Ca 0.19 -4.27 -0.11 0.00 -0.03 0.00 0.00 56.01 51.79 2duq n LEU 128 Cb 0.33 -1.61 -0.04 0.00 -2.33 0.00 0.00 43.42 39.77 2duq n LEU 128 CO 0.16 1.42 0.21 -1.38 -1.33 0.00 0.00 177.39 176.47 2duq s HIS 129 N 2.54 -0.28 0.00 -1.77 -3.43 -1.26 -4.17 115.29 106.92 2duq s HIS 129 Ca 0.53 0.00 0.00 0.00 -0.80 0.00 0.00 55.06 54.79 2duq s HIS 129 Cb 0.15 0.32 0.00 0.00 -1.43 0.00 0.00 32.58 31.62 2duq s HIS 129 CO -0.07 -0.72 0.00 0.41 -2.00 0.00 0.00 174.74 172.35 2duq n GLY 130 N -0.21 -1.00 0.01 -1.38 0.00 -1.04 -4.41 105.19 97.15 2duq n GLY 130 Ca -0.16 -1.11 0.05 0.00 0.00 0.00 0.00 46.02 44.79 2duq n GLY 130 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2duq n ASP 131 N 0.00 2.18 0.00 1.61 9.92 0.28 -2.68 116.55 127.86 2duq n ASP 131 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2duq n ASP 131 Cb 0.00 1.48 0.00 0.00 -0.64 0.00 0.00 41.12 41.96 2duq n ASP 131 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2duq n GLY 132 N 1.85 0.71 3.36 0.44 0.00 -1.22 -1.86 105.19 108.49 2duq n GLY 132 Ca -0.04 -2.07 -0.29 0.00 0.00 0.00 0.00 46.02 43.61 2duq n GLY 132 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2duq s ILE 133 N -1.36 2.19 0.02 -0.61 1.01 -0.37 -2.67 121.20 119.41 2duq s ILE 133 Ca 0.00 -1.57 0.09 0.00 0.00 0.00 0.00 60.65 59.16 2duq s ILE 133 Cb 0.00 -1.90 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 2duq s ILE 133 CO 0.00 0.22 -0.26 0.00 0.00 0.00 0.00 174.94 174.90 2duq s ALA 134 N -0.94 2.25 -0.02 9.38 0.00 0.97 -0.10 121.76 133.29 2duq s ALA 134 Ca 0.13 -1.22 0.03 0.00 0.00 0.00 0.00 51.96 50.90 2duq s ALA 134 Cb -0.10 -0.52 -0.03 0.00 0.00 0.00 0.00 23.12 22.47 2duq s ALA 134 CO 0.04 0.53 -0.09 -0.51 0.00 0.00 0.00 175.76 175.73 2duq s LEU 135 N -1.04 3.03 0.03 0.00 1.43 -0.07 -0.87 118.68 121.18 2duq s LEU 135 Ca 0.11 -0.15 0.05 0.00 -1.03 0.00 0.00 54.13 53.12 2duq s LEU 135 Cb -0.10 -1.70 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 2duq s LEU 135 CO 0.01 0.31 -0.15 0.26 0.23 0.00 0.00 176.35 177.02 2duq s TRP 136 N -0.89 1.30 -0.31 0.29 0.52 -0.18 -0.75 118.94 118.93 2duq s TRP 136 Ca 0.14 -0.33 -0.03 0.00 0.02 0.00 0.00 56.10 55.91 2duq s TRP 136 Cb -0.11 -0.78 0.11 0.00 -1.15 0.00 0.00 33.47 31.54 2duq s TRP 136 CO 0.04 0.03 0.15 -0.47 0.02 0.00 0.00 176.95 176.73 2duq s TYR 137 N -0.73 0.47 0.09 -1.98 5.04 -0.57 -1.70 117.35 117.97 2duq s TYR 137 Ca 0.03 -1.12 -0.03 0.00 -2.44 0.00 0.00 57.07 53.51 2duq s TYR 137 Cb -0.07 -0.92 -0.03 0.00 0.35 0.00 0.00 41.96 41.28 2duq s TYR 137 CO 0.01 -0.83 0.06 0.95 -1.34 0.00 0.00 175.55 174.40 2duq s THR 138 N 1.77 0.16 0.19 4.34 -4.23 -0.56 -0.89 115.64 116.42 2duq s THR 138 Ca 0.12 -1.69 -0.07 0.00 -1.18 0.00 0.00 61.69 58.86 2duq s THR 138 Cb -0.18 -1.67 0.03 0.00 1.34 0.00 0.00 72.50 72.02 2duq s THR 138 CO -0.25 -0.72 1.60 -0.09 -0.54 0.00 0.00 174.62 174.62 2duq h ARG 139 N 2.94 0.92 -5.96 3.99 1.12 -1.43 0.20 114.38 116.16 2duq h ARG 139 Ca -0.34 -0.37 -0.67 0.00 -1.11 0.00 0.00 59.98 57.49 2duq h ARG 139 Cb 1.18 -0.05 -0.13 0.00 -0.01 0.00 0.00 29.97 30.96 2duq h ARG 139 CO 0.61 1.02 -0.60 -0.51 -3.11 0.00 0.00 179.97 177.38 2duq s ASP 140 N -6.71 5.43 0.20 -3.80 1.01 -1.26 -4.73 116.67 106.80 2duq s ASP 140 Ca -0.11 0.17 0.05 0.00 0.71 0.00 0.00 52.55 53.38 2duq s ASP 140 Cb 0.13 -1.55 -0.05 0.00 1.01 0.00 0.00 42.92 42.46 2duq s ASP 140 CO 0.85 0.36 -0.09 0.00 0.21 0.00 0.00 175.17 176.50 2duq s ARG 141 N -1.10 1.26 -1.52 8.23 1.04 -1.26 -4.85 118.95 120.75 2duq s ARG 141 Ca 0.16 -1.58 -0.13 0.00 -1.04 0.00 0.00 55.73 53.13 2duq s ARG 141 Cb -0.12 -0.83 0.08 0.00 -2.04 0.00 0.00 34.95 32.05 2duq s ARG 141 CO 0.05 0.07 0.91 1.28 -0.04 0.00 0.00 175.30 177.57 2duq n LEU 142 N -0.35 -2.43 -3.98 -1.89 4.77 -1.26 -4.99 117.00 106.88 2duq n LEU 142 Ca -0.08 -0.72 -0.31 0.00 -0.03 0.00 0.00 56.01 54.88 2duq n LEU 142 Cb 0.62 -2.52 -0.15 0.00 -2.33 0.00 0.00 43.42 39.03 2duq n LEU 142 CO 0.35 0.42 -0.43 -0.69 -1.33 0.00 0.00 177.39 175.71 2duq s VAL 143 N -3.25 1.72 0.96 4.08 1.01 -1.26 -5.12 120.40 118.53 2duq s VAL 143 Ca 0.63 -1.36 -0.15 0.00 0.00 0.00 0.00 61.98 61.09 2duq s VAL 143 Cb -0.31 -1.95 0.18 0.00 0.00 0.00 0.00 36.38 34.30 2duq s VAL 143 CO 0.77 -0.10 1.24 -2.16 0.00 0.00 0.00 175.10 174.86 2duq s PRO 144 N 1.31 0.68 0.00 2.72 0.04 -1.26 -1.57 135.00 136.92 2duq s PRO 144 Ca -0.06 -0.17 0.00 0.00 0.04 0.00 0.00 61.00 60.81 2duq s PRO 144 Cb -0.19 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.52 2duq s PRO 144 CO -0.06 -2.42 0.00 0.41 0.04 0.00 0.00 177.00 174.97 2duq n GLY 145 N -3.07 -0.54 0.05 0.56 0.00 -0.89 -3.47 105.19 97.83 2duq n GLY 145 Ca 0.12 -0.95 0.14 0.00 0.00 0.00 0.00 46.02 45.33 2duq n GLY 145 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2duq n PRO 146 N 0.00 0.33 -3.04 1.61 -0.04 -1.09 -2.63 135.00 130.14 2duq n PRO 146 Ca 0.00 -0.09 -0.45 0.00 -0.04 0.00 0.00 63.50 62.92 2duq n PRO 146 Cb 0.00 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 2duq n PRO 146 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2duq s VAL 147 N -2.73 5.04 -1.62 0.52 1.01 0.06 -4.36 120.40 118.32 2duq s VAL 147 Ca 0.21 -2.02 -0.13 0.00 0.00 0.00 0.00 61.98 60.05 2duq s VAL 147 Cb 0.19 -4.72 0.11 0.00 0.00 0.00 0.00 36.38 31.97 2duq s VAL 147 CO 0.53 -1.40 0.65 0.49 0.00 0.00 0.00 175.10 175.37 2duq n PHE 148 N 5.64 -1.69 -0.27 5.22 3.72 -1.26 -1.35 117.46 127.48 2duq n PHE 148 Ca 0.23 0.77 0.00 0.00 -0.05 0.00 0.00 57.45 58.41 2duq n PHE 148 Cb 0.47 -3.14 0.00 0.00 -0.94 0.00 0.00 39.48 35.88 2duq n PHE 148 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2duq n GLY 149 N -1.62 0.89 3.60 