#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b6j s GLN 102 N 0.00 3.33 -0.22 0.54 0.74 -1.26 -5.10 119.66 117.69 1b6j s GLN 102 Ca 0.00 -0.68 -0.05 0.00 0.05 0.00 0.00 55.36 54.68 1b6j s GLN 102 Cb 0.00 -2.78 -0.02 0.00 1.10 0.00 0.00 33.01 31.32 1b6j s GLN 102 CO 0.00 -0.01 -0.02 0.42 -0.55 0.00 0.00 175.29 175.13 1b6j s ILE 103 N 0.94 3.67 0.64 -2.34 1.01 -1.26 -5.11 121.20 118.75 1b6j s ILE 103 Ca -0.02 -0.40 -0.08 0.00 0.00 0.00 0.00 60.65 60.15 1b6j s ILE 103 Cb -0.15 -2.67 0.01 0.00 0.01 0.00 0.00 42.46 39.66 1b6j s ILE 103 CO -0.01 0.42 0.99 0.42 0.00 0.00 0.00 174.94 176.76 1b6j s THR 104 N 1.32 3.56 -0.23 2.92 -4.23 -1.26 -5.02 115.64 112.70 1b6j s THR 104 Ca 0.04 0.21 0.14 0.00 -1.18 0.00 0.00 61.69 60.90 1b6j s THR 104 Cb -0.14 -3.46 0.60 0.00 1.34 0.00 0.00 72.50 70.83 1b6j s THR 104 CO -0.00 -0.53 1.54 0.18 -0.54 0.00 0.00 174.62 175.26 1b6j n LEU 105 N -2.77 4.55 -0.06 4.79 4.77 -1.26 -4.52 117.00 122.50 1b6j n LEU 105 Ca 0.06 -3.19 0.00 0.00 -0.03 0.00 0.00 56.01 52.85 1b6j n LEU 105 Cb 0.57 -0.62 0.30 0.00 -2.33 0.00 0.00 43.42 41.35 1b6j n LEU 105 CO 0.55 0.80 1.04 -0.50 -1.33 0.00 0.00 177.39 177.95 1b6j h TRP 106 N 2.02 0.66 -2.33 -1.77 4.06 -2.06 -3.43 115.95 113.10 1b6j h TRP 106 Ca 0.09 -0.03 -0.55 0.00 2.06 0.00 0.00 58.89 60.46 1b6j h TRP 106 Cb 1.72 -0.20 -0.14 0.00 -1.00 0.00 0.00 29.16 29.54 1b6j h TRP 106 CO 0.80 0.53 -0.68 -0.65 -3.56 0.00 0.00 178.44 174.89 1b6j s GLN 107 N -5.26 1.67 0.24 0.49 1.11 -1.26 -5.10 119.66 111.55 1b6j s GLN 107 Ca -0.09 -1.86 -0.31 0.00 0.01 0.00 0.00 55.36 53.11 1b6j s GLN 107 Cb 0.16 -1.40 -0.12 0.00 -1.01 0.00 0.00 33.01 30.64 1b6j s GLN 107 CO 0.77 0.08 1.66 0.54 0.01 0.00 0.00 175.29 178.34 1b6j n ARG 108 N -0.68 2.70 -1.83 2.91 1.74 -1.26 -4.84 116.66 115.40 1b6j n ARG 108 Ca -0.05 0.97 -0.37 0.00 -0.77 0.00 0.00 57.85 57.62 1b6j n ARG 108 Cb 0.63 -2.78 -0.04 0.00 -1.02 0.00 0.00 32.46 29.25 1b6j n ARG 108 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1b6j n PRO 109 N 3.13 2.00 -3.41 5.56 -0.04 -1.26 -4.93 135.00 136.04 1b6j n PRO 109 Ca 0.13 -2.43 -0.38 0.00 -0.04 0.00 0.00 63.50 60.78 1b6j n PRO 109 Cb 0.35 -3.38 -0.06 0.00 -0.04 0.00 0.00 33.50 30.37 1b6j n PRO 109 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1b6j s LEU 110 N 5.68 4.34 0.20 1.53 1.43 -1.26 -1.34 118.68 129.26 1b6j s LEU 110 Ca 0.60 0.81 0.00 0.00 -1.03 0.00 0.00 54.13 54.51 1b6j s LEU 110 Cb 0.07 -2.60 -0.04 0.00 0.03 0.00 0.00 46.19 43.64 1b6j s LEU 110 CO 0.10 0.13 0.08 0.68 0.23 0.00 0.00 176.35 177.56 1b6j s VAL 111 N 0.02 0.35 -0.01 -1.59 -7.23 0.09 -4.91 120.40 107.12 1b6j s VAL 111 Ca 0.23 -1.98 -0.20 0.00 -1.81 0.00 0.00 61.98 58.23 1b6j s VAL 111 Cb -0.15 -2.37 -0.05 0.00 0.56 0.00 0.00 36.38 34.37 1b6j s VAL 111 CO 0.10 -0.20 0.57 -0.89 -0.31 0.00 0.00 175.10 174.37 1b6j s THR 112 N -3.89 4.93 0.21 5.32 2.01 -1.26 -0.44 115.64 122.51 1b6j s THR 112 Ca 0.32 1.20 0.07 0.00 0.31 0.00 0.00 61.69 63.59 1b6j s THR 112 Cb 0.07 -3.91 -0.05 0.00 0.01 0.00 0.00 72.50 68.62 1b6j s THR 112 CO 0.09 0.43 -0.11 0.27 -0.69 0.00 0.00 174.62 174.60 1b6j s ILE 113 N -0.22 1.55 -0.09 1.82 -4.36 0.11 -4.65 121.20 115.36 1b6j s ILE 113 Ca 0.30 -2.15 0.01 0.00 -0.26 0.00 