#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a2o s GLN 102 N 0.00 2.92 -0.25 0.54 0.74 -1.26 -5.09 119.66 117.26 3a2o s GLN 102 Ca 0.00 -0.93 -0.07 0.00 0.05 0.00 0.00 55.36 54.41 3a2o s GLN 102 Cb 0.00 -3.08 -0.03 0.00 1.10 0.00 0.00 33.01 31.01 3a2o s GLN 102 CO 0.00 -0.40 0.07 0.42 -0.55 0.00 0.00 175.29 174.83 3a2o s ILE 103 N 1.37 4.29 0.77 -2.34 1.01 -1.26 -5.09 121.20 119.95 3a2o s ILE 103 Ca 0.01 -0.21 -0.09 0.00 0.00 0.00 0.00 60.65 60.36 3a2o s ILE 103 Cb -0.17 -3.02 0.09 0.00 0.01 0.00 0.00 42.46 39.37 3a2o s ILE 103 CO -0.03 0.32 1.10 0.42 0.00 0.00 0.00 174.94 176.75 3a2o s THR 104 N 1.61 2.16 -0.10 2.92 -4.23 -1.26 -5.02 115.64 111.71 3a2o s THR 104 Ca 0.06 -0.20 0.15 0.00 -1.18 0.00 0.00 61.69 60.52 3a2o s THR 104 Cb -0.15 -2.96 0.22 0.00 1.34 0.00 0.00 72.50 70.95 3a2o s THR 104 CO 0.04 0.00 1.11 0.18 -0.54 0.00 0.00 174.62 175.41 3a2o n LEU 105 N -3.14 2.24 0.20 4.79 4.77 -1.26 -4.61 117.00 119.99 3a2o n LEU 105 Ca 0.10 -2.82 0.04 0.00 -0.03 0.00 0.00 56.01 53.30 3a2o n LEU 105 Cb 0.60 -0.33 0.43 0.00 -2.33 0.00 0.00 43.42 41.79 3a2o n LEU 105 CO 0.51 0.66 0.81 -0.50 -1.33 0.00 0.00 177.39 177.54 3a2o h TRP 106 N 0.00 0.00 -1.94 -1.77 4.06 -2.06 -3.43 115.95 110.81 3a2o h TRP 106 Ca 0.00 0.00 -0.61 0.00 2.06 0.00 0.00 58.89 60.34 3a2o h TRP 106 Cb 0.90 0.00 -0.13 0.00 -1.00 0.00 0.00 29.16 28.92 3a2o h TRP 106 CO 0.00 0.28 -0.65 -1.59 -3.56 0.00 0.00 178.44 172.92 3a2o s LYS 107 N -4.37 1.84 0.36 0.49 -2.85 -1.26 -5.11 119.74 108.83 3a2o s LYS 107 Ca -0.03 -1.98 -0.28 0.00 -1.00 0.00 0.00 55.97 52.67 3a2o s LYS 107 Cb 0.15 -1.61 -0.11 0.00 -2.06 0.00 0.00 37.83 34.20 3a2o s LYS 107 CO 0.71 0.06 1.48 0.54 0.10 0.00 0.00 175.35 178.23 3a2o n ARG 108 N -0.83 2.59 -2.26 1.78 1.74 -1.26 -4.86 116.66 113.56 3a2o n ARG 108 Ca -0.05 0.91 -0.43 0.00 -0.77 0.00 0.00 57.85 57.51 3a2o n ARG 108 Cb 0.65 -2.63 0.00 0.00 -1.02 0.00 0.00 32.46 29.46 3a2o n ARG 108 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 3a2o n PRO 109 N 0.77 3.21 -3.14 5.56 -0.04 -1.26 -4.94 135.00 135.16 3a2o n PRO 109 Ca 0.03 -3.18 -0.39 0.00 -0.04 0.00 0.00 63.50 59.92 3a2o n PRO 109 Cb 0.38 -3.20 -0.06 0.00 -0.04 0.00 0.00 33.50 30.58 3a2o n PRO 109 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3a2o s LEU 110 N 1.95 4.49 0.23 1.53 1.43 -1.26 -1.23 118.68 125.81 3a2o s LEU 110 Ca 0.46 1.35 0.02 0.00 -1.03 0.00 0.00 54.13 54.92 3a2o s LEU 110 Cb 0.08 -3.05 -0.05 0.00 0.03 0.00 0.00 46.19 43.20 3a2o s LEU 110 CO -0.01 0.16 0.06 0.68 0.23 0.00 0.00 176.35 177.47 3a2o s VAL 111 N -0.64 0.63 -0.06 -1.59 -7.23 0.13 -4.97 120.40 106.67 3a2o s VAL 111 Ca 0.33 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.35 3a2o s VAL 111 Cb -0.20 -2.45 -0.05 0.00 0.56 0.00 0.00 36.38 34.23 3a2o s VAL 111 CO 0.21 -0.17 0.39 -0.89 -0.31 0.00 0.00 175.10 174.33 3a2o s THR 112 N -3.70 5.14 0.31 5.32 2.01 -1.26 -0.91 115.64 122.54 3a2o s THR 112 Ca 0.33 0.79 0.10 0.00 0.31 0.00 0.00 61.69 63.21 3a2o s THR 112 Cb 0.07 -3.71 -0.05 0.00 0.01 0.00 0.00 72.50 68.82 3a2o s THR 112 CO 0.10 0.48 -0.02 0.27 -0.69 0.00 0.00 174.62 174.77 3a2o s ILE 113 N -0.38 2.91 -0.09 1.82 -4.36 0.32 -1.15 121.20 120.27 3a2o s ILE 113 Ca 0.23 -2.01 0.01 0.00 -0.26 0.00 0.00 60.65 58.62 3a2o s ILE 113 Cb -0.15 -2.74 0.02 