#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dxj n ILE 75 N 0.00 0.00 -0.57 -0.18 5.41 -1.26 -2.77 119.36 119.99 3dxj n ILE 75 Ca 0.00 0.65 -0.04 0.00 1.00 0.00 0.00 62.75 64.36 3dxj n ILE 75 Cb 0.00 -1.58 -0.06 0.00 -0.71 0.00 0.00 39.64 37.29 3dxj n ILE 75 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3dxj n SER 76 N -0.17 4.26 -2.78 4.38 3.41 -1.26 -4.67 113.62 116.80 3dxj n SER 76 Ca 0.00 -2.20 -0.01 0.00 -0.26 0.00 0.00 58.87 56.40 3dxj n SER 76 Cb 0.00 -1.01 -0.00 0.00 -0.26 0.00 0.00 64.21 62.94 3dxj n SER 76 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 3dxj n THR 77 N 2.02 0.15 -0.28 6.66 5.66 -1.11 -4.70 114.28 122.67 3dxj n THR 77 Ca 0.14 -0.08 -0.18 0.00 -3.05 0.00 0.00 64.05 60.88 3dxj n THR 77 Cb 0.54 -1.53 -0.04 0.00 -1.55 0.00 0.00 70.33 67.75 3dxj n THR 77 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 3dxj n SER 78 N 4.07 0.88 -3.12 1.09 2.88 -1.26 -4.40 113.62 113.76 3dxj n SER 78 Ca 0.03 -2.22 -0.18 0.00 -1.33 0.00 0.00 58.87 55.16 3dxj n SER 78 Cb 0.02 -0.59 -0.03 0.00 -0.75 0.00 0.00 64.21 62.87 3dxj n SER 78 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 3dxj n ASP 79 N 6.28 0.15 -0.34 -3.46 5.68 -1.26 -4.95 116.55 118.66 3dxj n ASP 79 Ca 0.21 -3.00 0.19 0.00 -0.50 0.00 0.00 54.79 51.69 3dxj n ASP 79 Cb 0.16 -0.26 0.36 0.00 -1.14 0.00 0.00 41.12 40.24 3dxj n ASP 79 CO 0.00 0.00 0.00 -2.65 -1.33 0.00 0.00 177.20 173.22 3dxj n PRO 80 N 0.68 -0.07 0.00 0.11 -0.02 -1.26 -1.10 135.00 133.33 3dxj n PRO 80 Ca 0.21 1.45 0.00 0.00 -2.02 0.00 0.00 63.50 63.15 3dxj n PRO 80 Cb 0.63 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 3dxj n PRO 80 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 3dxj n VAL 81 N -5.42 0.00 -0.15 -1.45 0.24 -1.26 -0.28 118.33 110.01 3dxj n VAL 81 Ca 0.27 0.78 -0.03 0.00 -2.04 0.00 0.00 64.34 63.32 3dxj n VAL 81 Cb 0.88 -1.05 0.05 0.00 -1.47 0.00 0.00 33.84 32.26 3dxj n VAL 81 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 3dxj h ARG 82 N 0.00 0.08 0.00 7.34 3.08 -1.51 0.38 114.38 123.75 3dxj h ARG 82 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dxj h ARG 82 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.03 3dxj h ARG 82 CO 0.00 0.05 0.00 1.04 -1.07 0.00 0.00 179.97 179.99 3dxj n GLN 83 N -5.26 0.00 -0.50 0.04 6.02 0.62 0.11 117.38 118.40 3dxj n GLN 83 Ca 0.05 0.53 0.41 0.00 -0.01 0.00 0.00 57.00 57.97 3dxj n GLN 83 Cb 0.26 -1.28 0.71 0.00 1.02 0.00 0.00 30.24 30.95 3dxj n GLN 83 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 3dxj h TYR 84 N 0.00 0.32 0.00 1.08 3.20 -0.85 0.83 116.97 121.56 3dxj h TYR 84 Ca 0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 3dxj h TYR 84 Cb 0.00 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.19 3dxj h TYR 84 CO -0.19 -0.12 0.00 1.28 -1.64 0.00 0.00 178.16 177.49 3dxj n LEU 85 N -4.42 0.00 -0.24 2.82 4.77 0.13 -2.67 117.00 117.39 3dxj n LEU 85 Ca 0.38 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 3dxj n LEU 85 Cb 1.56 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.65 3dxj n LEU 85 CO 0.30 0.00 0.26 0.00 -1.33 0.00 0.00 177.39 176.62 3dxj n HIS 86 N -0.88 0.00 0.17 -1.77 1.44 0.29 -3.50 115.22 110.97 3dxj n HIS 86 Ca 0.05 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.77 3dxj n HIS 86 Cb 0.02 -0.03 0.06 0.00 0.12 0.00 0.00 29.99 30.16 3dxj n HIS 86 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 3dxj n GLU 87 N -0.18 0.08 0.11 -1.40 -0.58 -1.09 0.16 120.64 117.74 3dxj n GLU 87 Ca 0.00 0.00 0.07 0.00 -0.42 0.00 0.00 57.16 56.81 3dxj n GLU 87 Cb 0.08 -1.37 0.01 0.00 -0.57 0.00 0.00 31.44 29.59 3dxj n GLU 87 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 3dxj h ILE 88 N 0.00 0.27 0.00 -3.67 2.10 -1.89 -2.66 117.51 111.66 3dxj h ILE 88 Ca 0.00 -1.46 0.00 0.00 1.08 0.00 0.00 64.86 64.48 3dxj h ILE 88 Cb 0.00 1.87 0.00 0.00 -1.09 0.00 0.00 36.82 37.60 3dxj h ILE 88 CO 0.00 0.15 0.00 0.61 -1.08 0.00 0.00 178.15 177.83 3dxj n GLY 89 N 1.23 -1.44 3.78 8.18 0.00 0.41 -4.65 105.19 112.71 3dxj n GLY 89 Ca -0.02 -0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.58 3dxj n GLY 89 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dxj s GLN 90 N -3.06 3.99 -0.79 1.61 -1.52 -1.00 -4.97 119.66 113.92 3dxj s GLN 90 Ca 0.11 1.64 -0.13 0.00 -1.95 0.00 0.00 55.36 55.03 3dxj s GLN 90 Cb 0.15 -2.49 0.21 0.00 -0.22 0.00 0.00 33.01 30.65 3dxj s GLN 90 CO 0.48 -0.33 0.72 0.08 -0.25 0.00 0.00 175.29 176.00 3dxj s VAL 91 N -1.60 5.40 -1.35 1.09 1.01 -1.26 -4.85 120.40 118.83 3dxj s VAL 91 Ca 0.60 -2.47 0.00 0.00 0.00 0.00 0.00 61.98 60.11 3dxj s VAL 91 Cb -0.25 -4.35 0.00 0.00 0.00 0.00 0.00 36.38 31.77 3dxj s VAL 91 CO 0.31 -1.00 0.53 -2.65 0.00 0.00 0.00 175.10 172.29 3dxj n PRO 92 N 3.98 0.78 0.00 2.72 -0.02 -1.26 -4.31 135.00 136.89 3dxj n PRO 92 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 3dxj n PRO 92 Cb 0.46 -1.25 0.00 0.00 -0.02 0.00 0.00 33.50 32.68 3dxj n PRO 92 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3dxj n LEU 93 N -0.11 0.08 -4.33 2.45 7.94 -1.26 -4.66 117.00 117.11 3dxj n LEU 93 Ca 0.00 -0.04 -0.29 0.00 -1.11 0.00 0.00 56.01 54.57 3dxj n LEU 93 Cb 0.13 -0.02 -0.08 0.00 0.53 0.00 0.00 43.42 43.97 3dxj n LEU 93 CO 0.00 0.02 1.50 0.18 -1.11 0.00 0.00 177.39 177.98 3dxj n LEU 94 N 0.66 2.65 -4.70 -1.96 4.77 -1.26 -4.92 117.00 112.25 3dxj n LEU 94 Ca 0.00 -2.82 -0.31 0.00 -0.03 0.00 0.00 56.01 52.84 3dxj n LEU 94 Cb 0.02 -1.53 0.15 0.00 -2.33 0.00 0.00 43.42 39.72 3dxj n LEU 94 CO 0.00 -2.04 0.70 -0.89 -1.33 0.00 0.00 177.39 173.82 3dxj s THR 95 N 11.22 2.30 0.06 -5.08 2.01 -1.26 -4.56 115.64 120.33 3dxj s THR 95 Ca 0.70 0.10 -0.16 0.00 0.31 0.00 0.00 61.69 62.64 3dxj s THR 95 Cb 0.02 -2.26 -0.06 0.00 0.01 0.00 0.00 72.50 70.22 3dxj s THR 95 CO 0.17 -0.12 1.26 0.25 -0.69 0.00 0.00 174.62 175.48 3dxj h LEU 96 N -1.60 -0.88 -0.83 4.42 5.85 -1.99 -0.08 115.31 120.19 3dxj h LEU 96 Ca -0.44 0.11 0.33 0.00 0.84 0.00 0.00 57.88 58.72 3dxj h LEU 96 Cb 1.26 0.36 -0.15 0.00 0.37 0.00 0.00 40.66 42.50 3dxj h LEU 96 CO 0.44 -0.20 0.37 -0.62 -0.34 0.00 0.00 178.44 178.08 3dxj n GLU 97 N -3.97 -0.05 0.08 1.25 1.02 -1.26 -0.65 120.64 117.05 3dxj n GLU 97 Ca -0.02 1.16 -0.08 0.00 -0.02 0.00 0.00 57.16 58.20 3dxj n GLU 97 Cb 0.17 -2.04 -0.05 0.00 -0.02 0.00 0.00 31.44 29.49 3dxj n GLU 97 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3dxj h GLU 98 N 0.00 -0.28 -0.32 3.49 5.08 -1.45 -2.71 114.58 118.39 3dxj h GLU 98 Ca 0.67 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 59.08 3dxj h GLU 98 Cb 1.71 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.98 3dxj h GLU 98 CO -0.67 0.02 -0.21 0.93 -1.00 0.00 0.00 179.01 178.08 3dxj h GLU 99 N -0.99 -0.02 0.00 2.33 5.08 0.84 -0.99 114.58 120.83 3dxj h GLU 99 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3dxj h GLU 99 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 3dxj h GLU 99 CO 0.05 -0.01 0.00 0.28 -1.00 0.00 0.00 179.01 178.32 3dxj n VAL 100 N -3.77 0.00 -0.07 3.13 0.31 -0.07 -0.93 118.33 116.93 3dxj n VAL 100 Ca 0.00 0.56 -0.02 0.00 -0.01 0.00 0.00 64.34 64.88 3dxj n VAL 100 Cb 0.10 -0.86 -0.02 0.00 -0.91 0.00 0.00 33.84 32.15 3dxj n VAL 100 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 3dxj n GLU 101 N -0.73 -0.07 -0.22 5.55 2.13 -0.90 0.13 120.64 126.53 3dxj n GLU 101 Ca 0.00 0.52 -0.05 0.00 0.66 0.00 0.00 57.16 58.29 3dxj n GLU 101 Cb 0.00 -0.77 0.01 0.00 0.27 0.00 0.00 31.44 30.95 3dxj n GLU 101 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 3dxj h LEU 102 N 0.00 -1.19 0.00 4.31 5.85 0.23 -2.42 115.31 122.09 3dxj h LEU 102 Ca 0.03 0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.98 3dxj h LEU 102 Cb 0.07 0.59 0.00 0.00 0.37 0.00 0.00 40.66 41.69 3dxj h LEU 102 CO -0.15 -0.30 0.00 0.00 -0.34 0.00 0.00 178.44 177.64 3dxj n ALA 103 N -3.18 0.00 -0.27 1.25 0.00 0.34 -0.89 120.51 117.77 3dxj n ALA 103 Ca 0.05 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.56 3dxj n ALA 103 Cb 0.36 0.44 0.21 0.00 0.00 0.00 0.00 19.45 20.46 3dxj n ALA 103 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 3dxj h ARG 104 N 0.00 0.17 -0.00 0.00 0.11 -1.27 0.46 114.38 113.84 3dxj h ARG 104 Ca 0.00 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.07 3dxj h ARG 104 Cb 0.00 -0.04 -0.00 0.00 1.11 0.00 0.00 29.97 31.04 3dxj h ARG 104 CO 0.00 0.11 0.42 0.87 0.10 0.00 0.00 179.97 181.47 3dxj h LYS 105 N 0.17 0.00 0.00 0.08 1.57 -0.53 -0.83 116.57 117.04 3dxj h LYS 105 Ca 0.46 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.19 3dxj h LYS 105 Cb 0.85 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 3dxj h LYS 105 CO -0.63 0.00 -0.63 0.28 -0.57 0.00 0.00 179.45 177.90 3dxj h VAL 106 N 0.00 0.21 -0.42 0.50 2.07 0.49 -3.16 116.25 115.94 3dxj h VAL 106 Ca 0.00 -1.26 0.06 0.00 0.82 0.00 0.00 66.70 66.32 3dxj h VAL 106 Cb 0.83 0.49 -0.09 0.00 -1.52 0.00 0.00 31.29 31.01 3dxj h VAL 106 CO -0.00 0.07 -0.53 -0.33 0.02 0.00 0.00 177.57 176.80 3dxj h GLU 107 N -1.00 -0.36 -0.78 1.57 5.08 -1.10 0.49 114.58 118.48 3dxj h GLU 107 Ca -0.07 0.02 0.17 0.00 -1.00 0.00 0.00 59.36 58.49 3dxj h GLU 107 Cb 0.65 0.08 -0.14 0.00 0.50 0.00 0.00 28.75 29.84 3dxj h GLU 107 CO -0.04 -0.24 -0.05 0.93 -1.00 0.00 0.00 179.01 178.61 3dxj h GLU 108 N -0.38 0.06 -0.88 2.33 5.08 -1.38 0.42 114.58 119.83 3dxj h GLU 108 Ca 0.09 -0.00 0.19 0.00 -1.00 0.00 0.00 59.36 58.64 3dxj h GLU 108 Cb 0.59 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 29.72 3dxj h GLU 108 CO -0.60 0.04 0.42 0.78 -1.00 0.00 0.00 179.01 178.65 3dxj h GLY 109 N 0.07 1.48 0.34 -3.84 0.00 -0.04 0.14 103.07 101.21 3dxj h GLY 109 Ca 0.41 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.54 3dxj h GLY 109 CO -0.72 -0.17 -0.03 1.98 0.00 0.00 0.00 176.54 177.59 3dxj h MET 110 N 0.49 -0.09 -0.89 4.80 1.85 0.92 -2.58 114.93 119.44 3dxj h MET 110 Ca 0.52 0.01 0.21 0.00 -0.61 0.00 0.00 59.70 59.83 3dxj h MET 110 Cb 0.90 0.02 -0.16 0.00 0.43 0.00 0.00 31.60 32.79 3dxj h MET 110 CO -0.46 0.47 -0.05 0.93 -0.40 0.00 0.00 176.91 177.40 3dxj h GLU 111 N -0.76 0.04 0.03 0.39 5.08 -0.38 0.32 114.58 119.30 3dxj h GLU 111 Ca -0.01 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3dxj h GLU 111 Cb 0.60 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3dxj h GLU 111 CO 0.02 0.03 -0.09 0.00 -1.00 0.00 0.00 179.01 177.97 3dxj h ALA 112 N 1.87 -0.65 -0.64 3.43 0.00 -0.72 -1.13 119.26 121.42 3dxj h ALA 112 Ca 0.49 -0.02 0.19 0.00 0.00 0.00 0.00 54.91 55.57 3dxj h ALA 112 Cb 0.90 0.50 -0.12 0.00 0.00 0.00 0.00 17.79 19.07 3dxj h ALA 112 CO -0.83 -0.67 0.07 -0.89 0.00 0.00 0.00 179.25 176.92 3dxj n ILE 113 N -2.93 -0.27 0.34 0.00 5.41 0.98 0.17 119.36 123.06 3dxj n ILE 113 Ca -0.01 1.40 -0.19 0.00 1.00 0.00 0.00 62.75 64.94 3dxj n ILE 113 Cb 0.07 -2.07 -0.10 0.00 -0.71 0.00 0.00 39.64 36.83 3dxj n ILE 113 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 3dxj h LYS 114 N 0.00 -1.04 -0.26 0.38 1.57 0.13 0.02 116.57 117.38 3dxj h LYS 114 Ca 0.41 0.07 0.03 0.00 -1.87 0.00 0.00 60.65 59.29 3dxj h LYS 114 Cb 0.90 0.24 -0.04 0.00 0.08 0.00 0.00 32.23 33.41 3dxj h LYS 114 CO -0.59 -0.69 -0.22 0.87 -0.57 0.00 0.00 179.45 178.25 3dxj h LYS 115 N -1.08 -0.09 0.00 3.15 1.79 0.24 -1.78 116.57 118.80 3dxj h LYS 115 Ca -0.08 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 3dxj h LYS 115 Cb 0.91 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 3dxj h LYS 115 CO -0.01 -0.06 0.00 1.28 -1.08 0.00 0.00 179.45 179.58 3dxj n LEU 116 N -3.80 0.00 -0.18 2.94 4.77 -0.39 0.20 117.00 120.54 3dxj n LEU 116 Ca -0.00 0.20 -0.03 0.00 -0.03 0.00 0.00 56.01 56.15 3dxj n LEU 116 Cb 0.12 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.20 3dxj n LEU 116 CO -0.02 0.00 0.23 -1.54 -1.33 0.00 0.00 177.39 174.73 3dxj n SER 117 N -0.49 -0.37 0.46 -1.43 3.41 -0.03 0.16 113.62 115.32 3dxj n SER 117 Ca 0.00 0.77 -0.20 0.00 -0.26 0.00 0.00 58.87 59.18 3dxj n SER 117 Cb 0.00 -0.14 -0.10 0.00 -0.26 0.00 0.00 64.21 63.71 3dxj n SER 117 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3dxj h GLU 118 N 0.00 -1.20 -0.07 4.33 4.81 -0.13 2.76 114.58 125.09 3dxj h GLU 118 Ca 0.11 0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 