#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 -1.36 -0.18 -5.35 -1.26 -3.33 119.36 107.88 3dxj n ILE 75 Ca 0.00 0.34 -0.40 0.00 -0.27 0.00 0.00 62.75 62.42 3dxj n ILE 75 Cb 0.00 -1.19 -0.03 0.00 -1.74 0.00 0.00 39.64 36.69 3dxj n ILE 75 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 3dxj n SER 76 N 0.00 3.84 -2.36 7.28 7.64 -1.26 -4.73 113.62 124.02 3dxj n SER 76 Ca 0.00 -2.70 -0.03 0.00 1.01 0.00 0.00 58.87 57.15 3dxj n SER 76 Cb 0.00 -1.37 -0.04 0.00 -1.01 0.00 0.00 64.21 61.79 3dxj n SER 76 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 3dxj n THR 77 N 5.25 0.73 0.00 0.44 5.66 -1.21 -4.46 114.28 120.69 3dxj n THR 77 Ca 0.53 -0.36 0.00 0.00 -3.05 0.00 0.00 64.05 61.16 3dxj n THR 77 Cb 0.36 -1.61 0.00 0.00 -1.55 0.00 0.00 70.33 67.53 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 2.84 0.00 -3.32 1.09 2.88 -1.26 -3.53 113.62 112.32 3dxj n SER 78 Ca 0.10 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.27 3dxj n SER 78 Cb 0.22 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.70 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 0.02 6.73 -0.32 -3.46 5.68 -1.26 -4.83 116.55 119.10 3dxj n ASP 79 Ca 0.00 -3.72 0.20 0.00 -0.50 0.00 0.00 54.79 50.77 3dxj n ASP 79 Cb 0.00 -1.00 0.40 0.00 -1.14 0.00 0.00 41.12 39.38 3dxj n ASP 79 CO 0.00 0.00 0.00 -0.65 -1.33 0.00 0.00 177.20 175.22 3dxj h PRO 80 N 3.68 0.16 -0.57 0.11 0.11 -1.98 -0.34 132.00 133.18 3dxj h PRO 80 Ca 0.46 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.62 3dxj h PRO 80 Cb 0.33 -0.04 -0.07 0.00 0.11 0.00 0.00 31.00 31.33 3dxj h PRO 80 CO 1.14 0.11 -0.31 1.33 -0.21 0.00 0.00 178.00 180.06 3dxj n VAL 81 N -5.22 -0.37 0.31 3.15 0.24 -1.26 0.13 118.33 115.31 3dxj n VAL 81 Ca 0.28 1.37 -0.17 0.00 -2.04 0.00 0.00 64.34 63.78 3dxj n VAL 81 Cb 0.91 -1.71 -0.09 0.00 -1.47 0.00 0.00 33.84 31.48 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 -0.85 -0.45 7.34 3.08 -1.43 0.92 114.38 123.00 3dxj h ARG 82 Ca 0.11 0.06 0.05 0.00 0.07 0.00 0.00 59.98 60.27 3dxj h ARG 82 Cb 0.26 0.19 -0.08 0.00 0.08 0.00 0.00 29.97 30.42 3dxj h ARG 82 CO -0.54 -0.56 -0.50 1.96 -1.07 0.00 0.00 179.97 179.25 3dxj h GLN 83 N -0.88 -0.29 -0.88 0.04 4.20 0.12 0.94 115.11 118.36 3dxj h GLN 83 Ca -0.06 0.02 0.09 0.00 0.06 0.00 0.00 58.65 58.76 3dxj h GLN 83 Cb 0.73 0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.51 3dxj h GLN 83 CO 0.03 -0.19 0.57 -0.92 -0.67 0.00 0.00 178.83 177.65 3dxj h TYR 84 N -0.30 0.95 0.00 2.96 3.20 0.67 -0.50 116.97 123.95 3dxj h TYR 84 Ca 0.08 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.97 3dxj h TYR 84 Cb 0.50 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.47 3dxj h TYR 84 CO -0.76 0.44 0.00 1.28 -1.64 0.00 0.00 178.16 177.48 3dxj n LEU 85 N -4.52 0.53 -1.63 2.82 4.77 0.32 -1.79 117.00 117.49 3dxj n LEU 85 Ca 0.15 -0.26 0.06 0.00 -0.03 0.00 0.00 56.01 55.93 3dxj n LEU 85 Cb 0.30 -0.10 0.34 0.00 -2.33 0.00 0.00 43.42 41.62 3dxj n LEU 85 CO 0.31 0.09 0.77 0.00 -1.33 0.00 0.00 177.39 177.24 3dxj n HIS 86 N 0.81 1.69 0.15 -1.77 1.44 -0.20 -4.08 115.22 113.26 3dxj n HIS 86 Ca 0.00 -0.59 0.01 0.00 -2.01 0.00 0.00 57.72 55.13 3dxj n HIS 86 Cb 0.09 -0.41 0.08 0.00 0.12 0.00 0.00 29.99 29.87 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 0.59 0.06 0.05 -1.40 -0.58 -0.74 0.83 120.64 119.45 3dxj n GLU 87 Ca 0.23 0.18 -0.13 0.00 -0.42 0.00 0.00 57.16 57.02 3dxj n GLU 87 Cb 1.01 -1.50 -0.14 0.00 -0.57 0.00 0.00 31.44 30.24 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 1.30 0.00 -3.67 2.10 -1.87 -3.03 117.51 112.34 3dxj h ILE 88 Ca 0.00 -2.98 0.00 0.00 1.08 0.00 0.00 64.86 62.96 3dxj h ILE 88 Cb 0.02 2.75 0.00 0.00 -1.09 0.00 0.00 36.82 38.50 3dxj h ILE 88 CO 0.00 0.82 0.00 0.61 -1.08 0.00 0.00 178.15 178.50 3dxj n GLY 89 N 1.55 -0.77 3.75 8.18 0.00 0.24 -4.50 105.19 113.64 3dxj n GLY 89 Ca -0.11 -0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 3dxj n GLY 89 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dxj s GLN 90 N -3.05 4.30 -0.67 1.61 2.00 -1.15 -5.02 119.66 117.69 3dxj s GLN 90 Ca 0.03 0.62 -0.24 0.00 -2.00 0.00 0.00 55.36 53.76 3dxj s GLN 90 Cb 0.05 -3.37 0.05 0.00 0.80 0.00 0.00 33.01 30.54 3dxj s GLN 90 CO 0.14 0.29 1.07 0.08 -0.50 0.00 0.00 175.29 176.38 3dxj s VAL 91 N 0.11 4.13 -2.00 1.34 1.01 -1.26 -4.86 120.40 118.87 3dxj s VAL 91 Ca 0.29 0.03 0.15 0.00 0.00 0.00 0.00 61.98 62.46 3dxj s VAL 91 Cb -0.17 -4.74 0.43 0.00 0.00 0.00 0.00 36.38 31.90 3dxj s VAL 91 CO 0.14 -1.53 1.43 -2.65 0.00 0.00 0.00 175.10 172.50 3dxj n PRO 92 N 8.24 0.80 0.00 2.72 -0.02 -1.26 -4.43 135.00 141.05 3dxj n PRO 92 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3dxj n PRO 92 Cb 0.47 -1.29 0.00 0.00 -0.02 0.00 0.00 33.50 32.66 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 -0.79 0.00 -3.98 2.45 7.94 -1.26 -4.63 117.00 116.73 3dxj n LEU 93 Ca 0.11 0.00 -0.35 0.00 -1.11 0.00 0.00 56.01 54.67 3dxj n LEU 93 Cb 0.05 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 43.91 3dxj n LEU 93 CO 0.08 0.00 1.56 0.18 -1.11 0.00 0.00 177.39 178.11 3dxj n LEU 94 N 0.89 2.30 -4.66 -1.96 4.77 -1.26 -4.87 117.00 112.21 3dxj n LEU 94 Ca 0.00 -2.42 -0.42 0.00 -0.03 0.00 0.00 56.01 53.15 3dxj n LEU 94 Cb 0.00 -1.18 0.00 0.00 -2.33 0.00 0.00 43.42 39.92 3dxj n LEU 94 CO 0.00 -1.90 0.77 0.41 -1.33 0.00 0.00 177.39 175.35 3dxj n THR 95 N 7.35 2.34 -0.29 -5.08 -1.04 -1.26 -4.42 114.28 111.89 3dxj n THR 95 Ca 0.46 -0.50 -0.08 0.00 -2.04 0.00 0.00 64.05 61.89 3dxj n THR 95 Cb 0.44 -1.40 -0.07 0.00 -1.82 0.00 0.00 70.33 67.48 3dxj n THR 95 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 3dxj n LEU 96 N 0.52 -0.72 -0.46 -4.42 7.94 -1.26 0.32 117.00 118.92 3dxj n LEU 96 Ca 0.07 1.32 0.38 0.00 -1.11 0.00 0.00 56.01 56.66 3dxj n LEU 96 Cb 0.38 -0.21 0.66 0.00 0.53 0.00 0.00 43.42 44.78 3dxj n LEU 96 CO 0.59 -1.04 1.25 -0.33 -1.11 0.00 0.00 177.39 176.76 3dxj h GLU 97 N 0.00 0.08 0.00 1.96 5.08 -1.98 0.70 114.58 120.42 3dxj h GLU 97 Ca 0.11 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3dxj h GLU 97 Cb 0.28 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.51 3dxj h GLU 97 CO -0.64 0.05 0.00 0.39 -1.00 0.00 0.00 179.01 177.81 3dxj n GLU 98 N -4.63 0.00 -0.34 2.33 1.02 0.97 -1.08 120.64 118.91 3dxj n GLU 98 Ca 0.37 0.48 -0.07 0.00 -0.02 0.00 0.00 57.16 57.92 3dxj n GLU 98 Cb 1.45 -1.22 -0.06 0.00 -0.02 0.00 0.00 31.44 31.59 3dxj n GLU 98 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3dxj n GLU 99 N -1.93 -0.32 0.00 3.49 1.02 -0.60 0.02 120.64 122.32 3dxj n GLU 99 Ca 0.00 1.25 0.00 0.00 -0.02 0.00 0.00 57.16 58.39 3dxj n GLU 99 Cb 0.00 -1.83 0.00 0.00 -0.02 0.00 0.00 31.44 29.59 3dxj n GLU 99 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3dxj n VAL 100 N -5.07 0.00 -0.28 2.62 0.31 0.14 0.28 118.33 116.33 3dxj n VAL 100 Ca 0.03 1.03 -0.04 0.00 -0.01 0.00 0.00 64.34 65.35 3dxj n VAL 100 Cb 0.24 -1.54 -0.03 0.00 -0.91 0.00 0.00 33.84 31.60 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 -1.10 -0.24 -0.10 5.55 2.13 0.07 0.73 120.64 127.68 3dxj n GLU 101 Ca 0.00 1.04 -0.07 0.00 0.66 0.00 0.00 57.16 58.79 3dxj n GLU 101 Cb 0.00 -1.54 -0.01 0.00 0.27 0.00 0.00 31.44 30.16 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 -0.93 0.00 4.31 5.85 0.80 -2.49 115.31 122.85 3dxj h LEU 102 Ca 0.17 0.17 0.00 0.00 0.84 0.00 0.00 57.88 59.06 3dxj h LEU 102 Cb 0.34 0.44 0.00 0.00 0.37 0.00 0.00 40.66 41.81 3dxj h LEU 102 CO -0.66 -0.30 0.00 0.00 -0.34 0.00 0.00 178.44 177.14 3dxj n ALA 103 N -2.93 -0.04 -0.29 1.25 0.00 0.22 -1.06 120.51 117.67 3dxj n ALA 103 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.54 3dxj n ALA 103 Cb 0.32 0.46 0.24 0.00 0.00 0.00 0.00 19.45 20.48 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 0.47 -0.96 0.00 0.11 -1.41 0.36 114.38 112.94 3dxj h ARG 104 Ca 0.00 -0.03 0.21 0.00 0.10 0.00 0.00 59.98 60.27 3dxj h ARG 104 Cb 0.00 -0.11 -0.08 0.00 1.11 0.00 0.00 29.97 30.89 3dxj h ARG 104 CO 0.00 0.31 0.62 0.87 0.10 0.00 0.00 179.97 181.87 3dxj h LYS 105 N 0.49 0.48 0.23 0.08 1.57 -0.63 0.58 116.57 119.37 3dxj h LYS 105 Ca 0.49 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.23 3dxj h LYS 105 Cb 0.80 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.00 3dxj h LYS 105 CO -0.44 0.32 -0.11 0.28 -0.57 0.00 0.00 179.45 178.93 3dxj h VAL 106 N 0.49 0.00 -0.89 0.50 2.07 0.81 -2.40 116.25 116.83 3dxj h VAL 106 Ca 0.53 -0.52 0.10 0.00 0.82 0.00 0.00 66.70 67.62 3dxj h VAL 106 Cb 1.19 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.83 3dxj h VAL 106 CO -0.25 0.00 -0.53 -0.33 0.02 0.00 0.00 177.57 176.48 3dxj h GLU 107 N -0.83 -0.07 -0.95 1.57 5.08 -0.29 0.52 114.58 119.62 3dxj h GLU 107 Ca -0.03 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.48 3dxj h GLU 107 Cb 0.23 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.41 3dxj h GLU 107 CO 0.05 -0.04 0.56 0.93 -1.00 0.00 0.00 179.01 179.51 3dxj h GLU 108 N -0.07 0.80 -0.98 2.33 5.08 0.02 0.22 114.58 121.98 3dxj h GLU 108 Ca 0.19 -0.05 0.12 0.00 -1.00 0.00 0.00 59.36 58.61 3dxj h GLU 108 Cb 0.48 -0.18 -0.08 0.00 0.50 0.00 0.00 28.75 29.47 3dxj h GLU 108 CO -0.89 0.53 0.62 0.78 -1.00 0.00 0.00 179.01 179.05 3dxj h GLY 109 N 0.82 1.53 0.86 -3.84 0.00 0.54 -0.74 103.07 102.25 3dxj h GLY 109 Ca 0.50 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 47.38 3dxj h GLY 109 CO -0.32 0.17 -0.41 1.98 0.00 0.00 0.00 176.54 177.96 3dxj h MET 110 N 0.96 -1.11 -0.95 4.80 1.85 0.42 -2.65 114.93 118.25 3dxj h MET 110 Ca 0.48 0.08 0.24 0.00 -0.61 0.00 0.00 59.70 59.88 3dxj h MET 110 Cb 0.48 0.25 -0.06 0.00 0.43 0.00 0.00 31.60 32.70 3dxj h MET 110 CO -0.24 -0.74 0.64 0.93 -0.40 0.00 0.00 176.91 177.10 3dxj h GLU 111 N -1.31 0.25 0.39 0.39 5.08 -1.08 0.73 114.58 119.03 3dxj h GLU 111 Ca -0.12 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 3dxj h GLU 111 Cb 0.89 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 3dxj h GLU 111 CO 0.19 0.17 -0.31 0.00 -1.00 0.00 0.00 179.01 178.06 3dxj h ALA 112 N 1.58 -1.06 -1.30 3.43 0.00 -0.95 -0.71 119.26 120.26 3dxj h ALA 112 Ca 0.49 -0.13 0.38 0.00 0.00 0.00 0.00 54.91 55.65 3dxj h ALA 112 Cb 1.47 0.49 -0.08 0.00 0.00 0.00 0.00 17.79 19.67 3dxj h ALA 112 CO -0.14 -1.06 0.90 0.82 0.00 0.00 0.00 179.25 179.77 3dxj h ILE 113 N -0.67 0.31 0.79 0.00 2.04 -0.54 0.63 117.51 120.07 3dxj h ILE 113 Ca -0.05 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.73 3dxj h ILE 113 Cb 0.56 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 3dxj h ILE 113 CO 0.01 0.02 -0.42 0.11 0.00 0.00 0.00 178.15 177.87 3dxj h LYS 114 N 0.11 -1.07 0.11 2.37 1.57 -0.12 0.22 116.57 119.76 3dxj h LYS 114 Ca 0.69 0.07 0.01 0.00 -1.87 0.00 0.00 60.65 59.55 3dxj h LYS 114 Cb 2.39 0.24 -0.04 0.00 0.08 0.00 0.00 32.23 34.90 3dxj h LYS 114 CO -0.17 -0.72 -0.41 0.87 -0.57 0.00 0.00 179.45 178.45 3dxj h LYS 115 N -1.11 -0.58 -0.46 3.15 1.79 0.13 -1.46 116.57 118.02 3dxj h LYS 115 Ca -0.11 0.04 0.04 0.00 -2.18 0.00 0.00 60.65 58.44 3dxj h LYS 115 Cb 0.87 0.13 -0.06 0.00 -1.58 0.00 0.00 32.23 31.59 3dxj h LYS 115 CO 0.15 -0.39 -0.27 1.28 -1.08 0.00 0.00 179.45 179.14 3dxj n LEU 116 N -4.81 -0.49 -0.34 2.94 4.77 0.79 0.22 117.00 120.08 3dxj n LEU 116 Ca -0.07 1.31 0.12 0.00 -0.03 0.00 0.00 56.01 57.35 3dxj n LEU 116 Cb 0.32 -0.35 0.31 0.00 -2.33 0.00 0.00 43.42 41.37 3dxj n LEU 116 CO 0.13 -0.92 1.16 0.77 -1.33 0.00 0.00 177.39 177.20 3dxj h SER 117 N 0.00 0.68 -0.40 -1.43 4.64 -0.47 0.61 113.55 117.18 3dxj h SER 117 Ca 0.07 0.11 -0.14 0.00 -0.47 0.00 0.00 61.79 61.36 3dxj h SER 117 Cb 0.19 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 3dxj h SER 117 CO -0.44 0.22 -0.29 -0.08 -0.87 0.00 0.00 176.83 175.37 3dxj h GLU 118 N 0.68 0.90 -0.00 4.77 4.81 0.10 1.88 114.58 127.72 3dxj h GLU 118 Ca 0.56 -0.43 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3dxj h GLU 118 Cb 0.91 