0.00 1.25 0.00 0.00 42.46 40.83 3a2o s ILE 113 CO 0.10 -0.29 -0.11 -0.75 0.24 0.00 0.00 174.94 174.14 3a2o s LYS 114 N -3.68 1.68 -0.11 0.37 2.20 -0.09 -1.23 119.74 118.88 3a2o s LYS 114 Ca 0.33 -0.37 -0.06 0.00 -0.36 0.00 0.00 55.97 55.52 3a2o s LYS 114 Cb -0.03 -1.51 0.05 0.00 -1.51 0.00 0.00 37.83 34.83 3a2o s LYS 114 CO 0.19 -0.09 0.26 -1.50 -0.36 0.00 0.00 175.35 173.85 3a2o s ILE 115 N 1.07 -0.04 -1.56 5.43 2.07 -0.47 -1.52 121.20 126.18 3a2o s ILE 115 Ca -0.07 0.13 0.00 0.00 -1.41 0.00 0.00 60.65 59.31 3a2o s ILE 115 Cb -0.15 -0.40 0.00 0.00 0.13 0.00 0.00 42.46 42.04 3a2o s ILE 115 CO -0.01 0.06 0.00 0.61 -1.91 0.00 0.00 174.94 173.68 3a2o n GLY 116 N 4.17 0.14 2.67 1.50 0.00 -1.26 -2.01 105.19 110.40 3a2o n GLY 116 Ca -0.25 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.61 3a2o n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a2o n GLY 117 N -0.98 0.61 3.42 -0.02 0.00 -1.26 -5.01 105.19 101.95 3a2o n GLY 117 Ca -0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 3a2o n GLY 117 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3a2o s GLN 118 N -0.27 2.17 0.06 1.61 -0.21 -0.85 -5.11 119.66 117.06 3a2o s GLN 118 Ca 0.00 -0.90 -0.22 0.00 0.02 0.00 0.00 55.36 54.25 3a2o s GLN 118 Cb 0.00 -2.18 -0.06 0.00 1.00 0.00 0.00 33.01 31.76 3a2o s GLN 118 CO 0.00 0.56 0.67 -0.51 -2.12 0.00 0.00 175.29 173.89 3a2o s LEU 119 N -1.03 4.49 0.04 2.90 1.43 -1.26 -1.37 118.68 123.88 3a2o s LEU 119 Ca 0.12 1.36 -0.01 0.00 -1.03 0.00 0.00 54.13 54.57 3a2o s LEU 119 Cb -0.10 -3.07 -0.04 0.00 0.03 0.00 0.00 46.19 43.01 3a2o s LEU 119 CO 0.02 0.15 -0.03 -0.54 0.23 0.00 0.00 176.35 176.18 3a2o s LYS 120 N -0.59 0.55 0.07 1.70 1.02 -0.36 -4.98 119.74 117.14 3a2o s LYS 120 Ca 0.33 -1.10 -0.18 0.00 0.02 0.00 0.00 55.97 55.05 3a2o s LYS 120 Cb -0.20 0.19 -0.07 0.00 -0.52 0.00 0.00 37.83 37.24 3a2o s LYS 120 CO 0.21 -0.10 0.53 -2.00 -0.92 0.00 0.00 175.35 173.07 3a2o s GLU 121 N -3.44 4.11 0.10 1.68 2.12 -1.26 -0.53 118.70 121.47 3a2o s GLU 121 Ca 0.03 0.63 -0.09 0.00 0.36 0.00 0.00 54.97 55.89 3a2o s GLU 121 Cb 0.05 -3.18 0.00 0.00 0.26 0.00 0.00 34.13 31.25 3a2o s GLU 121 CO -0.08 0.63 0.21 0.00 -0.54 0.00 0.00 175.26 175.47 3a2o s ALA 122 N -1.16 -0.25 -0.21 6.30 0.00 -0.09 -4.50 121.76 121.85 3a2o s ALA 122 Ca 0.29 -0.60 -0.08 0.00 0.00 0.00 0.00 51.96 51.57 3a2o s ALA 122 Cb -0.18 0.53 -0.04 0.00 0.00 0.00 0.00 23.12 23.43 3a2o s ALA 122 CO 0.18 -0.53 0.08 -1.17 0.00 0.00 0.00 175.76 174.32 3a2o s LEU 123 N -2.87 3.78 -0.34 0.00 1.98 0.07 -0.69 118.68 120.61 3a2o s LEU 123 Ca 0.06 0.02 -0.29 0.00 -2.89 0.00 0.00 54.13 51.03 3a2o s LEU 123 Cb 0.05 -1.98 0.01 0.00 0.66 0.00 0.00 46.19 44.92 3a2o s LEU 123 CO -0.10 0.10 1.26 -0.76 -1.89 0.00 0.00 176.35 174.96 3a2o s LEU 124 N 0.80 3.82 -0.37 -0.68 1.43 -0.37 -0.67 118.68 122.64 3a2o s LEU 124 Ca 0.04 1.04 0.01 0.00 -1.03 0.00 0.00 54.13 54.19 3a2o s LEU 124 Cb -0.13 -3.54 0.11 0.00 0.03 0.00 0.00 46.19 42.66 3a2o s LEU 124 CO 0.02 -1.11 0.14 -0.62 0.23 0.00 0.00 176.35 175.01 3a2o s ASP 125 N 2.70 4.09 0.20 2.29 -1.08 -0.17 -4.78 116.67 119.93 3a2o s ASP 125 Ca 0.54 -2.12 0.22 0.00 -0.52 0.00 0.00 52.55 50.67 3a2o s ASP 125 Cb -0.14 -1.12 0.91 0.00 -1.46 0.00 0.00 42.92 41.10 3a2o s ASP 125 CO 0.24 -0.35 1.67 0.35 0.52 0.00 