3dxj h GLU 118 Cb 0.22 0.27 0.00 0.00 0.63 0.00 0.00 28.75 29.87 3dxj h GLU 118 CO -0.42 -0.80 0.00 -0.89 -0.73 0.00 0.00 179.01 176.17 3dxj n ILE 119 N -5.64 0.00 -0.01 2.32 5.41 0.54 -1.41 119.36 120.58 3dxj n ILE 119 Ca -0.15 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.60 3dxj n ILE 119 Cb 0.51 -0.16 0.00 0.00 -0.71 0.00 0.00 39.64 39.28 3dxj n ILE 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 3dxj n THR 120 N 0.19 0.00 -1.17 1.39 -1.04 0.38 -4.94 114.28 109.09 3dxj n THR 120 Ca 0.00 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.95 3dxj n THR 120 Cb 0.02 0.01 -0.03 0.00 -1.82 0.00 0.00 70.33 68.51 3dxj n THR 120 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3dxj n GLY 121 N 0.00 0.84 3.72 3.41 0.00 0.90 -5.01 105.19 109.05 3dxj n GLY 121 Ca 0.00 -0.64 -0.25 0.00 0.00 0.00 0.00 46.02 45.13 3dxj n GLY 121 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dxj s LEU 122 N -1.37 3.47 0.20 0.99 1.43 0.10 -5.00 118.68 118.52 3dxj s LEU 122 Ca 0.00 -0.38 -0.30 0.00 -1.03 0.00 0.00 54.13 52.41 3dxj s LEU 122 Cb 0.00 -2.06 -0.09 0.00 0.03 0.00 0.00 46.19 44.06 3dxj s LEU 122 CO 0.00 0.04 1.43 -1.81 0.23 0.00 0.00 176.35 176.23 3dxj s ASP 123 N -3.34 6.72 0.08 2.29 1.01 -1.26 -4.29 116.67 117.88 3dxj s ASP 123 Ca 0.30 2.55 -0.31 0.00 0.71 0.00 0.00 52.55 55.80 3dxj s ASP 123 Cb -0.08 -2.61 -0.16 0.00 1.01 0.00 0.00 42.92 41.07 3dxj s ASP 123 CO 0.21 -0.68 1.63 -0.65 0.21 0.00 0.00 175.17 175.89 3dxj h PRO 124 N 5.66 -0.75 -0.66 8.23 0.11 -1.92 -1.65 132.00 141.03 3dxj h PRO 124 Ca -0.45 0.05 0.14 0.00 0.11 0.00 0.00 66.00 65.85 3dxj h PRO 124 Cb 1.21 0.17 -0.12 0.00 0.11 0.00 0.00 31.00 32.37 3dxj h PRO 124 CO 0.81 -0.50 -0.12 0.38 -0.21 0.00 0.00 178.00 178.36 3dxj h ASP 125 N -0.78 -0.53 -0.45 -2.05 2.03 -1.96 0.20 116.42 112.88 3dxj h ASP 125 Ca -0.06 0.19 0.05 0.00 -0.73 0.00 0.00 57.03 56.48 3dxj h ASP 125 Cb 0.64 0.38 -0.08 0.00 -0.83 0.00 0.00 39.33 39.44 3dxj h ASP 125 CO 0.05 -0.20 -0.49 0.25 -1.03 0.00 0.00 179.24 177.82 3dxj h LEU 126 N 0.02 -1.67 0.00 0.15 5.85 -1.88 0.34 115.31 118.13 3dxj h LEU 126 Ca 0.33 0.23 0.00 0.00 0.84 0.00 0.00 57.88 59.27 3dxj h LEU 126 Cb 0.51 0.69 0.00 0.00 0.37 0.00 0.00 40.66 42.24 3dxj h LEU 126 CO -0.65 -0.32 0.00 -0.38 -0.34 0.00 0.00 178.44 176.74 3dxj n ILE 127 N -5.00 0.00 -0.35 4.05 5.41 0.61 -1.35 119.36 122.73 3dxj n ILE 127 Ca -0.02 1.07 0.30 0.00 1.00 0.00 0.00 62.75 65.10 3dxj n ILE 127 Cb 0.28 -1.68 0.55 0.00 -0.71 0.00 0.00 39.64 38.09 3dxj n ILE 127 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 176.55 176.63 3dxj h ARG 128 N 0.00 0.14 -0.51 0.38 0.11 -1.12 2.64 114.38 116.02 3dxj h ARG 128 Ca 0.00 -0.01 0.10 0.00 0.10 0.00 0.00 59.98 60.17 3dxj h ARG 128 Cb 0.00 -0.03 -0.10 0.00 1.11 0.00 0.00 29.97 30.95 3dxj h ARG 128 CO 0.00 0.09 -0.18 1.49 0.10 0.00 0.00 179.97 181.48 3dxj h GLU 129 N 0.14 -0.06 0.00 0.08 4.57 0.94 0.12 114.58 120.38 3dxj h GLU 129 Ca 0.80 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.98 3dxj h GLU 129 Cb 2.07 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 30.68 3dxj h GLU 129 CO -0.65 -0.04 0.00 0.28 -1.18 0.00 0.00 179.01 177.42 3dxj n VAL 130 N -5.39 0.00 -0.13 0.32 0.31 0.87 -2.29 118.33 112.03 3dxj n VAL 130 Ca 0.04 1.47 0.10 0.00 -0.01 0.00 0.00 64.34 65.94 3dxj n VAL 130 Cb 0.30 -2.39 0.18 0.00 -0.91 0.00 0.00 33.84 31.02 3dxj n VAL 130 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3dxj n VAL 131 N -2.05 -0.16 0.00 2.52 0.31 -0.45 -1.27 118.33 117.23 3dxj n VAL 131 Ca 0.00 0.82 0.00 0.00 -0.01 0.00 0.00 64.34 65.15 3dxj n VAL 131 Cb 0.00 -1.27 0.00 0.00 -0.91 0.00 0.00 33.84 31.66 3dxj n VAL 131 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3dxj n ARG 132 N -4.09 0.00 0.00 5.55 1.74 0.37 -2.46 116.66 117.77 3dxj n ARG 132 Ca 0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 3dxj n ARG 132 Cb 0.41 -0.83 0.00 0.00 -1.02 0.00 0.00 32.46 31.02 3dxj n ARG 132 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dxj n ALA 133 N -1.34 0.00 -0.03 7.54 0.00 -0.40 0.22 120.51 126.50 3dxj n ALA 133 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 3dxj n ALA 133 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 3dxj n ALA 133 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3dxj h LYS 134 N 0.00 -0.19 -0.40 0.00 1.79 -1.65 -0.68 116.57 115.44 3dxj h LYS 134 Ca 0.00 0.01 -0.11 0.00 -2.18 0.00 0.00 60.65 58.37 3dxj h LYS 134 Cb 0.00 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.68 3dxj h LYS 134 CO 0.00 -0.13 -0.21 0.82 -1.08 0.00 0.00 179.45 178.85 3dxj h ILE 135 N -0.20 1.27 0.00 1.86 2.04 0.29 -2.24 117.51 120.53 3dxj h ILE 135 Ca 0.12 -1.33 0.00 0.00 1.00 0.00 0.00 64.86 64.65 3dxj h ILE 135 Cb 0.38 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.65 3dxj h ILE 135 CO -0.31 0.45 0.00 0.18 0.00 0.00 0.00 178.15 178.46 3dxj n LEU 136 N -4.12 0.23 -1.46 1.44 4.77 0.30 -4.95 117.00 113.21 3dxj n LEU 136 Ca 0.00 -0.12 0.19 0.00 -0.03 0.00 0.00 56.01 56.06 3dxj n LEU 136 Cb 0.43 -0.12 -0.06 0.00 -2.33 0.00 0.00 43.42 41.34 3dxj n LEU 136 CO 0.45 0.06 -0.41 0.61 -1.33 0.00 0.00 177.39 176.76 3dxj n GLY 137 N 0.14 -2.48 0.02 -0.72 0.00 -0.40 -4.19 105.19 97.56 3dxj n GLY 137 Ca 0.00 -1.11 0.11 0.00 0.00 0.00 0.00 46.02 45.02 3dxj n GLY 137 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3dxj n SER 138 N -4.32 0.06 0.00 1.61 2.88 -1.26 -3.98 113.62 108.61 3dxj n SER 138 Ca -0.03 0.01 0.08 0.00 -1.33 0.00 0.00 58.87 57.60 3dxj n SER 138 Cb 0.68 1.89 0.39 0.00 -0.75 0.00 0.00 64.21 66.42 3dxj n SER 138 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3dxj n ALA 139 N -2.24 1.86 0.29 -1.46 0.00 -1.26 -2.55 120.51 115.14 3dxj n ALA 139 Ca -0.04 -0.07 0.05 0.00 0.00 0.00 0.00 53.44 53.38 3dxj n ALA 139 Cb 0.57 -1.25 -0.06 0.00 0.00 0.00 0.00 19.45 18.70 3dxj n ALA 139 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3dxj n ARG 140 N -1.30 2.70 -1.63 0.00 0.63 -1.26 -5.03 116.66 110.77 3dxj n ARG 140 Ca 0.07 -0.03 -0.51 0.00 -0.92 0.00 0.00 57.85 56.46 3dxj n ARG 140 Cb 0.13 -1.04 -0.06 0.00 0.45 0.00 0.00 32.46 31.95 3dxj n ARG 140 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 3dxj n VAL 141 N -1.43 0.08 -1.66 5.15 0.24 -1.06 -4.81 118.33 114.84 3dxj n VAL 141 Ca 0.01 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.34 61.87 3dxj n VAL 141 Cb 0.18 -1.13 -0.03 0.00 -1.47 0.00 0.00 33.84 31.39 3dxj n VAL 141 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dxj s ARG 142 N 1.20 3.05 0.61 7.34 1.70 -1.26 -4.79 118.95 126.81 3dxj s ARG 142 Ca 0.85 1.87 0.30 0.00 -0.47 0.00 0.00 55.73 58.29 3dxj s ARG 142 Cb -0.88 -4.37 1.65 0.00 -0.57 0.00 0.00 34.95 30.78 3dxj s ARG 142 CO 0.47 -2.19 2.01 1.25 -1.08 0.00 0.00 175.30 175.76 3dxj h HIS 143 N 15.19 0.00 -3.05 5.89 2.76 -1.98 -3.01 115.15 130.95 3dxj h HIS 143 Ca -0.38 0.00 -0.61 0.00 -2.20 0.00 0.00 60.37 57.17 3dxj h HIS 143 Cb 1.23 0.00 -0.40 0.00 1.55 0.00 0.00 27.41 29.79 3dxj h HIS 143 CO 0.95 0.00 -0.72 0.96 -1.30 0.00 0.00 177.93 177.81 3dxj s ILE 144 N -4.46 1.56 0.00 6.26 -4.36 -1.26 -4.84 121.20 114.09 3dxj s ILE 144 Ca -0.04 -2.63 -0.03 0.00 -0.26 0.00 0.00 60.65 57.68 3dxj s ILE 144 Cb 0.13 -2.09 -0.14 0.00 1.25 0.00 0.00 42.46 41.61 3dxj s ILE 144 CO 0.47 -0.88 2.18 -0.81 0.24 0.00 0.00 174.94 176.14 3dxj n PRO 145 N 3.52 1.08 -1.29 0.37 -0.04 -1.14 -3.52 135.00 133.97 3dxj n PRO 145 Ca 0.08 -0.53 0.00 0.00 -0.04 0.00 0.00 63.50 63.01 3dxj n PRO 145 Cb 0.34 -1.76 0.00 0.00 -0.04 0.00 0.00 33.50 32.04 3dxj n PRO 145 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dxj n GLY 146 N 2.70 0.57 2.30 0.55 0.00 -1.26 -3.00 105.19 107.04 3dxj n GLY 146 Ca 0.23 -0.82 -0.01 0.00 0.00 0.00 0.00 46.02 45.42 3dxj n GLY 146 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dxj n LEU 147 N 0.00 -4.37 0.00 0.99 4.77 -1.23 -4.30 117.00 112.87 3dxj n LEU 147 Ca 0.00 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 3dxj n LEU 147 Cb 0.23 -2.14 0.00 0.00 -2.33 0.00 0.00 43.42 39.18 3dxj n LEU 147 CO 0.00 -0.50 0.00 0.29 -1.33 0.00 0.00 177.39 175.85 3dxj n LYS 148 N -1.51 0.00 -0.24 3.23 5.02 -1.26 -4.96 118.16 118.44 3dxj n LYS 148 Ca -0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.21 3dxj n LYS 148 Cb 0.51 -1.97 -0.07 0.00 -0.02 0.00 0.00 35.03 33.48 3dxj n LYS 148 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 3dxj h GLU 149 N 3.30 -0.06 -5.66 1.97 4.81 -1.72 -3.36 114.58 113.86 3dxj h GLU 149 Ca 0.00 0.00 -0.66 0.00 -0.13 0.00 0.00 59.36 58.58 3dxj h GLU 149 Cb 0.00 0.01 -0.14 0.00 0.63 0.00 0.00 28.75 29.25 3dxj h GLU 149 CO 0.00 -0.04 -0.58 0.99 -0.73 0.00 0.00 179.01 178.65 3dxj s THR 150 N -4.68 4.66 -1.28 0.32 2.01 -1.26 -4.99 115.64 110.41 3dxj s THR 150 Ca -0.08 -0.10 -0.16 0.00 0.31 0.00 0.00 61.69 61.65 3dxj s THR 150 Cb 0.07 -3.02 -0.01 0.00 0.01 0.00 0.00 72.50 69.55 3dxj s THR 150 CO 0.41 0.56 2.16 0.18 -0.69 0.00 0.00 174.62 177.24 3dxj n LEU 151 N 2.61 6.17 -0.59 4.42 4.77 -1.26 -4.77 117.00 128.36 3dxj n LEU 151 Ca -0.18 -3.82 0.45 0.00 -0.03 0.00 0.00 56.01 52.43 3dxj n LEU 151 Cb 0.53 -1.52 0.71 0.00 -2.33 0.00 0.00 43.42 40.82 3dxj n LEU 151 CO 0.31 0.74 1.28 0.47 -1.33 0.00 0.00 177.39 178.87 3dxj n ASP 152 N 6.43 0.04 -0.00 -1.43 8.00 -1.26 0.04 116.55 128.37 3dxj n ASP 152 Ca 0.52 0.98 0.08 0.00 0.71 0.00 0.00 54.79 57.07 3dxj n ASP 152 Cb 0.39 -0.49 -0.11 0.00 -0.02 0.00 0.00 41.12 40.90 3dxj n ASP 152 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 3dxj n PRO 153 N -3.91 1.14 0.02 -0.24 -0.04 -1.26 -4.65 135.00 126.06 3dxj n PRO 153 Ca 0.39 -0.04 -0.01 0.00 -0.04 0.00 0.00 63.50 63.81 3dxj n PRO 153 Cb 1.73 -1.34 -0.00 0.00 -0.04 0.00 0.00 33.50 33.85 3dxj n PRO 153 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3dxj n LYS 154 N -1.58 0.04 0.28 0.54 5.02 0.11 -4.73 118.16 117.83 3dxj n LYS 154 Ca 0.02 0.02 0.19 0.00 -2.02 0.00 0.00 58.31 56.51 3dxj n LYS 154 Cb 0.32 -0.36 0.99 0.00 -0.02 0.00 0.00 35.03 35.95 3dxj n LYS 154 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 3dxj h THR 155 N -0.07 0.00 0.00 -0.18 2.02 -1.78 -3.29 112.91 109.60 3dxj h THR 155 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3dxj h THR 155 Cb 0.07 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 67.29 3dxj h THR 155 CO 0.00 0.00 0.00 1.33 0.37 0.00 0.00 175.52 177.22 3dxj n VAL 156 N -2.78 0.00 -0.32 3.16 0.24 -1.22 -3.43 118.33 113.98 3dxj n VAL 156 Ca -0.02 1.07 0.20 0.00 -2.04 0.00 0.00 64.34 63.55 3dxj n VAL 156 Cb 0.07 -1.99 0.41 0.00 -1.47 0.00 0.00 33.84 30.86 3dxj n VAL 156 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 3dxj h GLU 157 N 0.00 0.19 -0.90 7.34 3.07 -1.85 0.34 114.58 122.77 3dxj h GLU 157 Ca 0.00 -0.01 0.14 0.00 -0.50 0.00 0.00 59.36 58.99 3dxj h GLU 157 Cb 0.00 -0.04 -0.15 0.00 -0.84 0.00 0.00 28.75 27.72 3dxj h GLU 157 CO 0.00 0.12 -0.34 0.39 -1.40 0.00 0.00 179.01 177.78 3dxj n GLU 158 N -5.20 -0.20 0.31 2.33 1.02 -1.23 0.45 120.64 118.11 3dxj n GLU 158 Ca 0.28 1.38 -0.17 0.00 -0.02 0.00 0.00 57.16 58.64 3dxj n GLU 158 Cb 0.90 -2.05 -0.09 0.00 -0.02 0.00 0.00 31.44 30.19 3dxj n GLU 158 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3dxj h ILE 159 N 0.00 0.43 0.00 -3.67 1.08 -0.34 -2.97 117.51 112.04 3dxj h ILE 159 Ca 0.32 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.79 3dxj h ILE 159 Cb 0.54 0.43 0.00 0.00 -3.07 0.00 0.00 36.82 34.72 3dxj h ILE 159 CO -0.89 0.00 0.00 0.47 -0.69 0.00 0.00 178.15 177.04 3dxj n ASP 160 N -5.42 0.00 -0.35 1.72 8.00 0.17 -0.03 116.55 120.64 3dxj n ASP 160 Ca -0.12 0.97 0.33 0.00 0.71 0.00 0.00 54.79 56.67 3dxj n ASP 160 Cb 0.32 -0.47 0.68 0.00 -0.02 0.00 0.00 41.12 41.62 3dxj n ASP 160 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 3dxj h GLN 161 N 0.00 0.12 0.59 -1.24 7.50 -1.33 0.68 115.11 121.43 3dxj h GLN 161 Ca 0.00 -0.01 -0.03 0.00 0.50 0.00 0.00 58.65 59.11 3dxj h GLN 161 Cb 0.00 -0.03 0.01 0.00 0.05 0.00 0.00 27.48 27.51 3dxj h GLN 161 CO 0.00 0.08 -0.28 0.87 -1.50 0.00 0.00 178.83 178.00 3dxj h LYS 162 N 0.12 -0.77 -0.32 1.46 1.57 -0.28 1.28 116.57 119.64 3dxj h LYS 162 Ca 0.61 0.05 0.06 