0.00 60.65 58.55 1b6j s ILE 113 Cb -0.18 -2.09 0.02 0.00 1.25 0.00 0.00 42.46 41.46 1b6j s ILE 113 CO 0.17 -0.56 -0.10 -0.60 0.24 0.00 0.00 174.94 174.08 1b6j s ARG 114 N -3.70 1.67 -0.09 0.37 3.52 -0.09 -0.44 118.95 120.19 1b6j s ARG 114 Ca 0.23 -0.36 -0.06 0.00 -0.13 0.00 0.00 55.73 55.41 1b6j s ARG 114 Cb 0.01 -1.53 0.03 0.00 -1.56 0.00 0.00 34.95 31.91 1b6j s ARG 114 CO 0.06 -0.11 0.23 -1.50 -0.81 0.00 0.00 175.30 173.17 1b6j s ILE 115 N 1.14 -0.02 -1.47 4.11 2.07 -0.29 -1.41 121.20 125.33 1b6j s ILE 115 Ca -0.05 0.08 -0.05 0.00 -1.41 0.00 0.00 60.65 59.21 1b6j s ILE 115 Cb -0.14 -0.34 0.02 0.00 0.13 0.00 0.00 42.46 42.13 1b6j s ILE 115 CO -0.02 0.03 0.52 0.61 -1.91 0.00 0.00 174.94 174.17 1b6j n GLY 116 N 3.59 -0.51 3.00 1.50 0.00 -1.26 -1.26 105.19 110.24 1b6j n GLY 116 Ca -0.19 0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1b6j n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b6j n GLY 117 N -1.37 2.94 3.90 -0.02 0.00 -1.26 -5.01 105.19 104.37 1b6j n GLY 117 Ca -0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 1b6j n GLY 117 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b6j s GLN 118 N -0.02 3.49 -0.15 1.61 -0.21 -0.39 -5.10 119.66 118.89 1b6j s GLN 118 Ca 0.00 -0.26 -0.11 0.00 0.02 0.00 0.00 55.36 55.01 1b6j s GLN 118 Cb 0.00 -3.07 -0.05 0.00 1.00 0.00 0.00 33.01 30.89 1b6j s GLN 118 CO 0.00 0.65 0.22 -0.51 -2.12 0.00 0.00 175.29 173.53 1b6j s LEU 119 N -2.00 4.29 0.12 2.90 1.43 -1.26 -1.14 118.68 123.01 1b6j s LEU 119 Ca 0.29 0.46 -0.02 0.00 -1.03 0.00 0.00 54.13 53.83 1b6j s LEU 119 Cb -0.13 -2.24 -0.04 0.00 0.03 0.00 0.00 46.19 43.82 1b6j s LEU 119 CO 0.19 0.22 0.06 -0.54 0.23 0.00 0.00 176.35 176.51 1b6j s LYS 120 N -0.07 0.88 -0.20 1.70 1.02 0.41 -4.96 119.74 118.52 1b6j s LYS 120 Ca 0.14 -1.36 -0.09 0.00 0.02 0.00 0.00 55.97 54.68 1b6j s LYS 120 Cb -0.12 0.25 -0.04 0.00 -0.52 0.00 0.00 37.83 37.39 1b6j s LYS 120 CO 0.03 -0.24 0.10 -1.21 -0.92 0.00 0.00 175.35 173.11 1b6j s GLU 121 N -4.01 4.04 0.06 1.68 0.41 -1.26 0.07 118.70 119.69 1b6j s GLU 121 Ca 0.20 -0.30 0.02 0.00 -0.41 0.00 0.00 54.97 54.48 1b6j s GLU 121 Cb 0.07 -3.35 -0.03 0.00 -1.78 0.00 0.00 34.13 29.04 1b6j s GLU 121 CO -0.01 0.21 -0.07 0.00 -0.49 0.00 0.00 175.26 174.90 1b6j s ALA 122 N 0.58 0.71 -0.22 5.21 0.00 0.41 -4.47 121.76 123.99 1b6j s ALA 122 Ca 0.06 -0.97 -0.21 0.00 0.00 0.00 0.00 51.96 50.84 1b6j s ALA 122 Cb -0.12 0.09 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 1b6j s ALA 122 CO 0.01 -0.10 0.64 -1.17 0.00 0.00 0.00 175.76 175.14 1b6j s LEU 123 N -2.09 4.11 -0.48 0.00 2.96 0.69 -0.73 118.68 123.13 1b6j s LEU 123 Ca -0.02 0.79 -0.29 0.00 -0.22 0.00 0.00 54.13 54.39 1b6j s LEU 123 Cb -0.05 -2.89 0.02 0.00 0.50 0.00 0.00 46.19 43.77 1b6j s LEU 123 CO -0.01 -0.32 1.33 -0.76 -1.32 0.00 0.00 176.35 175.26 1b6j s LEU 124 N 2.18 3.54 -0.32 -0.68 1.43 -0.45 -0.65 118.68 123.73 1b6j s LEU 124 Ca 0.28 0.53 0.01 0.00 -1.03 0.00 0.00 54.13 53.92 1b6j s LEU 124 Cb -0.16 -3.38 0.08 0.00 0.03 0.00 0.00 46.19 42.76 1b6j s LEU 124 CO 0.09 -1.47 0.02 -0.62 0.23 0.00 0.00 176.35 174.60 1b6j s ASP 125 N 3.62 4.80 0.32 2.29 2.15 -0.29 -4.81 116.67 124.75 1b6j s ASP 125 Ca 0.54 -1.67 0.26 0.00 0.43 0.00 0.00 52.55 