#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fx5 s GLN 102 N 0.00 3.15 -0.26 0.54 0.74 -1.26 -5.09 119.66 117.47 3fx5 s GLN 102 Ca 0.00 -0.77 -0.06 0.00 0.05 0.00 0.00 55.36 54.58 3fx5 s GLN 102 Cb 0.00 -3.00 -0.00 0.00 1.10 0.00 0.00 33.01 31.11 3fx5 s GLN 102 CO 0.00 -0.28 0.04 0.42 -0.55 0.00 0.00 175.29 174.92 3fx5 s ILE 103 N 1.42 3.85 0.79 -2.34 1.01 -1.26 -5.10 121.20 119.57 3fx5 s ILE 103 Ca 0.04 -0.54 -0.10 0.00 0.00 0.00 0.00 60.65 60.04 3fx5 s ILE 103 Cb -0.15 -2.89 0.09 0.00 0.01 0.00 0.00 42.46 39.52 3fx5 s ILE 103 CO -0.04 0.23 1.13 0.42 0.00 0.00 0.00 174.94 176.68 3fx5 s THR 104 N 1.51 2.10 -0.10 2.92 -4.23 -1.26 -5.03 115.64 111.56 3fx5 s THR 104 Ca 0.04 -0.12 0.15 0.00 -1.18 0.00 0.00 61.69 60.58 3fx5 s THR 104 Cb -0.16 -2.98 0.23 0.00 1.34 0.00 0.00 72.50 70.93 3fx5 s THR 104 CO 0.01 0.00 1.12 0.18 -0.54 0.00 0.00 174.62 175.39 3fx5 n LEU 105 N -3.22 2.25 0.17 4.79 4.77 -1.26 -4.61 117.00 119.89 3fx5 n LEU 105 Ca 0.09 -2.84 0.03 0.00 -0.03 0.00 0.00 56.01 53.26 3fx5 n LEU 105 Cb 0.61 -0.34 0.39 0.00 -2.33 0.00 0.00 43.42 41.75 3fx5 n LEU 105 CO 0.53 0.66 0.81 -0.50 -1.33 0.00 0.00 177.39 177.56 3fx5 h TRP 106 N 0.00 0.10 -1.84 -1.77 4.06 -2.06 -3.43 115.95 111.01 3fx5 h TRP 106 Ca 0.00 -0.02 -0.60 0.00 2.06 0.00 0.00 58.89 60.34 3fx5 h TRP 106 Cb 0.91 -0.03 -0.11 0.00 -1.00 0.00 0.00 29.16 28.93 3fx5 h TRP 106 CO 0.00 0.35 -0.61 0.15 -3.56 0.00 0.00 178.44 174.77 3fx5 s LYS 107 N -4.45 2.03 0.41 0.49 3.01 -1.26 -5.11 119.74 114.85 3fx5 s LYS 107 Ca -0.04 -1.86 -0.27 0.00 -1.01 0.00 0.00 55.97 52.79 3fx5 s LYS 107 Cb 0.15 -1.84 -0.10 0.00 -1.01 0.00 0.00 37.83 35.03 3fx5 s LYS 107 CO 0.72 0.07 1.48 1.03 0.51 0.00 0.00 175.35 179.17 3fx5 s ARG 108 N -3.72 3.92 -1.40 1.68 0.52 -1.26 -4.85 118.95 113.85 3fx5 s ARG 108 Ca 0.35 2.54 -0.12 0.00 -0.52 0.00 0.00 55.73 57.99 3fx5 s ARG 108 Cb 0.03 -2.84 0.09 0.00 0.52 0.00 0.00 34.95 32.74 3fx5 s ARG 108 CO 0.19 -0.67 2.12 -0.35 0.02 0.00 0.00 175.30 176.61 3fx5 n PRO 109 N 0.18 3.20 -3.01 3.54 -0.04 -1.26 -4.93 135.00 132.68 3fx5 n PRO 109 Ca 0.03 -2.95 -0.40 0.00 -0.04 0.00 0.00 63.50 60.14 3fx5 n PRO 109 Cb 0.40 -3.13 -0.05 0.00 -0.04 0.00 0.00 33.50 30.68 3fx5 n PRO 109 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3fx5 s LEU 110 N 1.18 4.46 0.23 1.53 1.43 -1.26 -1.34 118.68 124.90 3fx5 s LEU 110 Ca 0.45 1.43 0.03 0.00 -1.03 0.00 0.00 54.13 55.00 3fx5 s LEU 110 Cb 0.13 -3.20 -0.05 0.00 0.03 0.00 0.00 46.19 43.10 3fx5 s LEU 110 CO -0.05 0.04 0.03 0.68 0.23 0.00 0.00 176.35 177.28 3fx5 s VAL 111 N -0.16 0.84 -0.04 -1.59 -7.23 0.18 -4.97 120.40 107.43 3fx5 s VAL 111 Ca 0.37 -2.01 -0.16 0.00 -1.81 0.00 0.00 61.98 58.37 3fx5 s VAL 111 Cb -0.20 -2.39 -0.05 0.00 0.56 0.00 0.00 36.38 34.29 3fx5 s VAL 111 CO 0.22 -0.26 0.44 -0.89 -0.31 0.00 0.00 175.10 174.31 3fx5 s THR 112 N -3.55 5.07 0.29 5.32 2.01 -1.26 -0.90 115.64 122.61 3fx5 s THR 112 Ca 0.30 0.90 0.11 0.00 0.31 0.00 0.00 61.69 63.31 3fx5 s THR 112 Cb 0.06 -3.76 -0.05 0.00 0.01 0.00 0.00 72.50 68.77 3fx5 s THR 112 CO 0.09 0.48 -0.10 0.27 -0.69 0.00 0.00 174.62 174.67 3fx5 s ILE 113 N -0.42 2.80 -0.11 1.82 -4.36 0.27 -1.01 121.20 120.19 3fx5 s ILE 113 Ca 0.24 -2.17 0.00 0.00 -0.26 0.00 0.00 60.65 58.46 3fx5 s ILE 113 Cb -0.16 -2.57 0.02 0.00 1.25 0.00 0.00 42.46 41.00 3fx5 s ILE 113 CO 0.12 -0.35 -0.10 -0.75 0.24 0.00 0.00 174.94 174.10 3fx5 s LYS 114 N -3.60 1.74 -0.01 0.37 2.20 0.00 -1.20 119.74 119.24 3fx5 s LYS 114 Ca 0.31 -0.36 -0.04 0.00 -0.36 0.00 0.00 55.97 55.53 3fx5 s LYS 114 Cb -0.04 -1.66 0.00 0.00 -1.51 0.00 0.00 37.83 34.62 3fx5 s LYS 114 CO 0.17 -0.19 0.08 0.42 -0.36 0.00 0.00 175.35 175.47 3fx5 s ILE 115 N 1.42 0.05 -1.90 5.43 1.01 -0.66 -1.21 121.20 125.33 3fx5 s ILE 115 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.26 3fx5 s ILE 115 Cb -0.13 -0.24 0.00 0.00 0.01 0.00 0.00 42.46 42.09 3fx5 s ILE 115 CO -0.06 -0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.28 3fx5 n GLY 116 N 2.28 1.06 2.86 6.18 0.00 -1.26 -0.95 105.19 115.36 3fx5 n GLY 116 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3fx5 n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fx5 n GLY 117 N -0.56 0.91 3.46 -0.02 0.00 -1.26 -5.01 105.19 102.72 3fx5 n GLY 117 Ca -0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 3fx5 n GLY 117 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3fx5 s GLN 118 N -0.02 2.40 0.06 1.61 -0.21 -0.12 -5.10 119.66 118.27 3fx5 s GLN 118 Ca 0.00 -0.77 -0.22 0.00 0.02 0.00 0.00 55.36 54.39 3fx5 s GLN 118 Cb 0.00 -2.32 -0.06 0.00 1.00 0.00 0.00 33.01 31.63 3fx5 s GLN 118 CO 0.00 0.60 0.67 -0.51 -2.12 0.00 0.00 175.29 173.94 3fx5 s LEU 119 N -0.88 4.48 0.05 2.90 1.43 -1.26 -1.66 118.68 123.75 3fx5 s LEU 119 Ca 0.12 1.36 -0.01 0.00 -1.03 0.00 0.00 54.13 54.57 3fx5 s LEU 119 Cb -0.11 -3.07 -0.04 0.00 0.03 0.00 0.00 46.19 43.00 3fx5 s LEU 119 CO 0.02 0.13 -0.03 -0.54 0.23 0.00 0.00 176.35 176.16 3fx5 s LYS 120 N -0.53 0.62 0.02 1.70 1.02 -0.34 -4.98 119.74 117.25 3fx5 s LYS 120 Ca 0.34 -1.22 -0.13 0.00 0.02 0.00 0.00 55.97 54.97 3fx5 s LYS 120 Cb -0.20 0.18 -0.06 0.00 -0.52 0.00 0.00 37.83 37.23 3fx5 s LYS 120 CO 0.21 -0.10 0.40 -2.00 -0.92 0.00 0.00 175.35 172.94 3fx5 s GLU 121 N -3.90 3.86 0.12 1.68 2.12 -1.26 -0.56 118.70 120.76 3fx5 s GLU 121 Ca 0.07 0.33 -0.11 0.00 0.36 0.00 0.00 54.97 55.63 3fx5 s GLU 121 Cb 0.08 -3.15 0.00 0.00 0.26 0.00 0.00 34.13 31.32 3fx5 s GLU 121 CO -0.10 0.65 0.27 0.00 -0.54 0.00 0.00 175.26 175.55 3fx5 s ALA 122 N -1.17 -0.33 -0.17 6.30 0.00 -0.08 -4.47 121.76 121.84 3fx5 s ALA 122 Ca 0.26 -0.57 -0.06 0.00 0.00 0.00 