1.37 0.00 -1.17 -1.86 105.19 106.42 2duq n GLY 149 Ca -0.05 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.71 2duq n GLY 149 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2duq s SER 150 N -2.94 3.92 0.48 1.61 0.15 -0.45 -2.10 113.70 114.37 2duq s SER 150 Ca 0.00 -1.23 -0.24 0.00 0.70 0.00 0.00 55.95 55.19 2duq s SER 150 Cb 0.00 -0.41 -0.07 0.00 -1.71 0.00 0.00 66.02 63.84 2duq s SER 150 CO 0.00 -0.34 1.32 -1.59 1.20 0.00 0.00 173.24 173.83 2duq s LYS 151 N -3.69 3.53 0.80 5.44 -2.85 -0.61 -0.76 119.74 121.61 2duq s LYS 151 Ca 0.35 2.17 -0.08 0.00 -1.00 0.00 0.00 55.97 57.40 2duq s LYS 151 Cb 0.05 -2.46 0.13 0.00 -2.06 0.00 0.00 37.83 33.49 2duq s LYS 151 CO 0.18 -0.86 1.12 0.34 0.10 0.00 0.00 175.35 176.23 2duq s ASP 152 N -0.90 4.07 -1.55 0.03 2.15 -1.26 -4.41 116.67 114.81 2duq s ASP 152 Ca 0.65 0.16 -0.05 0.00 0.43 0.00 0.00 52.55 53.73 2duq s ASP 152 Cb -0.38 -0.51 0.01 0.00 -0.30 0.00 0.00 42.92 41.73 2duq s ASP 152 CO 0.47 -2.08 0.65 0.59 -0.17 0.00 0.00 175.17 174.63 2duq n ASN 153 N -3.20 -6.11 -4.88 -0.34 4.13 -1.24 -4.95 115.26 98.67 2duq n ASN 153 Ca 0.13 -0.31 -0.30 0.00 1.68 0.00 0.00 54.58 55.78 2duq n ASN 153 Cb 0.60 -4.93 0.04 0.00 -1.54 0.00 0.00 39.78 33.95 2duq n ASN 153 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 2duq s PHE 154 N -3.19 3.34 -0.23 3.10 -0.12 -1.26 -4.41 117.98 115.20 2duq s PHE 154 Ca 0.33 1.05 -0.03 0.00 -0.05 0.00 0.00 56.93 58.23 2duq s PHE 154 Cb -0.15 -3.05 0.01 0.00 -0.63 0.00 0.00 43.02 39.20 2duq s PHE 154 CO 0.40 -1.15 -0.06 -1.01 -0.05 0.00 0.00 175.22 173.36 2duq s HIS 155 N -3.35 2.99 -1.49 3.49 3.76 -1.26 -2.01 115.29 117.42 2duq s HIS 155 Ca 0.58 -1.23 0.00 0.00 -0.15 0.00 0.00 55.06 54.26 2duq s HIS 155 Cb -0.11 -2.08 0.00 0.00 1.11 0.00 0.00 32.58 31.50 2duq s HIS 155 CO 0.52 -0.64 0.00 0.41 -0.85 0.00 0.00 174.74 174.18 2duq n GLY 156 N 4.74 0.39 3.58 -2.22 0.00 0.68 -1.09 105.19 111.27 2duq n GLY 156 Ca -0.18 -1.85 -0.34 0.00 0.00 0.00 0.00 46.02 43.65 2duq n GLY 156 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2duq s LEU 157 N 0.00 3.31 -0.04 0.99 2.96 -0.07 -1.31 118.68 124.52 2duq s LEU 157 Ca 0.00 -0.02 0.04 0.00 -0.22 0.00 0.00 54.13 53.93 2duq s LEU 157 Cb 0.00 -1.76 -0.00 0.00 0.50 0.00 0.00 46.19 44.93 2duq s LEU 157 CO 0.00 0.29 -0.15 0.00 -1.32 0.00 0.00 176.35 175.18 2duq s ALA 158 N -0.39 1.33 -0.25 5.97 0.00 -0.33 -1.51 121.76 126.58 2duq s ALA 158 Ca 0.06 -0.58 -0.02 0.00 0.00 0.00 0.00 51.96 51.43 2duq s ALA 158 Cb -0.12 -0.46 0.02 0.00 0.00 0.00 0.00 23.12 22.56 2duq s ALA 158 CO 0.02 0.23 -0.05 0.42 0.00 0.00 0.00 175.76 176.38 2duq s ILE 159 N 0.11 2.95 -0.19 0.00 1.09 0.07 -1.27 121.20 123.96 2duq s ILE 159 Ca -0.04 -0.99 -0.11 0.00 -1.10 0.00 0.00 60.65 58.41 2duq s ILE 159 Cb -0.11 -2.49 -0.05 0.00 -1.06 0.00 0.00 42.46 38.75 2duq s ILE 159 CO 0.02 0.20 0.18 -0.36 -0.10 0.00 0.00 174.94 174.88 2duq s PHE 160 N 1.34 3.42 -0.69 3.97 0.08 0.72 -0.89 117.98 125.93 2duq s PHE 160 Ca 0.00 0.41 -0.05 0.00 0.12 0.00 0.00 56.93 57.42 2duq s PHE 160 Cb -0.17 -2.22 0.18 0.00 -0.57 0.00 0.00 43.02 40.24 2duq s PHE 160 CO -0.04 0.27 0.53 -0.51 -0.10 0.00 0.00 175.22 175.37 2duq s LEU 161 N 0.41 5.51 -0.25 -0.37 1.02 0.85 -1.31 118.68 124.53 2duq s LEU 161 Ca 0.11 -2.92 -0.11 0.00 0.02 0.00 0.00 54.13 51.23 2duq s LEU 161 Cb -0.12 -1.92 -0.05 0.00 0.02 0.00 0.00 46.19 44.13 2duq s LEU 161 CO -0.00 -0.38 0.17 -0.62 0.02 0.00 0.00 176.35 175.54 2duq s ASP 162 N 0.83 6.08 0.00 2.29 3.68 -0.53 -1.24 116.67 127.78 2duq s ASP 162 Ca 0.18 0.07 0.13 0.00 2.13 0.00 0.00 52.55 55.07 2duq s ASP 162 Cb -0.18 -2.11 0.09 0.00 -1.45 0.00 0.00 42.92 39.27 2duq s ASP 162 CO -0.05 0.02 0.90 0.35 0.13 0.00 0.00 175.17 176.52 2duq n THR 163 N 4.57 0.00 -3.97 1.71 -2.24 -0.78 -0.86 114.28 112.71 2duq n THR 163 Ca -0.15 -0.48 -0.24 0.00 -2.27 0.00 0.00 64.05 60.91 2duq n THR 163 Cb 0.52 1.26 -0.17 0.00 -2.10 0.00 0.00 70.33 69.84 2duq n THR 163 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2duq s TYR 164 N -1.20 1.10 -0.64 4.78 5.04 -1.26 -4.70 117.35 120.47 2duq s TYR 164 Ca 0.15 -0.45 -0.27 0.00 -2.44 0.00 0.00 57.07 54.06 2duq s TYR 164 Cb 0.11 -0.99 0.01 0.00 0.35 0.00 0.00 41.96 41.45 2duq s TYR 164 CO 0.19 -0.38 1.45 -1.25 -1.34 0.00 0.00 175.55 174.22 2duq s PRO 165 N 1.56 3.12 0.20 4.97 0.04 -1.26 -4.82 135.00 138.80 2duq s PRO 165 Ca 0.00 0.21 0.08 0.00 0.04 0.00 0.00 61.00 61.33 2duq s PRO 165 Cb -0.13 -4.20 0.08 0.00 0.04 0.00 0.00 34.50 30.29 2duq s PRO 165 CO -0.05 -2.19 1.45 -0.91 0.04 0.00 0.00 177.00 175.34 2duq h ASN 166 N 11.45 0.02 -2.96 6.66 4.21 -1.85 -3.40 115.58 129.72 2duq h ASN 166 Ca -0.27 -0.02 -0.55 0.00 1.21 0.00 0.00 56.30 56.67 2duq h ASN 166 Cb 1.09 -0.01 -0.07 0.00 -1.12 0.00 0.00 38.32 38.21 2duq h ASN 166 CO 1.23 0.81 1.02 -0.62 -1.29 0.00 0.00 177.43 178.59 2duq s ASP 167 N -6.80 6.32 0.45 5.81 -1.08 -1.15 -4.80 116.67 115.43 2duq s ASP 167 Ca -0.00 0.06 0.17 0.00 -0.52 0.00 0.00 52.55 52.25 2duq s ASP 167 Cb 0.11 -2.55 1.12 0.00 -1.46 0.00 0.00 42.92 40.14 2duq s ASP 167 CO 0.79 -1.60 1.97 -0.33 0.52 0.00 0.00 175.17 176.53 2duq h GLU 168 N 10.02 0.31 -0.69 4.34 3.07 -1.87 -2.82 114.58 126.94 2duq h GLU 168 Ca -0.26 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.58 2duq h GLU 168 Cb 1.06 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.91 2duq h GLU 168 CO 1.20 0.20 0.00 0.25 -1.40 0.00 0.00 179.01 179.26 2duq n THR 169 N -4.46 1.64 -2.28 1.13 -2.24 -1.26 -4.97 114.28 101.84 2duq n THR 169 Ca 0.10 -1.15 -0.34 0.00 -2.27 0.00 0.00 64.05 60.39 2duq n THR 169 Cb 0.45 0.22 -0.00 0.00 -2.10 0.00 0.00 