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.28 3dxj h GLU 118 CO -0.41 1.09 -0.00 -0.89 -0.73 0.00 0.00 179.01 178.07 3dxj n ILE 119 N -4.14 0.00 -0.10 2.32 5.41 0.59 -3.39 119.36 120.05 3dxj n ILE 119 Ca -0.02 -0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.73 3dxj n ILE 119 Cb 0.49 -0.49 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 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 -1.08 0.00 -0.86 1.39 -1.04 0.18 -4.99 114.28 107.88 3dxj n THR 120 Ca 0.21 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 3dxj n THR 120 Cb 0.15 1.10 0.00 0.00 -1.82 0.00 0.00 70.33 69.76 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 0.23 0.21 3.73 3.41 0.00 0.63 -4.95 105.19 108.45 3dxj n GLY 121 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 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 0.00 4.32 -0.41 0.99 1.43 -0.71 -4.96 118.68 119.35 3dxj s LEU 122 Ca 0.00 1.06 -0.44 0.00 -1.03 0.00 0.00 54.13 53.72 3dxj s LEU 122 Cb 0.00 -2.93 -0.18 0.00 0.03 0.00 0.00 46.19 43.11 3dxj s LEU 122 CO 0.00 -0.04 1.67 0.47 0.23 0.00 0.00 176.35 178.67 3dxj n ASP 123 N 3.57 1.69 -0.34 2.29 8.00 -1.26 -4.24 116.55 126.26 3dxj n ASP 123 Ca -0.04 1.14 -0.09 0.00 0.71 0.00 0.00 54.79 56.51 3dxj n ASP 123 Cb 0.51 -0.99 -0.08 0.00 -0.02 0.00 0.00 41.12 40.55 3dxj n ASP 123 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3dxj n PRO 124 N 4.62 -0.36 -0.19 -0.24 -0.02 -1.26 -0.68 135.00 136.86 3dxj n PRO 124 Ca 0.29 1.41 -0.03 0.00 -2.02 0.00 0.00 63.50 63.16 3dxj n PRO 124 Cb 0.02 -2.08 0.04 0.00 -0.02 0.00 0.00 33.50 31.45 3dxj n PRO 124 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 3dxj h ASP 125 N 0.00 -0.78 -1.14 2.55 2.03 -1.94 0.31 116.42 117.44 3dxj h ASP 125 Ca 0.13 0.20 0.33 0.00 -0.73 0.00 0.00 57.03 56.96 3dxj h ASP 125 Cb 0.34 0.45 -0.10 0.00 -0.83 0.00 0.00 39.33 39.18 3dxj h ASP 125 CO -0.77 -0.25 0.74 0.25 -1.03 0.00 0.00 179.24 178.18 3dxj h LEU 126 N -0.08 0.36 0.24 0.15 5.85 -1.24 0.38 115.31 120.96 3dxj h LEU 126 Ca 0.27 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 59.07 3dxj h LEU 126 Cb 0.49 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.58 3dxj h LEU 126 CO -0.64 -0.01 -0.11 0.40 -0.34 0.00 0.00 178.44 177.74 3dxj h ILE 127 N 0.27 0.00 0.00 4.05 2.04 0.08 -3.11 117.51 120.84 3dxj h ILE 127 Ca 0.67 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 66.04 3dxj h ILE 127 Cb 1.91 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.99 3dxj h ILE 127 CO -0.33 0.00 0.20 0.08 0.00 0.00 0.00 178.15 178.10 3dxj h ARG 128 N -0.81 0.00 -0.38 2.37 0.11 -0.81 1.92 114.38 116.79 3dxj h ARG 128 Ca -0.03 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 59.98 3dxj h ARG 128 Cb 0.24 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.31 3dxj h ARG 128 CO 0.05 0.00 -0.06 1.49 0.10 0.00 0.00 179.97 181.55 3dxj h GLU 129 N 0.00 0.63 0.05 0.08 4.57 -0.23 -2.03 114.58 117.65 3dxj h GLU 129 Ca 0.00 -0.17 -0.21 0.00 -1.18 0.00 0.00 59.36 57.79 3dxj h GLU 129 Cb 0.41 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 3dxj h GLU 129 CO 0.00 0.70 -1.13 0.28 -1.18 0.00 0.00 179.01 177.68 3dxj h VAL 130 N 0.59 1.11 -0.88 0.32 2.07 0.29 -3.29 116.25 116.45 3dxj h VAL 130 Ca 0.11 -2.31 0.08 0.00 0.82 0.00 0.00 66.70 65.40 3dxj h VAL 130 Cb 0.47 2.65 -0.11 0.00 -1.52 0.00 0.00 31.29 32.78 3dxj h VAL 130 CO 0.02 0.55 -0.52 0.52 0.02 0.00 0.00 177.57 178.16 3dxj n VAL 131 N -4.22 -0.60 0.00 2.57 0.31 0.73 -1.73 118.33 115.39 3dxj n VAL 131 Ca -0.25 2.25 0.00 0.00 -0.01 0.00 0.00 64.34 66.33 3dxj n VAL 131 Cb 0.75 -2.79 0.00 0.00 -0.91 0.00 0.00 33.84 30.89 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 -5.03 0.00 -0.07 5.55 1.74 -0.77 -2.94 116.66 115.14 3dxj n ARG 132 Ca 0.02 0.71 -0.02 0.00 -0.77 0.00 0.00 57.85 57.79 3dxj n ARG 132 Cb 0.23 -1.45 -0.02 0.00 -1.02 0.00 0.00 32.46 30.20 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 -2.35 -0.11 0.12 7.54 0.00 -0.71 0.24 120.51 125.24 3dxj n ALA 133 Ca 0.00 0.15 0.06 0.00 0.00 0.00 0.00 53.44 53.66 3dxj n ALA 133 Cb 0.00 -0.03 0.53 0.00 0.00 0.00 0.00 19.45 19.96 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 0.27 0.18 0.00 1.79 -1.36 -1.65 116.57 115.80 3dxj h LYS 134 Ca 0.03 -0.02 -0.35 0.00 -2.18 0.00 0.00 60.65 58.14 3dxj h LYS 134 Cb 0.07 -0.06 0.01 0.00 -1.58 0.00 0.00 32.23 30.67 3dxj h LYS 134 CO -0.17 0.18 -1.71 0.82 -1.08 0.00 0.00 179.45 177.49 3dxj h ILE 135 N 0.28 0.99 0.00 1.86 2.04 0.33 -3.18 117.51 119.82 3dxj h ILE 135 Ca 0.09 -2.57 0.00 0.00 1.00 0.00 0.00 64.86 63.38 3dxj h ILE 135 Cb 0.01 2.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 3dxj h ILE 135 CO -0.02 0.85 0.00 0.18 0.00 0.00 0.00 178.15 179.16 3dxj n LEU 136 N -3.58 0.00 -0.79 1.44 4.77 0.12 -4.92 117.00 114.04 3dxj n LEU 136 Ca -0.23 0.01 0.02 0.00 -0.03 0.00 0.00 56.01 55.78 3dxj n LEU 136 Cb 1.07 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 42.14 3dxj n LEU 136 CO 0.52 -0.01 -0.27 0.61 -1.33 0.00 0.00 177.39 176.91 3dxj n GLY 137 N -0.46 -3.35 0.11 -0.72 0.00 -0.67 -3.82 105.19 96.29 3dxj n GLY 137 Ca 0.06 -1.11 0.15 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.36 0.40 0.28 1.61 2.88 -1.26 -2.63 113.62 112.55 3dxj n SER 138 Ca -0.01 -0.76 0.16 0.00 -1.33 0.00 0.00 58.87 56.93 3dxj n SER 138 Cb 0.28 -0.07 0.75 0.00 -0.75 0.00 0.00 64.21 64.41 3dxj n SER 138 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3dxj h ALA 139 N 3.80 1.04 0.00 -1.46 0.00 -1.91 -2.83 119.26 117.90 3dxj h ALA 139 Ca 0.00 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 3dxj h ALA 139 Cb 0.26 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3dxj h ALA 139 CO 0.00 0.06 -2.09 -2.13 0.00 0.00 0.00 179.25 175.10 3dxj n ARG 140 N -3.21 0.68 -1.71 0.00 0.63 -1.08 -4.98 116.66 106.98 3dxj n ARG 140 Ca -0.00 -0.14 -0.57 0.00 -0.92 0.00 0.00 57.85 56.21 3dxj n ARG 140 Cb 0.28 -1.51 -0.07 0.00 0.45 0.00 0.00 32.46 31.60 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 -2.38 0.31 -1.37 5.15 0.24 -1.07 -4.72 118.33 114.48 3dxj n VAL 141 Ca -0.12 -0.06 -0.53 0.00 -2.04 0.00 0.00 64.34 61.60 3dxj n VAL 141 Cb 0.72 -1.24 -0.10 0.00 -1.47 0.00 0.00 33.84 31.76 3dxj n VAL 141 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 3dxj n ARG 142 N 5.39 0.51 -0.20 7.34 1.85 -1.26 -4.77 116.66 125.52 3dxj n ARG 142 Ca 0.26 0.12 0.31 0.00 -1.00 0.00 0.00 57.85 57.54 3dxj n ARG 142 Cb 0.13 -2.00 0.69 0.00 -1.05 0.00 0.00 32.46 30.23 3dxj n ARG 142 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 3dxj h HIS 143 N 11.26 0.00 -2.58 2.89 -0.00 -1.97 -3.05 115.15 121.70 3dxj h HIS 143 Ca -0.17 0.00 -0.59 0.00 -0.00 0.00 0.00 60.37 59.61 3dxj h HIS 143 Cb 1.36 0.00 -0.39 0.00 -0.00 0.00 0.00 27.41 28.38 3dxj h HIS 143 CO 0.98 0.00 -0.86 0.96 -0.00 0.00 0.00 177.93 179.01 3dxj s ILE 144 N -4.72 0.33 0.31 6.26 -4.36 -1.26 -4.96 121.20 112.80 3dxj s ILE 144 Ca -0.04 -2.02 0.08 0.00 -0.26 0.00 0.00 60.65 58.41 3dxj s ILE 144 Cb 0.19 -1.25 0.32 0.00 1.25 0.00 0.00 42.46 42.97 3dxj s ILE 144 CO 0.66 -1.03 1.66 1.55 0.24 0.00 0.00 174.94 178.02 3dxj h PRO 145 N 6.68 0.29 0.00 0.37 0.13 -1.79 -3.36 132.00 134.32 3dxj h PRO 145 Ca 0.10 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 3dxj h PRO 145 Cb 0.95 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.01 3dxj h PRO 145 CO 0.31 0.19 0.00 0.41 -0.23 0.00 0.00 178.00 178.68 3dxj n GLY 146 N -1.33 -0.23 3.19 1.56 0.00 -1.26 -4.82 105.19 102.29 3dxj n GLY 146 Ca 0.26 0.11 -0.10 0.00 0.00 0.00 0.00 46.02 46.30 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 -6.00 0.00 0.99 4.77 -1.26 -3.49 117.00 112.01 3dxj n LEU 147 Ca 0.00 -0.47 0.00 0.00 -0.03 0.00 0.00 56.01 55.51 3dxj n LEU 147 Cb 0.00 -3.22 0.00 0.00 -2.33 0.00 0.00 43.42 37.87 3dxj n LEU 147 CO 0.00 -0.37 0.00 0.29 -1.33 0.00 0.00 177.39 175.98 3dxj n LYS 148 N -2.68 0.00 0.00 3.23 5.02 -1.26 -5.01 118.16 117.45 3dxj n LYS 148 Ca -0.05 0.41 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 3dxj n LYS 148 Cb 0.57 -3.38 0.00 0.00 -0.02 0.00 0.00 35.03 32.21 3dxj n LYS 148 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3dxj n GLU 149 N -2.85 0.00 -3.60 1.97 1.02 -1.23 -4.59 120.64 111.36 3dxj n GLU 149 Ca 0.00 0.26 -0.39 0.00 -0.02 0.00 0.00 57.16 57.01 3dxj n GLU 149 Cb 0.00 -1.25 -0.11 0.00 -0.02 0.00 0.00 31.44 30.05 3dxj n GLU 149 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3dxj s THR 150 N -2.02 4.91 -0.86 2.62 2.01 -1.26 -4.95 115.64 116.08 3dxj s THR 150 Ca 0.00 -0.32 -0.25 0.00 0.31 0.00 0.00 61.69 61.43 3dxj s THR 150 Cb 0.00 -3.50 -0.20 0.00 0.01 0.00 0.00 72.50 68.81 3dxj s THR 150 CO 0.00 0.04 1.92 0.18 -0.69 0.00 0.00 174.62 176.07 3dxj n LEU 151 N 5.04 2.38 0.32 4.42 4.77 -1.26 -4.60 117.00 128.07 3dxj n LEU 151 Ca -0.13 -2.62 0.20 0.00 -0.03 0.00 0.00 56.01 53.43 3dxj n LEU 151 Cb 0.49 -1.39 1.10 0.00 -2.33 0.00 0.00 43.42 41.29 3dxj n LEU 151 CO 0.35 -2.12 1.17 0.44 -1.33 0.00 0.00 177.39 175.89 3dxj h ASP 152 N 9.98 0.00 0.10 -1.43 3.32 -1.93 -1.15 116.42 125.31 3dxj h ASP 152 Ca 0.20 0.00 -0.37 0.00 0.02 0.00 0.00 57.03 56.88 3dxj h ASP 152 Cb 0.86 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.38 3dxj h ASP 152 CO 1.45 0.00 -2.08 -0.81 -1.72 0.00 0.00 179.24 176.09 3dxj n PRO 153 N -3.24 0.74 0.00 3.56 -0.04 -1.26 -4.63 135.00 130.13 3dxj n PRO 153 Ca -0.03 0.25 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 3dxj n PRO 153 Cb 0.13 -1.68 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 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 -3.46 0.00 -0.24 0.54 5.02 -0.94 -4.63 118.16 114.45 3dxj n LYS 154 Ca -0.34 0.00 0.20 0.00 -2.02 0.00 0.00 58.31 56.14 3dxj n LYS 154 Cb 1.03 0.00 0.32 0.00 -0.02 0.00 0.00 35.03 36.37 3dxj n LYS 154 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3dxj n THR 155 N 0.00 -0.09 0.05 -0.18 -1.04 -1.10 -1.18 114.28 110.74 3dxj n THR 155 Ca 0.00 0.79 -0.08 0.00 -2.04 0.00 0.00 64.05 62.72 3dxj n THR 155 Cb 0.00 -1.29 -0.05 0.00 -1.82 0.00 0.00 70.33 67.17 3dxj n THR 155 CO 0.00 0.00 0.00 -0.37 -0.64 0.00 0.00 175.07 174.06 3dxj h VAL 156 N 0.00 0.00 -0.03 12.58 -1.51 -1.49 -3.02 116.25 122.79 3dxj h VAL 156 Ca 0.41 0.00 0.02 0.00 -1.23 0.00 0.00 66.70 65.89 3dxj h VAL 156 Cb 1.38 0.00 -0.05 0.00 -2.13 0.00 0.00 31.29 30.49 3dxj h VAL 156 CO -0.17 0.00 -0.45 -0.33 -1.23 0.00 0.00 177.57 175.39 3dxj h GLU 157 N -0.36 -0.53 -0.24 5.19 3.07 -1.41 -1.69 114.58 118.62 3dxj h GLU 157 Ca -0.00 0.04 0.03 0.00 -0.50 0.00 0.00 59.36 58.92 3dxj h GLU 157 Cb 0.36 0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 28.36 3dxj h GLU 157 CO -0.14 -0.35 -0.12 0.39 -1.40 0.00 0.00 179.01 177.39 3dxj n GLU 158 N -4.96 -0.08 0.00 2.33 1.02 -1.20 0.83 120.64 118.58 3dxj n GLU 158 Ca -0.06 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.45 3dxj n GLU 158 Cb 0.33 -0.54 0.00 0.00 -0.02 0.00 0.00 31.44 31.21 3dxj n GLU 158 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3dxj n ILE 159 N -4.33 0.00 0.00 -3.67 2.08 -0.64 -1.71 119.36 111.09 3dxj n ILE 159 Ca 0.01 1.02 0.00 0.00 0.56 0.00 0.00 62.75 64.34 3dxj n ILE 159 Cb 0.08 -1.56 0.00 0.00 -0.75 0.00 0.00 39.64 37.41 3dxj n ILE 159 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 3dxj n ASP 160 N -1.03 0.00 -0.37 4.38 8.00 0.24 0.88 116.55 128.65 3dxj n ASP 160 Ca 0.00 0.53 0.29 0.00 0.71 0.00 0.00 54.79 56.33 3dxj n ASP 160 Cb 0.00 -0.25 0.59 0.00 -0.02 0.00 0.00 41.12 41.44 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 0.23 0.24 -1.24 7.50 -1.45 1.04 115.11 121.44 3dxj h GLN 161 Ca 0.00 -0.01 -0.01 0.00 0.50 0.00 0.00 58.65 59.12 3dxj h GLN 161 Cb 0.00 -0.05 0.00 0.00 0.05 0.00 0.00 27.48 27.48 3dxj h GLN 161 CO 0.00 0.15 -0.12 0.87 -1.50 0.00 0.00 178.83 178.24 3dxj h LYS 162 N 0.24 -0.31 0.56 1.46 1.57 0.14 0.71 116.57 120.94 3dxj h LYS 162 Ca 0.66 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.45 