52.10 1b6j s ASP 125 Cb -0.11 -1.67 1.07 0.00 -0.30 0.00 0.00 42.92 41.92 1b6j s ASP 125 CO 0.30 -0.32 1.77 0.71 -0.17 0.00 0.00 175.17 177.46 1b6j h THR 126 N 6.57 0.00 -0.45 1.71 1.35 -1.94 -2.56 112.91 117.60 1b6j h THR 126 Ca -0.15 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 1b6j h THR 126 Cb 1.04 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.53 1b6j h THR 126 CO 0.54 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.42 1b6j n GLY 127 N -0.01 1.35 3.36 5.82 0.00 -1.26 -4.85 105.19 109.59 1b6j n GLY 127 Ca 0.02 -0.59 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 1b6j n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b6j s ALA 128 N -1.41 2.86 0.20 4.61 0.00 -0.96 -4.98 121.76 122.07 1b6j s ALA 128 Ca 0.36 -1.07 -0.04 0.00 0.00 0.00 0.00 51.96 51.20 1b6j s ALA 128 Cb 0.19 -1.66 0.15 0.00 0.00 0.00 0.00 23.12 21.80 1b6j s ALA 128 CO 0.26 -0.25 1.58 -0.44 0.00 0.00 0.00 175.76 176.91 1b6j h ASP 129 N 7.72 0.75 -1.88 0.00 3.32 -1.89 0.19 116.42 124.62 1b6j h ASP 129 Ca -0.38 -0.31 -0.62 0.00 0.02 0.00 0.00 57.03 55.74 1b6j h ASP 129 Cb 1.17 -0.21 -0.13 0.00 0.22 0.00 0.00 39.33 40.38 1b6j h ASP 129 CO 0.60 1.02 -0.66 -1.81 -1.72 0.00 0.00 179.24 176.67 1b6j s ASP 130 N -6.82 3.78 -0.27 6.45 1.01 -1.26 -3.57 116.67 115.99 1b6j s ASP 130 Ca -0.09 -1.22 -0.14 0.00 0.71 0.00 0.00 52.55 51.81 1b6j s ASP 130 Cb 0.12 -0.36 -0.04 0.00 1.01 0.00 0.00 42.92 43.65 1b6j s ASP 130 CO 0.84 -0.25 0.33 -0.89 0.21 0.00 0.00 175.17 175.41 1b6j s THR 131 N -2.63 5.21 -0.16 -1.27 2.01 -1.26 -3.41 115.64 114.14 1b6j s THR 131 Ca 0.33 0.49 0.02 0.00 0.31 0.00 0.00 61.69 62.83 1b6j s THR 131 Cb 0.04 -3.66 0.01 0.00 0.01 0.00 0.00 72.50 68.90 1b6j s THR 131 CO 0.17 0.19 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.39 1b6j s VAL 132 N 1.93 2.10 0.12 3.82 1.01 -0.08 -0.87 120.40 128.43 1b6j s VAL 132 Ca 0.13 -0.95 0.07 0.00 0.00 0.00 0.00 61.98 61.24 1b6j s VAL 132 Cb -0.16 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 1b6j s VAL 132 CO 0.10 0.54 -0.09 -0.76 0.00 0.00 0.00 175.10 174.89 1b6j s LEU 133 N 1.04 3.06 0.68 3.92 1.43 0.94 0.27 118.68 130.02 1b6j s LEU 133 Ca -0.01 -0.41 -0.15 0.00 -1.03 0.00 0.00 54.13 52.53 1b6j s LEU 133 Cb -0.14 -1.83 0.01 0.00 0.03 0.00 0.00 46.19 44.26 1b6j s LEU 133 CO -0.07 0.16 1.13 -1.83 0.23 0.00 0.00 176.35 175.97 1b6j s GLU 134 N -2.36 2.60 -0.20 1.70 -1.05 -1.26 -2.21 118.70 115.91 1b6j s GLU 134 Ca 0.22 1.45 -0.39 0.00 -0.15 0.00 0.00 54.97 56.11 1b6j s GLU 134 Cb -0.11 -1.92 -0.18 0.00 -0.44 0.00 0.00 34.13 31.49 1b6j s GLU 134 CO 0.14 -1.42 1.17 -1.91 0.95 0.00 0.00 175.26 174.20 1b6j n GLU 135 N -2.57 0.00 -3.63 -4.83 4.07 -1.11 -4.67 120.64 107.89 1b6j n GLU 135 Ca 0.11 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 57.09 1b6j n GLU 135 Cb 0.52 -1.34 -0.07 0.00 -0.06 0.00 0.00 31.44 30.48 1b6j n GLU 135 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1b6j s MET 136 N 1.22 0.79 -1.27 5.31 0.23 -1.26 -5.04 119.30 119.27 1b6j s MET 136 Ca 0.87 1.05 -0.16 0.00 -1.03 0.00 0.00 55.69 56.42 1b6j s MET 136 Cb -1.23 0.32 0.11 0.00 -1.53 0.00 0.00 34.83 32.51 1b6j s MET 136 CO 0.61 -0.11 1.64 -1.71 -2.03 0.00 0.00 175.02 173.42 1b6j n ASN 137 