0.00 175.17 177.60 3a2o n THR 126 N 4.24 0.84 1.41 1.71 -2.24 -1.26 -2.16 114.28 116.82 3a2o n THR 126 Ca 0.03 0.21 0.14 0.00 -2.27 0.00 0.00 64.05 62.16 3a2o n THR 126 Cb 0.39 -1.10 0.66 0.00 -2.10 0.00 0.00 70.33 68.18 3a2o n THR 126 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a2o n GLY 127 N 0.07 -1.08 3.57 3.38 0.00 -1.26 -4.82 105.19 105.05 3a2o n GLY 127 Ca 0.03 -0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 3a2o n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a2o s ALA 128 N -2.52 3.30 0.22 4.61 0.00 -0.92 -4.98 121.76 121.48 3a2o s ALA 128 Ca 0.29 -0.87 -0.01 0.00 0.00 0.00 0.00 51.96 51.36 3a2o s ALA 128 Cb 0.20 -1.96 0.22 0.00 0.00 0.00 0.00 23.12 21.59 3a2o s ALA 128 CO 0.47 -0.04 1.60 -0.44 0.00 0.00 0.00 175.76 177.35 3a2o h ASP 129 N 7.20 0.59 -2.32 0.00 3.32 -1.87 0.62 116.42 123.95 3a2o h ASP 129 Ca -0.36 -0.26 -0.57 0.00 0.02 0.00 0.00 57.03 55.86 3a2o h ASP 129 Cb 1.17 -0.16 -0.14 0.00 0.22 0.00 0.00 39.33 40.42 3a2o h ASP 129 CO 0.65 0.92 -0.67 -1.81 -1.72 0.00 0.00 179.24 176.62 3a2o s ASP 130 N -6.85 3.35 -0.18 6.45 1.11 -1.26 -2.15 116.67 117.14 3a2o s ASP 130 Ca -0.07 -1.22 -0.12 0.00 0.18 0.00 0.00 52.55 51.32 3a2o s ASP 130 Cb 0.12 -0.28 -0.05 0.00 1.07 0.00 0.00 42.92 43.79 3a2o s ASP 130 CO 0.82 -0.29 0.23 -0.89 1.18 0.00 0.00 175.17 176.22 3a2o s THR 131 N -2.79 5.35 -0.03 -1.27 2.01 -1.26 -3.34 115.64 114.31 3a2o s THR 131 Ca 0.32 0.40 0.00 0.00 0.31 0.00 0.00 61.69 62.72 3a2o s THR 131 Cb 0.04 -3.57 0.03 0.00 0.01 0.00 0.00 72.50 69.01 3a2o s THR 131 CO 0.15 0.40 0.00 0.54 -0.69 0.00 0.00 174.62 175.03 3a2o s VAL 132 N 0.47 0.17 0.07 3.82 0.11 -0.26 -0.94 120.40 123.84 3a2o s VAL 132 Ca 0.13 0.10 0.09 0.00 -2.93 0.00 0.00 61.98 59.37 3a2o s VAL 132 Cb -0.12 -0.27 -0.03 0.00 -1.53 0.00 0.00 36.38 34.42 3a2o s VAL 132 CO 0.02 0.15 -0.23 -0.63 -3.33 0.00 0.00 175.10 171.07 3a2o s ILE 133 N 1.08 2.45 0.91 7.04 -1.09 0.34 -1.26 121.20 130.67 3a2o s ILE 133 Ca -0.09 -1.44 -0.12 0.00 -2.23 0.00 0.00 60.65 56.78 3a2o s ILE 133 Cb -0.13 -2.03 0.09 0.00 -1.58 0.00 0.00 42.46 38.81 3a2o s ILE 133 CO -0.02 0.26 0.86 -0.62 -1.23 0.00 0.00 174.94 174.19 3a2o n GLU 134 N 1.37 -0.30 -1.57 2.79 1.02 -1.26 -1.76 120.64 120.93 3a2o n GLU 134 Ca -0.17 -0.03 -0.58 0.00 -0.02 0.00 0.00 57.16 56.36 3a2o n GLU 134 Cb 0.52 -2.18 -0.08 0.00 -0.02 0.00 0.00 31.44 29.69 3a2o n GLU 134 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3a2o n GLU 135 N -3.09 0.40 -3.72 3.49 -0.58 -1.25 -4.63 120.64 111.26 3a2o n GLU 135 Ca 0.10 0.15 -0.06 0.00 -0.42 0.00 0.00 57.16 56.93 3a2o n GLU 135 Cb 0.52 -1.70 -0.02 0.00 -0.57 0.00 0.00 31.44 29.68 3a2o n GLU 135 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3a2o s MET 136 N 0.77 1.37 -0.15 3.49 0.23 -1.26 -5.05 119.30 118.70 3a2o s MET 136 Ca 0.91 -0.71 -0.16 0.00 -1.03 0.00 0.00 55.69 54.71 3a2o s MET 136 Cb -1.20 0.50 -0.04 0.00 -1.53 0.00 0.00 34.83 32.55 3a2o s MET 136 CO 0.58 -0.62 0.38 -1.12 -2.03 0.00 0.00 175.02 172.20 3a2o s SER 137 N -2.86 6.53 0.11 -1.18 0.01 -1.26 -5.07 113.70 109.98 3a2o s SER 137 Ca 0.10 0.62 0.07 0.00 1.31 0.00 0.00 55.95 58.05 3a2o s SER 137 Cb -0.03 -2.23 -0.04 0.00 0.21 0.00 0.00 66.02 63.94 3a2o s SER 137 CO 0.01 0.04 -0.17 -0.76 0.41 0.00 0.00 173.24 172.77 3a2o s