3dxj h LYS 162 Cb 1.97 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 34.34 3dxj h LYS 162 CO -0.29 -0.11 -0.44 -0.07 -0.57 0.00 0.00 179.45 177.97 3dxj h LEU 163 N -0.46 -1.16 -1.66 2.94 3.38 0.20 -2.21 115.31 116.33 3dxj h LEU 163 Ca -0.03 0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.09 3dxj h LEU 163 Cb 0.35 0.37 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 3dxj h LEU 163 CO 0.05 -0.63 0.35 0.11 0.09 0.00 0.00 178.44 178.41 3dxj h LYS 164 N -0.98 0.39 0.00 1.13 1.57 0.46 0.35 116.57 119.49 3dxj h LYS 164 Ca -0.07 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3dxj h LYS 164 Cb 0.83 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.05 3dxj h LYS 164 CO 0.01 0.26 0.00 -1.13 -0.57 0.00 0.00 179.45 178.01 3dxj n SER 165 N -4.47 0.00 -4.84 0.86 3.41 0.25 -4.78 113.62 104.04 3dxj n SER 165 Ca 0.08 -1.39 -0.34 0.00 -0.26 0.00 0.00 58.87 56.96 3dxj n SER 165 Cb 0.30 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.19 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 -1.19 4.21 0.55 1.04 1.43 0.12 -5.02 118.68 119.82 3dxj s LEU 166 Ca 0.07 1.21 -0.20 0.00 -1.03 0.00 0.00 54.13 54.17 3dxj s LEU 166 Cb 0.03 -3.70 -0.07 0.00 0.03 0.00 0.00 46.19 42.48 3dxj s LEU 166 CO 0.05 -0.05 0.97 -2.65 0.23 0.00 0.00 176.35 174.90 3dxj n PRO 167 N 0.21 1.05 -0.14 1.29 -0.02 -1.26 -4.29 135.00 131.84 3dxj n PRO 167 Ca -0.00 0.39 -0.04 0.00 -2.02 0.00 0.00 63.50 61.83 3dxj n PRO 167 Cb 0.52 -2.12 -0.03 0.00 -0.02 0.00 0.00 33.50 31.85 3dxj n PRO 167 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3dxj n LYS 168 N -0.61 -0.14 -0.27 -0.52 5.02 -1.26 -0.79 118.16 119.58 3dxj n LYS 168 Ca 0.12 1.01 0.24 0.00 -2.02 0.00 0.00 58.31 57.66 3dxj n LYS 168 Cb 0.45 -1.49 0.41 0.00 -0.02 0.00 0.00 35.03 34.37 3dxj n LYS 168 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3dxj n GLU 169 N -3.71 -0.02 -0.09 1.97 4.71 -1.26 0.70 120.64 122.94 3dxj n GLU 169 Ca 0.01 0.79 -0.22 0.00 -0.01 0.00 0.00 57.16 57.72 3dxj n GLU 169 Cb 0.09 -1.52 -0.12 0.00 -1.01 0.00 0.00 31.44 28.87 3dxj n GLU 169 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 3dxj n HIS 170 N -3.99 0.48 0.29 -0.32 8.25 0.03 -4.28 115.22 115.67 3dxj n HIS 170 Ca 0.25 0.13 0.18 0.00 -0.26 0.00 0.00 57.72 58.02 3dxj n HIS 170 Cb 0.94 -1.06 0.91 0.00 1.12 0.00 0.00 29.99 31.90 3dxj n HIS 170 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3dxj h LYS 171 N -0.32 0.00 -0.44 -0.41 3.64 0.24 -2.10 116.57 117.18 3dxj h LYS 171 Ca -0.53 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.80 3dxj h LYS 171 Cb 1.80 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.60 3dxj h LYS 171 CO -0.13 0.00 0.10 0.07 -2.27 0.00 0.00 179.45 177.22 3dxj h ARG 172 N 0.00 0.70 -0.44 1.90 0.11 -1.24 -2.48 114.38 112.93 3dxj h ARG 172 Ca 0.04 -0.17 0.13 0.00 0.10 0.00 0.00 59.98 60.07 3dxj h ARG 172 Cb 0.51 -0.09 -0.02 0.00 1.11 0.00 0.00 29.97 31.48 3dxj h ARG 172 CO -0.00 0.71 0.32 1.88 0.10 0.00 0.00 179.97 182.98 3dxj h TYR 173 N 0.57 0.00 0.49 4.08 0.99 -1.62 -1.62 116.97 119.86 3dxj h TYR 173 Ca 0.14 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.84 3dxj h TYR 173 Cb 0.32 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.05 3dxj h TYR 173 CO 0.02 0.00 -0.28 1.25 -0.00 0.00 0.00 178.16 179.15 3dxj h LEU 174 N 0.00 -0.70 -0.89 3.88 5.85 -1.54 0.57 115.31 122.49 3dxj h LEU 174 Ca 0.21 0.03 0.19 0.00 0.84 0.00 0.00 57.88 59.16 3dxj h LEU 174 Cb 0.85 0.20 -0.11 0.00 0.37 0.00 0.00 40.66 41.97 3dxj h LEU 174 CO -0.00 -0.44 0.43 0.45 -0.34 0.00 0.00 178.44 178.53 3dxj h HIS 175 N -0.72 0.73 -0.21 1.25 3.86 -1.42 0.98 115.15 119.62 3dxj h HIS 175 Ca -0.07 0.04 0.03 0.00 -1.16 0.00 0.00 60.37 59.21 3dxj h HIS 175 Cb 0.57 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 28.82 3dxj h HIS 175 CO 0.02 0.05 0.03 0.82 0.86 0.00 0.00 177.93 179.71 3dxj h ILE 176 N 0.50 0.89 -0.64 2.45 2.04 -0.97 0.20 117.51 121.98 3dxj h ILE 176 Ca 0.53 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 66.33 3dxj h ILE 176 Cb 0.92 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 3dxj h ILE 176 CO -0.46 0.02 0.32 0.00 0.00 0.00 0.00 178.15 178.03 3dxj h ALA 177 N 1.16 0.83 -0.05 1.87 0.00 0.33 0.55 119.26 123.95 3dxj h ALA 177 Ca 0.10 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3dxj h ALA 177 Cb 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3dxj h ALA 177 CO -0.14 0.38 -0.20 0.00 0.00 0.00 0.00 179.25 179.29 3dxj h ARG 178 N 0.88 -0.20 -0.46 0.00 2.47 0.23 0.07 114.38 117.37 3dxj h ARG 178 Ca 0.22 0.01 -0.03 0.00 -1.26 0.00 0.00 59.98 58.93 3dxj h ARG 178 Cb 0.10 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 28.45 3dxj h ARG 178 CO -0.03 -0.14 0.16 0.93 0.56 0.00 0.00 179.97 181.45 3dxj h GLU 179 N -0.21 0.66 0.20 0.04 5.08 -0.55 -1.42 114.58 118.38 3dxj h GLU 179 Ca 0.01 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 3dxj h GLU 179 Cb 0.25 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 3dxj h GLU 179 CO -0.16 0.57 -0.42 0.78 -1.00 0.00 0.00 179.01 178.78 3dxj h GLY 180 N 0.83 -1.17 1.36 -3.84 0.00 0.91 1.44 103.07 102.60 3dxj h GLY 180 Ca 0.16 0.60 -0.02 0.00 0.00 0.00 0.00 47.33 48.06 3dxj h GLY 180 CO -0.01 -0.32 0.28 -2.09 0.00 0.00 0.00 176.54 174.40 3dxj h GLU 181 N -0.67 0.83 -0.04 4.80 4.57 -0.92 -1.38 114.58 121.77 3dxj h GLU 181 Ca -0.02 -0.10 -0.00 0.00 -1.18 0.00 0.00 59.36 58.05 3dxj h GLU 181 Cb 0.64 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 29.07 3dxj h GLU 181 CO -0.17 0.65 0.02 0.00 -1.18 0.00 0.00 179.01 178.33 3dxj h ALA 182 N 1.48 0.06 -0.57 2.92 0.00 -0.73 -2.84 119.26 119.57 3dxj h ALA 182 Ca 0.21 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.14 3dxj h ALA 182 Cb 0.09 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.76 3dxj h ALA 182 CO -0.03 -0.40 -0.51 0.00 0.00 0.00 0.00 179.25 178.32 3dxj h ALA 183 N 0.92 -0.54 -0.04 0.00 0.00 0.29 -2.51 119.26 117.37 3dxj h ALA 183 Ca 0.02 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3dxj h ALA 183 Cb 0.10 1.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 3dxj h ALA 183 CO -0.00 -0.94 -0.03 -2.13 0.00 0.00 0.00 179.25 176.15 3dxj n ARG 184 N -5.37 -0.02 -0.01 0.00 0.63 -0.60 -1.69 116.66 109.60 3dxj n ARG 184 Ca -0.00 0.63 -0.00 0.00 -0.92 0.00 0.00 57.85 57.56 3dxj n ARG 184 Cb 0.33 -0.94 -0.00 0.00 0.45 0.00 0.00 32.46 32.30 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 -2.76 -0.01 -0.39 -0.14 1.13 -0.94 -1.19 117.38 113.07 3dxj n GLN 185 Ca 0.00 0.67 -0.10 0.00 -1.94 0.00 0.00 57.00 55.62 3dxj n GLN 185 Cb 0.01 -1.00 -0.09 0.00 0.11 0.00 0.00 30.24 29.27 3dxj n GLN 185 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 3dxj n HIS 186 N -2.71 -0.41 -0.25 1.08 8.25 -0.68 -0.36 115.22 120.14 3dxj n HIS 186 Ca 0.00 1.16 0.01 0.00 -0.26 0.00 0.00 57.72 58.62 3dxj n HIS 186 Cb 0.00 -0.57 0.08 0.00 1.12 0.00 0.00 29.99 30.62 3dxj n HIS 186 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3dxj h LEU 187 N 0.00 -0.75 0.00 2.41 5.85 -0.93 0.47 115.31 122.36 3dxj h LEU 187 Ca 0.15 0.22 0.00 0.00 0.84 0.00 0.00 57.88 59.09 3dxj h LEU 187 Cb 0.38 0.48 0.00 0.00 0.37 0.00 0.00 40.66 41.89 3dxj h LEU 187 CO -0.87 -0.25 0.00 -0.38 -0.34 0.00 0.00 178.44 176.60 3dxj n ILE 188 N -5.48 0.00 -0.25 4.05 5.41 0.51 -2.39 119.36 121.21 3dxj n ILE 188 Ca 0.09 1.43 -0.05 0.00 1.00 0.00 0.00 62.75 65.23 3dxj n ILE 188 Cb 0.38 -2.25 -0.03 0.00 -0.71 0.00 0.00 39.64 37.02 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 -2.12 -0.22 0.00 0.38 1.02 -0.13 0.16 120.64 119.73 3dxj n GLU 189 Ca 0.00 0.93 0.00 0.00 -0.02 0.00 0.00 57.16 58.07 3dxj n GLU 189 Cb 0.00 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 3dxj n GLU 189 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dxj n ALA 190 N -3.59 1.42 0.00 0.62 0.00 0.15 -1.66 120.51 117.45 3dxj n ALA 190 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3dxj n ALA 190 Cb 0.19 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.70 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 -0.69 0.04 -0.51 0.00 3.02 0.43 -4.79 115.26 112.76 3dxj n ASN 191 Ca 0.00 -0.09 0.42 0.00 -0.03 0.00 0.00 54.58 54.88 3dxj n ASN 191 Cb 0.00 0.20 0.74 0.00 -0.61 0.00 0.00 39.78 40.11 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 0.00 0.10 -0.50 3.41 3.38 -0.79 1.28 115.31 122.19 3dxj h LEU 192 Ca 0.00 0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.88 3dxj h LEU 192 Cb 0.00 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3dxj h LEU 192 CO 0.00 -0.05 -0.27 -0.09 0.09 0.00 0.00 178.44 178.12 3dxj h ARG 193 N 0.05 0.94 -0.90 1.13 2.43 -1.87 -2.38 114.38 113.79 3dxj h ARG 193 Ca 0.79 -0.43 0.09 0.00 -0.81 0.00 0.00 59.98 59.62 3dxj h ARG 193 Cb 2.92 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 32.38 3dxj h ARG 193 CO -0.15 1.09 0.54 1.25 -1.51 0.00 0.00 179.97 181.20 3dxj h LEU 194 N 0.80 0.81 0.38 3.80 7.12 0.13 -1.07 115.31 127.29 3dxj h LEU 194 Ca 0.09 0.04 -0.01 0.00 0.13 0.00 0.00 57.88 58.13 3dxj h LEU 194 Cb 0.84 -0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.84 3dxj h LEU 194 CO 0.07 0.48 -0.25 0.58 -0.13 0.00 0.00 178.44 179.19 3dxj h VAL 195 N 0.92 0.47 -0.09 1.05 2.07 -1.18 -2.99 116.25 116.51 3dxj h VAL 195 Ca 0.42 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.95 3dxj h VAL 195 Cb 0.33 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 3dxj h VAL 195 CO -0.23 0.00 -0.07 0.58 0.02 0.00 0.00 177.57 177.88 3dxj h VAL 196 N -0.62 0.00 -0.91 2.57 2.07 -0.73 -0.32 116.25 118.31 3dxj h VAL 196 Ca -0.04 0.00 0.32 0.00 0.82 0.00 0.00 66.70 67.80 3dxj h VAL 196 Cb 0.52 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.12 3dxj h VAL 196 CO 0.03 0.00 0.26 -1.54 0.02 0.00 0.00 177.57 176.34 3dxj n SER 197 N -3.18 0.11 0.10 0.57 3.41 -0.67 -1.29 113.62 112.67 3dxj n SER 197 Ca 0.00 1.53 -0.12 0.00 -0.26 0.00 0.00 58.87 60.03 3dxj n SER 197 Cb 0.03 -0.66 -0.08 0.00 -0.26 0.00 0.00 64.21 63.25 3dxj n SER 197 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 3dxj h ILE 198 N 0.00 0.79 -0.94 -1.33 2.04 -0.95 -3.30 117.51 113.82 3dxj h ILE 198 Ca 0.67 -0.89 0.28 0.00 1.00 0.00 0.00 64.86 65.92 3dxj h ILE 198 Cb 1.61 1.25 -0.16 0.00 -0.74 0.00 0.00 36.82 38.77 3dxj h ILE 198 CO -0.78 0.17 0.20 0.00 0.00 0.00 0.00 178.15 177.75 3dxj h ALA 199 N -0.23 1.39 -0.99 1.87 0.00 -0.13 0.50 119.26 121.66 3dxj h ALA 199 Ca -0.03 0.28 0.34 0.00 0.00 0.00 0.00 54.91 55.50 3dxj h ALA 199 Cb 0.51 0.43 -0.16 0.00 0.00 0.00 0.00 17.79 18.57 3dxj h ALA 199 CO 0.05 -0.59 0.47 0.87 0.00 0.00 0.00 179.25 180.05 3dxj h LYS 200 N 0.09 0.16 -0.33 0.00 1.57 -1.58 0.36 116.57 116.83 3dxj h LYS 200 Ca 0.62 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 59.34 3dxj h LYS 200 Cb 1.36 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.61 3dxj h LYS 200 CO -0.78 0.10 -0.03 0.87 -0.57 0.00 0.00 179.45 179.04 3dxj h LYS 201 N 0.16 0.53 -0.77 3.15 6.56 -1.08 -2.96 116.57 122.16 3dxj h LYS 201 Ca 0.74 -0.12 0.00 0.00 -1.06 0.00 0.00 60.65 60.21 3dxj h LYS 201 Cb 1.78 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 33.37 3dxj h LYS 201 CO -0.70 0.58 0.00 0.66 -2.06 0.00 0.00 179.45 177.93 3dxj n TYR 202 N -4.26 0.49 -1.39 -1.35 4.02 0.11 -4.93 117.16 109.85 3dxj n TYR 202 Ca 0.01 -0.18 -0.32 0.00 -0.01 0.00 0.00 57.90 57.41 3dxj n TYR 202 Cb 0.27 -0.17 0.08 0.00 -0.02 0.00 0.00 39.34 39.50 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 -1.50 3.07 0.00 -0.72 2.01 -1.12 -3.31 115.64 114.06 3dxj s THR 203 Ca 0.14 0.41 0.00 0.00 0.31 0.00 0.00 61.69 62.55 3dxj s THR 203 Cb 0.10 -2.87 0.00 0.00 0.01 0.00 0.00 72.50 69.74 3dxj s THR 203 CO 0.05 -0.39 0.00 0.61 -0.69 0.00 0.00 174.62 174.20 3dxj n GLY 204 N -0.67 1.84 0.32 4.40 0.00 -1.26 -4.75 105.19 105.07 3dxj n GLY 204 Ca 0.10 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.27 