N 3.15 5.03 -4.76 -1.18 4.05 -1.26 -4.99 115.26 115.30 1b6j n ASN 137 Ca -0.16 -2.95 -0.40 0.00 0.45 0.00 0.00 54.58 51.53 1b6j n ASN 137 Cb 0.56 -1.67 -0.05 0.00 1.23 0.00 0.00 39.78 39.85 1b6j n ASN 137 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1b6j s LEU 138 N 2.96 4.54 0.61 1.20 1.43 -1.26 -5.03 118.68 123.14 1b6j s LEU 138 Ca 0.49 2.09 -0.13 0.00 -1.03 0.00 0.00 54.13 55.55 1b6j s LEU 138 Cb 0.02 -3.69 -0.04 0.00 0.03 0.00 0.00 46.19 42.51 1b6j s LEU 138 CO 0.04 -0.04 1.03 -2.16 0.23 0.00 0.00 176.35 175.45 1b6j s PRO 139 N -1.46 3.49 0.00 1.29 0.04 -1.26 -4.97 135.00 132.13 1b6j s PRO 139 Ca 0.44 0.90 0.00 0.00 0.04 0.00 0.00 61.00 62.38 1b6j s PRO 139 Cb -0.28 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.20 1b6j s PRO 139 CO 0.35 -0.65 0.00 0.41 0.04 0.00 0.00 177.00 177.15 1b6j n GLY 140 N -2.09 2.87 3.78 0.56 0.00 -1.26 -5.04 105.19 104.01 1b6j n GLY 140 Ca 0.07 -2.02 -0.37 0.00 0.00 0.00 0.00 46.02 43.70 1b6j n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b6j s LYS 141 N -2.67 4.21 0.11 1.61 3.01 -1.26 -5.06 119.74 119.69 1b6j s LYS 141 Ca 0.00 1.50 -0.03 0.00 -1.01 0.00 0.00 55.97 56.43 1b6j s LYS 141 Cb 0.00 -2.57 -0.03 0.00 -1.01 0.00 0.00 37.83 34.22 1b6j s LYS 141 CO 0.00 -0.10 0.08 1.67 0.51 0.00 0.00 175.35 177.51 1b6j s TRP 142 N -1.66 0.66 0.05 3.18 1.48 -1.26 -4.62 118.94 116.77 1b6j s TRP 142 Ca 0.57 -1.08 0.08 0.00 -1.06 0.00 0.00 56.10 54.61 1b6j s TRP 142 Cb -0.22 -0.37 -0.03 0.00 -1.16 0.00 0.00 33.47 31.70 1b6j s TRP 142 CO 0.27 -0.52 -0.21 0.15 -4.06 0.00 0.00 176.95 172.58 1b6j s LYS 143 N -3.99 1.40 0.38 3.25 -0.14 -0.51 -4.90 119.74 115.24 1b6j s LYS 143 Ca 0.18 -0.99 -0.25 0.00 -1.36 0.00 0.00 55.97 53.54 1b6j s LYS 143 Cb 0.07 -1.55 -0.09 0.00 -1.68 0.00 0.00 37.83 34.58 1b6j s LYS 143 CO -0.02 0.39 1.11 -1.25 -0.76 0.00 0.00 175.35 174.82 1b6j s PRO 144 N -1.29 4.19 0.06 -1.68 0.04 -1.26 0.21 135.00 135.27 1b6j s PRO 144 Ca 0.08 1.70 -0.15 0.00 0.04 0.00 0.00 61.00 62.67 1b6j s PRO 144 Cb -0.09 -2.70 0.03 0.00 0.04 0.00 0.00 34.50 31.77 1b6j s PRO 144 CO 0.02 -0.16 0.35 0.21 0.04 0.00 0.00 177.00 177.46 1b6j s LYS 145 N -2.24 0.90 -0.10 4.56 2.20 0.10 -4.84 119.74 120.31 1b6j s LYS 145 Ca 0.55 -0.54 0.03 0.00 -0.36 0.00 0.00 55.97 55.66 1b6j s LYS 145 Cb -0.27 0.39 0.01 0.00 -1.51 0.00 0.00 37.83 36.45 1b6j s LYS 145 CO 0.34 -0.31 -0.19 -1.64 -0.36 0.00 0.00 175.35 173.20 1b6j s MET 146 N -2.88 2.53 0.11 4.03 -1.94 -1.26 -0.05 119.30 119.84 1b6j s MET 146 Ca -0.03 -0.69 0.09 0.00 -1.71 0.00 0.00 55.69 53.35 1b6j s MET 146 Cb 0.00 -2.00 -0.04 0.00 2.01 0.00 0.00 34.83 34.80 1b6j s MET 146 CO -0.05 0.07 -0.22 0.96 -0.01 0.00 0.00 175.02 175.76 1b6j s ILE 147 N 0.61 1.84 0.45 2.53 -4.36 -0.94 -4.96 121.20 116.38 1b6j s ILE 147 Ca -0.14 -1.58 0.03 0.00 -0.26 0.00 0.00 60.65 58.70 1b6j s ILE 147 Cb -0.17 -1.66 -0.01 0.00 1.25 0.00 0.00 42.46 41.87 1b6j s ILE 147 CO 0.04 -0.01 0.11 -0.83 0.24 0.00 0.00 174.94 174.49 1b6j s GLY 148 N -1.91 2.84 0.00 6.27 0.00 -1.26 -1.04 107.32 112.22 1b6j s GLY 148 Ca 0.08 -0.84 0.00 0.00 0.00 0.00 0.00 44.72 43.97 1b6j s GLY 148 CO 0.05 -1.93 0.00 0.61 0.00 0.00 0.00 173.10 171.82 1b6j n GLY 149 N -1.05 -0.68 3.71 0.20 0.00 -0.51 -4.97 105.19 101.89 1b6j n GLY 149 Ca -0.10 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 1b6j n GLY 149 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b6j s ILE 150 N -3.71 2.77 0.00 -0.61 1.01 -1.26 -2.15 121.20 117.26 1b6j s ILE 150 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.18 1b6j s ILE 150 Cb 0.00 -3.34 0.00 0.00 0.01 0.00 0.00 42.46 39.13 1b6j s ILE 150 CO 0.00 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.59 1b6j n GLY 151 N 3.74 3.33 0.00 6.18 0.00 -1.26 -4.95 105.19 112.23 1b6j n GLY 151 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1b6j n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b6j n GLY 152 N -1.45 0.63 3.72 -0.02 0.00 -0.91 -5.09 105.19 102.07 1b6j n GLY 152 Ca 0.00 -2.01 -0.24 0.00 0.00 0.00 0.00 46.02 43.77 1b6j n GLY 152 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1b6j s PHE 153 N -1.50 2.91 0.05 1.61 0.40 -1.26 -1.43 117.98 118.76 1b6j s PHE 153 Ca 0.00 -0.14 0.01 0.00 -0.60 0.00 0.00 56.93 56.20 1b6j s PHE 153 Cb 0.00 -1.34 -0.03 0.00 0.51 0.00 0.00 43.02 42.17 1b6j s PHE 153 CO 0.00 0.55 -0.06 0.96 0.70 0.00 0.00 175.22 177.37 1b6j s ILE 154 N -2.06 0.46 -0.02 0.64 -4.36 -0.20 -4.98 121.20 110.68 1b6j s ILE 154 Ca 0.31 -1.21 -0.20 0.00 -0.26 0.00 0.00 60.65 59.29 1b6j s ILE 154 Cb -0.08 -0.74 -0.05 0.00 1.25 0.00 0.00 42.46 42.84 1b6j s ILE 154 CO 0.22 -0.51 0.58 -0.54 0.24 0.00 0.00 174.94 174.93 1b6j s LYS 155 N -2.01 4.31 0.12 0.37 1.02 -1.26 -2.22 119.74 120.07 1b6j s LYS 155 Ca -0.07 0.70 0.01 0.00 0.02 0.00 0.00 55.97 56.63 1b6j s LYS 155 Cb -0.07 -3.35 -0.04 0.00 -0.52 0.00 0.00 37.83 33.85 1b6j s LYS 155 CO -0.01 0.35 -0.01 0.14 -0.92 0.00 0.00 175.35 174.90 1b6j s VAL 156 N -0.12 0.47 -0.18 3.17 -7.23 0.93 -4.48 120.40 112.96 1b6j s VAL 156 Ca 0.31 -1.92 -0.07 0.00 -1.81 0.00 0.00 61.98 58.48 1b6j s VAL 156 Cb -0.18 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 34.84 1b6j s VAL 156 CO 0.16 -0.67 0.05 -0.13 -0.31 0.00 0.00 175.10 174.21 1b6j s ARG 157 N -3.92 3.93 -0.23 4.82 0.52 -0.26 -0.72 118.95 123.09 1b6j s ARG 157 Ca 0.18 -0.36 -0.14 0.00 -0.52 0.00 0.00 55.73 54.89 1b6j s ARG 157 Cb 0.07 -3.18 -0.04 0.00 0.52 0.00 0.00 34.95 32.31 1b6j s ARG 157 CO -0.01 0.28 0.31 -1.14 0.02 0.00 0.00 175.30 174.76 1b6j s GLN 158 N 0.33 4.11 -0.11 3.54 0.74 0.13 -1.23 119.66 127.16 1b6j s GLN 158 Ca 0.03 0.01 0.01 0.00 0.05 0.00 0.00 55.36 55.46 1b6j s GLN 158 Cb -0.12 -3.56 -0.01 0.00 1.10 0.00 0.00 33.01 30.41 1b6j s GLN 158 CO 0.00 -0.05 -0.17 0.71 -0.55 0.00 0.00 175.29 175.24 1b6j s TYR 159 N 1.36 2.72 0.23 1.67 2.02 -0.14 -1.42 117.35 123.79 1b6j s TYR 159 Ca 0.14 -0.72 0.06 0.00 -0.37 0.00 0.00 57.07 56.19 1b6j s TYR 159 Cb -0.15 -1.78 -0.04 0.00 -0.40 0.00 0.00 41.96 39.60 1b6j s TYR 159 CO 0.07 -0.24 0.21 -0.51 -1.57 0.00 0.00 175.55 173.51 1b6j s ASP 160 N 0.25 5.64 -1.42 2.29 1.01 -1.26 -0.50 116.67 122.67 1b6j s ASP 160 Ca -0.11 -0.18 -0.04 0.00 0.71 0.00 0.00 52.55 52.93 1b6j s ASP 160 Cb -0.16 -1.48 0.03 0.00 1.01 0.00 0.00 42.92 42.32 1b6j s ASP 160 CO 0.06 -0.02 0.65 0.00 0.21 0.00 0.00 175.17 176.07 1b6j n GLN 161 N -1.03 -4.25 -3.57 8.23 1.13 -1.13 -4.90 117.38 111.87 1b6j n GLN 161 Ca -0.08 0.51 -0.37 0.00 -1.94 