0.00 51.96 51.60 3fx5 s ALA 122 Cb -0.16 0.64 -0.03 0.00 0.00 0.00 0.00 23.12 23.57 3fx5 s ALA 122 CO 0.14 -0.59 0.02 -1.17 0.00 0.00 0.00 175.76 174.17 3fx5 s LEU 123 N -2.88 3.57 -0.40 0.00 1.98 0.02 -0.65 118.68 120.32 3fx5 s LEU 123 Ca 0.08 -0.01 -0.29 0.00 -2.89 0.00 0.00 54.13 51.02 3fx5 s LEU 123 Cb 0.04 -1.89 0.02 0.00 0.66 0.00 0.00 46.19 45.02 3fx5 s LEU 123 CO -0.08 0.17 1.23 -0.76 -1.89 0.00 0.00 176.35 175.03 3fx5 s LEU 124 N 0.37 3.71 -0.36 -0.68 1.43 -0.45 -0.77 118.68 121.92 3fx5 s LEU 124 Ca -0.00 0.79 0.03 0.00 -1.03 0.00 0.00 54.13 53.91 3fx5 s LEU 124 Cb -0.13 -3.54 0.11 0.00 0.03 0.00 0.00 46.19 42.65 3fx5 s LEU 124 CO 0.01 -1.22 0.10 -0.62 0.23 0.00 0.00 176.35 174.86 3fx5 s ASP 125 N 2.81 4.42 0.36 2.29 -1.08 -0.08 -4.79 116.67 120.59 3fx5 s ASP 125 Ca 0.53 -2.16 0.27 0.00 -0.52 0.00 0.00 52.55 50.67 3fx5 s ASP 125 Cb -0.11 -1.37 1.11 0.00 -1.46 0.00 0.00 42.92 41.09 3fx5 s ASP 125 CO 0.28 -0.36 1.81 0.71 0.52 0.00 0.00 175.17 178.13 3fx5 h THR 126 N 6.32 0.00 -0.06 1.71 1.35 -1.94 -2.46 112.91 117.84 3fx5 h THR 126 Ca -0.07 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 3fx5 h THR 126 Cb 0.99 1.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.59 3fx5 h THR 126 CO 0.52 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.40 3fx5 n GLY 127 N 0.05 -0.33 3.42 5.82 0.00 -1.26 -4.82 105.19 108.06 3fx5 n GLY 127 Ca 0.02 -0.31 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 3fx5 n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fx5 s ALA 128 N -1.93 2.88 0.25 4.61 0.00 -0.93 -4.99 121.76 121.65 3fx5 s ALA 128 Ca 0.36 -0.95 -0.01 0.00 0.00 0.00 0.00 51.96 51.36 3fx5 s ALA 128 Cb 0.18 -1.55 0.32 0.00 0.00 0.00 0.00 23.12 22.07 3fx5 s ALA 128 CO 0.29 0.01 1.71 -0.44 0.00 0.00 0.00 175.76 177.33 3fx5 h ASP 129 N 7.17 0.67 -2.26 0.00 3.32 -1.87 0.54 116.42 123.99 3fx5 h ASP 129 Ca -0.33 -0.21 -0.58 0.00 0.02 0.00 0.00 57.03 55.94 3fx5 h ASP 129 Cb 1.19 -0.18 -0.14 0.00 0.22 0.00 0.00 39.33 40.42 3fx5 h ASP 129 CO 0.60 0.84 -0.67 -1.81 -1.72 0.00 0.00 179.24 176.48 3fx5 s ASP 130 N -6.73 3.40 -0.23 6.45 1.11 -1.26 -2.29 116.67 117.12 3fx5 s ASP 130 Ca -0.09 -1.22 -0.10 0.00 0.18 0.00 0.00 52.55 51.32 3fx5 s ASP 130 Cb 0.14 -0.29 -0.05 0.00 1.07 0.00 0.00 42.92 43.79 3fx5 s ASP 130 CO 0.81 -0.29 0.14 -0.89 1.18 0.00 0.00 175.17 176.12 3fx5 s THR 131 N -2.77 5.21 -0.05 -1.27 2.01 -1.26 -3.18 115.64 114.33 3fx5 s THR 131 Ca 0.32 0.13 -0.00 0.00 0.31 0.00 0.00 61.69 62.45 3fx5 s THR 131 Cb 0.04 -3.42 0.03 0.00 0.01 0.00 0.00 72.50 69.15 3fx5 s THR 131 CO 0.15 0.36 -0.01 0.54 -0.69 0.00 0.00 174.62 174.96 3fx5 s VAL 132 N 1.04 0.38 0.10 3.82 0.11 -0.53 -1.01 120.40 124.31 3fx5 s VAL 132 Ca 0.07 0.03 0.07 0.00 -2.93 0.00 0.00 61.98 59.22 3fx5 s VAL 132 Cb -0.14 -0.48 -0.04 