0.00 -1.87 0.00 0.00 60.65 59.50 3dxj h LYS 162 Cb 2.14 0.17 -0.06 0.00 0.08 0.00 0.00 32.23 34.56 3dxj h LYS 162 CO -0.13 -0.51 -0.03 -0.07 -0.57 0.00 0.00 179.45 178.14 3dxj h LEU 163 N -0.92 -0.20 -1.03 2.94 3.38 0.88 0.22 115.31 120.58 3dxj h LEU 163 Ca -0.08 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.03 3dxj h LEU 163 Cb 0.61 0.16 -0.07 0.00 0.09 0.00 0.00 40.66 41.46 3dxj h LEU 163 CO 0.13 -0.06 0.65 0.11 0.09 0.00 0.00 178.44 179.35 3dxj h LYS 164 N 0.05 1.14 -0.72 1.13 1.57 0.30 0.16 116.57 120.20 3dxj h LYS 164 Ca 0.16 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 3dxj h LYS 164 Cb 0.23 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.28 3dxj h LYS 164 CO -0.29 0.76 0.00 -1.13 -0.57 0.00 0.00 179.45 178.21 3dxj n SER 165 N -4.49 0.72 -4.83 0.86 3.41 0.44 -4.77 113.62 104.97 3dxj n SER 165 Ca 0.15 -1.60 -0.28 0.00 -0.26 0.00 0.00 58.87 56.88 3dxj n SER 165 Cb 0.17 -0.36 -0.05 0.00 -0.26 0.00 0.00 64.21 63.71 3dxj n SER 165 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3dxj s LEU 166 N -0.10 3.94 0.71 1.04 1.43 0.57 -4.97 118.68 121.30 3dxj s LEU 166 Ca 0.00 -0.01 -0.16 0.00 -1.03 0.00 0.00 54.13 52.93 3dxj s LEU 166 Cb 0.00 -2.57 -0.05 0.00 0.03 0.00 0.00 46.19 43.61 3dxj s LEU 166 CO 0.00 0.11 0.49 -2.65 0.23 0.00 0.00 176.35 174.52 3dxj n PRO 167 N -0.09 0.30 0.02 1.29 -0.02 -1.26 -4.25 135.00 130.99 3dxj n PRO 167 Ca -0.08 0.14 -0.09 0.00 -2.02 0.00 0.00 63.50 61.45 3dxj n PRO 167 Cb 0.53 -1.78 -0.05 0.00 -0.02 0.00 0.00 33.50 32.17 3dxj n PRO 167 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3dxj h LYS 168 N -0.33 -0.34 -0.63 -0.52 1.57 -1.94 1.42 116.57 115.80 3dxj h LYS 168 Ca -0.45 0.02 0.21 0.00 -1.87 0.00 0.00 60.65 58.56 3dxj h LYS 168 Cb 1.35 0.08 -0.12 0.00 0.08 0.00 0.00 32.23 33.63 3dxj h LYS 168 CO 0.43 -0.23 0.14 0.39 -0.57 0.00 0.00 179.45 179.60 3dxj n GLU 169 N -4.13 -0.05 -0.05 3.15 4.71 -1.26 0.27 120.64 123.29 3dxj n GLU 169 Ca -0.04 0.91 -0.02 0.00 -0.01 0.00 0.00 57.16 58.00 3dxj n GLU 169 Cb 0.22 -1.51 -0.01 0.00 -1.01 0.00 0.00 31.44 29.13 3dxj n GLU 169 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 3dxj h HIS 170 N 0.00 0.00 -1.12 -0.32 3.86 -1.65 -3.36 115.15 112.57 3dxj h HIS 170 Ca 0.44 0.00 0.32 0.00 -1.16 0.00 0.00 60.37 59.97 3dxj h HIS 170 Cb 1.02 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.45 3dxj h HIS 170 CO -0.20 0.00 1.07 -0.22 0.86 0.00 0.00 177.93 179.44 3dxj h LYS 171 N -0.75 0.00 -0.18 2.45 3.64 0.44 1.19 116.57 123.37 3dxj h LYS 171 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 3dxj h LYS 171 Cb 0.20 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 3dxj h LYS 171 CO 0.00 0.00 0.07 0.07 -2.27 0.00 0.00 179.45 177.32 3dxj h ARG 172 N 0.00 0.27 -1.12 1.90 0.11 0.35 -1.15 114.38 114.74 3dxj h ARG 172 Ca 0.53 -0.05 0.32 0.00 0.10 0.00 0.00 59.98 60.88 3dxj h ARG 172 Cb 2.66 -0.04 -0.11 0.00 1.11 0.00 0.00 29.97 33.59 3dxj h ARG 172 CO -0.01 0.35 0.71 1.88 0.10 0.00 0.00 179.97 183.00 3dxj h TYR 173 N 0.12 0.67 0.00 4.08 -1.99 0.13 -2.20 116.97 117.78 3dxj h TYR 173 Ca 0.06 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.81 3dxj h TYR 173 Cb 0.19 -0.18 0.00 0.00 2.00 0.00 0.00 36.73 38.73 3dxj h TYR 173 CO -0.01 -0.05 0.00 -0.11 -0.00 0.00 0.00 178.16 177.99 3dxj n LEU 174 N -4.72 0.00 0.21 3.88 7.94 -0.44 -1.18 117.00 122.70 3dxj n LEU 174 Ca 0.30 0.77 0.16 0.00 -1.11 0.00 0.00 56.01 56.13 3dxj n LEU 174 Cb 1.05 -0.27 0.65 0.00 0.53 0.00 0.00 43.42 45.38 3dxj n LEU 174 CO 0.21 -0.27 1.14 0.45 -1.11 0.00 0.00 177.39 177.81 3dxj h HIS 175 N 0.00 0.00 0.48 1.96 -0.00 -1.44 0.10 115.15 116.25 3dxj h HIS 175 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.35 3dxj h HIS 175 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 3dxj h HIS 175 CO -0.28 0.00 -0.23 0.82 -0.00 0.00 0.00 177.93 178.24 3dxj h ILE 176 N 0.00 0.00 -0.98 2.45 2.04 -0.90 0.21 117.51 120.34 3dxj h ILE 176 Ca 0.10 -0.11 0.16 0.00 1.00 0.00 0.00 64.86 66.01 3dxj h ILE 176 Cb 1.17 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 37.16 3dxj h ILE 176 CO -0.00 0.00 0.61 0.00 0.00 0.00 0.00 178.15 178.76 3dxj h ALA 177 N -1.60 1.70 -1.75 1.87 0.00 0.01 2.11 119.26 121.61 3dxj h ALA 177 Ca -0.07 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3dxj h ALA 177 Cb 0.49 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3dxj h ALA 177 CO 0.11 -0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.90 3dxj n ARG 178 N -4.66 0.00 -0.29 0.00 5.12 0.14 0.25 116.66 117.23 3dxj n ARG 178 Ca 0.21 0.50 0.11 0.00 -1.93 0.00 0.00 57.85 56.73 3dxj n ARG 178 Cb 0.50 -1.21 0.26 0.00 -1.16 0.00 0.00 32.46 30.85 3dxj n ARG 178 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 3dxj h GLU 179 N 0.00 0.28 -0.76 5.56 4.39 0.41 -0.70 114.58 123.76 3dxj h GLU 179 Ca 0.00 -0.02 0.11 0.00 0.34 0.00 0.00 59.36 59.79 3dxj h GLU 179 Cb 0.00 -0.06 -0.13 0.00 -0.10 0.00 0.00 28.75 28.46 3dxj h GLU 179 CO 0.00 0.19 -0.42 0.78 -1.16 0.00 0.00 179.01 178.39 3dxj h GLY 180 N 0.29 -0.28 0.70 -3.84 0.00 0.47 0.67 103.07 101.07 3dxj h GLY 180 Ca 0.51 0.56 -0.01 0.00 0.00 0.00 0.00 47.33 48.39 3dxj h GLY 180 CO -0.57 -0.16 -0.00 -2.09 0.00 0.00 0.00 176.54 173.72 3dxj h GLU 181 N -0.12 0.06 -0.51 4.80 4.57 0.13 -2.21 114.58 121.30 3dxj h GLU 181 Ca 0.24 -0.02 0.10 0.00 -1.18 0.00 0.00 59.36 58.50 3dxj h GLU 181 Cb 0.55 -0.00 -0.10 0.00 -0.16 0.00 0.00 28.75 29.04 3dxj h GLU 181 CO -0.81 0.37 -0.20 0.00 -1.18 0.00 0.00 179.01 177.19 3dxj h ALA 182 N 0.69 0.19 -0.22 2.92 0.00 -0.68 0.97 119.26 123.13 3dxj h ALA 182 Ca 0.01 0.18 0.06 0.00 0.00 0.00 0.00 54.91 55.16 3dxj h ALA 182 Cb 0.35 0.51 -0.07 0.00 0.00 0.00 0.00 17.79 18.58 3dxj h ALA 182 CO 0.00 -0.53 -0.37 0.00 0.00 0.00 0.00 179.25 178.35 3dxj h ALA 183 N 1.30 -0.42 -0.08 0.00 0.00 0.37 -2.35 119.26 118.08 3dxj h ALA 183 Ca 0.24 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.19 3dxj h ALA 183 Cb 0.45 0.73 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 3dxj h ALA 183 CO -0.56 -0.84 -0.05 -2.13 0.00 0.00 0.00 179.25 175.67 3dxj n ARG 184 N -5.42 -0.04 -0.10 0.00 0.63 0.27 -1.10 116.66 110.91 3dxj n ARG 184 Ca -0.02 0.90 -0.03 0.00 -0.92 0.00 0.00 57.85 57.78 3dxj n ARG 184 Cb 0.35 -1.35 -0.02 0.00 0.45 0.00 0.00 32.46 31.88 3dxj n ARG 184 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 3dxj n GLN 185 N -3.07 -0.10 -0.15 -0.14 1.13 -0.77 -0.58 117.38 113.70 3dxj n GLN 185 Ca 0.00 0.72 -0.05 0.00 -1.94 0.00 0.00 57.00 55.73 3dxj n GLN 185 Cb 0.02 -1.07 -0.04 0.00 0.11 0.00 0.00 30.24 29.26 3dxj n GLN 185 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3dxj h HIS 186 N 0.00 -0.83 -0.92 1.08 3.86 -0.93 -1.30 115.15 116.12 3dxj h HIS 186 Ca 0.04 0.05 0.11 0.00 -1.16 0.00 0.00 60.37 59.41 3dxj h HIS 186 Cb 0.09 0.41 -0.13 0.00 1.06 0.00 0.00 27.41 28.85 3dxj h HIS 186 CO -0.59 -0.18 -0.46 -0.11 0.86 0.00 0.00 177.93 177.45 3dxj n LEU 187 N -3.98 -0.81 0.00 2.43 7.94 0.25 -1.70 117.00 121.13 3dxj n LEU 187 Ca 0.00 1.62 0.00 0.00 -1.11 0.00 0.00 56.01 56.52 3dxj n LEU 187 Cb 0.13 -0.28 0.00 0.00 0.53 0.00 0.00 43.42 43.80 3dxj n LEU 187 CO -0.05 -1.37 0.22 -0.38 -1.11 0.00 0.00 177.39 174.70 3dxj n ILE 188 N -5.23 0.00 -0.30 1.96 5.41 -0.52 -2.91 119.36 117.77 3dxj n ILE 188 Ca 0.05 0.94 -0.08 0.00 1.00 0.00 0.00 62.75 64.66 3dxj n ILE 188 Cb 0.29 -1.47 -0.07 0.00 -0.71 0.00 0.00 39.64 37.68 3dxj n ILE 188 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 3dxj n GLU 189 N -0.86 -0.31 -0.22 0.38 4.71 -0.87 -0.11 120.64 123.36 3dxj n GLU 189 Ca 0.00 1.10 0.28 0.00 -0.01 0.00 0.00 57.16 58.52 3dxj n GLU 189 Cb 0.00 -1.61 0.43 0.00 -1.01 0.00 0.00 31.44 29.25 3dxj n GLU 189 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3dxj n ALA 190 N -3.42 0.99 -0.25 0.62 0.00 -0.69 0.23 120.51 118.00 3dxj n ALA 190 Ca 0.01 0.34 0.03 0.00 0.00 0.00 0.00 53.44 53.83 3dxj n ALA 190 Cb 0.18 -0.59 0.08 0.00 0.00 0.00 0.00 19.45 19.12 3dxj n ALA 190 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3dxj n ASN 191 N -3.21 2.42 0.14 0.00 3.02 0.85 -4.56 115.26 113.91 3dxj n ASN 191 Ca 0.23 -2.20 0.15 0.00 -0.03 0.00 0.00 54.58 52.73 3dxj n ASN 191 Cb 1.51 -0.15 0.70 0.00 -0.61 0.00 0.00 39.78 41.23 3dxj n ASN 191 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3dxj h LEU 192 N 0.67 0.00 -0.15 3.41 3.38 0.30 -0.20 115.31 122.73 3dxj h LEU 192 Ca 0.00 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.74 3dxj h LEU 192 Cb 0.69 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.45 3dxj h LEU 192 CO 0.01 0.00 -0.93 -0.09 0.09 0.00 0.00 178.44 177.52 3dxj h ARG 193 N 0.00 0.54 -0.61 1.13 2.43 -1.81 -2.78 114.38 113.28 3dxj h ARG 193 Ca 0.13 -0.55 0.12 0.00 -0.81 0.00 0.00 59.98 58.88 3dxj h ARG 193 Cb 0.54 0.15 -0.10 0.00 -0.42 0.00 0.00 29.97 30.14 3dxj h ARG 193 CO -0.00 1.17 0.04 1.25 -1.51 0.00 0.00 179.97 180.93 3dxj h LEU 194 N 0.32 -0.18 0.00 3.80 7.12 -1.36 0.12 115.31 125.13 3dxj h LEU 194 Ca -0.09 0.14 0.00 0.00 0.13 0.00 0.00 57.88 58.06 3dxj h LEU 194 Cb 1.56 0.23 0.00 0.00 -0.53 0.00 0.00 40.66 41.92 3dxj h LEU 194 CO 0.17 -0.08 0.00 0.52 -0.13 0.00 0.00 178.44 178.93 3dxj n VAL 195 N -5.23 0.00 -0.36 1.05 0.31 -0.96 -2.14 118.33 111.00 3dxj n VAL 195 Ca 0.09 1.09 -0.00 0.00 -0.01 0.00 0.00 64.34 65.51 3dxj n VAL 195 Cb 0.35 -1.64 0.05 0.00 -0.91 0.00 0.00 33.84 31.69 3dxj n VAL 195 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3dxj n VAL 196 N -1.28 -0.49 0.12 2.52 0.31 -0.75 0.14 118.33 118.90 3dxj n VAL 196 Ca 0.00 2.22 0.16 0.00 -0.01 0.00 0.00 64.34 66.71 3dxj n VAL 196 Cb 0.00 -2.95 0.49 0.00 -0.91 0.00 0.00 33.84 30.47 3dxj n VAL 196 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 3dxj h SER 197 N 0.00 0.00 0.00 4.52 4.64 -0.25 -1.40 113.55 121.05 3dxj h SER 197 Ca 0.35 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.57 3dxj h SER 197 Cb 0.58 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.66 3dxj h SER 197 CO -0.95 0.00 -0.83 0.40 -0.87 0.00 0.00 176.83 174.59 3dxj h ILE 198 N 0.00 0.39 -1.10 0.95 2.04 0.14 -3.38 117.51 116.55 3dxj h ILE 198 Ca 0.19 -1.51 0.44 0.00 1.00 0.00 0.00 64.86 64.98 3dxj h ILE 198 Cb 1.76 0.95 -0.17 0.00 -0.74 0.00 0.00 36.82 38.63 3dxj h ILE 198 CO -0.00 0.13 0.63 0.00 0.00 0.00 0.00 178.15 178.91 3dxj n ALA 199 N -3.53 1.12 -0.33 1.87 0.00 -0.56 0.88 120.51 119.96 3dxj n ALA 199 Ca -0.18 0.98 0.19 0.00 0.00 0.00 0.00 53.44 54.44 3dxj n ALA 199 Cb 0.44 -1.03 0.41 0.00 0.00 0.00 0.00 19.45 19.27 3dxj n ALA 199 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3dxj h LYS 200 N 0.00 0.38 0.00 0.00 1.57 -1.66 0.47 116.57 117.34 3dxj h LYS 200 Ca 0.86 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 59.52 3dxj h LYS 200 Cb 2.40 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 34.61 3dxj h LYS 200 CO -0.69 0.25 -0.45 0.87 -0.57 0.00 0.00 179.45 178.86 3dxj h LYS 201 N 0.39 0.00 -1.06 3.15 6.56 0.25 -3.13 116.57 122.74 3dxj h LYS 201 Ca 0.67 0.00 -0.38 0.00 -1.06 0.00 0.00 60.65 59.88 3dxj h LYS 201 Cb 1.40 0.00 -0.21 0.00 -0.57 0.00 0.00 32.23 32.85 3dxj h LYS 201 CO -0.57 0.45 0.48 0.66 -2.06 0.00 0.00 179.45 178.42 3dxj n TYR 202 N -3.50 2.13 -2.83 -1.35 4.02 0.17 -4.94 117.16 110.86 3dxj n TYR 202 Ca 0.00 -1.60 -0.28 0.00 -0.01 0.00 0.00 57.90 56.01 3dxj n TYR 202 Cb 0.58 -0.81 -0.01 0.00 -0.02 0.00 0.00 39.34 39.08 3dxj n TYR 202 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3dxj s THR 203 N -2.45 4.90 0.00 -0.72 2.01 -1.14 -4.23 115.64 114.01 3dxj s THR 203 Ca 0.40 0.27 0.00 0.00 0.31 0.00 0.00 61.69 62.67 3dxj s THR 203 Cb 0.33 -3.81 0.00 0.00 0.01 0.00 0.00 72.50 69.03 3dxj s THR 203 CO 0.06 -0.67 0.00 0.61 -0.69 0.00 0.00 174.62 173.93 3dxj n GLY 204 N -1.78 0.86 0.38 4.40 0.00 -1.26 -4.73 105.19 103.05 3dxj n GLY 204 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.16 3dxj n GLY 204 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dxj n ARG 205 N 0.00 0.02 0.00 1.61 1.74 -1.26 -4.47 116.66 114.29 3dxj n ARG 205 Ca 0.00 0.84 0.00 0.00 -0.77 0.00 0.00 57.85 57.92 3dxj n ARG 205 Cb 0.00 -2.18 0.00 0.00 -1.02 0.00 0.00 32.46 29.26 3dxj n ARG 205 