LEU 138 N 0.65 2.35 0.57 2.44 1.43 -1.26 -4.96 118.68 119.90 3a2o s LEU 138 Ca 0.20 -0.74 -0.14 0.00 -1.03 0.00 0.00 54.13 52.42 3a2o s LEU 138 Cb -0.14 -0.68 -0.06 0.00 0.03 0.00 0.00 46.19 45.34 3a2o s LEU 138 CO 0.07 -0.05 1.01 -2.16 0.23 0.00 0.00 176.35 175.44 3a2o s PRO 139 N -2.26 3.73 0.18 1.29 0.04 -1.26 -4.96 135.00 131.76 3a2o s PRO 139 Ca 0.07 0.90 0.00 0.00 0.04 0.00 0.00 61.00 62.00 3a2o s PRO 139 Cb -0.08 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.36 3a2o s PRO 139 CO 0.04 -0.46 0.00 0.41 0.04 0.00 0.00 177.00 177.03 3a2o n GLY 140 N -1.99 -2.52 3.85 0.56 0.00 -1.26 -4.95 105.19 98.88 3a2o n GLY 140 Ca 0.07 -1.91 -0.32 0.00 0.00 0.00 0.00 46.02 43.86 3a2o n GLY 140 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3a2o s ARG 141 N -0.36 3.94 0.21 1.61 0.52 -1.26 -5.09 118.95 118.51 3a2o s ARG 141 Ca 0.00 0.79 0.08 0.00 -0.52 0.00 0.00 55.73 56.08 3a2o s ARG 141 Cb 0.00 -2.26 -0.05 0.00 0.52 0.00 0.00 34.95 33.16 3a2o s ARG 141 CO 0.00 -0.11 -0.15 1.67 0.02 0.00 0.00 175.30 176.72 3a2o s TRP 142 N -2.41 1.80 0.17 -0.53 1.48 -1.26 -4.64 118.94 113.55 3a2o s TRP 142 Ca 0.56 -0.53 0.09 0.00 -1.06 0.00 0.00 56.10 55.16 3a2o s TRP 142 Cb -0.10 -0.83 -0.04 0.00 -1.16 0.00 0.00 33.47 31.34 3a2o s TRP 142 CO 0.27 0.41 -0.20 -1.59 -4.06 0.00 0.00 176.95 171.79 3a2o s LYS 143 N -3.57 1.32 0.46 3.25 -2.85 -0.62 -4.91 119.74 112.82 3a2o s LYS 143 Ca 0.23 -1.41 -0.15 0.00 -1.00 0.00 0.00 55.97 53.63 3a2o s LYS 143 Cb -0.02 -1.45 -0.08 0.00 -2.06 0.00 0.00 37.83 34.23 3a2o s LYS 143 CO 0.08 0.30 0.91 -1.25 0.10 0.00 0.00 175.35 175.49 3a2o s PRO 144 N -2.70 3.94 -0.21 1.78 0.04 -1.26 -0.42 135.00 136.17 3a2o s PRO 144 Ca 0.16 0.83 -0.20 0.00 0.04 0.00 0.00 61.00 61.83 3a2o s PRO 144 Cb -0.07 -2.23 0.06 0.00 0.04 0.00 0.00 34.50 32.30 3a2o s PRO 144 CO 0.07 -0.15 0.57 0.21 0.04 0.00 0.00 177.00 177.74 3a2o s LYS 145 N -3.82 0.67 -0.15 4.56 2.20 -1.01 -4.85 119.74 117.35 3a2o s LYS 145 Ca 0.57 0.77 -0.03 0.00 -0.36 0.00 0.00 55.97 56.92 3a2o s LYS 145 Cb -0.10 0.33 -0.03 0.00 -1.51 0.00 0.00 37.83 36.52 3a2o s LYS 145 CO 0.28 -0.09 -0.04 1.41 -0.36 0.00 0.00 175.35 176.55 3a2o s MET 146 N 0.26 3.65 0.01 4.03 -2.45 -1.26 -0.92 119.30 122.61 3a2o s MET 146 Ca -0.00 -0.52 0.06 0.00 -1.25 0.00 0.00 55.69 53.97 3a2o s MET 146 Cb -0.04 -2.90 -0.02 0.00 1.25 0.00 0.00 34.83 33.13 3a2o s MET 146 CO 0.01 0.25 -0.17 -1.50 1.05 0.00 0.00 175.02 174.66 3a2o s ILE 147 N 0.33 1.39 0.08 10.11 2.07 -0.45 -4.98 121.20 129.75 3a2o s ILE 147 Ca -0.04 -0.91 0.08 0.00 -1.41 0.00 0.00 60.65 58.36 3a2o s ILE 147 Cb -0.14 -1.19 -0.03 0.00 0.13 0.00 0.00 42.46 41.23 3a2o s ILE 147 CO 0.03 0.25 -0.21 -0.83 -1.91 0.00 0.00 174.94 172.27 3a2o s GLY 148 N -0.77 1.22 0.00 1.50 0.00 -1.26 -1.22 107.32 106.79 3a2o s GLY 148 Ca 0.06 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 43.59 3a2o s GLY 148 CO 0.00 -1.16 0.00 0.61 0.00 0.00 0.00 173.10 172.55 3a2o n GLY 149 N 1.37 1.84 3.72 0.20 0.00 -1.04 -5.01 105.19 106.27 3a2o n GLY 149 Ca -0.18 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 3a2o n GLY 149 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a2o s ILE 150 N -0.45 2.69 0.00 -0.61 1.01 -1.26 -2.57 121.20 120.01 3a2o s ILE 150 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 