0.00 -1.53 0.00 0.00 36.38 34.20 3fx5 s VAL 132 CO 0.04 0.22 -0.13 0.27 -3.33 0.00 0.00 175.10 172.17 3fx5 s ILE 133 N 1.37 3.20 0.79 7.04 -4.36 0.38 -1.18 121.20 128.44 3fx5 s ILE 133 Ca -0.04 -1.29 -0.12 0.00 -0.26 0.00 0.00 60.65 58.93 3fx5 s ILE 133 Cb -0.13 -2.47 0.07 0.00 1.25 0.00 0.00 42.46 41.18 3fx5 s ILE 133 CO -0.02 0.14 1.14 -1.61 0.24 0.00 0.00 174.94 174.84 3fx5 s GLU 134 N -2.08 1.92 0.11 0.37 2.02 -1.26 -1.74 118.70 118.05 3fx5 s GLU 134 Ca 0.20 1.49 -0.35 0.00 0.02 0.00 0.00 54.97 56.33 3fx5 s GLU 134 Cb -0.11 -1.83 -0.18 0.00 0.10 0.00 0.00 34.13 32.11 3fx5 s GLU 134 CO 0.12 -1.94 0.99 0.39 0.02 0.00 0.00 175.26 174.83 3fx5 n GLU 135 N -3.34 0.47 -3.69 1.61 -0.58 -1.26 -4.75 120.64 109.10 3fx5 n GLU 135 Ca 0.11 0.17 -0.04 0.00 -0.42 0.00 0.00 57.16 56.98 3fx5 n GLU 135 Cb 0.52 -1.56 -0.01 0.00 -0.57 0.00 0.00 31.44 29.82 3fx5 n GLU 135 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3fx5 s MET 136 N -0.34 1.02 -0.18 3.49 0.23 -1.26 -5.08 119.30 117.18 3fx5 s MET 136 Ca 0.78 -0.53 -0.17 0.00 -1.03 0.00 0.00 55.69 54.74 3fx5 s MET 136 Cb -1.03 0.37 -0.04 0.00 -1.53 0.00 0.00 34.83 32.60 3fx5 s MET 136 CO 0.55 -0.46 0.46 0.45 -2.03 0.00 0.00 175.02 173.98 3fx5 s SER 137 N -2.84 6.55 0.14 -1.18 0.15 -1.26 -5.07 113.70 110.19 3fx5 s SER 137 Ca 0.11 0.65 0.09 0.00 0.70 0.00 0.00 55.95 57.50 3fx5 s SER 137 Cb -0.01 -2.27 -0.04 0.00 -1.71 0.00 0.00 66.02 62.00 3fx5 s SER 137 CO -0.01 -0.09 -0.20 -0.76 1.20 0.00 0.00 173.24 173.38 3fx5 s LEU 138 N 1.24 2.39 0.53 3.45 1.43 -1.26 -4.93 118.68 121.52 3fx5 s LEU 138 Ca 0.23 -0.80 -0.13 0.00 -1.03 0.00 0.00 54.13 52.39 3fx5 s LEU 138 Cb -0.15 -0.90 -0.06 0.00 0.03 0.00 0.00 46.19 45.11 3fx5 s LEU 138 CO 0.09 0.02 0.95 -2.16 0.23 0.00 0.00 176.35 175.48 3fx5 s PRO 139 N -2.45 3.80 0.13 1.29 0.04 -1.26 -4.97 135.00 131.58 3fx5 s PRO 139 Ca 0.13 0.78 0.00 0.00 0.04 0.00 0.00 61.00 61.95 3fx5 s PRO 139 Cb -0.08 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.29 3fx5 s PRO 139 CO 0.06 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.20 3fx5 n GLY 140 N -1.91 -2.98 3.83 0.56 0.00 -1.26 -4.94 105.19 98.50 3fx5 n GLY 140 Ca 0.05 -1.82 -0.32 0.00 0.00 0.00 0.00 46.02 43.93 3fx5 n GLY 140 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fx5 s ARG 141 N -0.74 4.01 0.27 1.61 0.52 -1.26 -5.08 118.95 118.27 3fx5 s ARG 141 Ca 0.00 1.03 0.11 0.00 -0.52 0.00 0.00 55.73 56.35 3fx5 s ARG 141 Cb 0.00 -2.14 -0.05 0.00 0.52 0.00 0.00 34.95 33.28 3fx5 s ARG 141 CO 0.00 -0.22 -0.19 1.67 0.02 0.00 0.00 175.30 176.58 3fx5 s TRP 142 N -2.47 2.18 0.17 -0.53 1.48 -1.26 -4.65 118.94 113.86 3fx5 s TRP 142 Ca 0.60 -0.38 0.09 0.00 -1.06 0.00 0.00 56.10 55.36 3fx5 s TRP 142 Cb -0.10 -0.95 -0.04 0.00 -1.16 0.00 0.00 33.47 31.22 3fx5 s TRP 142 CO 0.26 0.65 -0.20 -1.59 -4.06 0.00 0.00 176.95 172.00 3fx5 s LYS 143 N -3.54 1.33 0.39 3.25 -2.85 -0.57 -4.91 119.74 112.84 3fx5 s LYS 143 Ca 0.29 -1.41 -0.23 0.00 -1.00 0.00 0.00 55.97 53.61 3fx5 s LYS 143 Cb -0.04 -1.49 -0.10 0.00 -2.06 0.00 0.00 37.83 34.13 3fx5 s LYS 143 CO 0.13 0.32 0.96 -1.25 0.10 0.00 0.00 175.35 175.61 3fx5 s PRO 144 N -2.65 4.33 0.00 1.78 0.04 -1.26 -0.72 135.00 136.52 3fx5 s PRO 144 Ca 0.16 1.25 -0.15 0.00 0.04 0.00 0.00 61.00 62.30 3fx5 s PRO 144 Cb -0.07 -2.44 0.02 0.00 0.04 0.00 0.00 34.50 32.06 3fx5 s PRO 144 CO 0.07 0.05 0.33 0.21 0.04 0.00 0.00 177.00 177.69 3fx5 s LYS 145 N -2.70 0.73 -0.11 4.56 2.20 -1.06 -4.84 119.74 118.50 3fx5 s LYS 145 Ca 0.58 -0.27 -0.01 0.00 -0.36 0.00 0.00 55.97 55.91 3fx5 s LYS 145 Cb -0.14 0.32 -0.02 0.00 -1.51 0.00 0.00 37.83 36.48 3fx5 s LYS 145 CO 0.19 -0.21 -0.09 -1.64 -0.36 0.00 0.00 175.35 173.23 3fx5 s MET 146 N -1.70 3.24 0.14 4.03 -1.94 -1.26 -1.41 119.30 120.39 3fx5 s MET 146 Ca -0.11 -0.61 0.07 0.00 -1.71 0.00 0.00 55.69 53.34 3fx5 s MET 146 Cb -0.04 -2.68 -0.04 0.00 2.01 0.00 0.00 34.83 34.09 3fx5 s MET 146 CO 0.02 0.37 -0.16 0.96 -0.01 0.00 0.00 175.02 176.19 3fx5 s ILE 147 N -0.02 1.58 0.30 2.53 -4.36 -0.54 -4.97 121.20 115.72 3fx5 s ILE 147 Ca -0.01 -1.80 0.02 0.00 -0.26 0.00 0.00 60.65 58.59 3fx5 s ILE 147 Cb -0.14 -1.68 -0.01 0.00 1.25 0.00 0.00 42.46 41.88 3fx5 s ILE 147 CO 0.03 -0.35 0.35 0.61 0.24 0.00 0.00 174.94 175.83 3fx5 n GLY 148 N 0.45 2.58 0.00 6.27 0.00 -1.26 -0.74 105.19 112.49 3fx5 n GLY 148 Ca -0.15 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.17 3fx5 n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fx5 n GLY 149 N -0.53 -0.78 3.75 -0.02 0.00 -0.78 -4.97 105.19 101.87 3fx5 n GLY 149 Ca 0.03 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 3fx5 n GLY 149 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fx5 s ILE 150 N -4.00 2.86 0.00 -0.61 1.01 -1.26 -2.12 121.20 117.07 3fx5 s ILE 150 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 60.65 61.39 3fx5 s ILE 150 Cb 0.00 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 39.00 3fx5 s ILE 150 CO 0.00 0.12 0.00 0.61 0.00 0.00 0.00 174.94 175.67 3fx5 n GLY 151 N 2.03 2.22 0.00 6.18 0.00 -1.26 -4.93 105.19 109.43 3fx5 n GLY 151 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3fx5 n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fx5 n GLY 152 N -2.00 0.24 3.65 -0.02 0.00 -0.90 -5.02 105.19 101.14 3fx5 n GLY 152 Ca 0.00 -2.23 -0.32 0.00 0.00 0.00 0.00 46.02 43.48 3fx5 n GLY 152 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fx5 s PHE 153 N 0.00 2.99 0.08 1.61 0.40 -1.26 -1.86 117.98 119.93 3fx5 s PHE 153 Ca 0.00 0.01 0.03 0.00 -0.60 0.00 0.00 56.93 56.37 3fx5 s PHE 153 Cb 0.00 -1.61 -0.03 0.00 0.51 0.00 0.00 43.02 41.89 3fx5 s PHE 153 CO 0.00 