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dxj n GLY 206 N -1.48 0.44 3.65 -0.13 0.00 -1.26 -5.07 105.19 101.34 3dxj n GLY 206 Ca 0.11 -0.44 0.01 0.00 0.00 0.00 0.00 46.02 45.70 3dxj n GLY 206 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dxj s LEU 207 N 0.00 -0.11 -0.22 0.99 2.96 -1.26 -4.62 118.68 116.43 3dxj s LEU 207 Ca 0.00 0.18 -0.42 0.00 -0.22 0.00 0.00 54.13 53.66 3dxj s LEU 207 Cb 0.00 1.16 -0.19 0.00 0.50 0.00 0.00 46.19 47.66 3dxj s LEU 207 CO 0.00 -0.03 1.38 -0.24 -1.32 0.00 0.00 176.35 176.14 3dxj n SER 208 N 2.95 0.91 -0.33 3.68 2.88 -1.26 -4.62 113.62 117.83 3dxj n SER 208 Ca -0.16 1.16 0.08 0.00 -1.33 0.00 0.00 58.87 58.62 3dxj n SER 208 Cb 0.56 -0.96 0.19 0.00 -0.75 0.00 0.00 64.21 63.25 3dxj n SER 208 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 3dxj h PHE 209 N 4.42 -0.32 0.01 0.66 3.57 -1.98 0.38 116.94 123.68 3dxj h PHE 209 Ca -0.47 0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.11 3dxj h PHE 209 Cb 1.38 0.29 -0.02 0.00 2.79 0.00 0.00 35.95 40.39 3dxj h PHE 209 CO 0.63 -0.40 -0.22 -0.07 -2.23 0.00 0.00 178.31 176.01 3dxj h LEU 210 N 0.01 -0.68 -0.81 0.59 3.38 -1.99 0.52 115.31 116.34 3dxj h LEU 210 Ca 0.50 0.07 0.18 0.00 0.09 0.00 0.00 57.88 58.73 3dxj h LEU 210 Cb 0.88 0.25 -0.15 0.00 0.09 0.00 0.00 40.66 41.74 3dxj h LEU 210 CO -0.94 -0.22 -0.05 0.44 0.09 0.00 0.00 178.44 177.77 3dxj h ASP 211 N -0.28 -0.48 -0.02 -0.43 3.32 -1.04 0.28 116.42 117.77 3dxj h ASP 211 Ca 0.00 0.22 0.01 0.00 0.02 0.00 0.00 57.03 57.28 3dxj h ASP 211 Cb 0.30 0.41 -0.03 0.00 0.22 0.00 0.00 39.33 40.23 3dxj h ASP 211 CO -0.14 -0.23 -0.24 -0.07 -1.72 0.00 0.00 179.24 176.84 3dxj h LEU 212 N 0.06 -0.74 0.00 1.55 3.38 0.11 0.60 115.31 120.28 3dxj h LEU 212 Ca 0.44 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.49 3dxj h LEU 212 Cb 0.77 0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3dxj h LEU 212 CO -0.75 -0.22 0.00 -0.38 0.09 0.00 0.00 178.44 177.17 3dxj n ILE 213 N -3.80 0.00 -0.32 1.22 5.41 0.17 -1.26 119.36 120.78 3dxj n ILE 213 Ca -0.03 1.46 0.17 0.00 1.00 0.00 0.00 62.75 65.35 3dxj n ILE 213 Cb 0.17 -1.98 0.34 0.00 -0.71 0.00 0.00 39.64 37.46 3dxj n ILE 213 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 3dxj h GLN 214 N 0.00 0.12 0.41 0.38 1.08 -0.77 0.38 115.11 116.70 3dxj h GLN 214 Ca 0.00 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 3dxj h GLN 214 Cb 0.00 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.41 3dxj h GLN 214 CO 0.00 0.08 -0.19 0.93 -0.95 0.00 0.00 178.83 178.69 3dxj h GLU 215 N 0.12 -0.52 -0.45 1.46 4.39 0.53 -0.73 114.58 119.38 3dxj h GLU 215 Ca 0.62 0.04 0.08 0.00 0.34 0.00 0.00 59.36 60.44 3dxj h GLU 215 Cb 1.34 0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 30.09 3dxj h GLU 215 CO -0.75 -0.35 0.31 0.78 -1.16 0.00 0.00 179.01 177.84 3dxj h GLY 216 N -0.55 0.33 0.63 -3.84 0.00 0.15 -0.48 103.07 99.32 3dxj h GLY 216 Ca -0.06 -0.10 0.03 0.00 0.00 0.00 0.00 47.33 47.20 3dxj h GLY 216 CO 0.09 0.07 -0.10 3.43 0.00 0.00 0.00 176.54 180.03 3dxj h ASN 217 N 0.25 -0.32 -0.62 0.19 2.35 0.10 0.12 115.58 117.66 3dxj h ASN 217 Ca 0.21 0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.95 3dxj h ASN 217 Cb 0.49 0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.99 3dxj h ASN 217 CO -0.04 -0.14 0.14 0.06 -1.65 0.00 0.00 177.43 175.80 3dxj h GLN 218 N -0.14 1.00 -0.36 0.81 3.07 0.04 -1.06 115.11 118.46 3dxj h GLN 218 Ca 0.07 -0.25 0.08 0.00 0.09 0.00 0.00 58.65 58.64 3dxj h GLN 218 Cb 0.23 -0.13 -0.02 0.00 0.08 0.00 0.00 27.48 27.65 3dxj h GLN 218 CO -0.17 0.91 0.25 0.78 0.09 0.00 0.00 178.83 180.70 3dxj h GLY 219 N 0.91 0.17 0.63 0.06 0.00 -0.73 -1.34 103.07 102.76 3dxj h GLY 219 Ca 0.19 -0.05 -0.03 0.00 0.00 0.00 0.00 47.33 47.44 3dxj h GLY 219 CO 0.00 0.04 -0.30 -2.00 0.00 0.00 0.00 176.54 174.28 3dxj h LEU 220 N 0.13 -0.71 -0.93 3.11 5.85 0.49 -2.01 115.31 121.23 3dxj h LEU 220 Ca 0.17 0.02 0.22 0.00 0.84 0.00 0.00 57.88 59.13 3dxj h LEU 220 Cb 0.50 0.18 -0.17 0.00 0.37 0.00 0.00 40.66 41.54 3dxj h LEU 220 CO -0.02 -0.40 -0.10 0.40 -0.34 0.00 0.00 178.44 177.99 3dxj h ILE 221 N -1.08 0.09 0.11 4.05 2.04 -0.60 0.80 117.51 122.92 3dxj h ILE 221 Ca -0.09 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 65.79 3dxj h ILE 221 Cb 0.65 0.07 -0.04 0.00 -0.74 0.00 0.00 36.82 36.75 3dxj h ILE 221 CO 0.14 0.00 -0.33 -0.09 0.00 0.00 0.00 178.15 177.88 3dxj h ARG 222 N 0.02 -0.53 -1.03 2.37 9.65 -1.24 0.12 114.38 123.74 3dxj h ARG 222 Ca 0.50 0.04 0.31 0.00 -1.10 0.00 0.00 59.98 59.73 3dxj h ARG 222 Cb 0.90 0.12 -0.14 0.00 -1.39 0.00 0.00 29.97 29.46 3dxj h ARG 222 CO -0.90 -0.35 0.60 0.00 2.80 0.00 0.00 179.97 182.12 3dxj h ALA 223 N 0.09 2.00 0.08 2.80 0.00 0.13 0.52 119.26 124.88 3dxj h ALA 223 Ca 0.03 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3dxj h ALA 223 Cb 0.58 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3dxj h ALA 223 CO -0.20 -0.58 -0.04 0.28 0.00 0.00 0.00 179.25 178.72 3dxj h VAL 224 N 0.36 0.00 0.00 0.00 2.07 0.11 -3.23 116.25 115.55 3dxj h VAL 224 Ca 0.71 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.23 3dxj h VAL 224 Cb 1.64 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 3dxj h VAL 224 CO -0.54 0.00 0.00 1.21 0.02 0.00 0.00 177.57 178.26 3dxj n GLU 225 N -2.29 0.00 -1.88 1.57 2.13 0.46 -2.21 120.64 118.42 3dxj n GLU 225 Ca -0.01 0.46 -0.22 0.00 0.66 0.00 0.00 57.16 58.04 3dxj n GLU 225 Cb 0.04 -0.83 -0.07 0.00 0.27 0.00 0.00 31.44 30.84 3dxj n GLU 225 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 3dxj s LYS 226 N -1.49 2.03 -0.30 5.31 -0.14 0.15 -4.80 119.74 120.51 3dxj s LYS 226 Ca 0.00 -0.61 -0.12 0.00 -1.36 0.00 0.00 55.97 53.89 3dxj s LYS 226 Cb 0.00 -5.08 0.14 0.00 -1.68 0.00 0.00 37.83 31.20 3dxj s LYS 226 CO 0.00 -4.35 0.75 0.12 -0.76 0.00 0.00 175.35 171.11 3dxj s PHE 227 N 12.97 -1.14 -0.64 3.18 5.36 -0.94 -4.64 117.98 132.14 3dxj s PHE 227 Ca 0.75 1.99 -0.10 0.00 -0.96 0.00 0.00 56.93 58.61 3dxj s PHE 227 Cb -0.04 0.68 0.16 0.00 -0.34 0.00 0.00 43.02 43.48 3dxj s PHE 227 CO 0.11 -0.57 0.53 -1.83 -1.46 0.00 0.00 175.22 172.01 3dxj s GLU 228 N 2.70 2.95 0.37 10.12 -1.05 -1.26 -4.90 118.70 127.64 3dxj s GLU 228 Ca -0.05 -2.16 0.05 0.00 -0.15 0.00 0.00 54.97 52.65 3dxj s GLU 228 Cb -0.10 -4.11 0.73 0.00 -0.44 0.00 0.00 34.13 30.21 3dxj s GLU 228 CO -0.19 -1.24 2.01 0.10 0.95 0.00 0.00 175.26 176.89 3dxj h TYR 229 N 7.98 0.62 -1.06 4.83 -0.00 -1.95 -2.59 116.97 124.79 3dxj h TYR 229 Ca -0.07 -0.00 0.39 0.00 -0.00 0.00 0.00 58.73 59.05 3dxj h TYR 229 Cb 1.04 -0.20 -0.14 0.00 -0.00 0.00 0.00 36.73 37.43 3dxj h TYR 229 CO 0.80 0.43 0.65 1.63 -0.00 0.00 0.00 178.16 181.67 3dxj n LYS 230 N -4.42 -0.04 -2.91 0.10 5.02 -1.26 -2.89 118.16 111.76 3dxj n LYS 230 Ca 0.04 1.13 -0.43 0.00 -2.02 0.00 0.00 58.31 57.03 3dxj n LYS 230 Cb 0.09 -2.15 -0.05 0.00 -0.02 0.00 0.00 35.03 32.90 3dxj n LYS 230 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3dxj s ARG 231 N -5.15 3.27 -0.22 1.97 0.52 -0.98 -4.97 118.95 113.40 3dxj s ARG 231 Ca -0.07 -0.43 -0.35 0.00 -0.52 0.00 0.00 55.73 54.35 3dxj s ARG 231 Cb 0.28 -4.07 -0.12 0.00 0.52 0.00 0.00 34.95 31.56 3dxj s ARG 231 CO 0.70 -1.45 1.98 -2.13 0.02 0.00 0.00 175.30 174.42 3dxj n ARG 232 N 7.19 1.63 0.00 3.54 3.00 -1.14 -4.93 116.66 125.95 3dxj n ARG 232 Ca -0.00 0.55 0.00 0.00 -0.00 0.00 0.00 57.85 58.40 3dxj n ARG 232 Cb 0.47 -2.53 0.00 0.00 0.00 0.00 0.00 32.46 30.40 3dxj n ARG 232 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.63 179.60 3dxj n PHE 233 N 7.77 0.00 -1.59 -0.14 1.16 -1.26 -5.15 117.46 118.24 3dxj n PHE 233 Ca 0.30 0.00 -0.53 0.00 -1.87 0.00 0.00 57.45 55.35 3dxj n PHE 233 Cb 0.25 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.06 3dxj n PHE 233 CO 0.00 0.00 0.00 1.17 -1.87 0.00 0.00 176.76 176.06 3dxj n LYS 234 N -0.41 1.05 -0.03 3.97 4.81 -1.26 -4.92 118.16 121.37 3dxj n LYS 234 Ca 0.00 0.38 -0.12 0.00 -0.87 0.00 0.00 58.31 57.70 3dxj n LYS 234 Cb 0.00 -2.01 -0.07 0.00 0.02 0.00 0.00 35.03 32.96 3dxj n LYS 234 CO 0.00 0.00 0.00 0.35 1.17 0.00 0.00 177.40 178.92 3dxj h PHE 235 N 4.62 0.18 0.00 5.64 3.57 -2.00 -2.39 116.94 126.56 3dxj h PHE 235 Ca -0.48 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 60.98 3dxj h PHE 235 Cb 1.34 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 40.04 3dxj h PHE 235 CO 0.61 0.47 0.00 0.45 -2.23 0.00 0.00 178.31 177.60 3dxj n SER 236 N -4.80 0.00 -0.47 0.41 2.88 -1.26 0.13 113.62 110.51 3dxj n SER 236 Ca -0.07 0.47 0.39 0.00 -1.33 0.00 0.00 58.87 58.33 3dxj n SER 236 Cb 0.22 -0.02 0.67 0.00 -0.75 0.00 0.00 64.21 64.34 3dxj n SER 236 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 3dxj h THR 237 N 0.00 0.08 0.00 2.46 1.35 -1.98 -1.03 112.91 113.79 3dxj h THR 237 Ca 0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 3dxj h THR 237 Cb 0.00 0.02 0.00 0.00 -1.73 0.00 0.00 68.15 66.44 3dxj h THR 237 CO 0.00 0.01 0.00 0.00 -0.25 0.00 0.00 175.52 175.28 3dxj n TYR 238 N -4.65 0.00 -0.32 4.73 9.36 0.34 -3.78 117.16 122.84 3dxj n TYR 238 Ca 0.39 0.00 0.31 0.00 3.32 0.00 0.00 57.90 61.91 3dxj n TYR 238 Cb 1.51 0.00 0.56 0.00 -0.63 0.00 0.00 39.34 40.78 3dxj n TYR 238 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3dxj n ALA 239 N -2.25 1.00 -0.29 2.98 0.00 0.18 -0.10 120.51 122.04 3dxj n ALA 239 Ca 0.00 0.91 0.27 0.00 0.00 0.00 0.00 53.44 54.62 3dxj n ALA 239 Cb 0.00 -0.94 0.49 0.00 0.00 0.00 0.00 19.45 18.99 3dxj n ALA 239 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3dxj n THR 240 N -4.97 -0.29 0.00 0.00 -1.04 -0.41 -0.19 114.28 107.38 3dxj n THR 240 Ca 0.35 1.54 0.00 0.00 -2.04 0.00 0.00 64.05 63.90 3dxj n THR 240 Cb 1.23 -2.51 0.00 0.00 -1.82 0.00 0.00 70.33 67.24 3dxj n THR 240 CO 0.00 0.00 0.00 1.87 -0.64 0.00 0.00 175.07 176.30 3dxj n TRP 241 N -4.61 0.00 -0.28 -1.42 -0.00 0.86 -2.73 117.44 109.27 3dxj n TRP 241 Ca 0.30 0.00 -0.02 0.00 -0.00 0.00 0.00 57.50 57.79 3dxj n TRP 241 Cb 1.08 -0.23 0.02 0.00 -0.00 0.00 0.00 31.31 32.18 3dxj n TRP 241 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 177.69 178.60 3dxj n TRP 242 N -1.26 -0.02 -0.30 5.87 7.02 0.74 0.36 117.44 129.85 3dxj n TRP 242 Ca 0.00 0.87 -0.09 0.00 -1.02 0.00 0.00 57.50 57.26 3dxj n TRP 242 Cb 0.00 -0.74 -0.08 0.00 -2.42 0.00 0.00 31.31 28.07 3dxj n TRP 242 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 3dxj h ILE 243 N 0.00 0.00 -0.88 -0.99 2.04 -1.36 0.99 117.51 117.31 3dxj h ILE 243 Ca 0.23 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.25 3dxj h ILE 243 Cb 0.41 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 36.33 3dxj h ILE 243 CO -0.70 0.00 -0.31 0.03 0.00 0.00 0.00 178.15 177.18 3dxj h ARG 244 N -0.06 -0.03 0.05 2.37 3.08 0.11 -0.80 114.38 119.09 3dxj h ARG 244 Ca 0.12 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 3dxj h ARG 244 Cb 0.36 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 3dxj h ARG 244 CO -0.71 -0.02 -0.05 1.96 -1.07 0.00 0.00 179.97 180.08 3dxj h GLN 245 N -0.03 -0.10 -1.03 0.04 1.08 -0.64 0.88 115.11 115.31 3dxj h GLN 245 Ca 0.36 0.01 0.42 0.00 -1.45 0.00 0.00 58.65 57.99 3dxj h GLN 245 Cb 0.62 0.02 -0.17 0.00 -0.05 0.00 0.00 27.48 27.90 3dxj h GLN 245 CO -0.91 -0.06 0.58 0.00 -0.95 0.00 0.00 178.83 177.49 3dxj n ALA 246 N -2.31 1.06 -0.73 3.87 0.00 -0.65 0.16 120.51 121.92 3dxj n ALA 246 Ca -0.01 0.98 0.00 0.00 0.00 0.00 0.00 53.44 54.40 3dxj n ALA 246 Cb 0.05 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.49 3dxj n ALA 246 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3dxj n ILE 247 N -5.13 0.00 -0.31 0.00 5.41 -0.35 -0.91 119.36 118.07 3dxj n ILE 247 Ca 0.38 0.99 0.05 0.00 1.00 0.00 0.00 62.75 65.17 3dxj n ILE 247 Cb 1.30 -1.89 0.13 0.00 -0.71 0.00 0.00 39.64 38.47 3dxj n ILE 247 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 3dxj h ASN 248 N 0.00 -0.75 -0.33 4.38 2.35 0.53 0.33 115.58 122.10 3dxj h ASN 248 Ca 0.00 0.26 0.03 0.00 -0.55 0.00 0.00 56.30 56.04 3dxj h ASN 248 Cb 0.00 0.52 -0.04 0.00 0.05 0.00 0.00 38.32 38.85 3dxj h ASN 248 CO 0.00 -0.28 -0.20 -1.14 -1.65 0.00 0.00 177.43 174.16 3dxj n ARG 249 N -5.54 -0.15 0.12 0.81 3.00 0.42 0.14 116.66 115.48 3dxj n ARG 