3dxj n GLY 204 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3dxj h ARG 205 N 0.32 0.00 0.00 1.61 3.08 -1.93 -3.43 114.38 114.02 3dxj h ARG 205 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dxj h ARG 205 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3dxj h ARG 205 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 3dxj n GLY 206 N -1.22 0.61 0.00 0.04 0.00 -1.26 -5.09 105.19 98.27 3dxj n GLY 206 Ca -0.02 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.71 3dxj n GLY 206 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3dxj n LEU 207 N 0.00 0.00 -4.71 0.99 7.94 -1.26 -4.68 117.00 115.28 3dxj n LEU 207 Ca 0.00 0.00 -0.56 0.00 -1.11 0.00 0.00 56.01 54.34 3dxj n LEU 207 Cb 0.00 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 43.88 3dxj n LEU 207 CO 0.00 0.00 1.37 -0.24 -1.11 0.00 0.00 177.39 177.41 3dxj n SER 208 N 0.00 2.64 -0.29 1.96 2.88 -1.26 -4.75 113.62 114.81 3dxj n SER 208 Ca 0.00 1.05 0.08 0.00 -1.33 0.00 0.00 58.87 58.67 3dxj n SER 208 Cb 0.00 -1.19 0.16 0.00 -0.75 0.00 0.00 64.21 62.43 3dxj n SER 208 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 3dxj n PHE 209 N 5.71 0.37 0.03 0.66 7.35 -1.26 0.93 117.46 131.25 3dxj n PHE 209 Ca 0.26 0.98 -0.13 0.00 -0.76 0.00 0.00 57.45 57.80 3dxj n PHE 209 Cb 0.17 -1.02 -0.08 0.00 0.35 0.00 0.00 39.48 38.90 3dxj n PHE 209 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 3dxj h LEU 210 N 0.00 -1.38 -0.69 -2.13 3.38 -1.99 0.26 115.31 112.76 3dxj h LEU 210 Ca 0.42 0.16 0.09 0.00 0.09 0.00 0.00 57.88 58.64 3dxj h LEU 210 Cb 0.74 0.53 -0.11 0.00 0.09 0.00 0.00 40.66 41.91 3dxj h LEU 210 CO -0.80 -0.42 -0.49 0.44 0.09 0.00 0.00 178.44 177.27 3dxj h ASP 211 N -0.52 -1.70 -0.42 -0.43 3.32 0.22 0.56 116.42 117.43 3dxj h ASP 211 Ca 0.02 0.27 0.06 0.00 0.02 0.00 0.00 57.03 57.39 3dxj h ASP 211 Cb 0.58 0.77 -0.09 0.00 0.22 0.00 0.00 39.33 40.81 3dxj h ASP 211 CO -0.32 -0.32 -0.52 -0.07 -1.72 0.00 0.00 179.24 176.29 3dxj h LEU 212 N -0.18 -1.73 -0.11 1.55 3.38 -0.47 0.19 115.31 117.93 3dxj h LEU 212 Ca 0.18 0.24 0.02 0.00 0.09 0.00 0.00 57.88 58.40 3dxj h LEU 212 Cb 0.54 0.73 -0.03 0.00 0.09 0.00 0.00 40.66 41.99 3dxj h LEU 212 CO -0.76 -0.39 -0.20 0.40 0.09 0.00 0.00 178.44 177.57 3dxj h ILE 213 N -0.37 0.00 -1.09 1.22 2.04 0.32 0.96 117.51 120.58 3dxj h ILE 213 Ca 0.10 0.00 0.32 0.00 1.00 0.00 0.00 64.86 66.27 3dxj h ILE 213 Cb 0.59 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.55 3dxj h ILE 213 CO -0.60 0.00 0.68 1.56 0.00 0.00 0.00 178.15 179.79 3dxj h GLN 214 N -0.17 0.32 0.37 2.37 1.08 0.54 0.58 115.11 120.19 3dxj h GLN 214 Ca 0.02 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 3dxj h GLN 214 Cb 0.23 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 3dxj h GLN 214 CO -0.20 0.21 -0.18 0.93 -0.95 0.00 0.00 178.83 178.64 3dxj h GLU 215 N 0.33 -0.48 -1.28 1.46 4.39 0.16 -1.24 114.58 117.92 3dxj h GLU 215 Ca 0.69 0.03 0.37 0.00 0.34 0.00 0.00 59.36 60.79 3dxj h GLU 215 Cb 1.77 0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 30.47 3dxj h GLU 215 CO -0.42 -0.32 0.94 0.78 -1.16 0.00 0.00 179.01 178.83 3dxj h GLY 216 N -0.60 0.00 0.87 -3.84 0.00 0.39 0.67 103.07 100.57 3dxj h GLY 216 Ca -0.05 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.24 3dxj h GLY 216 CO 0.08 0.00 -0.42 3.43 0.00 0.00 0.00 176.54 179.63 3dxj h ASN 217 N 0.00 -0.99 -0.65 0.19 2.35 0.54 0.23 115.58 117.24 3dxj h ASN 217 Ca 0.61 0.03 0.04 0.00 -0.55 0.00 0.00 56.30 56.43 3dxj h ASN 217 Cb 2.49 0.26 -0.05 0.00 0.05 0.00 0.00 38.32 41.07 3dxj h ASN 217 CO -0.01 -0.69 0.39 0.06 -1.65 0.00 0.00 177.43 175.53 3dxj h GLN 218 N -1.21 0.73 -0.99 0.81 3.07 0.13 0.56 115.11 118.21 3dxj h GLN 218 Ca -0.12 -0.04 0.26 0.00 0.09 0.00 0.00 58.65 58.83 3dxj h GLN 218 Cb 0.90 -0.17 -0.07 0.00 0.08 0.00 0.00 27.48 28.23 3dxj h GLN 218 CO 0.20 0.48 0.67 0.78 0.09 0.00 0.00 178.83 181.05 3dxj h GLY 219 N 0.75 0.69 0.78 0.06 0.00 0.03 0.50 103.07 105.89 3dxj h GLY 219 Ca 0.27 -0.13 -0.03 0.00 0.00 0.00 0.00 47.33 47.44 3dxj h GLY 219 CO -0.13 -0.05 -0.03 -2.00 0.00 0.00 0.00 176.54 174.34 3dxj h LEU 220 N 0.26 0.31 -0.46 3.11 5.85 0.35 -2.64 115.31 122.09 3dxj h LEU 220 Ca 0.52 -0.35 0.09 0.00 0.84 0.00 0.00 57.88 58.98 3dxj h LEU 220 Cb 1.54 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 42.40 3dxj h LEU 220 CO -0.16 0.59 -0.14 0.40 -0.34 0.00 0.00 178.44 178.78 3dxj h ILE 221 N 0.02 0.48 0.17 4.05 2.04 0.11 -0.64 117.51 123.75 3dxj h ILE 221 Ca 0.04 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.92 3dxj h ILE 221 Cb 0.45 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 36.97 3dxj h ILE 221 CO 0.01 0.00 -0.47 -0.09 0.00 0.00 0.00 178.15 177.61 3dxj h ARG 222 N -0.04 -0.70 -1.00 2.37 9.65 -1.35 0.61 114.38 123.92 3dxj h ARG 222 Ca 0.22 0.05 0.38 0.00 -1.10 0.00 0.00 59.98 59.53 3dxj h ARG 222 Cb 0.38 0.16 -0.18 0.00 -1.39 0.00 0.00 29.97 28.94 3dxj h ARG 222 CO -0.49 -0.47 0.47 0.00 2.80 0.00 0.00 179.97 182.27 3dxj h ALA 223 N -0.37 1.98 0.08 2.80 0.00 -0.88 0.29 119.26 123.16 3dxj h ALA 223 Ca 0.00 0.27 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 3dxj h ALA 223 Cb 0.73 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3dxj h ALA 223 CO -0.24 -0.84 -0.04 0.28 0.00 0.00 0.00 179.25 178.41 3dxj h VAL 224 N 0.05 0.00 0.00 0.00 2.07 0.51 -3.31 116.25 115.58 3dxj h VAL 224 Ca 0.79 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 68.30 3dxj h VAL 224 Cb 2.01 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 3dxj h VAL 224 CO -0.77 0.00 0.00 1.21 0.02 0.00 0.00 177.57 178.03 3dxj n GLU 225 N -2.32 0.00 -1.51 1.57 2.13 0.75 -2.58 120.64 118.67 3dxj n GLU 225 Ca -0.01 0.50 -0.14 0.00 0.66 0.00 0.00 57.16 58.16 3dxj n GLU 225 Cb 0.04 -0.93 -0.11 0.00 0.27 0.00 0.00 31.44 30.71 3dxj n GLU 225 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3dxj n LYS 226 N -1.28 0.08 -3.31 5.31 4.76 0.25 -4.75 118.16 119.23 3dxj n LYS 226 Ca 0.00 -1.61 0.03 0.00 -2.87 0.00 0.00 58.31 53.86 3dxj n LYS 226 Cb 0.00 -3.77 -0.03 0.00 -1.84 0.00 0.00 35.03 29.39 3dxj n LYS 226 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 3dxj s PHE 227 N 16.40 -0.75 -0.42 2.13 5.36 -1.07 -4.72 117.98 134.92 3dxj s PHE 227 Ca 0.78 1.08 -0.12 0.00 -0.96 0.00 0.00 56.93 57.71 3dxj s PHE 227 Cb -0.04 0.37 0.06 0.00 -0.34 0.00 0.00 43.02 43.07 3dxj s PHE 227 CO 0.19 -0.39 0.28 -1.83 -1.46 0.00 0.00 175.22 172.01 3dxj s GLU 228 N 2.64 2.78 0.48 10.12 -1.05 -1.26 -4.93 118.70 127.48 3dxj s GLU 228 Ca 0.00 -1.30 0.15 0.00 -0.15 0.00 0.00 54.97 53.67 3dxj s GLU 228 Cb -0.08 -3.86 1.12 0.00 -0.44 0.00 0.00 34.13 30.87 3dxj s GLU 228 CO -0.16 -0.88 2.07 0.10 0.95 0.00 0.00 175.26 177.34 3dxj h TYR 229 N 8.51 0.03 -1.47 4.83 -0.00 -1.97 -2.81 116.97 124.08 3dxj h TYR 229 Ca -0.25 -0.00 0.43 0.00 -0.00 0.00 0.00 58.73 58.90 3dxj h TYR 229 Cb 1.10 -0.01 -0.06 0.00 -0.00 0.00 0.00 36.73 37.76 3dxj h TYR 229 CO 0.60 0.10 1.15 1.63 -0.00 0.00 0.00 178.16 181.65 3dxj n LYS 230 N -4.44 0.00 -3.09 0.10 5.02 -1.26 -3.26 118.16 111.24 3dxj n LYS 230 Ca -0.02 0.89 -0.44 0.00 -2.02 0.00 0.00 58.31 56.71 3dxj n LYS 230 Cb 0.16 -2.08 -0.05 0.00 -0.02 0.00 0.00 35.03 33.04 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 -4.42 3.07 -0.86 1.97 0.52 -1.06 -4.98 118.95 113.19 3dxj s ARG 231 Ca -0.04 -1.18 -0.27 0.00 -0.52 0.00 0.00 55.73 53.72 3dxj s ARG 231 Cb 0.20 -4.23 -0.19 0.00 0.52 0.00 0.00 34.95 31.24 3dxj s ARG 231 CO 0.66 -1.52 2.54 -2.13 0.02 0.00 0.00 175.30 174.87 3dxj n ARG 232 N 6.48 0.30 -3.65 3.54 3.00 -1.20 -4.89 116.66 120.24 3dxj n ARG 232 Ca -0.08 -0.05 -0.02 0.00 -0.00 0.00 0.00 57.85 57.69 3dxj n ARG 232 Cb 0.43 -2.08 -0.06 0.00 0.00 0.00 0.00 32.46 30.76 3dxj n ARG 232 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.63 177.04 3dxj s PHE 233 N 9.07 -0.03 0.33 -0.14 -0.12 -1.26 -5.16 117.98 120.66 3dxj s PHE 233 Ca 1.23 0.07 -0.26 0.00 -0.05 0.00 0.00 56.93 57.92 3dxj s PHE 233 Cb -0.86 0.49 -0.14 0.00 -0.63 0.00 0.00 43.02 41.89 3dxj s PHE 233 CO 0.42 -0.02 0.80 1.17 -0.05 0.00 0.00 175.22 177.54 3dxj n LYS 234 N 1.13 0.91 0.13 1.99 4.81 -1.26 -4.95 118.16 120.92 3dxj n LYS 234 Ca -0.06 0.32 -0.11 0.00 -0.87 0.00 0.00 58.31 57.60 3dxj n LYS 234 Cb 0.58 -1.63 -0.07 0.00 0.02 0.00 0.00 35.03 33.93 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 1.44 -0.36 0.00 5.64 3.57 -1.99 -3.22 116.94 122.03 3dxj h PHE 235 Ca -0.38 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.11 3dxj h PHE 235 Cb 1.37 0.12 0.00 0.00 2.79 0.00 0.00 35.95 40.23 3dxj h PHE 235 CO 0.43 -0.02 0.00 0.45 -2.23 0.00 0.00 178.31 176.94 3dxj n SER 236 N -5.05 0.00 -0.41 0.41 2.88 -1.26 0.15 113.62 110.34 3dxj n SER 236 Ca -0.08 0.07 0.32 0.00 -1.33 0.00 0.00 58.87 57.85 3dxj n SER 236 Cb 0.25 0.00 0.50 0.00 -0.75 0.00 0.00 64.21 64.21 3dxj n SER 236 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3dxj n THR 237 N -0.18 -0.05 0.00 2.46 -2.24 -1.26 -1.30 114.28 111.71 3dxj n THR 237 Ca 0.00 1.01 0.00 0.00 -2.27 0.00 0.00 64.05 62.79 3dxj n THR 237 Cb 0.00 -1.67 0.00 0.00 -2.10 0.00 0.00 70.33 66.56 3dxj n THR 237 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dxj n TYR 238 N -3.43 0.00 -0.50 4.78 9.36 0.40 -3.85 117.16 123.91 3dxj n TYR 238 Ca 0.28 0.00 0.39 0.00 3.32 0.00 0.00 57.90 61.89 3dxj n TYR 238 Cb 1.20 0.00 0.62 0.00 -0.63 0.00 0.00 39.34 40.53 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 -3.00 1.36 -0.22 2.98 0.00 -0.73 0.62 120.51 121.52 3dxj n ALA 239 Ca 0.00 0.60 0.14 0.00 0.00 0.00 0.00 53.44 54.18 3dxj n ALA 239 Cb 0.00 -0.90 0.26 0.00 0.00 0.00 0.00 19.45 18.81 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 -3.86 -0.27 0.00 0.00 -1.04 -0.42 -0.60 114.28 108.08 3dxj n THR 240 Ca 0.35 1.40 0.00 0.00 -2.04 0.00 0.00 64.05 63.76 3dxj n THR 240 Cb 1.49 -2.12 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 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 -4.73 0.00 -0.20 -1.42 -0.00 0.20 -3.00 117.44 108.30 3dxj n TRP 241 Ca 0.19 0.00 -0.00 0.00 -0.00 0.00 0.00 57.50 57.69 3dxj n TRP 241 Cb 0.62 0.00 0.03 0.00 -0.00 0.00 0.00 31.31 31.96 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 -0.51 0.04 -0.08 5.87 7.02 0.23 0.88 117.44 130.90 3dxj n TRP 242 Ca 0.00 0.64 -0.12 0.00 -1.02 0.00 0.00 57.50 57.01 3dxj n TRP 242 Cb 0.00 -0.71 -0.06 0.00 -2.42 0.00 0.00 31.31 28.12 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 0.10 -0.94 -0.99 2.04 -1.51 0.32 117.51 116.53 3dxj h ILE 243 Ca 0.19 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.29 3dxj h ILE 243 Cb 0.32 0.10 -0.17 0.00 -0.74 0.00 0.00 36.82 36.33 3dxj h ILE 243 CO -0.52 0.00 -0.03 0.03 0.00 0.00 0.00 178.15 177.63 3dxj h ARG 244 N -0.41 0.03 0.00 2.37 3.08 0.59 0.38 114.38 120.42 3dxj h ARG 244 Ca 0.10 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 3dxj h ARG 244 Cb 0.61 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.65 3dxj h ARG 244 CO -0.51 0.02 0.00 1.04 -1.07 0.00 0.00 179.97 179.45 3dxj n GLN 245 N -5.48 0.00 -0.21 0.04 1.13 0.93 -1.23 117.38 112.57 3dxj n GLN 245 Ca 0.20 0.52 0.12 0.00 -1.94 0.00 0.00 57.00 55.89 3dxj n GLN 245 Cb 0.65 -1.49 0.22 0.00 0.11 0.00 0.00 30.24 29.74 3dxj n GLN 245 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3dxj n ALA 246 N -2.03 0.39 -1.00 -1.58 0.00 -0.05 -0.23 120.51 116.01 3dxj n ALA 246 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 53.44 54.08 3dxj n ALA 246 Cb 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 18.94 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 -4.67 0.00 -0.21 0.00 5.41 -0.02 -2.24 119.36 117.63 3dxj n ILE 247 Ca 0.16 0.76 -0.06 0.00 1.00 0.00 0.00 62.75 64.62 3dxj n ILE 247 Cb 0.54 -1.57 -0.05 0.00 -0.71 0.00 0.00 39.64 37.85 3dxj n ILE 247 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3dxj n ASN 248 N -0.44 -0.53 -0.21 4.38 3.02 -0.37 0.61 