70.33 68.89 2duq n THR 169 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2duq s THR 170 N -1.64 3.40 -2.53 4.28 -1.32 -1.07 -4.95 115.64 111.81 2duq s THR 170 Ca 0.52 0.84 0.22 0.00 -1.21 0.00 0.00 61.69 62.05 2duq s THR 170 Cb 0.32 -3.33 0.13 0.00 -1.51 0.00 0.00 72.50 68.11 2duq s THR 170 CO 0.27 -0.22 1.15 -0.62 -2.21 0.00 0.00 174.62 172.99 2duq n GLU 171 N -1.35 1.87 -1.91 7.08 1.02 -1.26 -5.00 120.64 121.10 2duq n GLU 171 Ca 0.11 -1.60 -0.41 0.00 -0.02 0.00 0.00 57.16 55.24 2duq n GLU 171 Cb 0.52 -1.42 -0.01 0.00 -0.02 0.00 0.00 31.44 30.51 2duq n GLU 171 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2duq s ARG 172 N -1.93 4.15 -0.19 3.49 0.52 -1.26 -5.01 118.95 118.72 2duq s ARG 172 Ca 0.23 2.44 -0.14 0.00 -0.52 0.00 0.00 55.73 57.74 2duq s ARG 172 Cb 0.18 -2.97 -0.04 0.00 0.52 0.00 0.00 34.95 32.63 2duq s ARG 172 CO 0.33 -0.45 0.32 0.08 0.02 0.00 0.00 175.30 175.61 2duq s VAL 173 N -1.14 5.27 0.16 3.52 1.01 -1.26 -5.07 120.40 122.90 2duq s VAL 173 Ca 0.52 0.57 0.04 0.00 0.00 0.00 0.00 61.98 63.11 2duq s VAL 173 Cb -0.44 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 2duq s VAL 173 CO 0.59 0.33 0.23 -0.36 0.00 0.00 0.00 175.10 175.89 2duq s PHE 174 N 0.89 3.36 0.70 5.22 0.40 -1.26 -4.28 117.98 123.01 2duq s PHE 174 Ca 0.16 0.06 -0.15 0.00 -0.60 0.00 0.00 56.93 56.40 2duq s PHE 174 Cb -0.14 -1.60 0.03 0.00 0.51 0.00 0.00 43.02 41.82 2duq s PHE 174 CO 0.06 0.51 1.16 -2.14 0.70 0.00 0.00 175.22 175.51 2duq s PRO 175 N -3.24 2.40 -0.07 0.24 0.02 -1.25 -4.92 135.00 128.19 2duq s PRO 175 Ca 0.33 1.57 0.02 0.00 0.02 0.00 0.00 61.00 62.94 2duq s PRO 175 Cb -0.11 -1.88 0.02 0.00 0.02 0.00 0.00 34.50 32.55 2duq s PRO 175 CO 0.27 -1.59 -0.11 -0.47 -0.33 0.00 0.00 177.00 174.77 2duq s TYR 176 N -2.18 1.39 -0.21 6.54 5.04 -0.04 -1.43 117.35 126.46 2duq s TYR 176 Ca 0.70 -0.54 -0.09 0.00 -2.44 0.00 0.00 57.07 54.71 2duq s TYR 176 Cb -0.25 -1.05 -0.05 0.00 0.35 0.00 0.00 41.96 40.96 2duq s TYR 176 CO 0.44 -0.31 0.11 0.42 -1.34 0.00 0.00 175.55 174.88 2duq s ILE 177 N 0.85 5.11 0.07 3.14 1.01 0.56 -1.45 121.20 130.49 2duq s ILE 177 Ca -0.11 0.09 -0.00 0.00 0.00 0.00 0.00 60.65 60.62 2duq s ILE 177 Cb -0.15 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.94 2duq s ILE 177 CO 0.01 0.41 -0.03 -0.94 0.00 0.00 0.00 174.94 174.40 2duq s SER 178 N 0.64 0.61 0.13 3.58 1.04 -0.43 -0.48 113.70 118.80 2duq s SER 178 Ca 0.06 -1.02 0.10 0.00 0.48 0.00 0.00 55.95 55.57 2duq s SER 178 Cb -0.12 0.19 -0.04 0.00 0.10 0.00 0.00 66.02 66.14 2duq s SER 178 CO 0.01 -0.58 -0.22 0.68 0.98 0.00 0.00 173.24 174.10 2duq s VAL 179 N -3.87 2.55 -0.03 5.02 -7.23 -0.65 -0.20 120.40 115.99 2duq s VAL 179 Ca 0.09 -1.68 -0.01 0.00 -1.81 0.00 0.00 61.98 58.57 2duq s VAL 179 Cb 0.07 -2.16 0.02 0.00 0.56 0.00 0.00 36.38 34.87 2duq s VAL 179 CO -0.08 0.06 0.06 -0.32 -0.31 0.00 0.00 175.10 174.52 2duq s MET 180 N -2.19 0.03 -0.12 4.82 0.00 -0.40 -1.17 119.30 120.27 2duq s MET 180 Ca 0.17 0.17 0.03 0.00 0.00 0.00 0.00 55.69 56.06 2duq s MET 180 Cb -0.10 -0.11 0.01 0.00 0.00 0.00 0.00 34.83 34.63 2duq s MET 180 CO 0.08 -0.09 -0.21 0.08 0.00 0.00 0.00 175.02 174.88 2duq s VAL 181 N 0.61 1.94 -0.03 10.11 1.01 -1.26 -1.18 120.40 131.59 2duq s VAL 181 Ca -0.05 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.02 2duq s VAL 181 Cb -0.07 -1.71 0.02 0.00 0.00 0.00 0.00 36.38 34.62 2duq s VAL 181 CO -0.02 0.53 -0.06 0.21 0.00 0.00 0.00 175.10 175.76 2duq s ASN 182 N 0.67 0.94 -0.25 3.32 3.84 -0.43 -4.93 114.94 118.10 2duq s ASN 182 Ca -0.11 -0.14 0.13 0.00 0.21 0.00 0.00 52.86 52.95 2duq s ASN 182 Cb -0.16 -0.38 0.73 0.00 -0.55 0.00 0.00 41.25 40.89 2duq s ASN 182 CO 0.02 -0.01 1.69 -0.46 -2.79 0.00 0.00 177.10 175.55 2duq n ASN 183 N 3.74 4.99 0.00 -4.21 0.23 -1.26 -0.23 115.26 118.52 2duq n ASN 183 Ca -0.23 -3.07 0.00 0.00 -0.53 0.00 0.00 54.58 50.76 2duq n ASN 183 Cb 0.52 -0.67 0.00 0.00 -2.08 0.00 0.00 39.78 37.55 2duq n ASN 183 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2duq n GLY 184 N 0.09 3.35 0.23 4.83 0.00 -0.85 -4.88 105.19 107.96 2duq n GLY 184 Ca 0.30 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.45 2duq n GLY 184 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2duq h SER 185 N 0.00 0.00 -2.99 1.61 4.64 -1.86 -3.43 113.55 111.52 2duq h SER 185 Ca 0.00 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.71 2duq h SER 185 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.04 2duq h SER 185 CO 0.00 0.00 -0.33 -0.76 -0.87 0.00 0.00 176.83 174.87 2duq s LEU 186 N -6.19 4.36 -0.11 5.97 1.43 -1.26 -5.07 118.68 117.81 2duq s LEU 186 Ca 0.06 0.64 0.01 0.00 -1.03 0.00 0.00 54.13 53.81 2duq s LEU 186 Cb 0.06 -2.81 -0.02 0.00 0.03 0.00 0.00 46.19 43.45 2duq s LEU 186 CO 0.65 0.22 -0.14 -0.55 0.23 0.00 0.00 176.35 176.75 2duq s SER 187 N -1.76 3.96 -0.16 2.29 0.15 -1.26 -3.59 113.70 113.33 2duq s SER 187 Ca 0.30 -0.32 -0.29 0.00 0.70 0.00 0.00 55.95 56.34 2duq s SER 187 Cb -0.13 -1.45 -0.03 0.00 -1.71 0.00 0.00 66.02 62.69 2duq s SER 187 CO 0.17 0.20 1.52 -0.47 1.20 0.00 0.00 173.24 175.86 2duq s TYR 188 N 0.15 2.28 -0.74 3.44 5.04 -1.26 -4.93 117.35 121.33 2duq s TYR 188 Ca -0.07 0.57 -0.21 0.00 -2.44 0.00 0.00 57.07 54.91 2duq s TYR 188 Cb -0.15 -3.85 0.09 0.00 0.35 0.00 0.00 41.96 38.40 2duq s TYR 188 CO 0.05 -2.84 1.00 0.34 -1.34 0.00 0.00 175.55 172.76 2duq s ASP 189 N 3.34 6.31 0.19 4.32 3.68 -1.26 -4.90 116.67 128.35 2duq s ASP 189 Ca 0.67 -1.34 -0.13 0.00 2.13 0.00 0.00 52.55 53.88 2duq s ASP 189 Cb -0.26 -2.41 0.10 0.00 -1.45 0.00 0.00 42.92 38.91 2duq s ASP 189 CO 0.25 -1.31 1.84 -0.74 0.13 0.00 0.00 175.17 