249 Ca 0.14 1.10 0.05 0.00 -0.00 0.00 0.00 57.85 59.14 3dxj n ARG 249 Cb 0.47 -1.63 0.49 0.00 0.00 0.00 0.00 32.46 31.78 3dxj n ARG 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3dxj h ALA 250 N -0.43 1.75 0.48 5.13 0.00 0.14 -2.35 119.26 123.97 3dxj h ALA 250 Ca 0.05 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3dxj h ALA 250 Cb 0.14 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3dxj h ALA 250 CO -0.31 0.20 -0.29 0.82 0.00 0.00 0.00 179.25 179.67 3dxj h ILE 251 N 0.27 0.41 -1.00 0.00 2.04 0.31 0.37 117.51 119.90 3dxj h ILE 251 Ca 0.07 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.02 3dxj h ILE 251 Cb 0.08 0.41 -0.08 0.00 -0.74 0.00 0.00 36.82 36.50 3dxj h ILE 251 CO -0.01 0.00 0.64 0.00 0.00 0.00 0.00 178.15 178.78 3dxj h ALA 252 N -0.24 1.47 -1.12 1.87 0.00 -0.71 0.41 119.26 120.93 3dxj h ALA 252 Ca -0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3dxj h ALA 252 Cb 0.59 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3dxj h ALA 252 CO 0.06 0.33 0.00 -0.25 0.00 0.00 0.00 179.25 179.39 3dxj n ASP 253 N -4.56 0.00 0.14 0.00 10.43 -0.69 -4.20 116.55 117.66 3dxj n ASP 253 Ca 0.17 0.76 0.13 0.00 2.57 0.00 0.00 54.79 58.42 3dxj n ASP 253 Cb 0.27 -0.31 0.29 0.00 1.84 0.00 0.00 41.12 43.21 3dxj n ASP 253 CO 0.00 0.00 0.00 1.56 -1.07 0.00 0.00 177.20 177.69 3dxj h GLN 254 N 0.00 0.00 -0.34 -1.24 4.20 -0.36 -3.40 115.11 113.98 3dxj h GLN 254 Ca 0.00 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.74 3dxj h GLN 254 Cb 0.00 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 27.73 3dxj h GLN 254 CO 0.00 0.00 -0.29 0.00 -0.67 0.00 0.00 178.83 177.87 3dxj h ALA 255 N 2.34 -0.43 -2.39 3.87 0.00 -1.02 -3.43 119.26 118.19 3dxj h ALA 255 Ca 0.00 0.03 -0.48 0.00 0.00 0.00 0.00 54.91 54.46 3dxj h ALA 255 Cb 0.83 1.04 0.13 0.00 0.00 0.00 0.00 17.79 19.79 3dxj h ALA 255 CO 0.00 -0.60 0.28 0.50 0.00 0.00 0.00 179.25 179.43 3dxj s ARG 256 N -4.32 1.39 0.11 0.00 3.52 -1.26 -4.94 118.95 113.44 3dxj s ARG 256 Ca -0.07 0.63 0.25 0.00 -0.13 0.00 0.00 55.73 56.40 3dxj s ARG 256 Cb 0.05 -1.84 0.44 0.00 -1.56 0.00 0.00 34.95 32.04 3dxj s ARG 256 CO 0.31 -2.10 1.40 2.41 -0.81 0.00 0.00 175.30 176.51 3dxj n THR 257 N -3.76 0.31 -5.04 4.11 -1.04 -1.26 -4.78 114.28 102.82 3dxj n THR 257 Ca 0.07 -0.23 -0.29 0.00 -2.04 0.00 0.00 64.05 61.56 3dxj n THR 257 Cb 0.57 -0.13 -0.16 0.00 -1.82 0.00 0.00 70.33 68.78 3dxj n THR 257 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 3dxj s ILE 258 N -3.13 1.75 -0.02 12.58 -1.09 -1.26 -5.09 121.20 124.94 3dxj s ILE 258 Ca 0.08 -0.88 -0.30 0.00 -2.23 0.00 0.00 60.65 57.32 3dxj s ILE 258 Cb 0.14 -1.50 -0.07 0.00 -1.58 0.00 0.00 42.46 39.45 3dxj s ILE 258 CO 0.70 0.49 1.75 -0.60 -1.23 0.00 0.00 174.94 176.05 3dxj s ARG 259 N 0.10 4.17 0.01 2.79 6.06 -1.26 -5.00 118.95 125.81 3dxj s ARG 259 Ca -0.08 2.33 -0.03 0.00 -2.50 0.00 0.00 55.73 55.45 3dxj s ARG 259 Cb -0.14 -4.01 -0.01 0.00 0.06 0.00 0.00 34.95 30.85 3dxj s ARG 259 CO 0.04 -0.87 0.04 -1.50 -2.50 0.00 0.00 175.30 170.51 3dxj s ILE 260 N 4.05 0.08 0.88 4.11 2.07 -1.26 -5.15 121.20 125.97 3dxj s ILE 260 Ca 0.78 -0.68 -0.12 0.00 -1.41 0.00 0.00 60.65 59.22 3dxj s ILE 260 Cb -0.37 -0.28 0.09 0.00 0.13 0.00 0.00 42.46 42.03 3dxj s ILE 260 CO 0.33 -0.37 0.94 -2.65 -1.91 0.00 0.00 174.94 171.29 3dxj n PRO 261 N 1.82 -0.16 0.09 3.50 -0.02 -1.26 -4.88 135.00 134.09 3dxj n PRO 261 Ca -0.21 0.02 -0.10 0.00 -2.02 0.00 0.00 63.50 61.18 3dxj n PRO 261 Cb 0.56 -2.23 -0.07 0.00 -0.02 0.00 0.00 33.50 31.74 3dxj n PRO 261 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3dxj h VAL 262 N -1.39 0.60 -1.34 -1.45 2.07 -1.99 -2.60 116.25 110.14 3dxj h VAL 262 Ca -0.44 -0.96 0.39 0.00 0.82 0.00 0.00 66.70 66.50 3dxj h VAL 262 Cb 1.29 1.00 -0.07 0.00 -1.52 0.00 0.00 31.29 31.99 3dxj h VAL 262 CO 0.41 0.15 0.95 1.12 0.02 0.00 0.00 177.57 180.22 3dxj h HIS 263 N -0.93 0.14 0.40 1.57 2.07 -2.00 1.26 115.15 117.66 3dxj h HIS 263 Ca -0.03 0.01 -0.02 0.00 -2.85 0.00 0.00 60.37 57.48 3dxj h HIS 263 Cb 0.49 -0.04 -0.00 0.00 2.57 0.00 0.00 27.41 30.43 3dxj h HIS 263 CO 0.06 -0.01 -0.25 0.52 -3.07 0.00 0.00 177.93 175.18 3dxj h MET 264 N 0.06 -0.58 -0.66 5.12 2.07 -1.88 -2.98 114.93 116.07 3dxj h MET 264 Ca 0.67 0.04 0.06 0.00 -2.07 0.00 0.00 59.70 58.40 3dxj h MET 264 Cb 2.51 0.13 -0.08 0.00 -1.87 0.00 0.00 31.60 32.29 3dxj h MET 264 CO -0.09 -0.39 -0.42 0.28 1.07 0.00 0.00 176.91 177.37 3dxj h VAL 265 N -0.61 0.00 0.00 -2.22 2.07 0.19 -0.88 116.25 114.80 3dxj h VAL 265 Ca -0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.47 3dxj h VAL 265 Cb 0.49 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 3dxj h VAL 265 CO 0.05 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 177.02 3dxj n GLU 266 N -4.61 0.00 -0.28 1.57 1.02 -0.22 0.50 120.64 118.61 3dxj n GLU 266 Ca 0.01 0.20 0.05 0.00 -0.02 0.00 0.00 57.16 57.39 3dxj n GLU 266 Cb 0.19 -0.39 0.14 0.00 -0.02 0.00 0.00 31.44 31.36 3dxj n GLU 266 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3dxj h THR 267 N 0.00 0.22 -0.37 2.62 1.35 -1.31 0.65 112.91 116.06 3dxj h THR 267 Ca 0.00 -0.01 0.05 0.00 -0.55 0.00 0.00 66.41 65.89 3dxj h THR 267 Cb 0.00 0.18 -0.08 0.00 -1.73 0.00 0.00 68.15 66.53 3dxj h THR 267 CO 0.00 0.01 -0.55 0.40 -0.25 0.00 0.00 175.52 175.13 3dxj h ILE 268 N 0.03 0.00 0.60 6.82 2.04 0.15 0.80 117.51 127.95 3dxj h ILE 268 Ca 0.42 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.26 3dxj h ILE 268 Cb 0.71 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 3dxj h ILE 268 CO -0.79 0.00 -0.43 0.78 0.00 0.00 0.00 178.15 177.71 3dxj h ASN 269 N -0.41 -1.11 -0.53 1.72 2.35 -0.56 -0.01 115.58 117.03 3dxj h ASN 269 Ca 0.07 0.07 0.20 0.00 -0.55 0.00 0.00 56.30 56.09 3dxj h ASN 269 Cb 0.59 0.34 -0.10 0.00 0.05 0.00 0.00 38.32 39.21 3dxj h ASN 269 CO -0.57 -0.63 0.19 1.17 -1.65 0.00 0.00 177.43 175.94 3dxj n LYS 270 N -5.55 -0.04 0.00 0.81 4.81 0.16 -0.80 118.16 117.56 3dxj n LYS 270 Ca -0.13 0.75 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 3dxj n LYS 270 Cb 0.44 -1.29 0.00 0.00 0.02 0.00 0.00 35.03 34.19 3dxj n LYS 270 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3dxj n LEU 271 N -4.34 0.73 -0.09 3.14 4.77 0.26 -2.89 117.00 118.58 3dxj n LEU 271 Ca 0.18 0.22 -0.01 0.00 -0.03 0.00 0.00 56.01 56.37 3dxj n LEU 271 Cb 0.59 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.68 3dxj n LEU 271 CO -0.01 0.00 0.12 -1.54 -1.33 0.00 0.00 177.39 174.63 3dxj n SER 272 N -0.34 -0.17 -0.19 -1.43 3.41 0.02 0.12 113.62 115.03 3dxj n SER 272 Ca 0.00 0.38 -0.09 0.00 -0.26 0.00 0.00 58.87 58.90 3dxj n SER 272 Cb 0.00 -0.08 -0.07 0.00 -0.26 0.00 0.00 64.21 63.80 3dxj n SER 272 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3dxj h ARG 273 N 0.00 -0.14 -0.62 4.33 3.08 -1.17 -0.46 114.38 119.40 3dxj h ARG 273 Ca 0.06 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.25 3dxj h ARG 273 Cb 0.12 0.03 -0.12 0.00 0.08 0.00 0.00 29.97 30.08 3dxj h ARG 273 CO -0.21 -0.09 -0.15 1.15 -1.07 0.00 0.00 179.97 179.60 3dxj h THR 274 N -0.14 0.39 -0.70 2.04 2.02 0.99 -1.44 112.91 116.07 3dxj h THR 274 Ca 0.08 -0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.42 3dxj h THR 274 Cb 0.36 0.38 -0.13 0.00 -1.74 0.00 0.00 68.15 67.02 3dxj h THR 274 CO -0.54 0.00 -0.09 0.00 0.37 0.00 0.00 175.52 175.26 3dxj n ALA 275 N -3.03 0.25 0.38 6.16 0.00 -0.19 0.24 120.51 124.33 3dxj n ALA 275 Ca 0.07 0.76 -0.15 0.00 0.00 0.00 0.00 53.44 54.12 3dxj n ALA 275 Cb 0.32 -0.50 -0.07 0.00 0.00 0.00 0.00 19.45 19.20 3dxj n ALA 275 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dxj h ARG 276 N 0.00 -0.96 0.00 0.00 3.08 -1.23 0.73 114.38 116.00 3dxj h ARG 276 Ca 0.37 0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.49 3dxj h ARG 276 Cb 0.67 0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.94 3dxj h ARG 276 CO -0.69 -0.64 0.25 1.04 -1.07 0.00 0.00 179.97 178.86 3dxj n GLN 277 N -5.17 0.04 -0.04 0.04 6.02 0.14 -0.12 117.38 118.29 3dxj n GLN 277 Ca -0.12 0.42 -0.04 0.00 -0.01 0.00 0.00 57.00 57.24 3dxj n GLN 277 Cb 0.39 -1.88 -0.01 0.00 1.02 0.00 0.00 30.24 29.76 3dxj n GLN 277 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3dxj n LEU 278 N -1.63 0.93 -0.37 1.08 4.77 0.17 -4.01 117.00 117.93 3dxj n LEU 278 Ca -0.00 0.16 0.01 0.00 -0.03 0.00 0.00 56.01 56.14 3dxj n LEU 278 Cb 0.26 -0.58 0.07 0.00 -2.33 0.00 0.00 43.42 40.85 3dxj n LEU 278 CO 0.03 -0.41 0.61 -0.61 -1.33 0.00 0.00 177.39 175.68 3dxj h GLN 279 N -0.45 -0.00 0.00 3.23 -0.00 0.12 0.50 115.11 118.50 3dxj h GLN 279 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 3dxj h GLN 279 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.93 3dxj h GLN 279 CO 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 178.83 178.83 3dxj n GLN 280 N -5.52 0.00 -0.08 1.69 10.64 0.83 -0.06 117.38 124.89 3dxj n GLN 280 Ca 0.12 0.45 -0.07 0.00 -1.83 0.00 0.00 57.00 55.67 3dxj n GLN 280 Cb 0.43 -1.14 -0.05 0.00 -0.86 0.00 0.00 30.24 28.62 3dxj n GLN 280 CO 0.00 0.00 0.00 1.49 -1.83 0.00 0.00 177.06 176.72 3dxj h GLU 281 N 0.00 -0.19 0.00 2.61 4.57 -1.45 0.32 114.58 120.44 3dxj h GLU 281 Ca 0.00 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 3dxj h GLU 281 Cb 0.00 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.63 3dxj h GLU 281 CO 0.00 -0.13 0.06 -0.11 -1.18 0.00 0.00 179.01 177.65 3dxj n LEU 282 N -4.10 0.00 0.00 1.64 7.94 0.17 -4.77 117.00 117.87 3dxj n LEU 282 Ca -0.02 0.39 0.00 0.00 -1.11 0.00 0.00 56.01 55.27 3dxj n LEU 282 Cb 0.18 -0.39 0.00 0.00 0.53 0.00 0.00 43.42 43.74 3dxj n LEU 282 CO 0.00 -0.39 0.00 0.61 -1.11 0.00 0.00 177.39 176.50 3dxj n GLY 283 N -1.38 1.27 1.65 -3.96 0.00 0.92 -4.83 105.19 98.85 3dxj n GLY 283 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3dxj n GLY 283 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3dxj n ARG 284 N -0.24 1.23 -3.00 1.61 1.85 -1.19 -4.88 116.66 112.05 3dxj n ARG 284 Ca 0.00 -1.54 -0.44 0.00 -1.00 0.00 0.00 57.85 54.87 3dxj n ARG 284 Cb 0.00 0.24 -0.04 0.00 -1.05 0.00 0.00 32.46 31.61 3dxj n ARG 284 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 3dxj s GLU 285 N -2.93 3.11 0.64 2.89 0.41 -1.26 -3.80 118.70 117.75 3dxj s GLU 285 Ca 0.10 -1.16 -0.18 0.00 -0.41 0.00 0.00 54.97 53.32 3dxj s GLU 285 Cb -0.01 -4.29 -0.03 0.00 -1.78 0.00 0.00 34.13 28.02 3dxj s GLU 285 CO 0.06 -1.67 1.10 -0.35 -0.49 0.00 0.00 175.26 173.91 3dxj n PRO 286 N 6.89 0.92 -4.37 0.39 -0.04 -1.26 -5.01 135.00 132.52 3dxj n PRO 286 Ca -0.05 0.36 -0.26 0.00 -0.04 0.00 0.00 63.50 63.51 3dxj n PRO 286 Cb 0.44 -2.32 -0.09 0.00 -0.04 0.00 0.00 33.50 31.49 3dxj n PRO 286 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 3dxj s THR 287 N -1.50 2.17 0.00 0.52 -1.32 -1.26 -4.85 115.64 109.40 3dxj s THR 287 Ca 0.79 -1.86 0.00 0.00 -1.21 0.00 0.00 61.69 59.41 3dxj s THR 287 Cb -0.39 -2.99 0.00 0.00 -1.51 0.00 0.00 72.50 67.61 3dxj s THR 287 CO 0.44 -0.01 0.00 -1.22 -2.21 0.00 0.00 174.62 171.62 3dxj n TYR 288 N -1.10 0.00 -0.06 9.09 0.53 -1.26 0.11 117.16 124.48 3dxj n TYR 288 Ca -0.03 0.00 -0.02 0.00 -1.02 0.00 0.00 57.90 56.83 3dxj n TYR 288 Cb 0.66 0.00 -0.01 0.00 -1.03 0.00 0.00 39.34 38.95 3dxj n TYR 288 CO 0.00 0.00 0.00 0.39 -1.02 0.00 0.00 176.86 176.23 3dxj n GLU 289 N -0.50 -0.06 -0.06 -0.72 4.71 -1.26 0.37 120.64 123.13 3dxj n GLU 289 Ca 0.00 0.75 -0.02 0.00 -0.01 0.00 0.00 57.16 57.88 3dxj n GLU 289 Cb 0.00 -1.11 -0.01 0.00 -1.01 0.00 0.00 31.44 29.30 3dxj n GLU 289 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 3dxj h GLU 290 N 0.00 -0.00 0.55 3.49 3.07 0.47 0.35 114.58 122.50 3dxj h GLU 290 Ca 0.02 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.86 3dxj h GLU 290 Cb 0.06 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 27.97 3dxj h GLU 290 CO -0.13 -0.00 -0.26 0.97 -1.40 0.00 0.00 179.01 178.18 3dxj h ILE 291 N -0.00 0.46 -0.78 3.13 6.09 0.62 0.25 117.51 127.27 3dxj h ILE 291 Ca 0.02 -0.05 0.19 0.00 -1.37 0.00 0.00 64.86 63.65 3dxj h ILE 291 Cb 0.06 0.48 -0.15 0.00 0.47 0.00 0.00 36.82 37.69 3dxj h ILE 291 CO -0.14 0.01 -0.09 0.00 -3.07 0.00 0.00 178.15 174.86 3dxj n ALA 292 N -2.43 0.30 -0.01 0.18 0.00 1.20 0.36 120.51 