115.26 121.73 3dxj n ASN 248 Ca 0.00 1.08 -0.06 0.00 -0.03 0.00 0.00 54.58 55.58 3dxj n ASN 248 Cb 0.00 -0.21 -0.05 0.00 -0.61 0.00 0.00 39.78 38.91 3dxj n ASN 248 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 3dxj n ARG 249 N -4.27 -0.22 -0.07 3.52 3.00 0.69 0.55 116.66 119.86 3dxj n ARG 249 Ca 0.01 0.84 -0.07 0.00 -0.00 0.00 0.00 57.85 58.63 3dxj n ARG 249 Cb 0.13 -1.24 -0.01 0.00 0.00 0.00 0.00 32.46 31.34 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 0.17 0.26 -0.03 5.13 0.00 0.64 -2.94 119.26 122.50 3dxj h ALA 250 Ca 0.08 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3dxj h ALA 250 Cb 0.21 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3dxj h ALA 250 CO -0.48 -0.38 -0.02 0.82 0.00 0.00 0.00 179.25 179.20 3dxj h ILE 251 N 0.13 0.00 0.00 0.00 2.04 0.11 1.20 117.51 121.00 3dxj h ILE 251 Ca 0.12 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.98 3dxj h ILE 251 Cb 0.14 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.22 3dxj h ILE 251 CO -0.18 0.00 0.49 0.00 0.00 0.00 0.00 178.15 178.46 3dxj h ALA 252 N -1.08 1.43 -0.61 1.87 0.00 -1.43 0.37 119.26 119.80 3dxj h ALA 252 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dxj h ALA 252 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3dxj h ALA 252 CO -0.03 -0.43 0.00 -0.25 0.00 0.00 0.00 179.25 178.55 3dxj n ASP 253 N -2.40 0.00 0.21 0.00 10.43 0.39 -4.65 116.55 120.53 3dxj n ASP 253 Ca -0.01 0.23 0.11 0.00 2.57 0.00 0.00 54.79 57.68 3dxj n ASP 253 Cb 0.52 -0.40 0.15 0.00 1.84 0.00 0.00 41.12 43.22 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 -0.81 -1.24 4.20 -0.52 -3.35 115.11 113.39 3dxj h GLN 254 Ca 0.00 0.00 0.19 0.00 0.06 0.00 0.00 58.65 58.90 3dxj h GLN 254 Cb 0.00 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 27.64 3dxj h GLN 254 CO 0.00 0.06 0.04 0.00 -0.67 0.00 0.00 178.83 178.27 3dxj h ALA 255 N 1.93 0.90 -2.71 3.87 0.00 -0.39 -3.41 119.26 119.46 3dxj h ALA 255 Ca -0.00 0.25 -0.61 0.00 0.00 0.00 0.00 54.91 54.55 3dxj h ALA 255 Cb 1.05 0.43 -0.06 0.00 0.00 0.00 0.00 17.79 19.21 3dxj h ALA 255 CO 0.01 -0.44 -0.23 0.50 0.00 0.00 0.00 179.25 179.09 3dxj s ARG 256 N -6.08 3.93 0.38 0.00 3.52 -1.26 -4.94 118.95 114.50 3dxj s ARG 256 Ca -0.13 0.36 0.05 0.00 -0.13 0.00 0.00 55.73 55.87 3dxj s ARG 256 Cb 0.24 -3.24 0.73 0.00 -1.56 0.00 0.00 34.95 31.12 3dxj s ARG 256 CO 0.76 0.64 2.00 1.15 -0.81 0.00 0.00 175.30 179.04 3dxj h THR 257 N 3.85 1.14 -3.69 4.11 2.02 -1.80 -3.36 112.91 115.17 3dxj h THR 257 Ca -0.51 -0.36 -0.64 0.00 0.77 0.00 0.00 66.41 65.68 3dxj h THR 257 Cb 1.21 0.52 -0.19 0.00 -1.74 0.00 0.00 68.15 67.96 3dxj h THR 257 CO 0.63 0.16 -0.56 -0.63 0.37 0.00 0.00 175.52 175.48 3dxj s ILE 258 N -5.45 4.86 0.37 3.11 1.01 -1.26 -5.05 121.20 118.79 3dxj s ILE 258 Ca -0.09 0.01 -0.28 0.00 0.00 0.00 0.00 60.65 60.30 3dxj s ILE 258 Cb 0.17 -3.28 -0.11 0.00 0.01 0.00 0.00 42.46 39.24 3dxj s ILE 258 CO 0.75 0.32 1.37 -1.14 0.00 0.00 0.00 174.94 176.24 3dxj n ARG 259 N 4.73 2.34 -3.58 2.79 3.00 -1.26 -5.00 116.66 119.69 3dxj n ARG 259 Ca -0.15 0.82 -0.16 0.00 -0.00 0.00 0.00 57.85 58.36 3dxj n ARG 259 Cb 0.52 -2.48 -0.07 0.00 0.00 0.00 0.00 32.46 30.43 3dxj n ARG 259 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 3dxj s ILE 260 N -1.12 0.00 0.85 5.15 2.07 -1.26 -5.12 121.20 121.77 3dxj s ILE 260 Ca 0.55 0.00 -0.17 0.00 -1.41 0.00 0.00 60.65 59.62 3dxj s ILE 260 Cb -0.52 -1.00 -0.12 0.00 0.13 0.00 0.00 42.46 40.95 3dxj s ILE 260 CO 0.62 0.00 -0.39 -2.65 -1.91 0.00 0.00 174.94 170.62 3dxj n PRO 261 N 1.86 0.00 0.00 3.50 -0.02 -1.26 -4.83 135.00 134.26 3dxj n PRO 261 Ca -0.16 0.01 -0.21 0.00 -2.02 0.00 0.00 63.50 61.11 3dxj n PRO 261 Cb 0.56 -1.17 -0.14 0.00 -0.02 0.00 0.00 33.50 32.73 3dxj n PRO 261 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3dxj n VAL 262 N -2.37 1.78 0.21 -1.45 0.31 -1.26 -2.93 118.33 112.62 3dxj n VAL 262 Ca 0.02 -0.62 0.12 0.00 -0.01 0.00 0.00 64.34 63.86 3dxj n VAL 262 Cb 0.53 -1.76 0.67 0.00 -0.91 0.00 0.00 33.84 32.37 3dxj n VAL 262 CO 0.00 0.00 0.00 1.12 -1.32 0.00 0.00 176.83 176.63 3dxj h HIS 263 N 0.01 0.00 0.21 3.52 2.07 -2.00 -0.01 115.15 118.96 3dxj h HIS 263 Ca -0.42 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.09 3dxj h HIS 263 Cb 2.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.98 3dxj h HIS 263 CO 0.08 0.00 -0.10 0.52 -3.07 0.00 0.00 177.93 175.36 3dxj h MET 264 N 0.00 -0.27 -0.69 5.12 2.07 -1.90 -3.26 114.93 116.00 3dxj h MET 264 Ca 0.00 0.02 0.06 0.00 -2.07 0.00 0.00 59.70 57.71 3dxj h MET 264 Cb 0.19 0.06 -0.09 0.00 -1.87 0.00 0.00 31.60 29.89 3dxj h MET 264 CO 0.00 -0.18 -0.47 0.28 1.07 0.00 0.00 176.91 177.62 3dxj h VAL 265 N -0.55 0.00 0.00 -2.22 2.07 -0.90 -2.09 116.25 112.56 3dxj h VAL 265 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 3dxj h VAL 265 Cb 0.21 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.98 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 -4.80 0.00 -0.20 1.57 1.02 -0.76 0.14 120.64 117.61 3dxj n GLU 266 Ca 0.01 0.12 -0.05 0.00 -0.02 0.00 0.00 57.16 57.22 3dxj n GLU 266 Cb 0.22 -0.25 -0.05 0.00 -0.02 0.00 0.00 31.44 31.35 3dxj n GLU 266 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3dxj n THR 267 N -0.64 -0.33 -0.23 2.62 -2.24 -0.92 -0.72 114.28 111.83 3dxj n THR 267 Ca 0.00 1.91 0.04 0.00 -2.27 0.00 0.00 64.05 63.73 3dxj n THR 267 Cb 0.00 -2.43 0.09 0.00 -2.10 0.00 0.00 70.33 65.89 3dxj n THR 267 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 3dxj n ILE 268 N -4.08 -0.27 0.16 2.28 5.41 0.12 0.13 119.36 123.11 3dxj n ILE 268 Ca 0.01 1.45 -0.13 0.00 1.00 0.00 0.00 62.75 65.09 3dxj n ILE 268 Cb 0.13 -2.01 -0.08 0.00 -0.71 0.00 0.00 39.64 36.97 3dxj n ILE 268 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 3dxj h ASN 269 N 0.00 -0.38 -0.78 4.38 2.35 0.76 -2.86 115.58 119.06 3dxj h ASN 269 Ca 0.31 -0.17 0.20 0.00 -0.55 0.00 0.00 56.30 56.09 3dxj h ASN 269 Cb 0.47 0.10 -0.15 0.00 0.05 0.00 0.00 38.32 38.80 3dxj h ASN 269 CO -0.65 0.02 -0.03 1.17 -1.65 0.00 0.00 177.43 176.30 3dxj n LYS 270 N -5.12 -0.06 0.00 0.81 4.81 0.34 -0.25 118.16 118.68 3dxj n LYS 270 Ca -0.09 1.17 0.00 0.00 -0.87 0.00 0.00 58.31 58.52 3dxj n LYS 270 Cb 0.27 -1.84 0.00 0.00 0.02 0.00 0.00 35.03 33.48 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 -5.12 0.00 -0.15 3.14 4.77 0.79 -1.73 117.00 118.69 3dxj n LEU 271 Ca 0.17 0.45 -0.04 0.00 -0.03 0.00 0.00 56.01 56.56 3dxj n LEU 271 Cb 0.56 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.61 3dxj n LEU 271 CO -0.07 0.00 0.21 -1.54 -1.33 0.00 0.00 177.39 174.67 3dxj n SER 272 N -0.65 -0.38 -0.33 -1.43 3.41 0.65 0.27 113.62 115.16 3dxj n SER 272 Ca 0.00 0.72 0.24 0.00 -0.26 0.00 0.00 58.87 59.57 3dxj n SER 272 Cb 0.00 -0.12 0.47 0.00 -0.26 0.00 0.00 64.21 64.29 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 0.08 0.08 4.33 3.08 -0.91 -0.19 114.38 120.85 3dxj h ARG 273 Ca 0.06 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 3dxj h ARG 273 Cb 0.15 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.18 3dxj h ARG 273 CO -0.34 0.05 -0.04 1.15 -1.07 0.00 0.00 179.97 179.73 3dxj h THR 274 N 0.09 1.17 -1.43 2.04 2.02 0.46 -3.02 112.91 114.24 3dxj h THR 274 Ca 0.74 -1.30 0.46 0.00 0.77 0.00 0.00 66.41 67.08 3dxj h THR 274 Cb 1.78 1.96 -0.10 0.00 -1.74 0.00 0.00 68.15 70.05 3dxj h THR 274 CO -0.76 0.30 0.97 0.00 0.37 0.00 0.00 175.52 176.40 3dxj n ALA 275 N -2.49 1.40 0.02 6.16 0.00 -0.10 -0.16 120.51 125.33 3dxj n ALA 275 Ca -0.08 0.70 -0.01 0.00 0.00 0.00 0.00 53.44 54.05 3dxj n ALA 275 Cb 0.29 -0.97 -0.00 0.00 0.00 0.00 0.00 19.45 18.76 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 -0.05 0.00 0.00 3.08 -1.50 0.04 114.38 115.94 3dxj h ARG 276 Ca 0.81 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.86 3dxj h ARG 276 Cb 2.85 0.01 0.00 0.00 0.08 0.00 0.00 29.97 32.91 3dxj h ARG 276 CO -0.26 -0.04 0.60 1.04 -1.07 0.00 0.00 179.97 180.24 3dxj n GLN 277 N -2.38 0.03 -0.01 0.04 6.02 0.77 -1.19 117.38 120.66 3dxj n GLN 277 Ca -0.01 0.46 -0.01 0.00 -0.01 0.00 0.00 57.00 57.43 3dxj n GLN 277 Cb 0.02 -2.20 -0.00 0.00 1.02 0.00 0.00 30.24 29.08 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 -1.76 0.38 -0.19 1.08 4.77 -0.38 -3.78 117.00 117.11 3dxj n LEU 278 Ca -0.00 0.06 -0.02 0.00 -0.03 0.00 0.00 56.01 56.02 3dxj n LEU 278 Cb 0.61 -0.41 -0.01 0.00 -2.33 0.00 0.00 43.42 41.28 3dxj n LEU 278 CO 0.02 -0.48 0.26 1.67 -1.33 0.00 0.00 177.39 177.53 3dxj n GLN 279 N -2.88 -0.15 0.26 3.23 0.00 -0.00 0.39 117.38 118.23 3dxj n GLN 279 Ca -0.02 0.74 -0.11 0.00 -0.00 0.00 0.00 57.00 57.61 3dxj n GLN 279 Cb 0.08 -1.09 -0.05 0.00 0.00 0.00 0.00 30.24 29.18 3dxj n GLN 279 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.06 176.50 3dxj h GLN 280 N 0.00 -0.66 -0.40 3.69 3.07 -1.37 1.02 115.11 120.45 3dxj h GLN 280 Ca 0.13 0.05 0.10 0.00 0.09 0.00 0.00 58.65 59.02 3dxj h GLN 280 Cb 0.25 0.15 -0.02 0.00 0.08 0.00 0.00 27.48 27.94 3dxj h GLN 280 CO -0.47 -0.44 0.28 1.49 0.09 0.00 0.00 178.83 179.78 3dxj h GLU 281 N -0.69 0.08 -0.00 0.06 4.57 0.06 0.32 114.58 118.98 3dxj h GLU 281 Ca -0.07 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 3dxj h GLU 281 Cb 0.54 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.11 3dxj h GLU 281 CO 0.10 0.05 -0.32 -0.11 -1.18 0.00 0.00 179.01 177.54 3dxj n LEU 282 N -4.44 0.49 0.00 1.64 7.94 1.25 -4.90 117.00 118.97 3dxj n LEU 282 Ca 0.06 0.05 0.00 0.00 -1.11 0.00 0.00 56.01 55.01 3dxj n LEU 282 Cb 0.42 -0.27 0.00 0.00 0.53 0.00 0.00 43.42 44.11 3dxj n LEU 282 CO 0.36 0.11 0.00 0.61 -1.11 0.00 0.00 177.39 177.35 3dxj n GLY 283 N 1.45 0.44 4.00 -3.96 0.00 0.35 -4.77 105.19 102.70 3dxj n GLY 283 Ca 0.08 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.90 3dxj n GLY 283 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3dxj s ARG 284 N 0.00 2.41 -0.57 1.61 1.70 -1.15 -4.80 118.95 118.15 3dxj s ARG 284 Ca 0.00 -1.62 -0.23 0.00 -0.47 0.00 0.00 55.73 53.41 3dxj s ARG 284 Cb 0.00 -2.56 0.05 0.00 -0.57 0.00 0.00 34.95 31.87 3dxj s ARG 284 CO 0.00 -0.67 0.88 -1.21 -1.08 0.00 0.00 175.30 173.22 3dxj s GLU 285 N -4.51 3.22 0.22 3.89 0.41 -1.26 -3.87 118.70 116.79 3dxj s GLU 285 Ca 0.55 -0.58 -0.31 0.00 -0.41 0.00 0.00 54.97 54.22 3dxj s GLU 285 Cb -0.06 -4.12 -0.14 0.00 -1.78 0.00 0.00 34.13 28.03 3dxj s GLU 285 CO 0.34 -1.53 1.23 -0.35 -0.49 0.00 0.00 175.26 174.46 3dxj n PRO 286 N 7.25 1.54 -4.10 0.39 -0.04 -1.26 -5.00 135.00 133.78 3dxj n PRO 286 Ca -0.02 0.55 -0.24 0.00 -0.04 0.00 0.00 63.50 63.74 3dxj n PRO 286 Cb 0.46 -2.08 -0.05 0.00 -0.04 0.00 0.00 33.50 31.79 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 -0.30 4.48 0.00 0.52 -1.32 -1.26 -4.84 115.64 112.93 3dxj s THR 287 Ca 0.69 -1.22 0.00 0.00 -1.21 0.00 0.00 61.69 59.95 3dxj s THR 287 Cb -0.75 -3.35 0.00 0.00 -1.51 0.00 0.00 72.50 66.89 3dxj s THR 287 CO 0.53 -0.22 0.00 -1.22 -2.21 0.00 0.00 174.62 171.50 3dxj n TYR 288 N -0.73 0.00 0.00 9.09 0.53 -1.26 0.31 117.16 125.11 3dxj n TYR 288 Ca -0.08 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.80 3dxj n TYR 288 Cb 0.56 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 38.87 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 -1.45 0.00 -0.33 -0.72 4.71 -1.26 0.36 120.64 121.95 3dxj n GLU 289 Ca 0.00 0.80 -0.04 0.00 -0.01 0.00 0.00 57.16 57.91 3dxj n GLU 289 Cb 0.00 -1.31 -0.01 0.00 -1.01 0.00 0.00 31.44 29.11 3dxj n GLU 289 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 3dxj n GLU 290 N -2.23 -0.26 0.30 3.49 4.71 0.15 -0.39 120.64 126.41 3dxj n GLU 290 Ca 0.00 1.27 -0.16 0.00 -0.01 0.00 0.00 57.16 58.27 3dxj n GLU 290 Cb 0.00 -1.88 -0.08 0.00 -1.01 0.00 0.00 31.44 28.47 3dxj n GLU 290 CO 0.00 0.00 0.00 0.97 0.09 0.00 0.00 177.13 178.19 3dxj h ILE 291 N 0.00 0.35 -0.68 -3.67 6.09 0.22 -1.89 117.51 117.93 3dxj h ILE 291 Ca 0.23 -0.26 0.10 0.00 -1.37 0.00 0.00 64.86 63.56 3dxj h