60.65 61.14 3a2o s ILE 150 Cb 0.00 -3.32 0.00 0.00 0.01 0.00 0.00 42.46 39.15 3a2o s ILE 150 CO 0.00 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.59 3a2o n GLY 151 N 3.72 1.90 0.00 6.18 0.00 -1.26 -4.93 105.19 110.80 3a2o n GLY 151 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3a2o n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a2o n GLY 152 N -2.00 0.63 3.70 -0.02 0.00 -1.06 -5.06 105.19 101.38 3a2o n GLY 152 Ca 0.00 -2.03 -0.29 0.00 0.00 0.00 0.00 46.02 43.69 3a2o n GLY 152 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3a2o s PHE 153 N -1.38 3.00 0.14 1.61 0.40 -1.26 -2.50 117.98 117.98 3a2o s PHE 153 Ca 0.00 -0.03 0.07 0.00 -0.60 0.00 0.00 56.93 56.37 3a2o s PHE 153 Cb 0.00 -1.52 -0.04 0.00 0.51 0.00 0.00 43.02 41.97 3a2o s PHE 153 CO 0.00 0.49 -0.16 0.96 0.70 0.00 0.00 175.22 177.21 3a2o s ILE 154 N -1.40 1.51 -0.01 0.64 -4.36 -0.35 -4.98 121.20 112.25 3a2o s ILE 154 Ca 0.27 -1.79 -0.17 0.00 -0.26 0.00 0.00 60.65 58.69 3a2o s ILE 154 Cb -0.11 -1.65 -0.06 0.00 1.25 0.00 0.00 42.46 41.89 3a2o s ILE 154 CO 0.19 -0.38 0.47 -0.54 0.24 0.00 0.00 174.94 174.91 3a2o s LYS 155 N -2.73 4.10 0.17 0.37 1.02 -1.26 -1.34 119.74 120.06 3a2o s LYS 155 Ca 0.11 0.50 0.01 0.00 0.02 0.00 0.00 55.97 56.62 3a2o s LYS 155 Cb -0.05 -3.28 -0.04 0.00 -0.52 0.00 0.00 37.83 33.93 3a2o s LYS 155 CO 0.04 0.54 0.03 0.14 -0.92 0.00 0.00 175.35 175.18 3a2o s VAL 156 N -0.64 0.50 -0.23 3.17 -7.23 -0.10 -4.46 120.40 111.41 3a2o s VAL 156 Ca 0.26 -1.96 -0.09 0.00 -1.81 0.00 0.00 61.98 58.37 3a2o s VAL 156 Cb -0.17 -2.14 -0.04 0.00 0.56 0.00 0.00 36.38 34.59 3a2o s VAL 156 CO 0.14 -0.43 0.12 -0.13 -0.31 0.00 0.00 175.10 174.49 3a2o s ARG 157 N -3.96 3.97 -0.28 4.82 0.52 -0.06 -2.40 118.95 121.56 3a2o s ARG 157 Ca 0.25 -0.33 -0.13 0.00 -0.52 0.00 0.00 55.73 55.00 3a2o s ARG 157 Cb 0.07 -3.43 -0.04 0.00 0.52 0.00 0.00 34.95 32.06 3a2o s ARG 157 CO 0.04 0.06 0.31 -1.14 0.02 0.00 0.00 175.30 174.58 3a2o s GLN 158 N 1.03 3.97 -0.13 3.54 0.74 0.44 -0.72 119.66 128.52 3a2o s GLN 158 Ca 0.06 -0.11 -0.01 0.00 0.05 0.00 0.00 55.36 55.35 3a2o s GLN 158 Cb -0.14 -3.66 -0.02 0.00 1.10 0.00 0.00 33.01 30.29 3a2o s GLN 158 CO 0.04 -0.25 -0.09 0.71 -0.55 0.00 0.00 175.29 175.14 3a2o s TYR 159 N 1.96 2.90 0.14 1.67 1.51 -0.41 -1.59 117.35 123.53 3a2o s TYR 159 Ca 0.12 -0.45 0.03 0.00 -1.01 0.00 0.00 57.07 55.76 3a2o s TYR 159 Cb -0.16 -1.87 -0.04 0.00 -0.11 0.00 0.00 41.96 39.79 3a2o s TYR 159 CO 0.10 -0.09 0.25 -0.51 -1.11 0.00 0.00 175.55 174.19 3a2o s ASP 160 N 0.23 6.20 -1.35 2.29 1.01 -1.26 -0.92 116.67 122.87 3a2o s ASP 160 Ca -0.06 0.13 -0.07 0.00 0.71 0.00 0.00 52.55 53.26 3a2o s ASP 160 Cb -0.15 -1.84 0.02 0.00 1.01 0.00 0.00 42.92 41.97 3a2o s ASP 160 CO 0.04 0.07 1.07 0.00 0.21 0.00 0.00 175.17 176.57 3a2o n GLN 161 N -0.41 -7.04 -3.22 8.23 6.02 -1.12 -4.90 117.38 114.94 3a2o n GLN 161 Ca -0.07 0.78 -0.39 0.00 -0.01 0.00 0.00 57.00 57.31 3a2o n GLN 161 Cb 0.54 -5.76 -0.06 0.00 1.02 0.00 0.00 30.24 25.98 3a2o n GLN 161 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3a2o s ILE 162 N -3.35 5.06 -0.00 5.09 -1.09 -0.06 -4.67 121.20 122.18 3a2o s ILE 162 Ca 0.42 1.17 -0.30 0.00 -2.23 0.00 0.00 60.65 59.71 3a2o s ILE 162 Cb -0.19 -3.91 -0.04 0.00 -1.58 0.00 0.00 42.46 36.74 