175.35 2duq h HIS 190 N 9.33 0.73 0.00 -5.34 -0.00 -1.93 -0.51 115.15 117.43 2duq h HIS 190 Ca -0.15 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.24 2duq h HIS 190 Cb 1.06 -0.24 0.00 0.00 -0.00 0.00 0.00 27.41 28.22 2duq h HIS 190 CO 1.02 0.45 0.00 0.66 -0.00 0.00 0.00 177.93 180.06 2duq h SER 191 N 0.78 0.00 -0.16 3.26 4.64 -1.92 -1.58 113.55 118.56 2duq h SER 191 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2duq h SER 191 Cb -0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2duq h SER 191 CO -0.06 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.19 2duq n LYS 192 N -2.85 2.51 -2.60 4.77 4.76 -0.79 -2.92 118.16 121.04 2duq n LYS 192 Ca -0.02 -2.32 -0.19 0.00 -2.87 0.00 0.00 58.31 52.91 2duq n LYS 192 Cb 0.07 -1.45 -0.00 0.00 -1.84 0.00 0.00 35.03 31.81 2duq n LYS 192 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2duq n ASP 193 N -0.50 -5.11 -2.15 4.39 10.43 -0.60 -2.33 116.55 120.69 2duq n ASP 193 Ca 0.13 -0.02 -0.18 0.00 2.57 0.00 0.00 54.79 57.29 2duq n ASP 193 Cb 0.59 -4.25 -0.03 0.00 1.84 0.00 0.00 41.12 39.27 2duq n ASP 193 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2duq n GLY 194 N -1.05 0.17 0.32 0.44 0.00 -0.27 -4.89 105.19 99.91 2duq n GLY 194 Ca -0.17 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.94 2duq n GLY 194 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2duq h ARG 195 N 0.00 0.58 -0.02 1.61 9.65 -1.73 -2.37 114.38 122.11 2duq h ARG 195 Ca -0.42 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.43 2duq h ARG 195 Cb 1.28 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.73 2duq h ARG 195 CO 0.52 0.39 -0.01 0.91 2.80 0.00 0.00 179.97 184.58 2duq n TRP 196 N -4.89 0.00 0.21 2.20 7.02 -1.26 -3.64 117.44 117.08 2duq n TRP 196 Ca 0.19 0.00 0.02 0.00 -1.02 0.00 0.00 57.50 56.69 2duq n TRP 196 Cb 0.51 -0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 29.37 2duq n TRP 196 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2duq n THR 197 N 0.22 0.00 -2.34 -0.99 -2.24 -0.99 -5.04 114.28 102.90 2duq n THR 197 Ca 0.19 -0.38 -0.33 0.00 -2.27 0.00 0.00 64.05 61.25 2duq n THR 197 Cb 0.37 0.99 -0.02 0.00 -2.10 0.00 0.00 70.33 69.57 2duq n THR 197 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2duq s GLU 198 N -1.46 3.60 -0.21 -0.78 -1.05 -0.93 -4.63 118.70 113.25 2duq s GLU 198 Ca 0.02 1.30 -0.03 0.00 -0.15 0.00 0.00 54.97 56.10 2duq s GLU 198 Cb 0.03 -2.07 -0.20 0.00 -0.44 0.00 0.00 34.13 31.46 2duq s GLU 198 CO 0.19 -0.59 -0.01 1.28 0.95 0.00 0.00 175.26 177.08 2duq n LEU 199 N -1.40 2.75 -3.53 1.83 4.77 -0.32 -5.01 117.00 116.09 2duq n LEU 199 Ca 0.09 0.04 -0.10 0.00 -0.03 0.00 0.00 56.01 56.01 2duq n LEU 199 Cb 0.53 -0.98 -0.02 0.00 -2.33 0.00 0.00 43.42 40.62 2duq n LEU 199 CO 0.43 0.86 0.52 0.00 -1.33 0.00 0.00 177.39 177.87 2duq s ALA 200 N -2.53 -1.62 0.18 -1.18 0.00 -1.26 -5.03 121.76 110.33 2duq s ALA 200 Ca -0.31 0.51 -0.22 0.00 0.00 0.00 0.00 51.96 51.94 2duq s ALA 200 Cb 0.08 0.73 0.08 0.00 0.00 0.00 0.00 23.12 24.01 2duq s ALA 200 CO 0.65 -0.80 1.03 0.20 0.00 0.00 0.00 175.76 176.84 2duq s GLY 201 N -2.71 0.09 0.05 0.00 0.00 -1.26 -1.64 107.32 101.86 2duq s GLY 201 Ca 0.04 -0.30 -0.20 0.00 0.00 0.00 0.00 44.72 44.26 2duq s GLY 201 CO -0.08 2.21 0.46 0.00 0.00 0.00 0.00 173.10 175.68 2duq s THR 203 N -2.59 3.84 -0.16 0.00 2.01 -1.26 -0.32 115.64 117.15 2duq s THR 203 Ca -0.04 1.53 -0.09 0.00 0.31 0.00 0.00 61.69 63.40 2duq s THR 203 Cb -0.01 -3.85 0.06 0.00 0.01 0.00 0.00 72.50 68.71 2duq s THR 203 CO -0.03 0.13 0.39 0.00 -0.69 0.00 0.00 174.62 174.42 2duq s ALA 204 N -1.54 -1.00 -1.11 7.40 0.00 -0.52 -4.88 121.76 120.12 2duq s ALA 204 Ca 0.52 1.45 -0.10 0.00 0.00 0.00 0.00 51.96 53.83 2duq s ALA 204 Cb -0.23 -0.88 0.25 0.00 0.00 0.00 0.00 23.12 22.26 2duq s ALA 204 CO 0.29 -0.25 1.15 0.34 0.00 0.00 0.00 175.76 177.29 2duq s ASP 205 N 1.31 7.23 0.00 0.00 2.15 -1.26 -3.80 116.67 122.30 2duq s ASP 205 Ca -0.09 -3.40 0.09 0.00 0.43 0.00 0.00 52.55 49.58 2duq s ASP 205 Cb -0.08 -2.25 -0.03 0.00 -0.30 0.00 0.00 42.92 40.26 2duq s ASP 205 CO -0.12 -0.41 0.51 2.22 -0.17 0.00 0.00 175.17 177.21 2duq n PHE 206 N 3.41 0.00 -2.93 -5.34 -1.74 -1.26 -4.96 117.46 104.65 2duq n PHE 206 Ca 0.26 0.00 -0.37 0.00 -0.56 0.00 0.00 57.45 56.78 2duq n PHE 206 Cb 0.41 0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.34 2duq n PHE 206 CO 0.00 0.00 0.00 1.03 -0.56 0.00 0.00 176.76 177.23 2duq s ARG 207 N -1.42 4.46 -1.48 3.97 0.52 -1.26 -4.35 118.95 119.39 2duq s ARG 207 Ca 0.06 1.14 -0.08 0.00 -0.52 0.00 0.00 55.73 56.32 2duq s ARG 207 Cb 0.07 -2.90 0.06 0.00 0.52 0.00 0.00 34.95 32.70 2duq s ARG 207 CO 0.26 0.36 0.76 0.09 0.02 0.00 0.00 175.30 176.80 2duq n ASN 208 N 0.76 -2.71 -4.86 0.23 3.02 -0.59 -4.96 115.26 106.16 2duq n ASN 208 Ca -0.01 -0.87 -0.35 0.00 -0.03 0.00 0.00 54.58 53.32 2duq n ASN 208 Cb 0.50 -3.58 -0.06 0.00 -0.61 0.00 0.00 39.78 36.04 2duq n ASN 208 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2duq s ARG 209 N -6.50 3.87 0.00 3.52 1.81 -1.26 -4.98 118.95 115.42 2duq s ARG 209 Ca 0.37 0.33 0.04 0.00 -1.72 0.00 0.00 55.73 54.75 2duq s ARG 209 Cb -0.19 -2.94 0.21 0.00 -0.45 0.00 0.00 34.95 31.58 2duq s ARG 209 CO 0.85 0.50 0.88 -0.25 -0.68 0.00 0.00 175.30 176.60 2duq n ASP 210 N 0.78 0.00 -3.79 0.23 8.00 -1.26 -4.79 116.55 115.72 2duq n ASP 210 Ca -0.06 -1.32 -0.08 0.00 0.71 0.00 0.00 54.79 54.03 2duq n ASP 210 Cb 0.52 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.59 2duq n ASP 210 CO 0.00 0.00 0.00 -1.38 -0.39 0.00 0.00 177.20 175.43 2duq s HIS 211 N -2.00 0.05 0.44 1.24 -3.43 -1.26 -5.15 115.29 105.18 2duq s HIS 211 