ILE 291 Cb 0.44 0.45 -0.11 0.00 0.47 0.00 0.00 36.82 38.06 3dxj h ILE 291 CO -0.81 0.03 -0.27 0.00 -3.07 0.00 0.00 178.15 174.03 3dxj n ALA 292 N -2.54 -0.10 0.07 0.18 0.00 1.15 0.23 120.51 119.49 3dxj n ALA 292 Ca -0.12 0.67 -0.08 0.00 0.00 0.00 0.00 53.44 53.91 3dxj n ALA 292 Cb 0.34 -0.29 -0.05 0.00 0.00 0.00 0.00 19.45 19.45 3dxj n ALA 292 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3dxj h GLU 293 N 0.00 -0.37 -0.68 0.00 5.08 -0.98 -2.33 114.58 115.30 3dxj h GLU 293 Ca 0.23 0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.72 3dxj h GLU 293 Cb 0.40 0.08 -0.12 0.00 0.50 0.00 0.00 28.75 29.61 3dxj h GLU 293 CO -0.67 -0.24 -0.39 0.00 -1.00 0.00 0.00 179.01 176.71 3dxj h ALA 294 N -1.16 -0.11 -0.80 3.43 0.00 0.30 -0.90 119.26 120.02 3dxj h ALA 294 Ca -0.01 0.17 0.19 0.00 0.00 0.00 0.00 54.91 55.26 3dxj h ALA 294 Cb 0.36 0.91 -0.14 0.00 0.00 0.00 0.00 17.79 18.93 3dxj h ALA 294 CO -0.11 -0.73 0.04 1.98 0.00 0.00 0.00 179.25 180.44 3dxj h MET 295 N -0.15 0.11 0.00 0.00 -1.53 0.32 -3.48 114.93 110.21 3dxj h MET 295 Ca 0.24 -0.01 0.00 0.00 -3.44 0.00 0.00 59.70 56.49 3dxj h MET 295 Cb 0.56 -0.02 0.00 0.00 -0.55 0.00 0.00 31.60 31.59 3dxj h MET 295 CO -0.76 0.07 0.00 0.41 0.14 0.00 0.00 176.91 176.78 3dxj n GLY 296 N -1.42 0.51 0.00 1.39 0.00 -0.35 -5.01 105.19 100.31 3dxj n GLY 296 Ca 0.15 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.51 3dxj n GLY 296 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dxj n PRO 297 N 0.00 0.00 -2.26 1.61 -0.02 -1.26 -3.30 135.00 129.78 3dxj n PRO 297 Ca 0.00 0.09 -0.41 0.00 -2.02 0.00 0.00 63.50 61.16 3dxj n PRO 297 Cb 0.00 -0.54 0.00 0.00 -0.02 0.00 0.00 33.50 32.94 3dxj n PRO 297 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dxj n GLY 298 N -0.20 5.21 3.27 -1.23 0.00 -1.26 -4.95 105.19 106.03 3dxj n GLY 298 Ca 0.00 -2.18 -0.29 0.00 0.00 0.00 0.00 46.02 43.55 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 -1.26 2.08 -0.04 1.61 0.52 -1.21 -5.09 118.94 115.55 3dxj s TRP 299 Ca 0.46 -0.39 -0.14 0.00 0.02 0.00 0.00 56.10 56.05 3dxj s TRP 299 Cb 0.15 -1.32 0.02 0.00 -1.15 0.00 0.00 33.47 31.17 3dxj s TRP 299 CO -0.05 -0.01 0.31 0.34 0.02 0.00 0.00 176.95 177.56 3dxj s ASP 300 N -0.68 -0.22 0.05 2.95 -1.08 -1.26 -4.81 116.67 111.62 3dxj s ASP 300 Ca 0.09 0.21 -0.11 0.00 -0.52 0.00 0.00 52.55 52.22 3dxj s ASP 300 Cb -0.09 0.39 -0.03 0.00 -1.46 0.00 0.00 42.92 41.73 3dxj s ASP 300 CO -0.00 -0.37 1.19 0.00 0.52 0.00 0.00 175.17 176.50 3dxj h ALA 301 N 4.26 -0.37 -0.78 3.66 0.00 -1.90 0.83 119.26 124.97 3dxj h ALA 301 Ca -0.29 0.01 0.22 0.00 0.00 0.00 0.00 54.91 54.85 3dxj h ALA 301 Cb 1.18 0.96 -0.04 0.00 0.00 0.00 0.00 17.79 19.89 3dxj h ALA 301 CO 0.38 -0.48 0.55 1.57 0.00 0.00 0.00 179.25 181.27 3dxj h LYS 302 N -0.09 0.07 0.26 0.00 5.09 -1.97 0.42 116.57 120.34 3dxj h LYS 302 Ca 0.04 -0.00 -0.01 0.00 0.09 0.00 0.00 60.65 60.76 3dxj h LYS 302 Cb 0.18 -0.02 0.00 0.00 0.10 0.00 0.00 32.23 32.50 3dxj h LYS 302 CO -0.25 0.04 -0.12 -0.09 -2.09 0.00 0.00 179.45 176.94 3dxj h ARG 303 N 0.07 -0.33 -0.17 0.07 2.43 -0.77 -2.03 114.38 113.64 3dxj h ARG 303 Ca 0.38 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.59 3dxj h ARG 303 Cb 1.40 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 31.00 3dxj h ARG 303 CO -0.03 0.01 -0.13 0.28 -1.51 0.00 0.00 179.97 178.58 3dxj h VAL 304 N -0.73 0.00 -0.67 0.20 2.07 0.38 -1.56 116.25 115.94 3dxj h VAL 304 Ca -0.04 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.55 3dxj h VAL 304 Cb 0.49 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.18 3dxj h VAL 304 CO 0.06 0.00 -0.40 1.21 0.02 0.00 0.00 177.57 178.46 3dxj n GLU 305 N -3.44 -0.30 0.00 1.57 2.13 0.11 -1.90 120.64 118.82 3dxj n GLU 305 Ca -0.00 1.11 0.00 0.00 0.66 0.00 0.00 57.16 58.93 3dxj n GLU 305 Cb 0.07 -1.64 0.00 0.00 0.27 0.00 0.00 31.44 30.14 3dxj n GLU 305 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 3dxj n GLU 306 N -4.69 0.00 0.00 5.31 -0.58 -0.66 -2.44 120.64 117.59 3dxj n GLU 306 Ca 0.01 0.58 0.00 0.00 -0.42 0.00 0.00 57.16 57.34 3dxj n GLU 306 Cb 0.18 -1.25 0.00 0.00 -0.57 0.00 0.00 31.44 29.80 3dxj n GLU 306 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 3dxj n THR 307 N -1.75 0.00 -0.41 2.62 -1.04 -0.79 0.11 114.28 113.02 3dxj n THR 307 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.90 3dxj n THR 307 Cb 0.00 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.41 3dxj n THR 307 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3dxj h LEU 308 N 0.00 -2.15 -0.88 -4.42 3.38 -1.35 0.43 115.31 110.32 3dxj h LEU 308 Ca 0.00 0.33 0.21 0.00 0.09 0.00 0.00 57.88 58.51 3dxj h LEU 308 Cb 0.00 0.95 -0.12 0.00 0.09 0.00 0.00 40.66 41.58 3dxj h LEU 308 CO 0.00 -0.23 0.39 0.11 0.09 0.00 0.00 178.44 178.80 3dxj h LYS 309 N -0.00 0.41 0.00 1.13 1.57 0.12 2.31 116.57 122.10 3dxj h LYS 309 Ca 0.16 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3dxj h LYS 309 Cb 0.41 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3dxj h LYS 309 CO -0.93 0.27 0.00 -0.89 -0.57 0.00 0.00 179.45 177.33 3dxj n ILE 310 N -5.03 0.75 -3.00 1.86 5.41 0.13 -3.64 119.36 115.85 3dxj n ILE 310 Ca 0.21 0.19 -0.36 0.00 1.00 0.00 0.00 62.75 63.79 3dxj n ILE 310 Cb 0.62 -0.89 -0.02 0.00 -0.71 0.00 0.00 39.64 38.64 3dxj n ILE 310 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3dxj n ALA 311 N -1.46 5.08 -3.00 -1.39 0.00 0.78 -4.96 120.51 115.55 3dxj n ALA 311 Ca 0.05 -4.74 0.00 0.00 0.00 0.00 0.00 53.44 48.75 3dxj n ALA 311 Cb 0.19 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 17.92 3dxj n ALA 311 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3dxj n GLN 312 N 0.61 3.48 -0.06 0.00 1.13 -1.24 -4.93 117.38 116.37 3dxj n GLN 312 Ca 0.33 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 55.28 3dxj n GLN 312 Cb 0.34 0.00 -0.05 0.00 0.11 0.00 0.00 30.24 30.64 3dxj n GLN 312 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3dxj n GLU 313 N 0.00 0.27 -0.16 -1.09 -0.58 -1.26 -5.02 120.64 112.80 3dxj n GLU 313 Ca 0.00 0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 3dxj n GLU 313 Cb 0.00 -1.06 0.00 0.00 -0.57 0.00 0.00 31.44 29.81 3dxj n GLU 313 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 3dxj n PRO 314 N -3.25 1.52 -3.42 3.49 -0.04 -1.26 -4.12 135.00 127.92 3dxj n PRO 314 Ca -0.23 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 62.92 3dxj n PRO 314 Cb 0.69 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 34.10 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 0.68 4.98 -0.16 0.52 1.01 -1.26 -5.07 120.40 121.11 3dxj s VAL 315 Ca 0.00 0.34 -0.27 0.00 0.00 0.00 0.00 61.98 62.04 3dxj s VAL 315 Cb 0.00 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 3dxj s VAL 315 CO 0.00 -0.11 0.93 -0.55 0.00 0.00 0.00 175.10 175.36 3dxj s SER 316 N -2.54 7.08 0.40 3.32 0.15 -1.26 -4.93 113.70 115.92 3dxj s SER 316 Ca 0.46 1.33 0.09 0.00 0.70 0.00 0.00 55.95 58.53 3dxj s SER 316 Cb -0.11 -2.50 0.84 0.00 -1.71 0.00 0.00 66.02 62.54 3dxj s SER 316 CO 0.24 -0.46 1.98 -0.07 1.20 0.00 0.00 173.24 176.13 3dxj h LEU 317 N 8.40 0.30 0.00 3.45 3.38 -1.97 -0.54 115.31 128.34 3dxj h LEU 317 Ca -0.28 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.65 3dxj h LEU 317 Cb 1.12 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3dxj h LEU 317 CO 0.87 0.35 0.00 -0.62 0.09 0.00 0.00 178.44 179.12 3dxj n GLU 318 N -4.37 0.46 -1.92 1.13 4.71 -1.26 -0.88 120.64 118.51 3dxj n GLU 318 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.16 56.73 3dxj n GLU 318 Cb 0.18 -1.48 -0.03 0.00 -1.01 0.00 0.00 31.44 29.10 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 -2.00 3.20 0.35 2.62 2.01 -0.21 -4.74 115.64 116.87 3dxj s THR 319 Ca 0.21 0.49 -0.28 0.00 0.31 0.00 0.00 61.69 62.42 3dxj s THR 319 Cb 0.10 -3.31 -0.11 0.00 0.01 0.00 0.00 72.50 69.18 3dxj s THR 319 CO 0.16 -0.02 1.41 -2.84 -0.69 0.00 0.00 174.62 172.64 3dxj s PRO 320 N 3.30 4.22 0.43 4.92 0.02 -1.26 0.35 135.00 146.97 3dxj s PRO 320 Ca 0.76 2.42 -0.02 0.00 0.02 0.00 0.00 61.00 64.18 3dxj s PRO 320 Cb -0.38 -3.01 -0.03 0.00 0.02 0.00 0.00 34.50 31.10 3dxj s PRO 320 CO 0.33 -0.39 0.68 0.42 -0.33 0.00 0.00 177.00 177.71 3dxj s ILE 321 N -1.09 4.75 0.44 2.83 -1.09 0.22 -4.81 121.20 122.46 3dxj s ILE 321 Ca 0.51 -0.21 0.18 0.00 -2.23 0.00 0.00 60.65 58.91 3dxj s ILE 321 Cb -0.44 -3.77 0.26 0.00 -1.58 0.00 0.00 42.46 36.93 3dxj s ILE 321 CO 0.58 -0.62 0.92 0.61 -1.23 0.00 0.00 174.94 175.21 3dxj n GLY 322 N -2.06 -0.54 0.27 6.18 0.00 -1.26 -0.39 105.19 107.40 3dxj n GLY 322 Ca -0.01 0.24 0.01 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.64 -1.53 1.61 1.82 -1.90 -3.45 116.42 112.33 3dxj h ASP 323 Ca 0.33 0.21 -0.17 0.00 -0.39 0.00 0.00 57.03 57.01 3dxj h ASP 323 Cb 2.08 0.44 0.00 0.00 0.68 0.00 0.00 39.33 42.53 3dxj h ASP 323 CO -0.00 -0.23 -0.23 -0.62 -1.61 0.00 0.00 179.24 176.54 3dxj n GLU 324 N -5.47 -1.11 0.00 0.28 1.02 0.48 -4.86 120.64 110.97 3dxj n GLU 324 Ca 0.10 0.41 0.00 0.00 -0.02 0.00 0.00 57.16 57.65 3dxj n GLU 324 Cb 0.38 -4.34 0.00 0.00 -0.02 0.00 0.00 31.44 27.46 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 -1.93 0.00 -0.20 3.49 5.02 -1.26 -5.04 118.16 118.24 3dxj n LYS 325 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 3dxj n LYS 325 Cb 0.57 -0.05 0.00 0.00 -0.02 0.00 0.00 35.03 35.53 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 -2.37 0.00 -4.67 4.39 3.85 -1.26 -5.12 116.55 111.37 3dxj n ASP 326 Ca 0.00 -0.85 -0.35 0.00 -0.71 0.00 0.00 54.79 52.89 3dxj n ASP 326 Cb 0.00 0.00 -0.10 0.00 -1.35 0.00 0.00 41.12 39.67 3dxj n ASP 326 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.20 175.75 3dxj s SER 327 N 0.00 5.21 0.09 -1.12 0.01 -1.26 -5.03 113.70 111.60 3dxj s SER 327 Ca 0.00 0.12 0.07 0.00 1.31 0.00 0.00 55.95 57.46 3dxj s SER 327 Cb 0.00 -1.49 -0.03 0.00 0.21 0.00 0.00 66.02 64.71 3dxj s SER 327 CO 0.00 0.36 -0.19 -0.36 0.41 0.00 0.00 173.24 173.46 3dxj s PHE 328 N -0.78 1.62 0.08 2.43 0.40 -1.26 0.70 117.98 121.17 3dxj s PHE 328 Ca 0.12 -0.42 -0.16 0.00 -0.60 0.00 0.00 56.93 55.87 3dxj s PHE 328 Cb -0.11 -0.90 -0.04 0.00 0.51 0.00 0.00 43.02 42.48 3dxj s PHE 328 CO 0.02 0.15 1.00 0.98 0.70 0.00 0.00 175.22 178.07 3dxj n TYR 329 N 1.25 -0.22 -0.12 0.36 4.19 0.15 -1.37 117.16 121.40 3dxj n TYR 329 Ca -0.20 0.64 -0.03 0.00 3.31 0.00 0.00 57.90 61.62 3dxj n TYR 329 Cb 0.54 -0.50 -0.03 0.00 0.49 0.00 0.00 39.34 39.84 3dxj n TYR 329 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 3dxj n GLY 330 N -1.13 -1.88 0.27 2.98 0.00 -0.06 -0.32 105.19 105.05 3dxj n GLY 330 Ca 0.01 0.56 0.07 0.00 0.00 0.00 0.00 46.02 46.66 3dxj n GLY 330 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dxj n ASP 331 N -3.63 0.00 -0.05 1.61 8.00 -0.47 0.12 116.55 122.13 3dxj n ASP 331 Ca 0.01 0.39 -0.05 0.00 0.71 0.00 0.00 54.79 55.85 3dxj n ASP 331 Cb 0.08 -0.07 -0.14 0.00 -0.02 0.00 0.00 41.12 40.96 3dxj n ASP 331 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3dxj n PHE 332 N -2.11 0.35 -1.91 1.24 3.01 0.57 -4.90 117.46 113.71 3dxj n PHE 332 Ca 0.06 0.12 -0.42 0.00 1.01 0.00 0.00 57.45 58.22 3dxj n PHE 332 Cb 0.79 -0.97 -0.03 0.00 -0.01 0.00 0.00 39.48 39.26 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 -2.74 3.42 0.31 4.37 1.09 0.32 -4.98 121.20 122.98 3dxj s ILE 333 Ca -0.07 0.49 -0.08 0.00 -1.10 0.00 0.00 60.65 59.88 3dxj s ILE 333 Cb 0.08 -3.35 -0.06 0.00 -1.06 0.00 0.00 42.46 38.06 3dxj s ILE 333 CO 0.84 -0.08 0.63 -2.16 -0.10 0.00 0.00 174.94 174.06 3dxj s PRO 334 N 4.44 3.75 -0.13 2.79 0.04 -1.26 -5.05 135.00 139.57 3dxj s PRO 334 Ca 0.79 0.26 -0.15 0.00 0.04 0.00 0.00 61.00 61.94 3dxj s PRO 334 Cb -0.34 -2.56 -0.05 0.00 0.04 0.00 0.00 34.50 31.60 3dxj s PRO 334 CO 0.33 0.17 0.35 0.34 0.04 0.00 0.00 177.00 178.23 3dxj s ASP 335 N -2.89 6.54 0.00 6.66 -1.08 -1.26 -4.93 116.67 119.71 3dxj s ASP 335 Ca 0.48 0.63 0.01 