0.00 0.00 57.00 55.12 1b6j n GLN 161 Cb 0.57 -4.98 -0.08 0.00 0.11 0.00 0.00 30.24 25.86 1b6j n GLN 161 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1b6j s ILE 162 N -3.69 5.31 0.00 5.09 -1.09 0.22 -4.75 121.20 122.29 1b6j s ILE 162 Ca 0.18 0.40 -0.30 0.00 -2.23 0.00 0.00 60.65 58.69 1b6j s ILE 162 Cb -0.09 -3.58 -0.05 0.00 -1.58 0.00 0.00 42.46 37.15 1b6j s ILE 162 CO 0.85 0.34 1.37 -2.84 -1.23 0.00 0.00 174.94 173.43 1b6j s PRO 163 N 0.92 4.30 -0.06 2.79 0.02 -1.26 -1.79 135.00 139.92 1b6j s PRO 163 Ca 0.12 1.93 0.00 0.00 0.02 0.00 0.00 61.00 63.08 1b6j s PRO 163 Cb -0.13 -3.54 0.02 0.00 0.02 0.00 0.00 34.50 30.87 1b6j s PRO 163 CO 0.04 -0.54 -0.03 0.08 -0.33 0.00 0.00 177.00 176.23 1b6j s VAL 164 N 2.26 0.48 -0.26 3.83 1.01 0.21 -4.38 120.40 123.55 1b6j s VAL 164 Ca 0.63 -0.03 -0.09 0.00 0.00 0.00 0.00 61.98 62.48 1b6j s VAL 164 Cb -0.31 -0.56 -0.04 0.00 0.00 0.00 0.00 36.38 35.48 1b6j s VAL 164 CO 0.26 0.24 0.13 -0.70 0.00 0.00 0.00 175.10 175.03 1b6j s GLU 165 N 1.31 3.83 -0.33 2.72 2.12 -0.50 -0.78 118.70 127.06 1b6j s GLU 165 Ca -0.05 -0.39 0.07 0.00 0.36 0.00 0.00 54.97 54.96 1b6j s GLU 165 Cb -0.13 -3.47 0.49 0.00 0.26 0.00 0.00 34.13 31.27 1b6j s GLU 165 CO -0.02 -0.14 1.47 -0.89 -0.54 0.00 0.00 175.26 175.14 1b6j n ILE 166 N 4.85 2.67 0.00 -3.70 5.41 -1.26 -0.92 119.36 126.41 1b6j n ILE 166 Ca -0.15 -3.09 0.00 0.00 1.00 0.00 0.00 62.75 60.51 1b6j n ILE 166 Cb 0.52 -0.58 0.00 0.00 -0.71 0.00 0.00 39.64 38.87 1b6j n ILE 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1b6j n GLY 168 N -1.02 0.00 3.59 7.39 0.00 -1.26 -4.76 105.19 109.13 1b6j n GLY 168 Ca 0.39 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.03 1b6j n GLY 168 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1b6j s HIS 169 N 0.00 3.23 0.41 1.61 4.02 -1.26 -5.07 115.29 118.22 1b6j s HIS 169 Ca 0.00 0.16 -0.23 0.00 1.02 0.00 0.00 55.06 56.01 1b6j s HIS 169 Cb 0.00 -2.40 -0.09 0.00 -1.02 0.00 0.00 32.58 29.06 1b6j s HIS 169 CO 0.00 -0.16 1.02 0.15 1.02 0.00 0.00 174.74 176.77 1b6j s LYS 170 N 1.79 4.17 0.16 1.40 1.02 -1.26 -4.37 119.74 122.65 1b6j s LYS 170 Ca 0.08 1.42 -0.17 0.00 0.02 0.00 0.00 55.97 57.32 1b6j s LYS 170 Cb -0.16 -2.47 0.03 0.00 -0.52 0.00 0.00 37.83 34.72 1b6j s LYS 170 CO 0.11 -0.11 0.46 0.00 -0.92 0.00 0.00 175.35 174.89 1b6j s ALA 171 N -1.76 -0.96 -0.18 5.17 0.00 0.04 -4.79 121.76 119.28 1b6j s ALA 171 Ca 0.59 -0.10 -0.09 0.00 0.00 0.00 0.00 51.96 52.36 1b6j s ALA 171 Cb -0.19 0.78 0.07 0.00 0.00 0.00 0.00 23.12 23.78 1b6j s ALA 171 CO 0.24 -0.72 0.41 -1.50 0.00 0.00 0.00 175.76 174.20 1b6j s ILE 172 N -3.83 -0.23 0.00 0.00 2.07 -1.26 -0.62 121.20 117.33 1b6j s ILE 172 Ca 0.06 0.12 0.00 0.00 -1.41 0.00 0.00 60.65 59.42 1b6j s ILE 172 Cb 0.01 -0.63 0.00 0.00 0.13 0.00 0.00 42.46 41.97 1b6j s ILE 172 CO -0.08 0.05 0.00 0.61 -1.91 0.00 0.00 174.94 173.61 1b6j n GLY 173 N 4.64 1.05 3.71 1.50 0.00 -0.74 -4.84 105.19 110.51 1b6j n GLY 173 Ca -0.18 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.76 1b6j n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1b6j s THR 174 N -2.18 4.47 -0.06 2.61 2.01 -1.26 -0.61 115.64 120.62 1b6j s THR 174 Ca 0.00 1.79 0.03 0.00 0.31 0.00 0.00 61.69 63.82 1b6j s THR 174 