120.11 3dxj n ALA 292 Ca -0.12 0.85 0.00 0.00 0.00 0.00 0.00 53.44 54.17 3dxj n ALA 292 Cb 0.31 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.19 3dxj n ALA 292 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3dxj n GLU 293 N -5.19 0.00 -0.27 0.00 1.02 0.08 -2.79 120.64 113.49 3dxj n GLU 293 Ca 0.16 0.50 0.01 0.00 -0.02 0.00 0.00 57.16 57.80 3dxj n GLU 293 Cb 0.50 -1.43 0.06 0.00 -0.02 0.00 0.00 31.44 30.55 3dxj n GLU 293 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dxj n ALA 294 N -1.99 0.02 0.09 0.62 0.00 0.39 -1.09 120.51 118.54 3dxj n ALA 294 Ca 0.00 0.74 -0.13 0.00 0.00 0.00 0.00 53.44 54.06 3dxj n ALA 294 Cb 0.00 -0.38 -0.06 0.00 0.00 0.00 0.00 19.45 19.01 3dxj n ALA 294 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 3dxj h MET 295 N 0.00 -0.52 0.00 0.00 -1.53 0.63 -3.49 114.93 110.03 3dxj h MET 295 Ca 0.29 0.04 0.00 0.00 -3.44 0.00 0.00 59.70 56.58 3dxj h MET 295 Cb 0.47 0.12 0.00 0.00 -0.55 0.00 0.00 31.60 31.63 3dxj h MET 295 CO -0.72 -0.34 0.00 0.41 0.14 0.00 0.00 176.91 176.39 3dxj n GLY 296 N -1.43 0.31 0.27 1.39 0.00 -0.25 -4.99 105.19 100.49 3dxj n GLY 296 Ca -0.06 -1.27 0.02 0.00 0.00 0.00 0.00 46.02 44.71 3dxj n GLY 296 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dxj n PRO 297 N 0.00 -0.11 -3.09 1.61 -0.04 -1.26 -2.81 135.00 129.30 3dxj n PRO 297 Ca 0.00 1.11 -0.22 0.00 -0.04 0.00 0.00 63.50 64.35 3dxj n PRO 297 Cb 0.00 -1.65 -0.03 0.00 -0.04 0.00 0.00 33.50 31.77 3dxj n PRO 297 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dxj n GLY 298 N -1.40 4.43 3.08 0.55 0.00 -1.26 -5.05 105.19 105.53 3dxj n GLY 298 Ca 0.10 -2.15 -0.33 0.00 0.00 0.00 0.00 46.02 43.64 3dxj n GLY 298 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3dxj s TRP 299 N -2.85 3.50 0.06 1.61 0.52 -1.12 -5.06 118.94 115.60 3dxj s TRP 299 Ca 0.44 -2.51 -0.04 0.00 0.02 0.00 0.00 56.10 54.00 3dxj s TRP 299 Cb 0.32 -2.51 -0.05 0.00 -1.15 0.00 0.00 33.47 30.08 3dxj s TRP 299 CO -0.10 -0.91 0.29 0.34 0.02 0.00 0.00 176.95 176.59 3dxj s ASP 300 N 1.16 6.46 0.00 2.95 -1.08 -1.26 -4.16 116.67 120.74 3dxj s ASP 300 Ca 0.01 0.50 0.00 0.00 -0.52 0.00 0.00 52.55 52.54 3dxj s ASP 300 Cb -0.20 -2.06 0.00 0.00 -1.46 0.00 0.00 42.92 39.20 3dxj s ASP 300 CO -0.05 0.17 0.98 0.00 0.52 0.00 0.00 175.17 176.78 3dxj n ALA 301 N 0.60 -0.34 0.25 3.66 0.00 -1.26 -1.08 120.51 122.33 3dxj n ALA 301 Ca -0.07 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.51 3dxj n ALA 301 Cb 0.52 0.14 0.61 0.00 0.00 0.00 0.00 19.45 20.71 3dxj n ALA 301 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 3dxj h LYS 302 N 0.00 0.00 0.00 0.00 5.09 -1.96 0.34 116.57 120.04 3dxj h LYS 302 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 3dxj h LYS 302 Cb 0.00 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.33 3dxj h LYS 302 CO 0.00 0.00 0.00 -2.13 -2.09 0.00 0.00 179.45 175.23 3dxj n ARG 303 N -2.98 0.00 -0.06 0.07 0.63 -0.58 -1.72 116.66 112.02 3dxj n ARG 303 Ca 0.02 0.32 -0.01 0.00 -0.92 0.00 0.00 57.85 57.25 3dxj n ARG 303 Cb 0.63 -1.18 -0.01 0.00 0.45 0.00 0.00 32.46 32.35 3dxj n ARG 303 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3dxj n VAL 304 N -1.46 -0.09 0.00 5.15 0.31 0.10 0.11 118.33 122.45 3dxj n VAL 304 Ca 0.00 0.39 0.00 0.00 -0.01 0.00 0.00 64.34 64.72 3dxj n VAL 304 Cb 0.00 -0.49 0.00 0.00 -0.91 0.00 0.00 33.84 32.44 3dxj n VAL 304 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 3dxj n GLU 305 N -3.70 0.00 -0.34 5.55 2.13 -0.12 -0.78 120.64 123.38 3dxj n GLU 305 Ca 0.00 0.76 0.20 0.00 0.66 0.00 0.00 57.16 58.78 3dxj n GLU 305 Cb 0.03 -1.15 0.43 0.00 0.27 0.00 0.00 31.44 31.02 3dxj n GLU 305 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 3dxj h GLU 306 N 0.00 0.47 0.19 5.31 4.39 0.17 -2.41 114.58 122.70 3dxj h GLU 306 Ca 0.00 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 3dxj h GLU 306 Cb 0.00 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 3dxj h GLU 306 CO 0.00 0.31 -0.17 1.15 -1.16 0.00 0.00 179.01 179.14 3dxj h THR 307 N 0.48 0.00 -1.00 1.13 2.02 -0.49 0.15 112.91 115.21 3dxj h THR 307 Ca 0.67 0.00 0.15 0.00 0.77 0.00 0.00 66.41 68.00 3dxj h THR 307 Cb 1.41 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 67.66 3dxj h THR 307 CO -0.50 0.00 -0.39 0.18 0.37 0.00 0.00 175.52 175.18 3dxj n LEU 308 N -3.32 -0.66 -0.17 2.58 4.77 -0.94 0.21 117.00 119.48 3dxj n LEU 308 Ca -0.04 1.74 -0.02 0.00 -0.03 0.00 0.00 56.01 57.65 3dxj n LEU 308 Cb 0.16 -0.40 0.05 0.00 -2.33 0.00 0.00 43.42 40.90 3dxj n LEU 308 CO 0.09 -1.56 0.79 0.11 -1.33 0.00 0.00 177.39 175.49 3dxj h LYS 309 N 0.00 0.03 -0.03 3.23 1.57 -1.21 0.16 116.57 120.31 3dxj h LYS 309 Ca 0.34 -0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 59.02 3dxj h LYS 309 Cb 0.59 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 3dxj h LYS 309 CO -0.99 0.02 -0.43 0.82 -0.57 0.00 0.00 179.45 178.30 3dxj h ILE 310 N 0.03 1.31 0.00 1.86 2.04 0.46 -2.97 117.51 120.25 3dxj h ILE 310 Ca 0.25 -1.51 0.00 0.00 1.00 0.00 0.00 64.86 64.60 3dxj h ILE 310 Cb 0.39 1.77 0.00 0.00 -0.74 0.00 0.00 36.82 38.24 3dxj h ILE 310 CO -0.50 0.44 0.00 0.00 0.00 0.00 0.00 178.15 178.08 3dxj n ALA 311 N -2.46 2.50 -2.20 1.87 0.00 0.55 -4.89 120.51 115.87 3dxj n ALA 311 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.04 3dxj n ALA 311 Cb 0.47 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.86 3dxj n ALA 311 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3dxj s GLN 312 N -1.50 4.30 0.11 0.00 -0.21 -1.04 -5.00 119.66 116.32 3dxj s GLN 312 Ca 0.00 0.85 -0.13 0.00 0.02 0.00 0.00 55.36 56.10 3dxj s GLN 312 Cb 0.00 -3.25 0.05 0.00 1.00 0.00 0.00 33.01 30.82 3dxj s GLN 312 CO 0.00 0.62 0.85 0.39 -2.12 0.00 0.00 175.29 175.03 3dxj n GLU 313 N 1.69 -0.18 0.00 2.91 4.71 -1.26 -4.95 120.64 123.56 3dxj n GLU 313 Ca -0.09 0.83 0.00 0.00 -0.01 0.00 0.00 57.16 57.89 3dxj n GLU 313 Cb 0.50 -1.23 0.00 0.00 -1.01 0.00 0.00 31.44 29.70 3dxj n GLU 313 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 3dxj n PRO 314 N -4.75 0.00 -3.82 3.49 -0.04 -1.26 -4.54 135.00 124.09 3dxj n PRO 314 Ca 0.04 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.37 3dxj n PRO 314 Cb 0.18 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.54 3dxj n PRO 314 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3dxj s VAL 315 N 1.19 0.04 0.13 0.52 1.01 -1.26 -5.16 120.40 116.87 3dxj s VAL 315 Ca 0.00 -0.34 -0.23 0.00 0.00 0.00 0.00 61.98 61.41 3dxj s VAL 315 Cb 0.00 -0.41 -0.07 0.00 0.00 0.00 0.00 36.38 35.89 3dxj s VAL 315 CO 0.00 -0.19 0.71 -0.55 0.00 0.00 0.00 175.10 175.08 3dxj s SER 316 N -0.69 7.28 0.22 3.32 0.15 -1.26 -4.95 113.70 117.76 3dxj s SER 316 Ca -0.08 1.51 0.12 0.00 0.70 0.00 0.00 55.95 58.20 3dxj s SER 316 Cb -0.04 -2.45 -0.01 0.00 -1.71 0.00 0.00 66.02 61.80 3dxj s SER 316 CO 0.01 0.21 1.40 -0.07 1.20 0.00 0.00 173.24 175.99 3dxj h LEU 317 N 4.52 0.00 -0.17 3.45 3.38 -1.99 -3.12 115.31 121.38 3dxj h LEU 317 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 3dxj h LEU 317 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 3dxj h LEU 317 CO 0.66 0.71 0.00 -0.62 0.09 0.00 0.00 178.44 179.28 3dxj n GLU 318 N -3.32 0.96 -2.22 1.13 4.71 -1.26 -0.82 120.64 119.83 3dxj n GLU 318 Ca 0.01 0.00 -0.42 0.00 -0.01 0.00 0.00 57.16 56.74 3dxj n GLU 318 Cb 0.81 -1.08 -0.03 0.00 -1.01 0.00 0.00 31.44 30.13 3dxj n GLU 318 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 3dxj s THR 319 N -1.83 3.52 0.42 2.62 2.01 -1.18 -4.79 115.64 116.40 3dxj s THR 319 Ca 0.00 1.05 -0.25 0.00 0.31 0.00 0.00 61.69 62.80 3dxj s THR 319 Cb 0.00 -3.67 -0.08 0.00 0.01 0.00 0.00 72.50 68.75 3dxj s THR 319 CO 0.00 0.06 1.27 -2.84 -0.69 0.00 0.00 174.62 172.42 3dxj s PRO 320 N 1.44 3.91 0.56 4.92 0.02 -1.26 0.28 135.00 144.88 3dxj s PRO 320 Ca 0.64 2.06 0.03 0.00 0.02 0.00 0.00 61.00 63.74 3dxj s PRO 320 Cb -0.34 -2.68 0.05 0.00 0.02 0.00 0.00 34.50 31.55 3dxj s PRO 320 CO 0.29 -0.51 0.78 0.42 -0.33 0.00 0.00 177.00 177.65 3dxj s ILE 321 N -1.32 2.59 0.59 2.83 -1.09 -0.17 -4.78 121.20 119.85 3dxj s ILE 321 Ca 0.58 -0.73 0.26 0.00 -2.23 0.00 0.00 60.65 58.54 3dxj s ILE 321 Cb -0.36 -2.87 0.39 0.00 -1.58 0.00 0.00 42.46 38.04 3dxj s ILE 321 CO 0.45 0.00 1.26 0.61 -1.23 0.00 0.00 174.94 176.03 3dxj n GLY 322 N -2.34 -0.74 0.36 6.18 0.00 -1.26 0.23 105.19 107.62 3dxj n GLY 322 Ca 0.10 0.36 0.08 0.00 0.00 0.00 0.00 46.02 46.56 3dxj n GLY 322 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3dxj h ASP 323 N 0.00 0.63 -1.10 1.61 1.82 -1.92 -3.45 116.42 114.03 3dxj h ASP 323 Ca 0.49 0.01 -0.41 0.00 -0.39 0.00 0.00 57.03 56.73 3dxj h ASP 323 Cb 2.87 -0.12 -0.15 0.00 0.68 0.00 0.00 39.33 42.61 3dxj h ASP 323 CO -0.01 0.39 -0.38 -0.62 -1.61 0.00 0.00 179.24 177.01 3dxj n GLU 324 N -4.50 -1.41 0.07 0.28 1.02 0.64 -4.78 120.64 111.96 3dxj n GLU 324 Ca 0.12 1.19 0.00 0.00 -0.02 0.00 0.00 57.16 58.45 3dxj n GLU 324 Cb 0.31 -5.56 0.00 0.00 -0.02 0.00 0.00 31.44 26.17 3dxj n GLU 324 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3dxj n LYS 325 N -2.46 0.00 -0.67 3.49 5.02 -1.26 -5.01 118.16 117.27 3dxj n LYS 325 Ca -0.20 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.09 3dxj n LYS 325 Cb 0.66 -0.22 -0.00 0.00 -0.02 0.00 0.00 35.03 35.45 3dxj n LYS 325 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3dxj n ASP 326 N -3.23 0.06 -4.78 4.39 3.85 -1.26 -5.08 116.55 110.49 3dxj n ASP 326 Ca 0.00 -1.72 -0.31 0.00 -0.71 0.00 0.00 54.79 52.05 3dxj n ASP 326 Cb 0.00 -0.12 -0.06 0.00 -1.35 0.00 0.00 41.12 39.58 3dxj n ASP 326 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 3dxj s SER 327 N -0.85 5.59 -0.03 -1.12 1.04 -1.26 -5.01 113.70 112.06 3dxj s SER 327 Ca 0.04 0.03 -0.03 0.00 0.48 0.00 0.00 55.95 56.48 3dxj s SER 327 Cb 0.05 -1.53 0.01 0.00 0.10 0.00 0.00 66.02 64.65 3dxj s SER 327 CO -0.02 0.19 0.08 -0.36 0.98 0.00 0.00 173.24 174.11 3dxj s PHE 328 N -1.35 -0.09 0.11 5.02 0.40 -1.26 -1.00 117.98 119.82 3dxj s PHE 328 Ca 0.28 0.22 -0.12 0.00 -0.60 0.00 0.00 56.93 56.72 3dxj s PHE 328 Cb -0.12 0.02 0.08 0.00 0.51 0.00 0.00 43.02 43.51 3dxj s PHE 328 CO 0.21 -0.05 0.84 0.98 0.70 0.00 0.00 175.22 177.90 3dxj n TYR 329 N 3.10 -0.06 -0.33 0.36 4.19 0.14 0.13 117.16 124.68 3dxj n TYR 329 Ca -0.13 0.67 0.23 0.00 3.31 0.00 0.00 57.90 61.99 3dxj n TYR 329 Cb 0.59 -0.66 0.51 0.00 0.49 0.00 0.00 39.34 40.27 3dxj n TYR 329 CO 0.00 0.00 0.00 0.78 0.91 0.00 0.00 176.86 178.55 3dxj h GLY 330 N 0.00 1.28 1.43 2.98 0.00 -1.26 0.57 103.07 108.06 3dxj h GLY 330 Ca 0.16 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.28 3dxj h GLY 330 CO -0.53 -0.17 0.22 -0.55 0.00 0.00 0.00 176.54 175.51 3dxj h ASP 331 N 0.38 0.00 0.00 0.19 3.32 0.75 -2.33 116.42 118.74 3dxj h ASP 331 Ca 0.62 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.60 3dxj h ASP 331 Cb 1.57 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.11 3dxj h ASP 331 CO -0.32 0.00 -1.57 0.49 -1.72 0.00 0.00 179.24 176.12 3dxj n PHE 332 N -2.21 0.00 -1.99 4.55 3.01 0.19 -4.94 117.46 116.07 3dxj n PHE 332 Ca -0.01 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.03 3dxj n PHE 332 Cb 0.25 -0.34 -0.03 0.00 -0.01 0.00 0.00 39.48 39.35 3dxj n PHE 332 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3dxj s ILE 333 N -2.60 3.34 0.38 4.37 1.01 -0.88 -4.98 121.20 121.84 3dxj s ILE 333 Ca -0.04 0.64 0.04 0.00 0.00 0.00 0.00 60.65 61.29 3dxj s ILE 333 Cb 0.06 -3.