0.00 -0.52 0.00 0.00 52.55 53.15 3dxj s ASP 335 Cb -0.11 -2.22 0.01 0.00 -1.46 0.00 0.00 42.92 39.14 3dxj s ASP 335 CO 0.27 0.09 0.55 -1.84 0.52 0.00 0.00 175.17 174.76 3dxj n GLU 336 N 3.45 -0.71 0.09 4.34 0.00 -1.26 -4.63 120.64 121.93 3dxj n GLU 336 Ca -0.11 -0.60 -0.14 0.00 0.00 0.00 0.00 57.16 56.32 3dxj n GLU 336 Cb 0.52 -1.02 -0.12 0.00 0.00 0.00 0.00 31.44 30.82 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 0.17 0.41 -3.76 -1.84 2.76 -2.06 -3.43 115.15 107.40 3dxj h HIS 337 Ca 0.00 -0.29 -0.63 0.00 -2.20 0.00 0.00 60.37 57.25 3dxj h HIS 337 Cb 0.06 -0.02 -0.15 0.00 1.55 0.00 0.00 27.41 28.84 3dxj h HIS 337 CO 0.00 1.21 -0.37 -0.51 -1.30 0.00 0.00 177.93 176.96 3dxj s LEU 338 N -7.15 4.04 0.41 0.26 1.43 -1.26 -5.06 118.68 111.36 3dxj s LEU 338 Ca -0.03 0.17 -0.26 0.00 -1.03 0.00 0.00 54.13 52.98 3dxj s LEU 338 Cb 0.08 -2.28 -0.09 0.00 0.03 0.00 0.00 46.19 43.93 3dxj s LEU 338 CO 0.87 -0.10 1.33 -2.84 0.23 0.00 0.00 176.35 175.84 3dxj s PRO 339 N 1.81 3.94 0.98 1.29 0.02 -1.26 -5.01 135.00 136.77 3dxj s PRO 339 Ca 0.11 2.23 -0.12 0.00 0.02 0.00 0.00 61.00 63.24 3dxj s PRO 339 Cb -0.16 -2.76 0.18 0.00 0.02 0.00 0.00 34.50 31.78 3dxj s PRO 339 CO 0.10 -0.54 1.09 -1.54 -0.33 0.00 0.00 177.00 175.78 3dxj s SER 340 N -0.66 2.73 0.65 2.53 1.04 -1.26 -4.49 113.70 114.24 3dxj s SER 340 Ca 0.57 1.29 0.32 0.00 0.48 0.00 0.00 55.95 58.62 3dxj s SER 340 Cb -0.40 -1.97 1.76 0.00 0.10 0.00 0.00 66.02 65.52 3dxj s SER 340 CO 0.51 -3.08 2.02 -0.65 0.98 0.00 0.00 173.24 173.03 3dxj h PRO 341 N -1.85 0.00 0.05 4.02 0.11 -1.98 0.31 132.00 132.66 3dxj h PRO 341 Ca -0.54 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 3dxj h PRO 341 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 3dxj h PRO 341 CO 0.56 0.00 -0.02 0.28 -0.21 0.00 0.00 178.00 178.61 3dxj h VAL 342 N 0.00 0.00 -0.01 3.15 2.07 -1.98 -2.35 116.25 117.12 3dxj h VAL 342 Ca 0.03 -0.13 0.02 0.00 0.82 0.00 0.00 66.70 67.45 3dxj h VAL 342 Cb 0.58 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.29 3dxj h VAL 342 CO -0.00 0.00 -0.51 0.44 0.02 0.00 0.00 177.57 177.52 3dxj h ASP 343 N -0.20 -1.57 -0.78 0.57 3.32 -1.76 0.83 116.42 116.84 3dxj h ASP 343 Ca -0.01 0.18 0.07 0.00 0.02 0.00 0.00 57.03 57.29 3dxj h ASP 343 Cb 0.05 0.60 -0.09 0.00 0.22 0.00 0.00 39.33 40.11 3dxj h ASP 343 CO 0.01 -0.51 -0.46 0.00 -1.72 0.00 0.00 179.24 176.56 3dxj n ALA 344 N -2.95 -0.50 0.15 3.45 0.00 0.11 0.83 120.51 121.59 3dxj n ALA 344 Ca -0.07 0.66 -0.14 0.00 0.00 0.00 0.00 53.44 53.89 3dxj n ALA 344 Cb 0.39 -0.09 -0.08 0.00 0.00 0.00 0.00 19.45 19.68 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 0.34 -0.32 -1.35 0.00 0.00 -0.73 0.13 119.26 117.34 3dxj h ALA 345 Ca 0.12 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3dxj h ALA 345 Cb 0.32 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3dxj h ALA 345 CO -0.73 -0.64 0.00 2.41 0.00 0.00 0.00 179.25 180.29 3dxj n THR 346 N -5.19 0.00 -0.39 0.00 -1.04 0.28 0.30 114.28 108.24 3dxj n THR 346 Ca -0.09 1.28 0.39 0.00 -2.04 0.00 0.00 64.05 63.58 3dxj n THR 346 Cb 0.17 -1.95 0.74 0.00 -1.82 0.00 0.00 70.33 67.48 3dxj n THR 346 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 3dxj h GLN 347 N 0.00 0.00 0.04 -2.82 4.20 0.42 1.61 115.11 118.55 3dxj h GLN 347 Ca 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 3dxj h GLN 347 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3dxj h GLN 347 CO 0.00 0.00 -0.02 0.66 -0.67 0.00 0.00 178.83 178.80 3dxj h SER 348 N 0.00 -0.04 0.05 1.46 4.64 0.25 -2.88 113.55 117.03 3dxj h SER 348 Ca 0.63 -0.63 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dxj h SER 348 Cb 2.66 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 64.76 3dxj h SER 348 CO -0.01 0.65 0.00 -0.11 -0.87 0.00 0.00 176.83 176.49 3dxj n LEU 349 N -4.78 0.00 -0.01 5.97 7.94 0.89 -3.01 117.00 124.00 3dxj n LEU 349 Ca -0.09 0.37 -0.00 0.00 -1.11 0.00 0.00 56.01 55.18 3dxj n LEU 349 Cb 0.33 -0.37 -0.00 0.00 0.53 0.00 0.00 43.42 43.91 3dxj n LEU 349 CO 0.31 -0.34 -0.03 0.25 -1.11 0.00 0.00 177.39 176.47 3dxj h LEU 350 N 0.00 0.00 -0.26 -1.96 5.85 0.32 -3.36 115.31 115.90 3dxj h LEU 350 Ca 0.00 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.80 3dxj h LEU 350 Cb 0.03 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 3dxj h LEU 350 CO 0.00 0.14 0.98 -1.20 -0.34 0.00 0.00 178.44 178.02 3dxj n SER 351 N -2.72 0.00 0.00 1.25 7.64 -1.15 -2.26 113.62 116.38 3dxj n SER 351 Ca -0.01 0.52 0.00 0.00 1.01 0.00 0.00 58.87 60.40 3dxj n SER 351 Cb 0.02 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 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 -2.54 0.00 -0.41 1.43 1.02 -1.25 -2.15 120.64 116.74 3dxj n GLU 352 Ca 0.06 0.00 0.33 0.00 -0.02 0.00 0.00 57.16 57.52 3dxj n GLU 352 Cb 1.06 -0.09 0.53 0.00 -0.02 0.00 0.00 31.44 32.91 3dxj n GLU 352 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3dxj n GLU 353 N 0.00 -0.02 0.00 3.49 4.71 -1.12 0.29 120.64 128.00 3dxj n GLU 353 Ca 0.00 0.85 0.00 0.00 -0.01 0.00 0.00 57.16 58.00 3dxj n GLU 353 Cb 0.00 -1.78 0.00 0.00 -1.01 0.00 0.00 31.44 28.65 3dxj n GLU 353 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3dxj n LEU 354 N -3.81 0.00 -0.44 -4.62 4.77 -0.96 -1.54 117.00 110.40 3dxj n LEU 354 Ca 0.30 0.35 0.40 0.00 -0.03 0.00 0.00 56.01 57.04 3dxj n LEU 354 Cb 1.25 0.00 0.77 0.00 -2.33 0.00 0.00 43.42 43.11 3dxj n LEU 354 CO 0.21 0.00 1.37 1.05 -1.33 0.00 0.00 177.39 178.69 3dxj h GLU 355 N 0.00 0.01 0.00 3.23 9.09 0.37 -2.49 114.58 124.79 3dxj h GLU 355 Ca 0.00 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3dxj h GLU 355 Cb 0.00 -0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3dxj h GLU 355 CO 0.00 0.01 0.00 1.63 0.05 0.00 0.00 179.01 180.70 3dxj n LYS 356 N -4.13 0.00 -0.34 1.06 5.02 0.96 -1.21 118.16 119.52 3dxj n LYS 356 Ca 0.31 0.07 0.22 0.00 -2.02 0.00 0.00 58.31 56.89 3dxj n LYS 356 Cb 1.47 -0.58 0.45 0.00 -0.02 0.00 0.00 35.03 36.35 3dxj n LYS 356 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dxj h ALA 357 N -2.70 1.90 -0.97 7.82 0.00 -1.24 0.15 119.26 124.22 3dxj h ALA 357 Ca 0.00 0.17 0.34 0.00 0.00 0.00 0.00 54.91 55.42 3dxj h ALA 357 Cb 0.00 0.12 -0.18 0.00 0.00 0.00 0.00 17.79 17.73 3dxj h ALA 357 CO 0.00 -0.48 0.27 -0.11 0.00 0.00 0.00 179.25 178.93 3dxj n LEU 358 N -5.01 0.11 0.23 0.00 7.94 -0.58 -2.37 117.00 117.33 3dxj n LEU 358 Ca 0.30 1.63 -0.12 0.00 -1.11 0.00 0.00 56.01 56.71 3dxj n LEU 358 Cb 0.91 -0.69 -0.06 0.00 0.53 0.00 0.00 43.42 44.10 3dxj n LEU 358 CO 0.11 -1.74 0.52 0.77 -1.11 0.00 0.00 177.39 175.94 3dxj h SER 359 N 0.00 -0.87 0.00 1.96 4.64 0.51 -2.96 113.55 116.83 3dxj h SER 359 Ca 0.71 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 62.09 3dxj h SER 359 Cb 1.70 0.28 0.00 0.00 -0.31 0.00 0.00 62.40 64.06 3dxj h SER 359 CO -0.83 -0.46 0.00 0.29 -0.87 0.00 0.00 176.83 174.95 3dxj n LYS 360 N -4.39 0.00 -2.57 4.77 4.76 -1.00 -4.70 118.16 115.03 3dxj n LYS 360 Ca -0.09 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.11 3dxj n LYS 360 Cb 0.31 -1.30 0.12 0.00 -1.84 0.00 0.00 35.03 32.33 3dxj n LYS 360 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3dxj s LEU 361 N -1.19 2.92 -0.67 -0.35 2.96 -1.12 -4.98 118.68 116.25 3dxj s LEU 361 Ca 0.00 -0.44 -0.26 0.00 -0.22 0.00 0.00 54.13 53.21 3dxj s LEU 361 Cb 0.00 -1.79 -0.03 0.00 0.50 0.00 0.00 46.19 44.87 3dxj s LEU 361 CO 0.00 -2.03 1.95 -0.94 -1.32 0.00 0.00 176.35 174.01 3dxj s SER 362 N -4.80 5.12 0.00 3.68 1.04 -1.26 -4.92 113.70 112.56 3dxj s SER 362 Ca 0.68 0.16 0.00 0.00 0.48 0.00 0.00 55.95 57.27 3dxj s SER 362 Cb -0.04 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.54 3dxj s SER 362 CO 0.46 -2.55 0.00 1.21 0.98 0.00 0.00 173.24 173.33 3dxj n GLU 363 N 9.09 0.00 0.00 4.02 2.13 -1.26 0.13 120.64 134.75 3dxj n GLU 363 Ca 0.27 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.09 3dxj n GLU 363 Cb 0.51 -0.01 0.00 0.00 0.27 0.00 0.00 31.44 32.21 3dxj n GLU 363 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3dxj n ARG 364 N 0.00 0.00 0.00 5.31 5.12 -1.26 -0.98 116.66 124.85 3dxj n ARG 364 Ca 0.00 0.93 0.00 0.00 -1.93 0.00 0.00 57.85 56.85 3dxj n ARG 364 Cb 0.00 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 29.81 3dxj n ARG 364 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 3dxj n GLU 365 N -2.84 0.00 -0.05 5.56 1.02 -1.07 -1.95 120.64 121.30 3dxj n GLU 365 Ca 0.00 0.40 -0.02 0.00 -0.02 0.00 0.00 57.16 57.52 3dxj n GLU 365 Cb 0.00 -1.53 -0.01 0.00 -0.02 0.00 0.00 31.44 29.87 3dxj n GLU 365 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dxj h ALA 366 N 1.85 0.00 -0.74 0.62 0.00 0.29 -3.37 119.26 117.92 3dxj h ALA 366 Ca 0.00 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 54.89 3dxj h ALA 366 Cb 0.06 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 3dxj h ALA 366 CO 0.00 0.06 0.49 0.00 0.00 0.00 0.00 179.25 179.80 3dxj h MET 367 N -1.00 0.65 0.00 0.00 -0.00 -1.00 -3.37 114.93 110.21 3dxj h MET 367 Ca -0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 59.70 59.66 3dxj h MET 367 Cb 0.16 -0.15 0.00 0.00 -0.00 0.00 0.00 31.60 31.61 3dxj h MET 367 CO -0.00 0.43 0.00 1.33 -0.00 0.00 0.00 176.91 178.67 3dxj n VAL 368 N -4.49 0.00 0.00 -0.10 0.24 -0.99 0.27 118.33 113.26 3dxj n VAL 368 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.42 3dxj n VAL 368 Cb 0.32 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.69 3dxj n VAL 368 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3dxj n LEU 369 N 0.00 0.00 -0.25 1.34 4.77 -1.26 0.27 117.00 121.87 3dxj n LEU 369 Ca 0.00 0.86 -0.05 0.00 -0.03 0.00 0.00 56.01 56.79 3dxj n LEU 369 Cb 0.00 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 3dxj n LEU 369 CO 0.00 -0.39 0.61 0.07 -1.33 0.00 0.00 177.39 176.35 3dxj h LYS 370 N 0.00 -0.13 -0.76 3.23 2.10 -1.37 1.26 116.57 120.89 3dxj h LYS 370 Ca 0.00 0.01 0.13 0.00 -2.00 0.00 0.00 60.65 58.79 3dxj h LYS 370 Cb 0.00 0.03 -0.13 0.00 -0.90 0.00 0.00 32.23 31.23 3dxj h LYS 370 CO 0.00 -0.09 -0.35 -0.07 -2.00 0.00 0.00 179.45 176.94 3dxj h LEU 371 N -0.14 -1.26 0.49 7.07 3.38 0.59 4.31 115.31 129.75 3dxj h LEU 371 Ca 0.25 0.26 -0.02 0.00 0.09 0.00 0.00 57.88 58.45 3dxj h LEU 371 Cb 0.56 0.65 0.00 0.00 0.09 0.00 0.00 40.66 41.97 3dxj h LEU 371 CO -0.75 -0.30 -0.24 -0.09 0.09 0.00 0.00 178.44 177.15 3dxj h ARG 372 N -0.09 -0.64 0.00 1.13 9.65 0.50 -2.83 114.38 122.10 3dxj h ARG 372 Ca 0.28 0.04 -0.31 0.00 -1.10 0.00 0.00 59.98 58.89 3dxj h ARG 372 Cb 0.57 0.15 -0.05 0.00 -1.39 0.00 0.00 29.97 29.25 3dxj h ARG 372 CO -0.81 -0.43 -2.00 1.17 2.80 0.00 0.00 179.97 180.70 3dxj n LYS 373 N -4.14 0.57 -0.18 0.20 0.00 0.36 0.14 118.16 115.11 3dxj n LYS 373 Ca -0.08 0.27 0.29 0.00 0.00 0.00 0.00 58.31 58.79 3dxj n LYS 373 Cb 0.26 -1.49 0.59 0.00 0.00 0.00 0.00 35.03 34.39 3dxj n LYS 373 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 3dxj h GLY 374 N -1.00 0.00 0.00 3.14 0.00 0.21 -3.29 103.07 102.13 3dxj h GLY 374 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 3dxj h GLY 374 CO -0.29 0.00 0.00 -0.10 0.00 0.00 0.00 176.54 176.15 3dxj n LEU 375 N -3.50 0.00 0.00 3.11 7.94 1.30 -4.88 117.00 120.97 3dxj n LEU 375 Ca 0.21 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.11 3dxj n LEU 375 Cb 1.30 0.00 0.00 0.00 0.53 0.00 0.00 43.42 45.25 3dxj n LEU 375 CO 0.28 0.00 0.00 -0.38 -1.11 0.00 0.00 177.39 176.18 3dxj n ILE 376 N 0.00 0.00 -3.64 1.96 5.41 -1.07 -5.00 119.36 117.02 3dxj n ILE 376 Ca 0.00 0.31 -0.04 0.00 1.00 0.00 0.00 62.75 64.02 3dxj n ILE 376 Cb 0.00 -1.10 -0.06 0.00 -0.71 0.00 0.00 39.64 37.77 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 -2.41 -0.11 0.00 4.38 -1.08 0.36 -4.85 116.67 112.96 3dxj s ASP 377 Ca 0.00 0.18 0.00 0.00 -0.52 0.00 0.00 52.55 52.21 3dxj s ASP 377 Cb 0.00 0.17 0.00 0.00 -1.46 0.00 0.00 42.92 41.63 3dxj s ASP 377 CO 0.00 -0.06 0.00 0.61 0.52 0.00 