Ca 0.05 -0.49 -0.26 0.00 -0.80 0.00 0.00 55.06 53.56 2duq s HIS 211 Cb 0.02 0.54 -0.08 0.00 -1.43 0.00 0.00 32.58 31.63 2duq s HIS 211 CO 0.04 -1.19 1.43 -0.51 -2.00 0.00 0.00 174.74 172.50 2duq s ASP 212 N -2.98 5.94 -0.06 7.38 1.01 -1.26 -5.01 116.67 121.69 2duq s ASP 212 Ca 0.16 2.92 0.05 0.00 0.71 0.00 0.00 52.55 56.38 2duq s ASP 212 Cb -0.04 -2.65 -0.00 0.00 1.01 0.00 0.00 42.92 41.23 2duq s ASP 212 CO 0.08 -1.13 -0.21 0.42 0.21 0.00 0.00 175.17 174.54 2duq s THR 213 N -1.20 1.75 0.15 -1.27 -4.23 -1.26 -4.63 115.64 104.96 2duq s THR 213 Ca 0.60 -0.88 0.05 0.00 -1.18 0.00 0.00 61.69 60.29 2duq s THR 213 Cb -0.44 -1.51 -0.04 0.00 1.34 0.00 0.00 72.50 71.85 2duq s THR 213 CO 0.56 0.49 -0.11 -0.36 -0.54 0.00 0.00 174.62 174.66 2duq s PHE 214 N 0.13 1.36 0.02 3.99 0.40 0.14 -2.19 117.98 121.83 2duq s PHE 214 Ca -0.09 -0.69 0.01 0.00 -0.60 0.00 0.00 56.93 55.56 2duq s PHE 214 Cb -0.14 -0.68 -0.02 0.00 0.51 0.00 0.00 43.02 42.69 2duq s PHE 214 CO 0.05 0.14 -0.05 -1.17 0.70 0.00 0.00 175.22 174.88 2duq s LEU 215 N -3.07 2.16 -0.02 -0.37 0.20 -0.03 -1.00 118.68 116.56 2duq s LEU 215 Ca 0.16 -0.36 0.05 0.00 0.69 0.00 0.00 54.13 54.67 2duq s LEU 215 Cb 0.01 -0.13 -0.01 0.00 -0.43 0.00 0.00 46.19 45.63 2duq s LEU 215 CO 0.02 -0.13 -0.17 0.00 -0.29 0.00 0.00 176.35 175.78 2duq s ALA 216 N -0.92 1.43 -0.15 5.97 0.00 -0.10 0.08 121.76 128.07 2duq s ALA 216 Ca -0.07 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.16 2duq s ALA 216 Cb -0.07 -0.37 0.03 0.00 0.00 0.00 0.00 23.12 22.71 2duq s ALA 216 CO -0.00 0.34 -0.13 0.08 0.00 0.00 0.00 175.76 176.06 2duq s VAL 217 N -0.37 1.50 -0.09 0.00 1.01 0.40 -1.79 120.40 121.07 2duq s VAL 217 Ca 0.06 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.40 2duq s VAL 217 Cb -0.07 -1.45 -0.03 0.00 0.00 0.00 0.00 36.38 34.83 2duq s VAL 217 CO -0.00 0.40 -0.10 -0.60 0.00 0.00 0.00 175.10 174.80 2duq s ARG 218 N 1.51 2.94 -0.06 2.72 3.52 0.31 -0.31 118.95 129.58 2duq s ARG 218 Ca 0.04 -0.61 -0.02 0.00 -0.13 0.00 0.00 55.73 55.01 2duq s ARG 218 Cb -0.13 -2.59 0.03 0.00 -1.56 0.00 0.00 34.95 30.70 2duq s ARG 218 CO -0.10 0.50 0.06 -0.47 -0.81 0.00 0.00 175.30 174.48 2duq s TYR 219 N -0.39 0.12 -0.28 5.12 5.04 -0.30 -1.35 117.35 125.32 2duq s TYR 219 Ca 0.05 0.15 -0.20 0.00 -2.44 0.00 0.00 57.07 54.64 2duq s TYR 219 Cb -0.12 -0.53 0.08 0.00 0.35 0.00 0.00 41.96 41.74 2duq s TYR 219 CO 0.02 -0.24 0.72 0.45 -1.34 0.00 0.00 175.55 175.16 2duq s SER 220 N 2.15 -0.84 -1.60 4.32 0.15 -0.92 -1.20 113.70 115.75 2duq s SER 220 Ca 0.05 1.44 -0.11 0.00 0.70 0.00 0.00 55.95 58.02 2duq s SER 220 Cb -0.13 1.39 0.10 0.00 -1.71 0.00 0.00 66.02 65.67 2duq s SER 220 CO -0.04 -0.24 0.61 0.54 1.20 0.00 0.00 173.24 175.31 2duq n ARG 221 N 3.64 -3.03 -0.82 5.44 1.74 -1.26 -0.70 116.66 121.66 2duq n ARG 221 Ca -0.18 0.36 0.00 0.00 -0.77 0.00 0.00 57.85 57.27 2duq n ARG 221 Cb 0.57 -4.80 0.00 0.00 -1.02 0.00 0.00 32.46 27.21 2duq n ARG 221 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2duq n GLY 222 N -1.67 1.33 3.62 -0.13 0.00 -1.26 -4.82 105.19 102.26 2duq n GLY 222 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 2duq n GLY 222 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2duq s ARG 223 N -0.01 4.04 -0.25 1.61 3.52 0.12 -0.60 118.95 127.37 2duq s ARG 223 Ca 0.00 0.05 -0.05 0.00 -0.13 0.00 0.00 55.73 55.60 2duq s ARG 223 Cb 0.00 -3.63 -0.00 0.00 -1.56 0.00 0.00 34.95 29.76 2duq s ARG 223 CO 0.00 -0.23 0.01 -1.17 -0.81 0.00 0.00 175.30 173.10 2duq s LEU 224 N 1.91 3.33 -0.09 -0.88 2.96 0.25 -2.18 118.68 123.99 2duq s LEU 224 Ca 0.15 -0.55 0.04 0.00 -0.22 0.00 0.00 54.13 53.55 2duq s LEU 224 Cb -0.16 -1.80 0.00 0.00 0.50 0.00 0.00 46.19 44.74 2duq s LEU 224 CO 0.09 -0.10 -0.22 -0.89 -1.32 0.00 0.00 176.35 173.92 2duq s THR 225 N 1.48 1.88 -0.14 3.68 2.01 -0.45 -1.26 115.64 122.84 2duq s THR 225 Ca 0.04 -0.92 0.01 0.00 0.31 0.00 0.00 61.69 61.14 2duq s THR 225 Cb -0.16 -1.64 0.00 0.00 0.01 0.00 0.00 72.50 70.72 2duq s THR 225 CO -0.01 0.52 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.57 2duq s VAL 226 N 0.40 2.41 0.19 3.82 1.01 0.06 -0.53 120.40 127.75 2duq s VAL 226 Ca -0.18 -0.87 0.08 0.00 0.00 0.00 0.00 61.98 61.02 2duq s VAL 226 Cb -0.18 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 2duq s VAL 226 CO 0.08 0.53 -0.17 -0.04 0.00 0.00 0.00 175.10 175.51 2duq s MET 227 N 0.74 1.32 0.23 2.72 -1.94 -0.74 -1.16 119.30 120.47 2duq s MET 227 Ca -0.08 -1.51 0.11 0.00 -1.71 0.00 0.00 55.69 52.51 2duq s MET 227 Cb -0.16 -1.26 -0.05 0.00 2.01 0.00 0.00 34.83 35.38 2duq s MET 227 CO 0.01 0.23 -0.21 0.95 -0.01 0.00 0.00 175.02 175.99 2duq s THR 228 N -2.48 2.49 -0.32 2.05 -4.23 -0.42 -0.92 115.64 111.81 2duq s THR 228 Ca 0.19 -2.17 -0.02 0.00 -1.18 0.00 0.00 61.69 58.51 2duq s THR 228 Cb -0.03 -2.25 0.12 0.00 1.34 0.00 0.00 72.50 71.67 2duq s THR 228 CO 0.07 -0.25 0.16 -0.62 -0.54 0.00 0.00 174.62 173.45 2duq s ASP 229 N -3.08 3.34 0.00 3.99 -1.08 -0.17 0.02 116.67 119.70 2duq s ASP 229 Ca 0.25 -1.71 0.00 0.00 -0.52 0.00 0.00 52.55 50.57 2duq s ASP 229 Cb -0.07 -0.42 0.00 0.00 -1.46 0.00 0.00 42.92 40.97 2duq s ASP 229 CO 0.13 -0.38 0.11 0.18 0.52 0.00 0.00 175.17 175.73 2duq n LEU 230 N 4.69 0.22 -0.68 -1.34 4.77 -1.26 -0.68 117.00 122.71 2duq n LEU 230 Ca 0.02 -0.44 0.06 0.00 -0.03 0.00 0.00 56.01 55.62 2duq n LEU 230 Cb 0.40 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.65 2duq n LEU 230 CO 0.09 0.06 0.63 -0.62 -1.33 0.00 0.00 177.39 176.22 2duq n GLU 231 N -0.43 2.79 -2.42 3.23 -0.58 -1.26 -4.92 120.64 117.05 2duq n GLU 231 Ca 0.00 -2.06 -0.17 0.00 -0.42 0.00 0.00 57.16 54.51 2duq