Cb 0.00 -4.15 0.00 0.00 0.01 0.00 0.00 72.50 68.37 1b6j s THR 174 CO 0.00 0.15 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.24 1b6j s VAL 175 N 0.95 1.31 -0.11 3.82 1.01 0.34 -4.46 120.40 123.27 1b6j s VAL 175 Ca 0.55 -0.61 -0.04 0.00 0.00 0.00 0.00 61.98 61.87 1b6j s VAL 175 Cb -0.25 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 1b6j s VAL 175 CO 0.29 0.39 0.06 -0.76 0.00 0.00 0.00 175.10 175.07 1b6j s LEU 176 N 0.35 3.91 -0.13 3.92 1.43 -0.05 -0.97 118.68 127.14 1b6j s LEU 176 Ca -0.10 0.26 0.02 0.00 -1.03 0.00 0.00 54.13 53.28 1b6j s LEU 176 Cb -0.14 -1.93 0.02 0.00 0.03 0.00 0.00 46.19 44.17 1b6j s LEU 176 CO 0.03 0.38 -0.17 -0.69 0.23 0.00 0.00 176.35 176.13 1b6j s VAL 177 N -0.84 1.70 0.16 -1.59 1.01 -0.37 -0.04 120.40 120.43 1b6j s VAL 177 Ca 0.13 -0.75 -0.14 0.00 0.00 0.00 0.00 61.98 61.22 1b6j s VAL 177 Cb -0.12 -1.54 0.05 0.00 0.00 0.00 0.00 36.38 34.77 1b6j s VAL 177 CO 0.03 0.48 0.68 0.61 0.00 0.00 0.00 175.10 176.90 1b6j n GLY 178 N 4.31 0.92 2.81 4.51 0.00 -0.94 -1.10 105.19 115.70 1b6j n GLY 178 Ca -0.19 -1.10 -0.32 0.00 0.00 0.00 0.00 46.02 44.41 1b6j n GLY 178 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1b6j n PRO 179 N -0.47 1.91 -3.75 1.61 -0.04 -1.26 -2.76 135.00 130.24 1b6j n PRO 179 Ca -0.03 -1.68 -0.34 0.00 -0.04 0.00 0.00 63.50 61.41 1b6j n PRO 179 Cb 0.41 -2.69 -0.05 0.00 -0.04 0.00 0.00 33.50 31.13 1b6j n PRO 179 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1b6j s THR 180 N 4.02 5.29 0.12 0.52 -1.32 -1.26 -5.00 115.64 118.01 1b6j s THR 180 Ca 0.48 0.16 0.25 0.00 -1.21 0.00 0.00 61.69 61.36 1b6j s THR 180 Cb 0.12 -3.57 0.25 0.00 -1.51 0.00 0.00 72.50 67.79 1b6j s THR 180 CO 0.02 0.34 1.84 1.55 -2.21 0.00 0.00 174.62 176.16 1b6j h PRO 181 N 3.90 0.00 -3.77 7.08 0.13 -1.98 -3.43 132.00 133.93 1b6j h PRO 181 Ca -0.50 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.50 1b6j h PRO 181 Cb 1.19 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.14 1b6j h PRO 181 CO 0.67 0.20 -0.54 0.54 -0.23 0.00 0.00 178.00 178.64 1b6j s VAL 182 N -3.65 0.12 -0.04 1.56 0.11 -1.26 -5.04 120.40 112.20 1b6j s VAL 182 Ca 0.01 -1.00 -0.30 0.00 -2.93 0.00 0.00 61.98 57.76 1b6j s VAL 182 Cb 0.10 -0.73 -0.03 0.00 -1.53 0.00 0.00 36.38 34.19 1b6j s VAL 182 CO 0.63 -0.55 1.11 0.20 -3.33 0.00 0.00 175.10 173.16 1b6j s ASN 183 N -1.89 7.16 -0.15 3.54 0.01 -1.26 -4.54 114.94 117.81 1b6j s ASN 183 Ca -0.08 1.74 0.02 0.00 -0.71 0.00 0.00 52.86 53.82 1b6j s ASN 183 Cb -0.03 -2.56 0.02 0.00 0.41 0.00 0.00 41.25 39.08 1b6j s ASN 183 CO -0.03 -0.48 -0.19 -0.63 -1.51 0.00 0.00 177.10 174.27 1b6j s ILE 184 N 1.79 1.89 -0.38 0.60 1.01 0.14 -0.22 121.20 126.02 1b6j s ILE 184 Ca 0.53 -0.85 -0.17 0.00 0.00 0.00 0.00 60.65 60.16 1b6j s ILE 184 Cb -0.23 -1.70 0.01 0.00 0.01 0.00 0.00 42.46 40.55 1b6j s ILE 184 CO 0.23 0.51 0.43 -0.63 0.00 0.00 0.00 174.94 175.48 1b6j s ILE 185 N 1.09 5.10 0.73 2.92 -1.09 0.17 -0.90 121.20 129.22 1b6j s ILE 185 Ca -0.01 -0.10 -0.03 0.00 -2.23 0.00 0.00 60.65 58.28 1b6j s ILE 185 Cb -0.14 -3.96 0.15 0.00 -1.58 0.00 0.00 42.46 36.93 1b6j s ILE 185 CO -0.07 -0.29 1.00 0.61 -1.23 0.00 0.00 174.94 174.97 1b6j n GLY 186 N 5.01 0.29 0.35 6.18 0.00 -1.22 -1.14 105.19 114.67 