0.00 175.17 176.24 3dxj n GLY 378 N 1.22 -0.32 3.58 2.66 0.00 -1.26 -4.23 105.19 106.84 3dxj n GLY 378 Ca -0.07 -0.92 -0.34 0.00 0.00 0.00 0.00 46.02 44.69 3dxj n GLY 378 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3dxj s ARG 379 N -1.68 3.58 -1.46 1.61 1.04 -1.26 -2.05 118.95 118.73 3dxj s ARG 379 Ca 0.00 -0.45 -0.03 0.00 -1.04 0.00 0.00 55.73 54.21 3dxj s ARG 379 Cb 0.00 -2.96 0.00 0.00 -2.04 0.00 0.00 34.95 29.96 3dxj s ARG 379 CO 0.00 0.36 0.46 -1.91 -0.04 0.00 0.00 175.30 174.17 3dxj n GLU 380 N 3.20 -3.95 -1.24 3.89 2.13 -1.26 -4.87 120.64 118.54 3dxj n GLU 380 Ca -0.17 0.85 -0.22 0.00 0.66 0.00 0.00 57.16 58.28 3dxj n GLU 380 Cb 0.53 -5.52 -0.04 0.00 0.27 0.00 0.00 31.44 26.68 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 -4.34 1.35 0.00 4.31 8.25 -1.26 -4.82 115.22 118.71 3dxj n HIS 381 Ca -0.13 -1.87 0.00 0.00 -0.26 0.00 0.00 57.72 55.46 3dxj n HIS 381 Cb 0.62 -1.27 0.00 0.00 1.12 0.00 0.00 29.99 30.47 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 0.93 0.00 -0.56 1.59 -1.04 -1.26 0.31 114.28 114.25 3dxj n THR 382 Ca 0.42 0.00 0.45 0.00 -2.04 0.00 0.00 64.05 62.87 3dxj n THR 382 Cb 0.60 0.00 0.73 0.00 -1.82 0.00 0.00 70.33 69.84 3dxj n THR 382 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3dxj h LEU 383 N 0.00 0.13 0.00 -4.42 3.38 -1.94 1.39 115.31 113.84 3dxj h LEU 383 Ca 0.00 0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 3dxj h LEU 383 Cb 0.00 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3dxj h LEU 383 CO 0.00 -0.16 -0.41 -0.33 0.09 0.00 0.00 178.44 177.63 3dxj h GLU 384 N 0.01 0.00 -1.31 1.13 5.08 0.43 -3.32 114.58 116.61 3dxj h GLU 384 Ca 0.90 0.00 0.38 0.00 -1.00 0.00 0.00 59.36 59.63 3dxj h GLU 384 Cb 3.16 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 32.34 3dxj h GLU 384 CO -0.29 0.81 0.92 0.93 -1.00 0.00 0.00 179.01 180.38 3dxj h GLU 385 N -1.00 0.07 0.68 2.33 5.08 0.22 0.34 114.58 122.29 3dxj h GLU 385 Ca -0.10 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.22 3dxj h GLU 385 Cb 0.93 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 30.18 3dxj h GLU 385 CO -0.06 0.04 -0.33 -0.39 -1.00 0.00 0.00 179.01 177.27 3dxj h VAL 386 N 0.07 0.00 0.00 3.13 -1.51 0.63 0.13 116.25 118.70 3dxj h VAL 386 Ca 0.65 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 66.10 3dxj h VAL 386 Cb 2.43 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 31.59 3dxj h VAL 386 CO -0.09 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.86 3dxj n GLY 387 N -1.35 -1.04 0.13 5.19 0.00 -0.67 -0.78 105.19 106.68 3dxj n GLY 387 Ca -0.11 -0.05 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 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 2.54 0.13 0.00 4.61 0.00 0.30 -1.99 119.26 124.85 3dxj h ALA 388 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3dxj h ALA 388 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3dxj h ALA 388 CO 0.00 0.20 0.00 0.34 0.00 0.00 0.00 179.25 179.79 3dxj n PHE 389 N -4.42 0.00 -3.04 0.00 7.35 0.38 -4.88 117.46 112.85 3dxj n PHE 389 Ca -0.08 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.49 3dxj n PHE 389 Cb 0.51 -0.20 0.04 0.00 0.35 0.00 0.00 39.48 40.18 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 -1.20 -1.43 0.00 -5.13 3.01 -0.73 -4.87 117.46 107.10 3dxj n PHE 390 Ca 0.17 0.50 0.00 0.00 1.01 0.00 0.00 57.45 59.13 3dxj n PHE 390 Cb 0.19 -3.01 0.00 0.00 -0.01 0.00 0.00 39.48 36.66 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 -1.25 -1.25 1.67 1.37 0.00 0.04 -4.94 105.19 100.82 3dxj n GLY 391 Ca 0.00 0.72 -0.24 0.00 0.00 0.00 0.00 46.02 46.50 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 0.80 -1.95 1.61 0.31 -1.26 -4.53 118.33 113.31 3dxj n VAL 392 Ca 0.00 -0.20 -0.32 0.00 -0.01 0.00 0.00 64.34 63.81 3dxj n VAL 392 Cb 0.00 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 32.94 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 -0.40 4.09 0.45 2.52 2.01 -1.26 -4.39 115.64 118.66 3dxj s THR 393 Ca 0.34 0.87 0.24 0.00 0.31 0.00 0.00 61.69 63.44 3dxj s THR 393 Cb -0.48 -3.50 0.43 0.00 0.01 0.00 0.00 72.50 68.96 3dxj s THR 393 CO 0.27 -0.71 1.82 0.08 -0.69 0.00 0.00 174.62 175.40 3dxj h ARG 394 N 0.11 0.25 -0.70 4.92 0.11 -1.90 0.54 114.38 117.70 3dxj h ARG 394 Ca -0.46 -0.02 0.15 0.00 0.10 0.00 0.00 59.98 59.76 3dxj h ARG 394 Cb 1.21 -0.06 -0.11 0.00 1.11 0.00 0.00 29.97 32.12 3dxj h ARG 394 CO 0.58 0.17 0.09 1.49 0.10 0.00 0.00 179.97 182.40 3dxj h GLU 395 N 0.26 0.18 -0.34 0.08 4.22 -1.98 -0.02 114.58 116.99 3dxj h GLU 395 Ca 0.53 -0.01 -0.17 0.00 0.08 0.00 0.00 59.36 59.79 3dxj h GLU 395 Cb 1.59 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.80 3dxj h GLU 395 CO -0.17 0.12 -0.44 -0.09 -2.18 0.00 0.00 179.01 176.25 3dxj h ARG 396 N 0.18 0.88 -0.76 1.92 2.43 -1.25 -3.25 114.38 114.53 3dxj h ARG 396 Ca 0.39 -0.49 0.13 0.00 -0.81 0.00 0.00 59.98 59.20 3dxj h ARG 396 Cb 0.66 0.03 -0.09 0.00 -0.42 0.00 0.00 29.97 30.15 3dxj h ARG 396 CO -0.55 1.13 0.34 0.82 -1.51 0.00 0.00 179.97 180.20 3dxj h ILE 397 N 0.70 0.72 -0.49 1.20 2.04 -0.89 -1.11 117.51 119.69 3dxj h ILE 397 Ca 0.04 -0.18 0.09 0.00 1.00 0.00 0.00 64.86 65.81 3dxj h ILE 397 Cb 1.03 0.16 -0.10 0.00 -0.74 0.00 0.00 36.82 37.17 3dxj h ILE 397 CO 0.10 0.09 -0.37 -0.09 0.00 0.00 0.00 178.15 177.89 3dxj h ARG 398 N 0.52 -0.23 0.49 2.37 1.12 -1.42 -2.41 114.38 114.82 3dxj h ARG 398 Ca 0.41 0.02 -0.02 0.00 -1.11 0.00 0.00 59.98 59.27 3dxj h ARG 398 Cb 0.56 0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 30.56 3dxj h ARG 398 CO -0.36 -0.15 -0.40 1.96 -3.11 0.00 0.00 179.97 177.91 3dxj h GLN 399 N -0.24 -0.83 0.00 0.20 4.20 -1.37 -3.16 115.11 113.91 3dxj h GLN 399 Ca 0.19 0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.95 3dxj h GLN 399 Cb 0.56 0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.52 3dxj h GLN 399 CO -0.61 -0.55 0.00 -0.89 -0.67 0.00 0.00 178.83 176.11 3dxj n ILE 400 N -4.84 0.00 -0.03 2.54 5.41 -0.71 -1.85 119.36 119.89 3dxj n ILE 400 Ca -0.10 0.66 -0.01 0.00 1.00 0.00 0.00 62.75 64.30 3dxj n ILE 400 Cb 0.38 -1.06 -0.01 0.00 -0.71 0.00 0.00 39.64 38.24 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 -0.58 -0.03 0.00 0.38 2.13 -1.08 0.13 120.64 121.59 3dxj n GLU 401 Ca 0.00 0.38 0.00 0.00 0.66 0.00 0.00 57.16 58.20 3dxj n GLU 401 Cb 0.00 -0.57 0.00 0.00 0.27 0.00 0.00 31.44 31.14 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 -2.71 0.00 -0.20 4.31 5.03 -0.77 0.25 115.26 121.17 3dxj n ASN 402 Ca 0.00 0.09 0.00 0.00 0.87 0.00 0.00 54.58 55.55 3dxj n ASN 402 Cb 0.02 0.00 0.08 0.00 -1.02 0.00 0.00 39.78 38.86 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 0.06 -0.48 3.52 1.79 -1.09 0.22 116.57 120.59 3dxj h LYS 403 Ca 0.00 -0.00 0.06 0.00 -2.18 0.00 0.00 60.65 58.52 3dxj h LYS 403 Cb 0.00 -0.01 -0.09 0.00 -1.58 0.00 0.00 32.23 30.55 3dxj h LYS 403 CO 0.00 0.04 -0.56 0.00 -1.08 0.00 0.00 179.45 177.86 3dxj h ALA 404 N 1.58 -0.74 -1.85 3.86 0.00 0.21 0.89 119.26 123.21 3dxj h ALA 404 Ca 0.31 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3dxj h ALA 404 Cb 0.50 1.14 0.00 0.00 0.00 0.00 0.00 17.79 19.43 3dxj h ALA 404 CO -0.57 -1.03 0.00 1.28 0.00 0.00 0.00 179.25 178.93 3dxj n LEU 405 N -5.37 0.00 -0.00 0.00 4.77 0.68 -3.26 117.00 113.82 3dxj n LEU 405 Ca -0.03 0.69 -0.00 0.00 -0.03 0.00 0.00 56.01 56.64 3dxj n LEU 405 Cb 0.33 -0.19 -0.00 0.00 -2.33 0.00 0.00 43.42 41.23 3dxj n LEU 405 CO -0.01 -0.19 0.36 0.54 -1.33 0.00 0.00 177.39 176.76 3dxj n ARG 406 N -1.24 -0.00 -0.24 3.23 1.74 0.65 -0.54 116.66 120.26 3dxj n ARG 406 Ca 0.00 0.73 0.22 0.00 -0.77 0.00 0.00 57.85 58.03 3dxj n ARG 406 Cb 0.00 -1.09 0.41 0.00 -1.02 0.00 0.00 32.46 30.76 3dxj n ARG 406 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3dxj n LYS 407 N -2.75 -0.05 0.00 5.56 4.76 0.31 -1.86 118.16 124.12 3dxj n LYS 407 Ca 0.00 1.01 0.00 0.00 -2.87 0.00 0.00 58.31 56.45 3dxj n LYS 407 Cb 0.00 -1.80 0.00 0.00 -1.84 0.00 0.00 35.03 31.39 3dxj n LYS 407 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 3dxj n LEU 408 N -4.68 0.60 0.00 -0.35 7.94 0.30 -3.16 117.00 117.65 3dxj n LEU 408 Ca 0.27 0.55 0.00 0.00 -1.11 0.00 0.00 56.01 55.72 3dxj n LEU 408 Cb 0.90 -0.30 0.00 0.00 0.53 0.00 0.00 43.42 44.55 3dxj n LEU 408 CO 0.00 -0.30 0.30 2.29 -1.11 0.00 0.00 177.39 178.57 3dxj n LYS 409 N -1.39 0.00 -0.15 1.96 2.85 -0.78 0.72 118.16 121.37 3dxj n LYS 409 Ca 0.00 0.60 0.16 0.00 -1.05 0.00 0.00 58.31 58.02 3dxj n LYS 409 Cb 0.00 -0.91 0.53 0.00 -0.65 0.00 0.00 35.03 34.00 3dxj n LYS 409 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 177.40 179.23 3dxj h TYR 410 N 0.00 0.44 0.00 5.58 -1.99 -1.76 1.29 116.97 120.52 3dxj h TYR 410 Ca 0.00 0.01 -0.10 0.00 2.00 0.00 0.00 58.73 60.65 3dxj h TYR 410 Cb 0.00 -0.14 -0.01 0.00 2.00 0.00 0.00 36.73 38.58 3dxj h TYR 410 CO -0.54 0.16 -0.46 1.25 -0.00 0.00 0.00 178.16 178.57 3dxj h HIS 411 N 0.37 0.00 -0.00 4.88 -0.00 -0.02 -1.03 115.15 119.35 3dxj h HIS 411 Ca 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.74 3dxj h HIS 411 Cb 0.90 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.31 3dxj h HIS 411 CO -0.00 0.46 -0.06 0.39 -0.00 0.00 0.00 177.93 178.72 3dxj n GLU 412 N -3.65 0.15 0.07 5.26 -0.58 0.41 -2.06 120.64 120.24 3dxj n GLU 412 Ca -0.01 -0.02 0.07 0.00 -0.42 0.00 0.00 57.16 56.78 3dxj n GLU 412 Cb 0.54 -1.50 0.33 0.00 -0.57 0.00 0.00 31.44 30.25 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 -1.41 0.29 0.00 1.62 7.64 0.82 -2.22 113.62 120.36 3dxj n SER 413 Ca 0.09 0.61 0.00 0.00 1.01 0.00 0.00 58.87 60.58 3dxj n SER 413 Cb 0.31 -0.66 0.00 0.00 -1.01 0.00 0.00 64.21 62.86 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 -1.86 0.00 -2.38 1.43 3.00 -0.88 -4.61 116.66 111.36 3dxj n ARG 414 Ca 0.01 0.20 -0.37 0.00 -0.01 0.00 0.00 57.85 57.67 3dxj n ARG 414 Cb 0.09 -0.64 -0.03 0.00 0.00 0.00 0.00 32.46 31.88 3dxj n ARG 414 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 3dxj s THR 415 N -0.80 3.86 -0.33 0.55 2.01 -0.94 -4.92 115.64 115.07 3dxj s THR 415 Ca 0.00 -1.29 -0.29 0.00 0.31 0.00 0.00 61.69 60.42 3dxj s THR 415 Cb 0.00 -4.89 -0.01 0.00 0.01 0.00 0.00 72.50 67.61 3dxj s THR 415 CO 0.00 -1.62 1.69 -0.13 -0.69 0.00 0.00 174.62 173.87 3dxj s ARG 416 N 5.25 3.46 0.00 4.92 1.81 -1.12 -4.74 118.95 128.52 3dxj s ARG 416 Ca 0.58 1.36 0.00 0.00 -1.72 0.00 0.00 55.73 55.96 3dxj s ARG 416 Cb 0.01 -4.14 0.00 0.00 -0.45 0.00 0.00 34.95 30.37 3dxj s ARG 416 CO 0.05 -1.71 0.00 1.63 -0.68 0.00 0.00 175.30 174.60 3dxj n LYS 417 N 8.24 0.00 0.23 3.54 5.02 -1.26 -4.82 118.16 129.11 3dxj n LYS 417 Ca 0.21 0.00 0.18 0.00 -2.02 0.00 0.00 58.31 56.68 3dxj n LYS 417 Cb 0.47 0.00 0.84 0.00 -0.02 0.00 0.00 35.03 36.31 3dxj n LYS 417 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3dxj h LEU 418 N 0.00 0.00 0.00 -0.35 4.07 -1.96 -3.20 115.31 113.87 3dxj h LEU 418 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3dxj h LEU 418 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 3dxj h LEU 418 CO 0.00 0.00 0.00 -1.14 -1.08 0.00 0.00 178.44 176.22 3dxj n ARG 419 N -3.38 0.00 -1.79 1.13 3.00 -1.26 -0.34 116.66 114.02 3dxj n ARG 419 Ca 0.02 0.50 -0.20 0.00 -0.00 0.00 0.00 57.85 58.16 3dxj n ARG 419 Cb 0.41 -0.77 -0.09 0.00 0.00 0.00 0.00 32.46 32.01 3dxj n ARG 419 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 3dxj s ASP 420 N -2.73 4.09 0.17 6.15 1.01 -1.21 -4.80 116.67 119.35 3dxj s ASP 420 Ca 0.00 -1.18 -0.33 0.00 0.71 0.00 0.00 52.55 51.75 3dxj s ASP 420 Cb 0.00 -2.59 -0.15 0.00 1.01 0.00 0.00 42.92 41.18 3dxj s ASP 420 CO 0.00 -4.04 1.24 0.33 0.21 0.00 0.00 175.17 172.91 3dxj n PHE 421 N 17.51 1.49 1.69 4.23 7.35 0.54 -5.07 117.46 145.21 3dxj n PHE 421 Ca 0.43 0.62 0.13 0.00 -0.76 0.00 0.00 57.45 57.87 3dxj n PHE 421 Cb 0.47 -2.32 0.80 0.00 0.35 0.00 0.00 39.48 38.77 3dxj n PHE 421 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28