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.11 3dxj s ILE 333 CO 0.45 -0.03 0.55 -2.16 0.00 0.00 0.00 174.94 173.75 3dxj s PRO 334 N 3.20 3.11 -0.10 2.79 0.04 -1.26 -5.01 135.00 137.78 3dxj s PRO 334 Ca 0.73 -0.78 -0.06 0.00 0.04 0.00 0.00 61.00 60.93 3dxj s PRO 334 Cb -0.36 -2.72 -0.04 0.00 0.04 0.00 0.00 34.50 31.42 3dxj s PRO 334 CO 0.31 -0.05 0.13 0.34 0.04 0.00 0.00 177.00 177.77 3dxj s ASP 335 N -4.18 6.28 0.00 6.66 -1.08 -1.26 -4.97 116.67 118.12 3dxj s ASP 335 Ca 0.46 0.42 0.00 0.00 -0.52 0.00 0.00 52.55 52.90 3dxj s ASP 335 Cb -0.10 -2.00 0.00 0.00 -1.46 0.00 0.00 42.92 39.36 3dxj s ASP 335 CO 0.34 0.38 0.00 -1.84 0.52 0.00 0.00 175.17 174.57 3dxj n GLU 336 N 1.81 3.15 0.24 4.34 0.00 -1.26 -4.71 120.64 124.21 3dxj n GLU 336 Ca -0.18 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.06 3dxj n GLU 336 Cb 0.54 -0.67 0.59 0.00 0.00 0.00 0.00 31.44 31.90 3dxj n GLU 336 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 3dxj h HIS 337 N 0.00 0.00 -3.24 -1.84 2.76 -2.07 -3.42 115.15 107.35 3dxj h HIS 337 Ca 0.00 0.00 -0.64 0.00 -2.20 0.00 0.00 60.37 57.53 3dxj h HIS 337 Cb 0.00 0.00 -0.16 0.00 1.55 0.00 0.00 27.41 28.80 3dxj h HIS 337 CO 0.00 0.18 -0.59 -0.51 -1.30 0.00 0.00 177.93 175.71 3dxj s LEU 338 N -7.84 3.70 0.32 0.26 1.43 -1.26 -5.08 118.68 110.21 3dxj s LEU 338 Ca -0.03 0.10 -0.29 0.00 -1.03 0.00 0.00 54.13 52.88 3dxj s LEU 338 Cb 0.14 -1.90 -0.10 0.00 0.03 0.00 0.00 46.19 44.36 3dxj s LEU 338 CO 0.64 0.26 1.35 -2.84 0.23 0.00 0.00 176.35 175.99 3dxj s PRO 339 N -0.15 4.32 0.57 1.29 0.02 -1.26 -5.00 135.00 134.78 3dxj s PRO 339 Ca 0.06 2.26 -0.18 0.00 0.02 0.00 0.00 61.00 63.16 3dxj s PRO 339 Cb -0.12 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.28 3dxj s PRO 339 CO 0.02 -0.27 1.11 -1.54 -0.33 0.00 0.00 177.00 175.99 3dxj s SER 340 N -0.28 5.61 0.55 2.53 1.04 -1.26 -4.59 113.70 117.29 3dxj s SER 340 Ca 0.51 2.09 0.47 0.00 0.48 0.00 0.00 55.95 59.51 3dxj s SER 340 Cb -0.41 -2.57 1.70 0.00 0.10 0.00 0.00 66.02 64.84 3dxj s SER 340 CO 0.52 -1.29 1.61 -0.65 0.98 0.00 0.00 173.24 174.40 3dxj h PRO 341 N 0.88 0.00 0.43 4.02 0.11 -1.99 0.29 132.00 135.75 3dxj h PRO 341 Ca -0.49 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 3dxj h PRO 341 Cb 1.25 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 3dxj h PRO 341 CO 0.56 0.00 -0.28 0.28 -0.21 0.00 0.00 178.00 178.36 3dxj h VAL 342 N 0.00 0.00 0.67 3.15 2.07 -1.99 -1.00 116.25 119.16 3dxj h VAL 342 Ca 0.89 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 68.38 3dxj h VAL 342 Cb 3.50 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 33.26 3dxj h VAL 342 CO -0.05 0.00 -0.43 0.44 0.02 0.00 0.00 177.57 177.55 3dxj h ASP 343 N -0.67 -1.09 -0.79 0.57 3.32 -0.80 0.32 116.42 117.28 3dxj h ASP 343 Ca -0.06 0.06 0.07 0.00 0.02 0.00 0.00 57.03 57.13 3dxj h ASP 343 Cb 0.54 0.32 -0.10 0.00 0.22 0.00 0.00 39.33 40.32 3dxj h ASP 343 CO 0.05 -0.66 -0.47 0.00 -1.72 0.00 0.00 179.24 176.45 3dxj n ALA 344 N -2.67 -0.50 -0.07 3.45 0.00 -0.55 0.13 120.51 120.30 3dxj n ALA 344 Ca -0.13 0.68 -0.07 0.00 0.00 0.00 0.00 53.44 53.91 3dxj n ALA 344 Cb 0.45 -0.12 -0.01 0.00 0.00 0.00 0.00 19.45 19.77 3dxj n ALA 344 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dxj h ALA 345 N 0.41 0.17 -0.19 0.00 0.00 -0.77 -0.10 119.26 118.78 3dxj h ALA 345 Ca 0.13 0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.20 3dxj h ALA 345 Cb 0.33 0.22 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 3dxj h ALA 345 CO -0.75 -0.47 -0.40 1.15 0.00 0.00 0.00 179.25 178.78 3dxj h THR 346 N -0.01 0.16 0.03 0.00 2.02 0.51 1.00 112.91 116.63 3dxj h THR 346 Ca 0.13 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.33 3dxj h THR 346 Cb 0.21 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 66.77 3dxj h THR 346 CO -0.29 0.00 -0.09 1.56 0.37 0.00 0.00 175.52 177.07 3dxj h GLN 347 N -0.44 -0.17 0.05 6.66 4.20 0.23 3.93 115.11 129.58 3dxj h GLN 347 Ca 0.09 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.84 3dxj h GLN 347 Cb 0.60 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.38 3dxj h GLN 347 CO -0.42 -0.11 -0.33 0.66 -0.67 0.00 0.00 178.83 177.95 3dxj h SER 348 N -0.18 -0.99 -0.99 1.46 4.64 -0.59 1.29 113.55 118.20 3dxj h SER 348 Ca 0.03 0.12 0.22 0.00 -0.47 0.00 0.00 61.79 61.69 3dxj h SER 348 Cb 0.21 0.38 -0.09 0.00 -0.31 0.00 0.00 62.40 62.59 3dxj h SER 348 CO -0.08 -0.41 0.63 0.25 -0.87 0.00 0.00 176.83 176.35 3dxj h LEU 349 N -0.52 0.55 0.14 5.97 5.85 0.19 -1.57 115.31 125.92 3dxj h LEU 349 Ca 0.05 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3dxj h LEU 349 Cb 0.58 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.59 3dxj h LEU 349 CO -0.24 0.17 -0.07 0.25 -0.34 0.00 0.00 178.44 178.22 3dxj h LEU 350 N 0.53 -0.16 -0.85 2.25 5.85 1.22 -3.01 115.31 121.13 3dxj h LEU 350 Ca 0.55 0.01 0.25 0.00 0.84 0.00 0.00 57.88 59.53 3dxj h LEU 350 Cb 1.19 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.23 3dxj h LEU 350 CO -0.29 -0.10 1.02 -1.20 -0.34 0.00 0.00 178.44 177.53 3dxj n SER 351 N -2.61 0.00 0.00 1.25 7.64 0.40 -2.87 113.62 117.42 3dxj n SER 351 Ca -0.02 0.63 0.00 0.00 1.01 0.00 0.00 58.87 60.48 3dxj n SER 351 Cb 0.07 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 3dxj n SER 351 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3dxj n GLU 352 N -2.90 0.00 -0.38 1.43 1.02 -0.79 -3.72 120.64 115.31 3dxj n GLU 352 Ca 0.19 0.00 0.35 0.00 -0.02 0.00 0.00 57.16 57.68 3dxj n GLU 352 Cb 1.27 -0.46 0.70 0.00 -0.02 0.00 0.00 31.44 32.93 3dxj n GLU 352 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3dxj h GLU 353 N 0.00 0.09 0.00 3.49 3.07 -1.64 -2.00 114.58 117.59 3dxj h GLU 353 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 3dxj h GLU 353 Cb 0.00 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 27.89 3dxj h GLU 353 CO 0.00 0.06 0.00 1.28 -1.40 0.00 0.00 179.01 178.95 3dxj n LEU 354 N -4.30 0.00 0.26 1.33 4.77 -1.17 -0.29 117.00 117.60 3dxj n LEU 354 Ca 0.29 0.63 0.18 0.00 -0.03 0.00 0.00 56.01 57.08 3dxj n LEU 354 Cb 1.27 -0.13 0.91 0.00 -2.33 0.00 0.00 43.42 43.14 3dxj n LEU 354 CO 0.36 -0.13 1.15 1.05 -1.33 0.00 0.00 177.39 178.49 3dxj h GLU 355 N 0.00 0.00 -0.20 3.23 4.11 -1.53 -1.28 114.58 118.91 3dxj h GLU 355 Ca 0.00 0.00 0.05 0.00 0.07 0.00 0.00 59.36 59.48 3dxj h GLU 355 Cb 0.00 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.18 3dxj h GLU 355 CO 0.00 0.00 -0.39 0.87 0.07 0.00 0.00 179.01 179.56 3dxj h LYS 356 N 0.00 -0.40 0.46 1.06 1.57 0.08 -1.60 116.57 117.73 3dxj h LYS 356 Ca 0.05 0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 3dxj h LYS 356 Cb 0.45 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.85 3dxj h LYS 356 CO -0.00 -0.27 -0.22 0.00 -0.57 0.00 0.00 179.45 178.39 3dxj h ALA 357 N 0.30 -0.61 -0.36 3.86 0.00 -0.08 -3.33 119.26 119.04 3dxj h ALA 357 Ca 0.10 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.86 3dxj h ALA 357 Cb 0.59 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 3dxj h ALA 357 CO -0.43 -0.74 -0.21 -0.11 0.00 0.00 0.00 179.25 177.76 3dxj n LEU 358 N -5.27 -0.38 -0.06 0.00 7.94 -0.83 -2.12 117.00 116.28 3dxj n LEU 358 Ca -0.11 0.69 -0.13 0.00 -1.11 0.00 0.00 56.01 55.35 3dxj n LEU 358 Cb 0.30 -0.11 -0.09 0.00 0.53 0.00 0.00 43.42 44.04 3dxj n LEU 358 CO 0.33 -0.55 0.50 0.77 -1.11 0.00 0.00 177.39 177.33 3dxj h SER 359 N 0.00 -1.64 0.00 1.96 4.64 -1.43 -2.97 113.55 114.10 3dxj h SER 359 Ca 0.06 0.20 -0.20 0.00 -0.47 0.00 0.00 61.79 61.38 3dxj h SER 359 Cb 0.15 0.66 -0.00 0.00 -0.31 0.00 0.00 62.40 62.89 3dxj h SER 359 CO -0.34 -0.41 1.40 0.29 -0.87 0.00 0.00 176.83 176.90 3dxj n LYS 360 N -5.16 1.24 -3.90 4.77 4.01 -0.90 -4.73 118.16 113.49 3dxj n LYS 360 Ca -0.04 -0.89 -0.08 0.00 -0.51 0.00 0.00 58.31 56.78 3dxj n LYS 360 Cb 0.33 -2.09 -0.02 0.00 -0.51 0.00 0.00 35.03 32.74 3dxj n LYS 360 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 3dxj s LEU 361 N 0.04 -0.02 -0.82 -0.35 2.96 -1.12 -5.06 118.68 114.30 3dxj s LEU 361 Ca 0.28 -0.81 -0.25 0.00 -0.22 0.00 0.00 54.13 53.13 3dxj s LEU 361 Cb 0.09 2.44 -0.18 0.00 0.50 0.00 0.00 46.19 49.04 3dxj s LEU 361 CO -0.02 -1.34 2.22 -1.20 -1.32 0.00 0.00 176.35 174.69 3dxj n SER 362 N -0.61 0.22 0.00 3.68 7.64 -1.26 -4.79 113.62 118.49 3dxj n SER 362 Ca -0.04 0.14 0.00 0.00 1.01 0.00 0.00 58.87 59.98 3dxj n SER 362 Cb 0.60 -0.75 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 3dxj n SER 362 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 3dxj n GLU 363 N 6.98 0.00 0.20 1.43 2.13 -1.26 0.24 120.64 130.35 3dxj n GLU 363 Ca 0.54 0.00 0.15 0.00 0.66 0.00 0.00 57.16 58.51 3dxj n GLU 363 Cb 0.03 -0.26 0.77 0.00 0.27 0.00 0.00 31.44 32.24 3dxj n GLU 363 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3dxj h ARG 364 N 0.00 0.00 0.00 5.31 2.47 -1.99 -2.31 114.38 117.85 3dxj h ARG 364 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3dxj h ARG 364 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 3dxj h ARG 364 CO 0.00 0.00 -0.46 0.93 0.56 0.00 0.00 179.97 181.00 3dxj h GLU 365 N 0.00 0.00 0.09 0.04 5.08 -1.84 -2.39 114.58 115.56 3dxj h GLU 365 Ca 0.08 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.12 3dxj h GLU 365 Cb 0.37 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 3dxj h GLU 365 CO -0.00 0.00 -1.68 0.00 -1.00 0.00 0.00 179.01 176.33 3dxj h ALA 366 N 2.42 0.43 -0.04 3.43 0.00 0.37 -3.33 119.26 122.54 3dxj h ALA 366 Ca 0.00 -1.26 -0.14 0.00 0.00 0.00 0.00 54.91 53.51 3dxj h ALA 366 Cb 0.79 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3dxj h ALA 366 CO 0.00 1.29 -0.62 0.52 0.00 0.00 0.00 179.25 180.44 3dxj h MET 367 N 0.05 0.14 -0.27 0.00 2.86 -1.56 -3.37 114.93 112.79 3dxj h MET 367 Ca -0.29 -0.10 0.02 0.00 -2.06 0.00 0.00 59.70 57.27 3dxj h MET 367 Cb 2.02 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 33.66 3dxj h MET 367 CO 0.12 0.72 -0.16 1.33 1.06 0.00 0.00 176.91 179.98 3dxj n VAL 368 N -3.84 -0.18 -0.06 -2.22 0.24 -0.90 0.32 118.33 111.69 3dxj n VAL 368 Ca -0.02 1.32 -0.08 0.00 -2.04 0.00 0.00 64.34 63.52 3dxj n VAL 368 Cb 0.62 -1.69 -0.02 0.00 -1.47 0.00 0.00 33.84 31.28 3dxj n VAL 368 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3dxj h LEU 369 N 0.00 -0.03 0.22 1.34 3.38 -1.81 -1.34 115.31 117.06 3dxj h LEU 369 Ca 0.04 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 3dxj h LEU 369 Cb 0.11 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3dxj h LEU 369 CO -0.25 0.01 -0.10 0.07 0.09 0.00 0.00 178.44 178.26 3dxj h LYS 370 N 0.11 -0.28 -1.25 1.13 2.10 -1.34 -2.27 116.57 114.77 3dxj h LYS 370 Ca 0.11 0.02 0.36 0.00 -2.00 0.00 0.00 60.65 59.14 3dxj h LYS 370 Cb 0.12 0.06 -0.05 0.00 -0.90 0.00 0.00 32.23 31.46 3dxj h LYS 370 CO -0.16 0.03 0.89 -0.07 -2.00 0.00 0.00 179.45 178.14 3dxj h LEU 371 N -0.60 0.02 0.00 7.07 3.38 0.51 1.45 115.31 127.15 3dxj h LEU 371 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3dxj h LEU 371 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3dxj h LEU 371 CO 0.05 0.00 0.00 -1.14 0.09 0.00 0.00 178.44 177.44 3dxj n ARG 372 N -4.19 0.00 -0.03 1.13 3.00 -0.52 -3.87 116.66 112.18 3dxj n ARG 372 Ca 0.27 0.22 -0.12 0.00 -0.00 0.00 0.00 57.85 58.22 3dxj n ARG 372 Cb 1.30 -0.79 -0.14 0.00 0.00 0.00 0.00 32.46 32.83 3dxj n ARG 372 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 3dxj n LYS 373 N -1.17 0.67 0.29 -0.14 2.85 -0.89 -0.07 118.16 119.69 3dxj n LYS 373 Ca 0.00 0.24 0.15 0.00 -1.05 0.00 0.00 58.31 57.64 3dxj n LYS 373 Cb 0.00 -1.72 0.86 0.00 -0.65 0.00 0.00 35.03 33.52 3dxj n LYS 373 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 3dxj h GLY 374 N 2.97 0.00 0.00 2.58 0.00 0.14 -3.11 103.07 105.66 3dxj h GLY 374 Ca -0.37 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 46.77 3dxj h GLY 374 CO 0.07 0.00 -1.76 1.04 0.00 0.00 0.00 176.54 175.88 3dxj n LEU 375 N -3.76 0.00 0.00 3.11 4.77 0.36 -4.88 117.00 116.60 3dxj n LEU 375 Ca -0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 3dxj n LEU 375 Cb 0.13 0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 3dxj n LEU 375 CO 0.28 0.26 0.00 -0.38 -1.33 0.00 0.00 177.39 176.22 3dxj n ILE 376 N -2.38 0.00 -3.63 -0.08 5.41 -0.93 -5.04 119.36 112.72 3dxj n ILE 376 Ca -0.17 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.51 3dxj n ILE 376 Cb 0.83 -0.05 -0.06 0.00 -0.71 0.00 0.00 39.64 39.65 3dxj n ILE 376 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 3dxj s ASP 377 N -0.63 -0.25 -0.26 4.38 -1.08 0.89 -4.85 116.67 114.87 3dxj s ASP 377 Ca 0.00 0.40 -0.01 0.00 -0.52 0.00 0.00 52.55 52.43 3dxj s ASP 377 Cb 0.00 0.38 0.00 0.00 -1.46 0.00 0.00 42.92 41.84 3dxj s ASP 377 CO 0.00 -0.14 0.26 0.61 0.52 0.00 0.00 175.17 176.41 3dxj n GLY 378 N 1.38 -0.69 3.78 2.66 0.00 -1.26 -4.02 105.19 107.03 3dxj n GLY 378 Ca -0.09 0.10 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 3dxj n GLY 378 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dxj