n GLU 231 Cb 0.03 -1.29 -0.00 0.00 -0.57 0.00 0.00 31.44 29.61 2duq n GLU 231 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2duq n ASP 232 N 0.59 -4.98 -0.86 1.62 2.03 -1.26 -4.91 116.55 108.78 2duq n ASP 232 Ca 0.12 -0.05 0.07 0.00 0.52 0.00 0.00 54.79 55.45 2duq n ASP 232 Cb 0.43 -4.04 0.22 0.00 -0.72 0.00 0.00 41.12 37.02 2duq n ASP 232 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2duq n LYS 233 N -2.74 3.00 -4.27 -0.67 5.02 -1.26 -4.98 118.16 112.26 2duq n LYS 233 Ca -0.18 -2.40 -0.32 0.00 -2.02 0.00 0.00 58.31 53.38 2duq n LYS 233 Cb 0.64 -1.52 -0.07 0.00 -0.02 0.00 0.00 35.03 34.06 2duq n LYS 233 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2duq n ASN 234 N 0.37 -0.22 -3.72 4.39 3.02 -1.26 -4.94 115.26 112.90 2duq n ASN 234 Ca 0.17 -1.19 -0.12 0.00 -0.03 0.00 0.00 54.58 53.41 2duq n ASN 234 Cb 0.62 -2.03 -0.07 0.00 -0.61 0.00 0.00 39.78 37.70 2duq n ASN 234 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 2duq s GLU 235 N -7.14 0.87 -0.07 3.52 -1.05 -1.26 -5.16 118.70 108.41 2duq s GLU 235 Ca 0.22 -0.52 -0.15 0.00 -0.15 0.00 0.00 54.97 54.38 2duq s GLU 235 Cb -0.12 0.38 -0.05 0.00 -0.44 0.00 0.00 34.13 33.89 2duq s GLU 235 CO 0.97 -0.29 0.37 -1.58 0.95 0.00 0.00 175.26 175.68 2duq s TRP 236 N -2.74 3.62 -0.12 4.83 0.52 -1.26 -4.37 118.94 119.41 2duq s TRP 236 Ca -0.04 0.85 -0.03 0.00 0.02 0.00 0.00 56.10 56.90 2duq s TRP 236 Cb -0.00 -2.32 -0.03 0.00 -1.15 0.00 0.00 33.47 29.96 2duq s TRP 236 CO -0.04 0.47 -0.02 0.21 0.02 0.00 0.00 176.95 177.58 2duq s LYS 237 N -0.39 3.33 0.33 4.98 2.20 0.10 -4.91 119.74 125.39 2duq s LYS 237 Ca 0.22 -0.47 -0.26 0.00 -0.36 0.00 0.00 55.97 55.10 2duq s LYS 237 Cb -0.15 -2.85 -0.14 0.00 -1.51 0.00 0.00 37.83 33.18 2duq s LYS 237 CO 0.10 0.46 0.74 0.09 -0.36 0.00 0.00 175.35 176.38 2duq n ASN 238 N 2.87 -0.02 0.15 1.43 5.03 -1.26 -1.30 115.26 122.15 2duq n ASN 238 Ca -0.18 1.05 0.00 0.00 0.87 0.00 0.00 54.58 56.33 2duq n ASN 238 Cb 0.53 -1.16 0.00 0.00 -1.02 0.00 0.00 39.78 38.13 2duq n ASN 238 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2duq s ILE 240 N -2.00 0.52 -0.28 0.00 1.01 -0.31 -4.37 121.20 115.76 2duq s ILE 240 Ca 0.00 -0.23 0.02 0.00 0.00 0.00 0.00 60.65 60.44 2duq s ILE 240 Cb 0.00 -0.47 0.17 0.00 0.01 0.00 0.00 42.46 42.18 2duq s ILE 240 CO 0.00 0.17 0.50 -0.62 0.00 0.00 0.00 174.94 174.98 2duq s ASP 241 N 0.14 -0.60 0.02 3.58 3.68 -1.26 -0.76 116.67 121.47 2duq s ASP 241 Ca -0.01 0.12 0.04 0.00 2.13 0.00 0.00 52.55 54.82 2duq s ASP 241 Cb -0.06 1.60 -0.02 0.00 -1.45 0.00 0.00 42.92 42.99 2duq s ASP 241 CO -0.00 -0.31 -0.12 0.27 0.13 0.00 0.00 175.17 175.13 2duq s ILE 242 N 2.69 0.97 0.45 4.11 -4.36 -0.38 -5.00 121.20 119.67 2duq s ILE 242 Ca 0.12 -0.79 0.08 0.00 -0.26 0.00 0.00 60.65 59.80 2duq s ILE 242 Cb -0.13 -0.86 0.00 0.00 1.25 0.00 0.00 42.46 42.72 2duq s ILE 242 CO -0.25 0.07 0.47 0.42 0.24 0.00 0.00 174.94 175.89 2duq s THR 243 N -0.65 2.58 -0.81 8.37 -4.23 -1.26 -0.59 115.64 119.05 2duq s THR 243 Ca 0.02 -1.24 0.00 0.00 -1.18 0.00 0.00 61.69 59.29 2duq s THR 243 Cb -0.07 -2.82 0.00 0.00 1.34 0.00 0.00 72.50 70.96 2duq s THR 243 CO 0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 2duq n GLY 244 N -1.72 0.11 3.63 3.99 0.00 -0.65 -4.74 105.19 105.81 2duq n GLY 244 Ca 0.05 -0.51 -0.39 0.00 0.00 0.00 0.00 46.02 45.17 2duq n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2duq s VAL 245 N -2.45 5.15 -0.24 1.61 1.01 0.23 -0.54 120.40 125.16 2duq s VAL 245 Ca 0.00 0.71 -0.07 0.00 0.00 0.00 0.00 61.98 62.61 2duq s VAL 245 Cb 0.00 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 2duq s VAL 245 CO 0.00 0.16 0.07 -0.13 0.00 0.00 0.00 175.10 175.19 2duq s ARG 246 N 1.95 3.67 -0.03 2.72 0.52 0.11 -4.13 118.95 123.76 2duq s ARG 246 Ca 0.18 -0.47 0.02 0.00 -0.52 0.00 0.00 55.73 54.94 2duq s ARG 246 Cb -0.15 -3.31 0.01 0.00 0.52 0.00 0.00 34.95 32.02 2duq s ARG 246 CO 0.09 -0.16 -0.08 -0.51 0.02 0.00 0.00 175.30 174.67 2duq s LEU 247 N 1.52 1.67 0.79 2.53 1.02 -1.26 -1.25 118.68 123.70 2duq s LEU 247 Ca 0.06 -0.18 -0.11 0.00 0.02 0.00 0.00 54.13 53.92 2duq s LEU 247 Cb -0.15 -0.54 0.07 0.00 0.02 0.00 0.00 46.19 45.59 2duq s LEU 247 CO 0.03 0.03 1.09 -2.16 0.02 0.00 0.00 176.35 175.36 2duq s PRO 248 N 0.40 2.12 0.78 1.29 0.04 -1.25 -4.93 135.00 133.45 2duq s PRO 248 Ca -0.06 0.83 -0.12 0.00 0.04 0.00 0.00 61.00 61.69 2duq s PRO 248 Cb -0.11 -1.91 0.06 0.00 0.04 0.00 0.00 34.50 32.59 2duq s PRO 248 CO 0.01 -1.64 1.14 0.95 0.04 0.00 0.00 177.00 177.50 2duq s THR 249 N -3.04 2.58 0.00 1.26 -4.23 -0.70 -4.48 115.64 107.03 2duq s THR 249 Ca 0.61 0.19 0.00 0.00 -1.18 0.00 0.00 61.69 61.31 2duq s THR 249 Cb -0.15 -3.16 0.00 0.00 1.34 0.00 0.00 72.50 70.52 2duq s THR 249 CO 0.55 -0.25 0.00 0.61 -0.54 0.00 0.00 174.62 174.99 2duq n GLY 250 N -3.08 0.58 3.98 3.99 0.00 0.16 -4.39 105.19 106.42 2duq n GLY 250 Ca 0.07 -0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.63 2duq n GLY 250 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2duq s TYR 251 N -2.00 2.49 -0.11 1.61 1.51 -1.22 -4.63 117.35 115.00 2duq s TYR 251 Ca 0.00 -0.09 -0.01 0.00 -1.01 0.00 0.00 57.07 55.95 2duq s TYR 251 Cb 0.00 -2.81 -0.03 0.00 -0.11 0.00 0.00 41.96 39.01 2duq s TYR 251 CO 0.00 -1.11 -0.04 0.71 -1.11 0.00 0.00 175.55 173.99 2duq s TYR 252 N -2.87 3.01 0.23 2.71 1.51 0.69 -0.62 117.35 122.01 2duq s TYR 252 Ca 0.60 -0.08 -0.30 0.00 -1.01 0.00 0.00 57.07 56.28 2duq s TYR 252 Cb -0.09 -1.82 -0.09 0.00 -0.11 0.00 0.00 41.96 39.85 2duq s TYR 252 CO 0.40 0.21 0.93 -0.06 -1.11 0.00 0.00 175.55 175.91 2duq s PHE 253 N -0.35 3.98 0.27 2.71 0.08 -1.26 -1.50 