1b6j n GLY 186 Ca -0.07 -1.97 0.16 0.00 0.00 0.00 0.00 46.02 44.13 1b6j n GLY 186 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1b6j h ARG 187 N 0.00 0.12 -0.13 1.61 3.08 -1.09 -2.09 114.38 115.88 1b6j h ARG 187 Ca -0.33 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 59.75 1b6j h ARG 187 Cb 1.15 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.17 1b6j h ARG 187 CO 0.33 0.08 0.10 -2.95 -1.07 0.00 0.00 179.97 176.46 1b6j h ASN 188 N 0.12 0.00 0.00 7.04 -1.07 -1.82 -1.84 115.58 118.01 1b6j h ASN 188 Ca 0.22 0.00 -0.32 0.00 0.07 0.00 0.00 56.30 56.27 1b6j h ASN 188 Cb 0.70 0.00 -0.06 0.00 -2.07 0.00 0.00 38.32 36.89 1b6j h ASN 188 CO -0.03 0.00 -2.20 0.18 0.07 0.00 0.00 177.43 175.45 1b6j n LEU 189 N -4.30 0.00 -0.17 6.14 4.77 -0.84 -4.40 117.00 118.21 1b6j n LEU 189 Ca 0.00 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.95 1b6j n LEU 189 Cb 0.22 0.43 0.16 0.00 -2.33 0.00 0.00 43.42 41.90 1b6j n LEU 189 CO 0.33 0.43 1.01 -0.07 -1.33 0.00 0.00 177.39 177.75 1b6j h LEU 190 N 0.00 0.86 -1.13 2.23 3.38 -1.13 -2.31 115.31 117.21 1b6j h LEU 190 Ca -0.47 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.31 1b6j h LEU 190 Cb 2.07 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.57 1b6j h LEU 190 CO 0.03 0.81 0.11 0.71 0.09 0.00 0.00 178.44 180.18 1b6j h THR 191 N 0.90 1.21 0.00 0.22 1.35 -1.57 -2.60 112.91 112.41 1b6j h THR 191 Ca 0.20 -0.76 -0.04 0.00 -0.55 0.00 0.00 66.41 65.26 1b6j h THR 191 Cb 0.26 0.73 -0.01 0.00 -1.73 0.00 0.00 68.15 67.41 1b6j h THR 191 CO -0.01 0.28 -0.18 1.56 -0.25 0.00 0.00 175.52 176.92 1b6j h GLN 192 N 0.70 0.00 -0.64 4.72 4.20 -1.62 -2.48 115.11 119.99 1b6j h GLN 192 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 1b6j h GLN 192 Cb 0.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.06 1b6j h GLN 192 CO -0.00 0.18 0.00 0.44 -0.67 0.00 0.00 178.83 178.78 1b6j n ILE 193 N -3.62 1.43 -2.03 2.54 -5.35 -1.00 -4.95 119.36 106.38 1b6j n ILE 193 Ca -0.01 -1.12 0.00 0.00 -0.27 0.00 0.00 62.75 61.34 1b6j n ILE 193 Cb 0.31 0.31 0.00 0.00 -1.74 0.00 0.00 39.64 38.52 1b6j n ILE 193 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1b6j n GLY 194 N 1.22 -5.30 0.00 3.28 0.00 -0.94 -5.09 105.19 98.36 1b6j n GLY 194 Ca 0.24 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1b6j n GLY 194 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1b6j n THR 196 N 1.59 0.00 -3.93 2.61 -2.24 -1.26 -5.05 114.28 106.01 1b6j n THR 196 Ca 0.00 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.43 1b6j n THR 196 Cb 0.00 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.14 1b6j n THR 196 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1b6j s LEU 197 N 0.00 3.96 -0.03 3.22 1.43 -1.26 -5.10 118.68 120.90 1b6j s LEU 197 Ca 0.00 0.15 0.03 0.00 -1.03 0.00 0.00 54.13 53.28 1b6j s LEU 197 Cb 0.00 -2.00 0.00 0.00 0.03 0.00 0.00 46.19 44.22 1b6j s LEU 197 CO 0.00 0.20 -0.10 0.20 0.23 0.00 0.00 176.35 176.88 1b6j s ASN 198 N 0.25 1.34 0.00 2.29 -0.87 -1.26 -5.30 114.94 111.38 1b6j s ASN 198 Ca 0.05 -0.21 0.00 0.00 -1.57 0.00 0.00 52.86 51.14 1b6j s ASN 198 Cb -0.12 -0.37 0.00 0.00 -0.02 0.00 0.00 41.25 40.74 1b6j s ASN 198 CO -0.00 0.07 0.00 2.22 -2.57 0.00 0.00 177.10 176.82