3a2o s ILE 162 CO 0.75 0.34 1.18 -0.63 -1.23 0.00 0.00 174.94 175.36 3a2o s ILE 163 N 0.36 4.22 -0.13 2.92 1.01 -1.26 -1.27 121.20 127.04 3a2o s ILE 163 Ca 0.30 1.57 -0.10 0.00 0.00 0.00 0.00 60.65 62.43 3a2o s ILE 163 Cb -0.17 -4.01 0.04 0.00 0.01 0.00 0.00 42.46 38.34 3a2o s ILE 163 CO 0.15 0.06 0.34 -0.51 0.00 0.00 0.00 174.94 174.98 3a2o s ILE 164 N 1.62 -0.02 -0.09 2.92 2.07 -0.52 -4.48 121.20 122.70 3a2o s ILE 164 Ca 0.57 0.06 -0.02 0.00 -1.41 0.00 0.00 60.65 59.84 3a2o s ILE 164 Cb -0.26 -0.49 -0.03 0.00 0.13 0.00 0.00 42.46 41.80 3a2o s ILE 164 CO 0.26 0.02 -0.00 -1.61 -1.91 0.00 0.00 174.94 171.70 3a2o s GLU 165 N 0.76 3.07 -0.25 3.50 2.02 -0.57 -0.92 118.70 126.32 3a2o s GLU 165 Ca -0.05 -0.42 0.01 0.00 0.02 0.00 0.00 54.97 54.54 3a2o s GLU 165 Cb -0.06 -2.81 0.06 0.00 0.10 0.00 0.00 34.13 31.42 3a2o s GLU 165 CO -0.05 0.65 -0.05 0.42 0.02 0.00 0.00 175.26 176.24 3a2o s ILE 166 N -0.72 1.64 -1.52 -1.63 -1.09 0.25 -0.91 121.20 117.22 3a2o s ILE 166 Ca 0.11 -1.34 -0.13 0.00 -2.23 0.00 0.00 60.65 57.06 3a2o s ILE 166 Cb -0.12 -1.90 0.08 0.00 -1.58 0.00 0.00 42.46 38.95 3a2o s ILE 166 CO 0.02 -0.13 0.90 0.00 -1.23 0.00 0.00 174.94 174.50 3a2o n ALA 167 N 4.62 -1.23 -0.08 9.38 0.00 -0.30 -0.87 120.51 132.03 3a2o n ALA 167 Ca -0.11 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3a2o n ALA 167 Cb 0.44 -4.23 0.00 0.00 0.00 0.00 0.00 19.45 15.65 3a2o n ALA 167 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2o n GLY 168 N -1.61 1.97 3.70 0.00 0.00 -1.26 -5.02 105.19 102.97 3a2o n GLY 168 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 3a2o n GLY 168 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3a2o s HIS 169 N -2.79 3.44 0.10 1.61 3.76 -0.05 -5.05 115.29 116.31 3a2o s HIS 169 Ca 0.00 0.68 -0.29 0.00 -0.15 0.00 0.00 55.06 55.30 3a2o s HIS 169 Cb 0.00 -2.47 -0.06 0.00 1.11 0.00 0.00 32.58 31.17 3a2o s HIS 169 CO 0.00 0.12 0.94 0.15 -0.85 0.00 0.00 174.74 175.10 3a2o s LYS 170 N 0.83 4.67 0.09 1.40 1.02 -1.26 -0.58 119.74 125.90 3a2o s LYS 170 Ca 0.20 1.40 0.01 0.00 0.02 0.00 0.00 55.97 57.61 3a2o s LYS 170 Cb -0.14 -3.38 -0.04 0.00 -0.52 0.00 0.00 37.83 33.75 3a2o s LYS 170 CO 0.07 0.21 -0.06 0.00 -0.92 0.00 0.00 175.35 174.65 3a2o s ALA 171 N 0.05 0.85 -0.18 5.17 0.00 -0.10 -4.83 121.76 122.72 3a2o s ALA 171 Ca 0.46 -1.31 -0.05 0.00 0.00 0.00 0.00 51.96 51.07 3a2o s ALA 171 Cb -0.23 0.19 0.07 0.00 0.00 0.00 0.00 23.12 23.15 3a2o s ALA 171 CO 0.29 -0.27 0.15 0.42 0.00 0.00 0.00 175.76 176.35 3a2o s ILE 172 N -3.69 -0.19 0.00 0.00 1.01 -1.26 -1.44 121.20 115.63 3a2o s ILE 172 Ca 0.10 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.62 3a2o s ILE 172 Cb 0.06 -0.61 0.00 0.00 0.01 0.00 0.00 42.46 41.92 3a2o s ILE 172 CO -0.06 -0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.25 3a2o n GLY 173 N 5.30 1.39 3.73 6.18 0.00 -0.40 -4.77 105.19 116.62 3a2o n GLY 173 Ca -0.06 -0.76 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 3a2o n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a2o s THR 174 N -2.41 4.56 -0.09 2.61 2.01 -1.26 -0.89 115.64 120.17 3a2o s THR 174 Ca 0.00 1.98 0.02 0.00 0.31 0.00 0.00 61.69 64.00 3a2o s THR 174 Cb 0.00 -4.28 0.01 0.00 0.01 0.00 0.00 72.50 68.24 3a2o s THR 174 CO 0.00 0.32 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.43 