s ARG 379 N -2.80 4.25 -0.96 1.61 3.00 -1.26 -3.57 118.95 119.22 3dxj s ARG 379 Ca 0.01 1.57 -0.06 0.00 -1.00 0.00 0.00 55.73 56.26 3dxj s ARG 379 Cb -0.00 -2.67 0.01 0.00 0.00 0.00 0.00 34.95 32.28 3dxj s ARG 379 CO 0.28 -0.07 0.84 -1.91 0.00 0.00 0.00 175.30 174.44 3dxj n GLU 380 N 0.18 -5.64 -1.15 5.12 2.13 -1.26 -4.88 120.64 115.14 3dxj n GLU 380 Ca 0.04 0.60 -0.22 0.00 0.66 0.00 0.00 57.16 58.24 3dxj n GLU 380 Cb 0.49 -4.92 0.00 0.00 0.27 0.00 0.00 31.44 27.27 3dxj n GLU 380 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 3dxj n HIS 381 N -4.20 1.65 0.00 4.31 8.25 -1.23 -4.85 115.22 119.15 3dxj n HIS 381 Ca -0.01 -2.02 0.00 0.00 -0.26 0.00 0.00 57.72 55.43 3dxj n HIS 381 Cb 0.55 -1.15 0.00 0.00 1.12 0.00 0.00 29.99 30.51 3dxj n HIS 381 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 3dxj n THR 382 N 0.49 0.00 0.00 1.59 -1.04 -1.26 0.32 114.28 114.38 3dxj n THR 382 Ca 0.39 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.40 3dxj n THR 382 Cb 0.57 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.08 3dxj n THR 382 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3dxj n LEU 383 N -1.77 0.00 -0.06 -4.42 4.77 -1.26 -0.86 117.00 113.39 3dxj n LEU 383 Ca 0.00 0.31 -0.08 0.00 -0.03 0.00 0.00 56.01 56.21 3dxj n LEU 383 Cb 0.00 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 40.75 3dxj n LEU 383 CO 0.00 -0.31 -0.57 -0.62 -1.33 0.00 0.00 177.39 174.56 3dxj n GLU 384 N -1.29 0.41 0.16 3.23 1.02 0.97 -4.50 120.64 120.63 3dxj n GLU 384 Ca 0.00 0.17 0.03 0.00 -0.02 0.00 0.00 57.16 57.33 3dxj n GLU 384 Cb 0.12 -1.22 0.16 0.00 -0.02 0.00 0.00 31.44 30.47 3dxj n GLU 384 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3dxj n GLU 385 N -4.23 0.05 0.18 3.49 1.02 0.54 0.80 120.64 122.48 3dxj n GLU 385 Ca -0.13 0.50 -0.10 0.00 -0.02 0.00 0.00 57.16 57.41 3dxj n GLU 385 Cb 0.43 -2.18 -0.05 0.00 -0.02 0.00 0.00 31.44 29.62 3dxj n GLU 385 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 3dxj h VAL 386 N 0.00 0.19 -0.00 2.62 -1.51 -1.18 -0.85 116.25 115.52 3dxj h VAL 386 Ca 0.00 -0.66 0.00 0.00 -1.23 0.00 0.00 66.70 64.81 3dxj h VAL 386 Cb 1.07 0.31 0.00 0.00 -2.13 0.00 0.00 31.29 30.53 3dxj h VAL 386 CO 0.00 0.04 -0.08 0.61 -1.23 0.00 0.00 177.57 176.91 3dxj n GLY 387 N 0.27 -1.23 0.15 5.19 0.00 0.14 -1.30 105.19 108.41 3dxj n GLY 387 Ca -0.08 -0.19 0.05 0.00 0.00 0.00 0.00 46.02 45.80 3dxj n GLY 387 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dxj h ALA 388 N 3.33 0.74 -0.11 4.61 0.00 0.43 -0.53 119.26 127.73 3dxj h ALA 388 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3dxj h ALA 388 Cb 0.38 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3dxj h ALA 388 CO 0.00 0.49 0.00 0.34 0.00 0.00 0.00 179.25 180.08 3dxj n PHE 389 N -3.15 0.13 -1.58 0.00 7.35 -0.33 -4.89 117.46 114.99 3dxj n PHE 389 Ca 0.01 -0.06 -0.15 0.00 -0.76 0.00 0.00 57.45 56.49 3dxj n PHE 389 Cb 0.69 0.00 -0.06 0.00 0.35 0.00 0.00 39.48 40.47 3dxj n PHE 389 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 3dxj n PHE 390 N 0.72 -0.44 0.00 -5.13 3.01 -0.21 -4.66 117.46 110.75 3dxj n PHE 390 Ca 0.17 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.63 3dxj n PHE 390 Cb 0.45 -2.82 0.00 0.00 -0.01 0.00 0.00 39.48 37.10 3dxj n PHE 390 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3dxj n GLY 391 N -0.37 1.08 3.41 1.37 0.00 -0.42 -4.92 105.19 105.35 3dxj n GLY 391 Ca -0.15 0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 3dxj n GLY 391 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3dxj n VAL 392 N 0.00 1.50 -1.88 1.61 0.31 -1.25 -4.61 118.33 114.00 3dxj n VAL 392 Ca 0.00 -0.50 -0.31 0.00 -0.01 0.00 0.00 64.34 63.52 3dxj n VAL 392 Cb 0.00 -0.38 0.01 0.00 -0.91 0.00 0.00 33.84 32.56 3dxj n VAL 392 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3dxj s THR 393 N -1.50 4.46 0.27 2.52 2.01 -1.26 -4.26 115.64 117.87 3dxj s THR 393 Ca 0.62 0.87 0.00 0.00 0.31 0.00 0.00 61.69 63.50 3dxj s THR 393 Cb -0.63 -3.70 0.25 0.00 0.01 0.00 0.00 72.50 68.44 3dxj s THR 393 CO 0.59 -0.97 1.76 0.08 -0.69 0.00 0.00 174.62 175.39 3dxj h ARG 394 N -0.20 0.61 -0.99 4.92 0.11 -1.94 -2.04 114.38 114.85 3dxj h ARG 394 Ca -0.45 -0.04 0.09 0.00 0.10 0.00 0.00 59.98 59.69 3dxj h ARG 394 Cb 1.20 -0.14 -0.12 0.00 1.11 0.00 0.00 29.97 32.02 3dxj h ARG 394 CO 0.60 0.40 -0.59 1.49 0.10 0.00 0.00 179.97 181.98 3dxj h GLU 395 N 0.63 -0.01 -0.87 0.08 4.22 -1.96 0.22 114.58 116.89 3dxj h GLU 395 Ca 0.48 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.90 3dxj h GLU 395 Cb 0.71 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.92 3dxj h GLU 395 CO -0.38 -0.00 0.44 -0.09 -2.18 0.00 0.00 179.01 176.80 3dxj h ARG 396 N -0.01 1.24 -0.62 1.92 2.43 -1.77 -3.07 114.38 114.51 3dxj h ARG 396 Ca 0.16 -0.17 0.08 0.00 -0.81 0.00 0.00 59.98 59.24 3dxj h ARG 396 Cb 0.42 -0.23 -0.10 0.00 -0.42 0.00 0.00 29.97 29.63 3dxj h ARG 396 CO -0.94 0.93 -0.50 0.82 -1.51 0.00 0.00 179.97 178.78 3dxj h ILE 397 N 1.23 0.04 -0.35 1.20 2.04 -0.26 -0.22 117.51 121.20 3dxj h ILE 397 Ca 0.30 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.19 3dxj h ILE 397 Cb 0.09 0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.16 3dxj h ILE 397 CO -0.04 0.00 -0.20 -1.14 0.00 0.00 0.00 178.15 176.76 3dxj n ARG 398 N -5.37 -0.15 -0.04 2.37 0.00 -0.90 -1.06 116.66 111.50 3dxj n ARG 398 Ca 0.00 0.91 -0.01 0.00 -0.00 0.00 0.00 57.85 58.75 3dxj n ARG 398 Cb 0.33 -1.36 -0.01 0.00 0.00 0.00 0.00 32.46 31.43 3dxj n ARG 398 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 3dxj h GLN 399 N 0.00 -0.02 -0.54 -0.14 4.20 -1.17 -2.69 115.11 114.76 3dxj h GLN 399 Ca 0.06 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.82 3dxj h GLN 399 Cb 0.14 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.86 3dxj h GLN 399 CO -0.33 -0.01 -0.32 -0.89 -0.67 0.00 0.00 178.83 176.62 3dxj n ILE 400 N -3.21 -0.37 -0.13 2.54 5.41 -0.22 -0.42 119.36 122.96 3dxj n ILE 400 Ca 0.00 1.63 -0.03 0.00 1.00 0.00 0.00 62.75 65.34 3dxj n ILE 400 Cb 0.04 -2.04 -0.03 0.00 -0.71 0.00 0.00 39.64 36.90 3dxj n ILE 400 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 3dxj n GLU 401 N -4.32 -0.14 0.00 0.38 2.13 -0.88 0.19 120.64 118.00 3dxj n GLU 401 Ca 0.01 1.14 0.00 0.00 0.66 0.00 0.00 57.16 58.97 3dxj n GLU 401 Cb 0.14 -1.69 0.00 0.00 0.27 0.00 0.00 31.44 30.16 3dxj n GLU 401 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3dxj n ASN 402 N -3.70 0.00 -0.34 4.31 5.03 0.44 -0.39 115.26 120.61 3dxj n ASN 402 Ca 0.01 0.00 0.11 0.00 0.87 0.00 0.00 54.58 55.57 3dxj n ASN 402 Cb 0.08 0.00 0.23 0.00 -1.02 0.00 0.00 39.78 39.07 3dxj n ASN 402 CO 0.00 0.00 0.00 0.11 -1.83 0.00 0.00 177.26 175.54 3dxj h LYS 403 N 0.00 0.01 0.00 3.52 1.79 -1.40 0.24 116.57 120.73 3dxj h LYS 403 Ca 0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3dxj h LYS 403 Cb 0.00 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 3dxj h LYS 403 CO 0.00 0.01 0.00 0.00 -1.08 0.00 0.00 179.45 178.38 3dxj n ALA 404 N -3.29 0.00 -0.04 3.86 0.00 0.13 0.19 120.51 121.35 3dxj n ALA 404 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.56 3dxj n ALA 404 Cb 0.66 0.19 -0.06 0.00 0.00 0.00 0.00 19.45 20.24 3dxj n ALA 404 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3dxj h LEU 405 N 0.00 -1.04 -0.07 0.00 3.38 0.03 -1.42 115.31 116.18 3dxj h LEU 405 Ca 0.00 0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.11 3dxj h LEU 405 Cb 0.00 0.42 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3dxj h LEU 405 CO 0.00 -0.25 -0.04 0.54 0.09 0.00 0.00 178.44 178.77 3dxj n ARG 406 N -4.23 -0.03 -0.42 1.13 1.74 0.76 0.37 116.66 115.98 3dxj n ARG 406 Ca -0.03 0.99 0.34 0.00 -0.77 0.00 0.00 57.85 58.39 3dxj n ARG 406 Cb 0.21 -1.48 0.63 0.00 -1.02 0.00 0.00 32.46 30.79 3dxj n ARG 406 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3dxj h LYS 407 N 0.00 0.14 0.00 5.56 1.79 0.24 -2.92 116.57 121.38 3dxj h LYS 407 Ca 0.01 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3dxj h LYS 407 Cb 0.03 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 3dxj h LYS 407 CO -0.07 0.09 0.00 -0.11 -1.08 0.00 0.00 179.45 178.28 3dxj n LEU 408 N -4.67 0.57 -0.18 2.94 7.94 0.16 -2.80 117.00 120.97 3dxj n LEU 408 Ca 0.35 0.15 -0.03 0.00 -1.11 0.00 0.00 56.01 55.37 3dxj n LEU 408 Cb 1.33 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 45.25 3dxj n LEU 408 CO 0.22 0.00 0.22 2.29 -1.11 0.00 0.00 177.39 179.01 3dxj n LYS 409 N -0.25 -0.16 0.27 1.96 -0.00 -0.78 0.26 118.16 119.46 3dxj n LYS 409 Ca 0.00 0.66 0.12 0.00 -0.00 0.00 0.00 58.31 59.09 3dxj n LYS 409 Cb 0.00 -0.98 0.74 0.00 -0.00 0.00 0.00 35.03 34.79 3dxj n LYS 409 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.40 179.28 3dxj h TYR 410 N 0.00 0.00 0.03 5.58 -1.99 -1.69 0.24 116.97 119.14 3dxj h TYR 410 Ca 0.10 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 60.62 3dxj h TYR 410 Cb 0.20 0.00 0.02 0.00 2.00 0.00 0.00 36.73 38.95 3dxj h TYR 410 CO -0.43 0.08 -0.81 1.25 -0.00 0.00 0.00 178.16 178.25 3dxj h HIS 411 N 0.00 0.76 0.00 4.88 -0.00 0.38 -2.84 115.15 118.34 3dxj h HIS 411 Ca -0.00 -0.44 0.00 0.00 -0.00 0.00 0.00 60.37 59.93 3dxj h HIS 411 Cb 0.19 -0.08 0.00 0.00 -0.00 0.00 0.00 27.41 27.52 3dxj h HIS 411 CO 0.00 1.27 0.00 0.39 -0.00 0.00 0.00 177.93 179.59 3dxj n GLU 412 N -4.07 0.71 0.06 5.26 -0.58 0.16 -0.43 120.64 121.76 3dxj n GLU 412 Ca -0.11 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.74 3dxj n GLU 412 Cb 0.78 -1.19 0.09 0.00 -0.57 0.00 0.00 31.44 30.55 3dxj n GLU 412 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 3dxj n SER 413 N -0.16 0.72 0.00 1.62 7.64 0.28 -4.01 113.62 119.71 3dxj n SER 413 Ca 0.00 0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.99 3dxj n SER 413 Cb 0.09 0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 3dxj n SER 413 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3dxj n ARG 414 N -2.23 0.00 -2.17 1.43 5.12 0.43 -4.61 116.66 114.62 3dxj n ARG 414 Ca 0.02 0.05 -0.30 0.00 -1.93 0.00 0.00 57.85 55.68 3dxj n ARG 414 Cb 0.47 -0.36 -0.05 0.00 -1.16 0.00 0.00 32.46 31.37 3dxj n ARG 414 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 3dxj s THR 415 N -0.17 3.58 -0.34 0.55 2.01 -1.22 -4.92 115.64 115.13 3dxj s THR 415 Ca 0.00 -0.57 -0.29 0.00 0.31 0.00 0.00 61.69 61.14 3dxj s THR 415 Cb 0.00 -4.33 0.00 0.00 0.01 0.00 0.00 72.50 68.18 3dxj s THR 415 CO 0.00 -1.19 1.40 -0.13 -0.69 0.00 0.00 174.62 174.01 3dxj s ARG 416 N 6.43 3.72 0.00 4.92 1.81 -1.26 -4.66 118.95 129.93 3dxj s ARG 416 Ca 0.64 1.15 0.00 0.00 -1.72 0.00 0.00 55.73 55.81 3dxj s ARG 416 Cb -0.04 -3.97 0.00 0.00 -0.45 0.00 0.00 34.95 30.48 3dxj s ARG 416 CO -0.01 -1.37 0.00 1.63 -0.68 0.00 0.00 175.30 174.87 3dxj n LYS 417 N 7.74 0.00 0.00 3.54 5.02 -1.26 -4.78 118.16 128.43 3dxj n LYS 417 Ca 0.16 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 3dxj n LYS 417 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.48 3dxj n LYS 417 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3dxj n LEU 418 N -0.26 0.00 0.28 -0.35 4.32 -1.26 -1.68 117.00 118.05 3dxj n LEU 418 Ca 0.00 0.00 0.18 0.00 -0.02 0.00 0.00 56.01 56.17 3dxj n LEU 418 Cb 0.00 0.00 0.79 0.00 -1.62 0.00 0.00 43.42 42.59 3dxj n LEU 418 CO 0.00 0.00 1.03 -0.09 -1.22 0.00 0.00 177.39 177.11 3dxj h ARG 419 N 0.00 0.00 -1.07 3.23 9.65 -1.91 -3.03 114.38 121.25 3dxj h ARG 419 Ca 0.00 0.00 -0.53 0.00 -1.10 0.00 0.00 59.98 58.35 3dxj h ARG 419 Cb 0.00 0.00 -0.26 0.00 -1.39 0.00 0.00 29.97 28.32 3dxj h ARG 419 CO 0.00 0.00 0.68 -0.25 2.80 0.00 0.00 179.97 183.20 3dxj n ASP 420 N -3.04 5.68 0.00 -3.80 8.00 -0.68 -4.82 116.55 117.89 3dxj n ASP 420 Ca -0.00 -3.52 0.00 0.00 0.71 0.00 0.00 54.79 51.98 3dxj n ASP 420 Cb 0.25 -0.91 0.00 0.00 -0.02 0.00 0.00 41.12 40.45 3dxj n ASP 420 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3dxj n PHE 421 N -0.76 0.00 0.00 1.24 7.35 -1.15 -5.18 117.46 118.96 3dxj n PHE 421 Ca 0.54 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.23 3dxj n PHE 421 Cb 1.05 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.88 3dxj n PHE 421 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28