0.44 -0.10 0.96 0.70 0.00 0.00 175.22 177.22 3fx5 s ILE 154 N -1.13 0.83 0.07 0.64 -4.36 0.08 -4.98 121.20 112.36 3fx5 s ILE 154 Ca 0.21 -1.48 -0.23 0.00 -0.26 0.00 0.00 60.65 58.88 3fx5 s ILE 154 Cb -0.11 -1.16 -0.06 0.00 1.25 0.00 0.00 42.46 42.37 3fx5 s ILE 154 CO 0.12 -0.50 0.68 -0.54 0.24 0.00 0.00 174.94 174.94 3fx5 s LYS 155 N -2.46 4.40 0.16 0.37 1.02 -1.26 -1.47 119.74 120.51 3fx5 s LYS 155 Ca 0.01 0.93 -0.00 0.00 0.02 0.00 0.00 55.97 56.93 3fx5 s LYS 155 Cb -0.05 -3.31 -0.04 0.00 -0.52 0.00 0.00 37.83 33.91 3fx5 s LYS 155 CO -0.00 0.45 0.05 0.14 -0.92 0.00 0.00 175.35 175.07 3fx5 s VAL 156 N -0.57 0.29 -0.22 3.17 -7.23 -0.50 -4.73 120.40 110.60 3fx5 s VAL 156 Ca 0.34 -1.95 -0.10 0.00 -1.81 0.00 0.00 61.98 58.46 3fx5 s VAL 156 Cb -0.20 -2.16 -0.05 0.00 0.56 0.00 0.00 36.38 34.53 3fx5 s VAL 156 CO 0.21 -0.39 0.15 -0.13 -0.31 0.00 0.00 175.10 174.63 3fx5 s ARG 157 N -4.02 4.12 -0.29 4.82 0.52 -0.26 -2.58 118.95 121.26 3fx5 s ARG 157 Ca 0.27 -0.25 -0.11 0.00 -0.52 0.00 0.00 55.73 55.11 3fx5 s ARG 157 Cb 0.07 -3.49 -0.05 0.00 0.52 0.00 0.00 34.95 32.01 3fx5 s ARG 157 CO 0.04 0.16 0.21 -1.14 0.02 0.00 0.00 175.30 174.59 3fx5 s GLN 158 N 0.77 3.91 -0.17 3.54 0.74 0.10 -0.69 119.66 127.86 3fx5 s GLN 158 Ca 0.08 -0.33 -0.02 0.00 0.05 0.00 0.00 55.36 55.14 3fx5 s GLN 158 Cb -0.12 -3.67 -0.01 0.00 1.10 0.00 0.00 33.01 30.30 3fx5 s GLN 158 CO 0.02 -0.21 -0.08 0.71 -0.55 0.00 0.00 175.29 175.17 3fx5 s TYR 159 N 1.78 2.90 0.17 1.67 1.51 -0.38 -1.52 117.35 123.48 3fx5 s TYR 159 Ca 0.07 -0.69 -0.01 0.00 -1.01 0.00 0.00 57.07 55.43 3fx5 s TYR 159 Cb -0.16 -1.96 -0.04 0.00 -0.11 0.00 0.00 41.96 39.69 3fx5 s TYR 159 CO 0.11 -0.30 0.35 -0.51 -1.11 0.00 0.00 175.55 174.09 3fx5 s ASP 160 N 0.74 6.40 -1.33 2.29 1.01 -1.26 -0.96 116.67 123.56 3fx5 s ASP 160 Ca -0.04 0.39 -0.07 0.00 0.71 0.00 0.00 52.55 53.55 3fx5 s ASP 160 Cb -0.15 -2.01 0.01 0.00 1.01 0.00 0.00 42.92 41.78 3fx5 s ASP 160 CO 0.02 0.01 1.12 0.00 0.21 0.00 0.00 175.17 176.53 3fx5 n GLN 161 N -0.39 -7.47 -3.26 8.23 6.02 -1.11 -4.90 117.38 114.51 3fx5 n GLN 161 Ca -0.05 0.82 -0.38 0.00 -0.01 0.00 0.00 57.00 57.38 3fx5 n GLN 161 Cb 0.53 -5.85 -0.06 0.00 1.02 0.00 0.00 30.24 25.88 3fx5 n GLN 161 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3fx5 s ILE 162 N -3.34 5.04 -0.02 5.09 -1.09 -0.13 -4.66 121.20 122.10 3fx5 s ILE 162 Ca 0.43 1.12 -0.30 0.00 -2.23 0.00 0.00 60.65 59.67 3fx5 s ILE 162 Cb -0.19 -3.88 -0.03 0.00 -1.58 0.00 0.00 42.46 36.78 3fx5 s ILE 162 CO 0.74 0.38 1.11 -0.63 -1.23 0.00 0.00 174.94 175.30 3fx5 s ILE 163 N 0.15 4.46 -0.13 2.92 1.01 -1.26 -1.26 121.20 127.09 3fx5 s ILE 163 Ca 0.29 1.76 -0.08 0.00 0.00 0.00 0.00 60.65 62.62 3fx5 s ILE 163 Cb -0.17 -4.13 0.05 0.00 0.01 0.00 0.00 42.46 38.22 3fx5 s ILE 163 CO 0.14 0.07 0.33 -0.51 