117.98 121.91 2duq s PHE 253 Ca 0.06 1.89 -0.13 0.00 0.12 0.00 0.00 56.93 58.87 2duq s PHE 253 Cb -0.12 -2.96 0.00 0.00 -0.57 0.00 0.00 43.02 39.37 2duq s PHE 253 CO 0.02 0.46 0.53 0.20 -0.10 0.00 0.00 175.22 176.34 2duq s GLY 254 N -1.15 0.53 -0.01 4.36 0.00 -0.69 -0.77 107.32 109.60 2duq s GLY 254 Ca 0.41 -0.85 -0.03 0.00 0.00 0.00 0.00 44.72 44.24 2duq s GLY 254 CO 0.31 -0.56 0.06 0.00 0.00 0.00 0.00 173.10 172.91 2duq s ALA 255 N -3.78 -0.14 0.11 3.20 0.00 0.21 -1.01 121.76 120.35 2duq s ALA 255 Ca 0.21 -0.07 -0.10 0.00 0.00 0.00 0.00 51.96 51.99 2duq s ALA 255 Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.11 2duq s ALA 255 CO 0.10 -0.11 0.26 -1.54 0.00 0.00 0.00 175.76 174.47 2duq s SER 256 N -0.68 0.03 0.09 0.00 1.04 -0.05 -0.21 113.70 113.91 2duq s SER 256 Ca -0.08 -0.62 -0.11 0.00 0.48 0.00 0.00 55.95 55.63 2duq s SER 256 Cb -0.05 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.47 2duq s SER 256 CO 0.00 -0.79 0.24 0.00 0.98 0.00 0.00 173.24 173.67 2duq s ALA 257 N -3.87 -0.40 0.01 5.32 0.00 -0.13 -0.02 121.76 122.67 2duq s ALA 257 Ca 0.07 -0.44 -0.05 0.00 0.00 0.00 0.00 51.96 51.54 2duq s ALA 257 Cb 0.04 0.50 -0.01 0.00 0.00 0.00 0.00 23.12 23.65 2duq s ALA 257 CO -0.09 -0.52 0.08 0.20 0.00 0.00 0.00 175.76 175.43 2duq s GLY 258 N -2.75 0.13 0.11 0.00 0.00 -1.09 -1.76 107.32 101.96 2duq s GLY 258 Ca 0.03 -0.35 0.05 0.00 0.00 0.00 0.00 44.72 44.45 2duq s GLY 258 CO -0.10 -0.47 -0.13 -0.51 0.00 0.00 0.00 173.10 171.89 2duq s THR 259 N -1.66 1.17 0.00 0.90 -4.23 -0.18 -0.56 115.64 111.08 2duq s THR 259 Ca -0.13 -1.67 0.00 0.00 -1.18 0.00 0.00 61.69 58.71 2duq s THR 259 Cb -0.07 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.33 2duq s THR 259 CO -0.00 -0.46 0.00 0.61 -0.54 0.00 0.00 174.62 174.22 2duq n GLY 260 N 0.57 2.41 0.24 3.99 0.00 -1.26 -2.85 105.19 108.29 2duq n GLY 260 Ca -0.16 -0.17 0.14 0.00 0.00 0.00 0.00 46.02 45.83 2duq n GLY 260 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2duq h ASP 261 N 0.00 0.00 -2.95 1.61 3.32 -1.97 0.56 116.42 116.99 2duq h ASP 261 Ca 0.00 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 56.42 2duq h ASP 261 Cb 0.00 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 39.40 2duq h ASP 261 CO 0.00 0.06 -0.74 -0.76 -1.72 0.00 0.00 179.24 176.08 2duq s LEU 262 N -6.29 2.88 0.34 1.55 1.43 -1.26 -4.90 118.68 112.43 2duq s LEU 262 Ca 0.03 -0.65 0.03 0.00 -1.03 0.00 0.00 54.13 52.52 2duq s LEU 262 Cb 0.08 -1.56 -0.02 0.00 0.03 0.00 0.00 46.19 44.73 2duq s LEU 262 CO 0.61 0.10 0.37 -0.94 0.23 0.00 0.00 176.35 176.72 2duq s SER 263 N -2.88 1.38 -0.19 2.29 1.04 -1.19 -4.16 113.70 109.98 2duq s SER 263 Ca 0.25 -1.65 -0.32 0.00 0.48 0.00 0.00 55.95 54.71 2duq s SER 263 Cb -0.08 0.61 0.15 0.00 0.10 0.00 0.00 66.02 66.79 2duq s SER 263 CO 0.15 -1.18 1.16 -1.81 0.98 0.00 0.00 173.24 172.54 2duq s ASP 264 N -3.32 -0.20 0.08 7.02 1.01 -1.09 -2.49 116.67 117.68 2duq s ASP 264 Ca 0.36 0.12 -0.31 0.00 0.71 0.00 0.00 52.55 53.44 2duq s ASP 264 Cb 0.01 0.18 -0.07 0.00 1.01 0.00 0.00 42.92 44.05 2duq s ASP 264 CO 0.25 -0.25 1.35 0.20 0.21 0.00 0.00 175.17 176.93 2duq s ASN 265 N -1.61 6.89 -0.32 0.27 0.01 0.17 -3.93 114.94 116.42 2duq s ASN 265 Ca 0.06 2.21 0.03 0.00 -0.71 0.00 0.00 52.86 54.44 2duq s ASN 265 Cb -0.01 -2.58 0.08 0.00 0.41 0.00 0.00 41.25 39.16 2duq s ASN 265 CO -0.04 -0.62 0.01 -1.00 -1.51 0.00 0.00 177.10 173.93 2duq s HIS 266 N 1.37 3.56 -0.06 2.20 3.76 -0.74 -2.16 115.29 123.22 2duq s HIS 266 Ca 0.63 -2.66 0.01 0.00 -0.15 0.00 0.00 55.06 52.89 2duq s HIS 266 Cb -0.34 -2.58 -0.03 0.00 1.11 0.00 0.00 32.58 30.74 2duq s HIS 266 CO 0.29 -0.92 -0.06 -0.51 -0.85 0.00 0.00 174.74 172.69 2duq s ASP 267 N 1.07 4.68 -0.27 1.40 1.01 0.25 -0.64 116.67 124.16 2duq s ASP 267 Ca 0.03 -0.03 -0.04 0.00 0.71 0.00 0.00 52.55 53.22 2duq s ASP 267 Cb -0.20 -1.17 0.02 0.00 1.01 0.00 0.00 42.92 42.58 2duq s ASP 267 CO -0.06 0.35 -0.01 -0.63 0.21 0.00 0.00 175.17 175.03 2duq s ILE 268 N -0.85 3.29 -0.03 0.77 -1.09 0.35 -0.88 121.20 122.76 2duq s ILE 268 Ca 0.13 -0.90 -0.17 0.00 -2.23 0.00 0.00 60.65 57.48 2duq s ILE 268 Cb -0.11 -2.68 -0.32 0.00 -1.58 0.00 0.00 42.46 37.76 2duq s ILE 268 CO 0.03 0.15 0.84 0.40 -1.23 0.00 0.00 174.94 175.13 2duq h ILE 269 N 6.04 1.27 -2.31 2.92 5.03 -1.08 0.22 117.51 129.60 2duq h ILE 269 Ca -0.32 -2.57 -0.04 0.00 -0.12 0.00 0.00 64.86 61.82 2duq h ILE 269 Cb 1.11 3.01 -0.17 0.00 -3.03 0.00 0.00 36.82 37.75 2duq h ILE 269 CO 0.58 0.77 0.22 -0.94 -0.68 0.00 0.00 178.15 178.10 2duq s SER 270 N -7.25 -0.61 -0.12 1.72 1.04 -0.82 -4.31 113.70 103.35 2duq s SER 270 Ca -0.13 0.45 -0.00 0.00 0.48 0.00 0.00 55.95 56.74 2duq s SER 270 Cb 0.03 0.54 0.03 0.00 0.10 0.00 0.00 66.02 66.72 2duq s SER 270 CO 0.87 -0.72 -0.07 -0.04 0.98 0.00 0.00 173.24 174.26 2duq s MET 271 N -2.08 1.51 -0.18 4.02 -1.94 -0.36 -0.94 119.30 119.34 2duq s MET 271 Ca -0.06 -0.28 0.01 0.00 -1.71 0.00 0.00 55.69 53.65 2duq s MET 271 Cb -0.00 -1.63 0.02 0.00 2.01 0.00 0.00 34.83 35.23 2duq s MET 271 CO 0.02 -0.28 -0.18 0.15 -0.01 0.00 0.00 175.02 174.71 2duq s LYS 272 N 1.70 2.80 -0.22 2.03 1.02 0.05 -0.11 119.74 127.01 2duq s LYS 272 Ca 0.05 -0.80 -0.08 0.00 0.02 0.00 0.00 55.97 55.16 2duq s LYS 272 Cb -0.13 -2.49 -0.04 0.00 -0.52 0.00 0.00 37.83 34.65 2duq s LYS 272 CO -0.08 -0.24 0.09 -1.17 -0.92 0.00 0.00 175.35 173.03 2duq s LEU 273 N 1.32 3.77 -0.11 3.17 1.98 -1.26 -0.76 118.68 126.79 2duq s LEU 273 Ca 0.04 -0.00 0.01 0.00 -2.89 0.00 0.00 54.13 51.29 2duq s LEU 273 Cb -0.13 -1.98 -0.02 0.00 0.66 0.00 0.00 46.19 44.71 2duq s LEU 273 CO -0.12 0.08 -0.13 -0.36 -1.89 0.00 0.00 176.35 