3a2o s VAL 175 N 0.03 1.32 -0.04 3.82 1.01 -0.09 -4.51 120.40 121.94 3a2o s VAL 175 Ca 0.45 -0.55 -0.13 0.00 0.00 0.00 0.00 61.98 61.75 3a2o s VAL 175 Cb -0.23 -1.22 -0.05 0.00 0.00 0.00 0.00 36.38 34.88 3a2o s VAL 175 CO 0.28 0.40 0.35 -0.76 0.00 0.00 0.00 175.10 175.38 3a2o s LEU 176 N 0.93 4.44 -0.09 3.92 1.43 -0.11 -1.28 118.68 127.91 3a2o s LEU 176 Ca -0.09 0.83 0.04 0.00 -1.03 0.00 0.00 54.13 53.88 3a2o s LEU 176 Cb -0.15 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.60 3a2o s LEU 176 CO 0.00 0.32 -0.21 -0.69 0.23 0.00 0.00 176.35 176.00 3a2o s VAL 177 N -0.94 1.85 -1.73 -1.59 1.01 0.10 -0.50 120.40 118.59 3a2o s VAL 177 Ca 0.22 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.30 3a2o s VAL 177 Cb -0.15 -1.61 0.00 0.00 0.00 0.00 0.00 36.38 34.61 3a2o s VAL 177 CO 0.11 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.33 3a2o n GLY 178 N 3.61 -0.74 2.58 4.51 0.00 -0.72 -0.88 105.19 113.54 3a2o n GLY 178 Ca -0.20 -0.82 -0.41 0.00 0.00 0.00 0.00 46.02 44.59 3a2o n GLY 178 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3a2o n PRO 179 N 0.00 4.33 -2.55 1.61 -0.04 -1.26 -3.76 135.00 133.33 3a2o n PRO 179 Ca 0.00 -3.46 -0.41 0.00 -0.04 0.00 0.00 63.50 59.59 3a2o n PRO 179 Cb 0.00 -2.71 -0.04 0.00 -0.04 0.00 0.00 33.50 30.71 3a2o n PRO 179 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 3a2o s THR 180 N -0.71 3.84 0.30 0.52 -1.32 -1.26 -4.98 115.64 112.04 3a2o s THR 180 Ca 0.50 1.68 0.30 0.00 -1.21 0.00 0.00 61.69 62.97 3a2o s THR 180 Cb 0.16 -4.07 0.32 0.00 -1.51 0.00 0.00 72.50 67.40 3a2o s THR 180 CO -0.07 0.33 2.03 -0.65 -2.21 0.00 0.00 174.62 174.05 3a2o h PRO 181 N 4.68 0.00 -3.54 7.08 0.11 -1.97 -3.44 132.00 134.91 3a2o h PRO 181 Ca -0.45 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.40 3a2o h PRO 181 Cb 1.21 0.00 -0.31 0.00 0.11 0.00 0.00 31.00 32.01 3a2o h PRO 181 CO 0.70 0.11 -0.69 0.08 -0.21 0.00 0.00 178.00 177.99 3a2o s VAL 182 N -3.94 -0.03 0.08 3.15 1.01 -1.26 -5.09 120.40 114.31 3a2o s VAL 182 Ca -0.01 0.12 -0.31 0.00 0.00 0.00 0.00 61.98 61.78 3a2o s VAL 182 Cb 0.11 -0.09 -0.09 0.00 0.00 0.00 0.00 36.38 36.32 3a2o s VAL 182 CO 0.57 0.05 1.69 0.20 0.00 0.00 0.00 175.10 177.61 3a2o s ASN 183 N 0.63 6.57 -0.10 3.32 0.01 -1.26 -4.80 114.94 119.31 3a2o s ASN 183 Ca -0.05 2.53 0.02 0.00 -0.71 0.00 0.00 52.86 54.65 3a2o s ASN 183 Cb -0.07 -2.56 0.01 0.00 0.41 0.00 0.00 41.25 39.04 3a2o s ASN 183 CO -0.02 -0.91 -0.16 0.27 -1.51 0.00 0.00 177.10 174.76 3a2o s ILE 184 N 2.72 1.53 -0.43 0.60 -4.36 -0.39 -0.75 121.20 120.12 3a2o s ILE 184 Ca 0.75 -0.68 -0.20 0.00 -0.26 0.00 0.00 60.65 60.26 3a2o s ILE 184 Cb -0.41 -1.37 0.02 0.00 1.25 0.00 0.00 42.46 41.95 3a2o s ILE 184 CO 0.33 0.44 0.58 -0.63 0.24 0.00 0.00 174.94 175.91 3a2o s ILE 185 N 0.75 4.90 0.35 8.37 -1.09 0.16 -1.11 121.20 133.54 3a2o s ILE 185 Ca -0.12 -0.00 0.03 0.00 -2.23 0.00 0.00 60.65 58.34 3a2o s ILE 185 Cb -0.16 -4.15 0.06 0.00 -1.58 0.00 0.00 42.46 36.63 3a2o s ILE 185 CO 0.02 -0.54 0.48 0.61 -1.23 0.00 0.00 174.94 174.29 3a2o n GLY 186 N 5.05 1.51 0.24 6.18 0.00 -1.21 -0.99 105.19 115.96 3a2o n GLY 186 Ca -0.03 -2.12 0.07 0.00 0.00 0.00 0.00 46.02 43.94 3a2o n GLY 186 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3a2o h ARG 187 N 0.00 0.00 -0.69 1.61 3.08 -0.76 -0.61 114.38 117.01 3a2o h ARG 187 Ca -0.16 0.00 0.08 0.00 0.07 0.00 0.00 59.98 59.97 3a2o h ARG 187 Cb 0.69 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.69 3a2o h ARG 187 CO 0.21 0.13 0.46 -2.95 -1.07 0.00 0.00 179.97 176.75 3a2o h ASN 188 N 0.00 0.57 0.13 7.04 -1.07 -1.70 -1.19 115.58 119.35 3a2o h ASN 188 Ca -0.00 0.01 -0.33 0.00 0.07 0.00 0.00 56.30 56.04 3a2o h ASN 188 Cb 0.25 -0.11 -0.06 0.00 -2.07 0.00 0.00 38.32 36.33 3a2o h ASN 188 CO 0.02 0.35 -2.20 0.18 0.07 0.00 0.00 177.43 175.85 3a2o n LEU 189 N -4.48 0.21 -0.23 6.14 4.77 -0.71 -3.97 117.00 118.73 3a2o n LEU 189 Ca 0.11 0.10 0.03 0.00 -0.03 0.00 0.00 56.01 56.21 3a2o n LEU 189 Cb 0.29 0.40 0.27 0.00 -2.33 0.00 0.00 43.42 42.05 3a2o n LEU 189 CO 0.33 0.45 1.24 -0.07 -1.33 0.00 0.00 177.39 178.01 3a2o h LEU 190 N 0.00 0.83 -0.92 2.23 3.38 -0.93 -1.48 115.31 118.42 3a2o h LEU 190 Ca -0.46 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.41 3a2o h LEU 190 Cb 2.14 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 42.68 3a2o h LEU 190 CO 0.04 0.57 -0.14 0.71 0.09 0.00 0.00 178.44 179.71 3a2o h THR 191 N 0.96 1.25 -0.21 0.22 1.35 -1.40 -1.27 112.91 113.81 3a2o h THR 191 Ca 0.31 -1.14 -0.04 0.00 -0.55 0.00 0.00 66.41 64.99 3a2o h THR 191 Cb 0.03 1.13 -0.01 0.00 -1.73 0.00 0.00 68.15 67.57 3a2o h THR 191 CO -0.09 0.38 -0.05 1.56 -0.25 0.00 0.00 175.52 177.07 3a2o h GLN 192 N 0.58 0.32 -0.12 4.72 4.20 -1.41 -2.39 115.11 121.01 3a2o h GLN 192 Ca 0.10 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.75 3a2o h GLN 192 Cb 0.57 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.30 3a2o h GLN 192 CO 0.04 0.39 0.00 0.44 -0.67 0.00 0.00 178.83 179.03 3a2o n ILE 193 N -4.31 0.14 -1.63 2.54 -5.35 -0.95 -4.95 119.36 104.85 3a2o n ILE 193 Ca 0.00 -0.36 0.00 0.00 -0.27 0.00 0.00 62.75 62.12 3a2o n ILE 193 Cb 0.23 0.55 0.00 0.00 -1.74 0.00 0.00 39.64 38.68 3a2o n ILE 193 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3a2o n GLY 194 N 1.19 0.40 3.76 3.28 0.00 -0.90 -5.02 105.19 107.90 3a2o n GLY 194 Ca 0.17 -0.94 -0.39 0.00 0.00 0.00 0.00 46.02 44.86 3a2o n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a2o s ALA 195 N -2.00 3.29 0.12 4.61 0.00 -0.51 -5.03 121.76 122.24 3a2o s ALA 195 Ca 0.00 0.58 0.04 0.00 0.00 0.00 0.00 51.96 52.58 3a2o s ALA 195 Cb 0.00 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 3a2o s ALA 195 CO 0.00 0.20 -0.09 0.95 0.00 0.00 0.00 175.76 176.81 3a2o s THR 196 N -1.35 1.01 -0.02 0.00 -4.23 -1.26 -4.71 115.64 105.08 3a2o s THR 196 Ca 0.45 -1.92 -0.11 0.00 -1.18 0.00 0.00 61.69 58.92 3a2o s THR 196 Cb -0.23 -1.68 -0.05 0.00 1.34 0.00 0.00 72.50 71.88 3a2o s THR 196 CO 0.29 -0.72 0.32 -0.22 -0.54 0.00 0.00 174.62 173.74 3a2o s LEU 197 N -2.95 4.43 -0.02 4.79 2.96 -1.26 -5.09 118.68 121.54 3a2o s LEU 197 Ca 0.13 0.77 -0.01 0.00 -0.22 0.00 0.00 54.13 54.80 3a2o s LEU 197 Cb 0.02 -2.50 0.02 0.00 0.50 0.00 0.00 46.19 44.23 3a2o s LEU 197 CO -0.01 0.32 0.04 0.20 -1.32 0.00 0.00 176.35 175.59 3a2o s ASN 198 N -1.20 0.01 0.00 3.68 0.01 -1.26 -5.29 114.94 110.89 3a2o s ASN 198 Ca 0.23 0.08 0.00 0.00 -0.71 0.00 0.00 52.86 52.46 3a2o s ASN 198 Cb -0.15 0.01 0.00 0.00 0.41 0.00 0.00 41.25 41.52 3a2o s ASN 198 CO 0.12 -0.09 0.00 2.22 -1.51 0.00 0.00 177.10 177.83