0.00 0.00 0.00 174.94 174.97 3fx5 s ILE 164 N 1.59 -0.02 -0.14 2.92 2.07 -0.46 -4.47 121.20 122.69 3fx5 s ILE 164 Ca 0.54 0.09 -0.06 0.00 -1.41 0.00 0.00 60.65 59.81 3fx5 s ILE 164 Cb -0.24 -0.49 -0.04 0.00 0.13 0.00 0.00 42.46 41.82 3fx5 s ILE 164 CO 0.24 0.04 0.09 -1.61 -1.91 0.00 0.00 174.94 171.79 3fx5 s GLU 165 N 1.05 3.59 -0.23 3.50 2.02 -0.35 -1.12 118.70 127.16 3fx5 s GLU 165 Ca -0.07 -0.25 0.01 0.00 0.02 0.00 0.00 54.97 54.67 3fx5 s GLU 165 Cb -0.08 -3.15 0.06 0.00 0.10 0.00 0.00 34.13 31.07 3fx5 s GLU 165 CO -0.08 0.57 -0.05 0.42 0.02 0.00 0.00 175.26 176.14 3fx5 s ILE 166 N -0.45 1.48 -1.48 -1.63 -1.09 0.34 -0.82 121.20 117.55 3fx5 s ILE 166 Ca 0.11 -1.19 -0.11 0.00 -2.23 0.00 0.00 60.65 57.23 3fx5 s ILE 166 Cb -0.12 -1.76 0.07 0.00 -1.58 0.00 0.00 42.46 39.07 3fx5 s ILE 166 CO 0.02 -0.11 0.83 0.00 -1.23 0.00 0.00 174.94 174.45 3fx5 n ALA 167 N 4.69 -1.19 -0.41 9.38 0.00 -0.18 -0.84 120.51 131.96 3fx5 n ALA 167 Ca -0.12 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3fx5 n ALA 167 Cb 0.44 -4.10 0.00 0.00 0.00 0.00 0.00 19.45 15.79 3fx5 n ALA 167 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fx5 n GLY 168 N -1.57 1.54 3.71 0.00 0.00 -1.26 -5.03 105.19 102.58 3fx5 n GLY 168 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 3fx5 n GLY 168 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fx5 s HIS 169 N -3.18 3.42 0.09 1.61 3.76 -0.02 -5.06 115.29 115.90 3fx5 s HIS 169 Ca 0.00 0.47 -0.29 0.00 -0.15 0.00 0.00 55.06 55.09 3fx5 s HIS 169 Cb 0.00 -2.30 -0.06 0.00 1.11 0.00 0.00 32.58 31.33 3fx5 s HIS 169 CO 0.00 0.20 0.92 0.15 -0.85 0.00 0.00 174.74 175.16 3fx5 s LYS 170 N 0.62 4.65 0.08 1.40 1.02 -1.26 -0.50 119.74 125.75 3fx5 s LYS 170 Ca 0.13 1.37 0.02 0.00 0.02 0.00 0.00 55.97 57.51 3fx5 s LYS 170 Cb -0.13 -3.38 -0.04 0.00 -0.52 0.00 0.00 37.83 33.77 3fx5 s LYS 170 CO 0.03 0.22 -0.06 0.00 -0.92 0.00 0.00 175.35 174.61 3fx5 s ALA 171 N 0.03 0.84 -0.15 5.17 0.00 -0.27 -4.82 121.76 122.56 3fx5 s ALA 171 Ca 0.45 -1.20 -0.04 0.00 0.00 0.00 0.00 51.96 51.17 3fx5 s ALA 171 Cb -0.23 0.14 0.06 0.00 0.00 0.00 0.00 23.12 23.10 3fx5 s ALA 171 CO 0.28 -0.20 0.14 0.42 0.00 0.00 0.00 175.76 176.40 3fx5 s ILE 172 N -3.14 -0.19 0.00 0.00 1.01 -1.26 -1.35 121.20 116.26 3fx5 s ILE 172 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.72 3fx5 s ILE 172 Cb 0.02 -0.51 0.00 0.00 0.01 0.00 0.00 42.46 41.98 3fx5 s ILE 172 CO -0.04 -0.13 0.00 0.61 0.00 0.00 0.00 174.94 175.37 3fx5 n GLY 173 N 5.30 1.29 3.72 6.18 0.00 -0.39 -4.78 105.19 116.51 3fx5 n GLY 173 Ca -0.06 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.83 3fx5 n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fx5 s THR 174 N -2.34 4.77 -0.11 2.61 2.01 -1.26 -0.95 115.64 120.37 3fx5 s THR 174 Ca 0.00 1.93 0.02 0.00 0.31 0.00 0.00 