173.93 2duq s PHE 274 N 0.92 2.79 0.13 5.38 0.40 0.29 -0.54 117.98 127.34 2duq s PHE 274 Ca 0.05 -0.49 -0.30 0.00 -0.60 0.00 0.00 56.93 55.58 2duq s PHE 274 Cb -0.14 -1.79 -0.06 0.00 0.51 0.00 0.00 43.02 41.54 2duq s PHE 274 CO 0.03 -0.09 1.06 -1.14 0.70 0.00 0.00 175.22 175.77 2duq s GLN 275 N 0.05 4.60 -0.18 0.44 0.74 -0.04 -1.24 119.66 124.04 2duq s GLN 275 Ca -0.05 1.61 -0.09 0.00 0.05 0.00 0.00 55.36 56.89 2duq s GLN 275 Cb -0.14 -3.33 -0.05 0.00 1.10 0.00 0.00 33.01 30.59 2duq s GLN 275 CO 0.04 0.06 0.12 -0.51 -0.55 0.00 0.00 175.29 174.45 2duq s LEU 276 N 0.06 4.17 -0.81 3.68 1.43 -0.99 -4.86 118.68 121.35 2duq s LEU 276 Ca 0.50 0.25 -0.22 0.00 -1.03 0.00 0.00 54.13 53.63 2duq s LEU 276 Cb -0.27 -2.06 0.08 0.00 0.03 0.00 0.00 46.19 43.97 2duq s LEU 276 CO 0.32 0.23 1.14 -0.04 0.23 0.00 0.00 176.35 178.23 2duq s MET 277 N 0.06 3.35 -0.07 1.70 -1.94 -1.26 -4.75 119.30 116.39 2duq s MET 277 Ca 0.09 -1.07 0.00 0.00 -1.71 0.00 0.00 55.69 53.00 2duq s MET 277 Cb -0.11 -4.63 0.02 0.00 2.01 0.00 0.00 34.83 32.12 2duq s MET 277 CO -0.00 -1.92 -0.05 0.08 -0.01 0.00 0.00 175.02 173.12 2duq s VAL 278 N 4.06 0.65 0.47 -6.03 1.01 -1.26 -5.14 120.40 114.17 2duq s VAL 278 Ca 0.31 -0.13 -0.22 0.00 0.00 0.00 0.00 61.98 61.95 2duq s VAL 278 Cb -0.09 -0.70 -0.08 0.00 0.00 0.00 0.00 36.38 35.51 2duq s VAL 278 CO 0.01 0.28 1.10 -1.61 0.00 0.00 0.00 175.10 174.89 2duq s GLU 279 N 1.32 3.77 0.00 2.72 0.41 -1.26 -5.01 118.70 120.65 2duq s GLU 279 Ca -0.04 1.59 0.00 0.00 -0.41 0.00 0.00 54.97 56.11 2duq s GLU 279 Cb -0.14 -2.28 0.00 0.00 -1.78 0.00 0.00 34.13 29.93 2duq s GLU 279 CO -0.02 -0.50 0.00 0.72 -0.49 0.00 0.00 175.26 174.96 2duq n HIS 280 N -0.68 0.00 0.00 1.61 8.25 -1.26 -5.06 115.22 118.08 2duq n HIS 280 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2duq n HIS 280 Cb 0.50 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.61 2duq n HIS 280 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 2duq n ILE 287 N 0.00 0.00 -2.87 1.59 -0.00 -1.26 -5.32 119.36 111.50 2duq n ILE 287 Ca 0.00 0.00 -0.43 0.00 -0.00 0.00 0.00 62.75 62.32 2duq n ILE 287 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 39.64 39.60 2duq n ILE 287 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 2duq s ASP 288 N -3.28 6.21 0.58 7.28 -1.08 -1.26 -4.89 116.67 120.23 2duq s ASP 288 Ca 0.00 -1.09 0.31 0.00 -0.52 0.00 0.00 52.55 51.25 2duq s ASP 288 Cb 0.00 -2.41 1.80 0.00 -1.46 0.00 0.00 42.92 40.85 2duq s ASP 288 CO 0.00 -1.40 2.22 -0.50 0.52 0.00 0.00 175.17 176.01 2duq h TRP 289 N 9.50 0.00 0.00 -5.34 4.06 -1.99 -1.49 115.95 120.70 2duq h TRP 289 Ca -0.25 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.70 2duq h TRP 289 Cb 1.07 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.23 2duq h TRP 289 CO 0.98 0.03 0.00 0.25 -3.56 0.00 0.00 178.44 176.14 2duq n THR 290 N -3.70 0.85 0.11 1.49 -2.24 -1.26 -1.71 114.28 107.82 2duq n THR 290 Ca -0.03 0.22 0.05 0.00 -2.27 0.00 0.00 64.05 62.03 2duq n THR 290 Cb 0.12 -1.12 0.09 0.00 -2.10 0.00 0.00 70.33 67.32 2duq n THR 290 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2duq n LYS 291 N -2.09 1.70 -1.71 -0.78 5.02 -0.56 -4.72 118.16 115.01 2duq n LYS 291 Ca 0.02 -1.56 -0.43 0.00 -2.02 0.00 0.00 58.31 54.32 2duq n LYS 291 Cb 0.22 -1.22 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 2duq n LYS 291 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2duq n ILE 292 N 0.48 0.12 -2.69 -0.18 5.41 -1.19 -4.97 119.36 116.33 2duq n ILE 292 Ca 0.08 -0.02 -0.42 0.00 1.00 0.00 0.00 62.75 63.39 2duq n ILE 292 Cb 0.33 -1.99 -0.03 0.00 -0.71 0.00 0.00 39.64 37.24 2duq n ILE 292 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 2duq s GLU 293 N 1.67 4.41 -0.01 0.38 2.12 -1.26 -3.89 118.70 122.13 2duq s GLU 293 Ca 0.78 1.38 -0.35 0.00 0.36 0.00 0.00 54.97 57.15 2duq s GLU 293 Cb -0.51 -3.55 -0.13 0.00 0.26 0.00 0.00 34.13 30.20 2duq s GLU 293 CO 0.34 -0.33 1.73 -2.30 -0.54 0.00 0.00 175.26 174.17 2duq n PRO 294 N 5.07 2.03 -3.71 4.30 -0.02 -1.25 -4.68 135.00 136.74 2duq n PRO 294 Ca 0.09 0.74 -0.09 0.00 -2.02 0.00 0.00 63.50 62.22 2duq n PRO 294 Cb 0.49 -2.54 -0.03 0.00 -0.02 0.00 0.00 33.50 31.40 2duq n PRO 294 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2duq s SER 295 N 2.73 -0.32 -0.07 2.55 1.04 -0.38 -4.24 113.70 115.00 2duq s SER 295 Ca 0.88 -0.43 0.02 0.00 0.48 0.00 0.00 55.95 56.90 2duq s SER 295 Cb -0.73 0.63 0.01 0.00 0.10 0.00 0.00 66.02 66.03 2duq s SER 295 CO 0.48 -1.13 -0.13 -0.69 0.98 0.00 0.00 173.24 172.75 2duq s VAL 296 N -3.86 1.23 -0.48 5.02 1.01 -1.26 0.08 120.40 122.14 2duq s VAL 296 Ca 0.08 -0.53 -0.29 0.00 0.00 0.00 0.00 61.98 61.25 2duq s VAL 296 Cb -0.02 -1.12 0.02 0.00 0.00 0.00 0.00 36.38 35.25 2duq s VAL 296 CO -0.02 0.38 1.35 0.21 0.00 0.00 0.00 175.10 177.02 2duq s ASN 297 N 0.68 6.33 0.00 3.32 3.04 0.30 -4.85 114.94 123.76 2duq s ASN 297 Ca -0.14 0.57 0.17 0.00 0.04 0.00 0.00 52.86 53.50 2duq s ASN 297 Cb -0.16 -2.54 0.14 0.00 -1.54 0.00 0.00 41.25 37.15 2duq s ASN 297 CO 0.04 -1.48 1.06 2.22 -3.04 0.00 0.00 177.10 175.89 2duq n PHE 298 N 8.85 0.02 -1.92 0.43 -1.74 -1.26 -4.81 117.46 117.03 2duq n PHE 298 Ca 0.14 -0.01 -0.29 0.00 -0.56 0.00 0.00 57.45 56.73 2duq n PHE 298 Cb 0.49 -0.00 0.10 0.00 1.52 0.00 0.00 39.48 41.58 2duq n PHE 298 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 2duq s LEU 299 N -1.43 2.53 0.00 5.98 1.02 -1.26 -5.27 118.68 120.25 2duq s LEU 299 Ca 0.21 0.72 0.31 0.00 0.02 0.00 0.00 54.13 55.39 2duq s LEU 299 Cb 0.15 -3.19 1.63 0.00 0.02 0.00 0.00 46.19 44.80 2duq s LEU 299 CO 0.22 -1.96 2.07 0.29 0.02 0.00 0.00 176.35 176.99