61.69 63.96 3fx5 s THR 174 Cb 0.00 -4.26 0.01 0.00 0.01 0.00 0.00 72.50 68.26 3fx5 s THR 174 CO 0.00 0.24 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.31 3fx5 s VAL 175 N 0.56 1.64 -0.06 3.82 1.01 -0.13 -4.51 120.40 122.74 3fx5 s VAL 175 Ca 0.47 -0.74 -0.11 0.00 0.00 0.00 0.00 61.98 61.60 3fx5 s VAL 175 Cb -0.21 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.65 3fx5 s VAL 175 CO 0.27 0.47 0.29 -0.76 0.00 0.00 0.00 175.10 175.36 3fx5 s LEU 176 N 0.82 4.43 -0.11 3.92 1.43 -0.18 -1.25 118.68 127.74 3fx5 s LEU 176 Ca -0.10 0.73 0.03 0.00 -1.03 0.00 0.00 54.13 53.77 3fx5 s LEU 176 Cb -0.16 -2.35 0.00 0.00 0.03 0.00 0.00 46.19 43.71 3fx5 s LEU 176 CO 0.01 0.35 -0.22 -0.69 0.23 0.00 0.00 176.35 176.03 3fx5 s VAL 177 N -1.00 2.20 -1.59 -1.59 1.01 0.13 -0.47 120.40 119.09 3fx5 s VAL 177 Ca 0.20 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.22 3fx5 s VAL 177 Cb -0.15 -1.86 0.00 0.00 0.00 0.00 0.00 36.38 34.37 3fx5 s VAL 177 CO 0.09 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.35 3fx5 n GLY 178 N 3.65 -1.35 3.71 4.51 0.00 -0.71 -1.10 105.19 113.89 3fx5 n GLY 178 Ca -0.19 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.45 3fx5 n GLY 178 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3fx5 s PRO 179 N -0.87 4.48 -0.05 1.61 0.04 -1.26 -4.14 135.00 134.81 3fx5 s PRO 179 Ca 0.00 1.18 -0.11 0.00 0.04 0.00 0.00 61.00 62.11 3fx5 s PRO 179 Cb 0.00 -3.47 0.02 0.00 0.04 0.00 0.00 34.50 31.09 3fx5 s PRO 179 CO 0.00 -0.05 0.26 -0.08 0.04 0.00 0.00 177.00 177.17 3fx5 s THR 180 N 1.09 0.04 0.37 1.26 -1.32 -1.26 -5.05 115.64 110.76 3fx5 s THR 180 Ca 0.45 -0.32 0.07 0.00 -1.21 0.00 0.00 61.69 60.68 3fx5 s THR 180 Cb -0.19 -0.48 0.17 0.00 -1.51 0.00 0.00 72.50 70.48 3fx5 s THR 180 CO 0.22 -0.18 1.91 1.55 -2.21 0.00 0.00 174.62 175.92 3fx5 h PRO 181 N 4.72 0.39 -2.73 7.08 0.13 -1.98 -3.44 132.00 136.18 3fx5 h PRO 181 Ca -0.28 -0.08 -0.12 0.00 -0.87 0.00 0.00 66.00 64.65 3fx5 h PRO 181 Cb 1.19 -0.06 -0.23 0.00 0.13 0.00 0.00 31.00 32.03 3fx5 h PRO 181 CO 0.37 0.45 -0.21 0.08 -0.23 0.00 0.00 178.00 178.46 3fx5 s VAL 182 N -4.91 0.01 0.03 1.56 1.01 -1.26 -5.13 120.40 111.71 3fx5 s VAL 182 Ca -0.07 -0.06 -0.37 0.00 0.00 0.00 0.00 61.98 61.48 3fx5 s VAL 182 Cb 0.16 -0.61 -0.16 0.00 0.00 0.00 0.00 36.38 35.76 3fx5 s VAL 182 CO 0.75 -0.04 1.46 0.59 0.00 0.00 0.00 175.10 177.86 3fx5 n ASN 183 N 2.56 2.04 -4.28 3.32 3.02 -1.26 -4.90 115.26 115.76 3fx5 n ASN 183 Ca -0.15 1.10 -0.34 0.00 -0.03 0.00 0.00 54.58 55.16 3fx5 n ASN 183 Cb 0.57 -1.22 -0.15 0.00 -0.61 0.00 0.00 39.78 38.37 3fx5 n ASN 183 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3fx5 s ILE 184 N 1.18 3.00 -0.45 2.41 1.01 -0.32 -0.80 121.20 127.23 3fx5 s ILE 184 Ca 0.86 -0.63 -0.17 0.00 0.00 0.00 0.00 60.65 60.72 3fx5 s ILE 184 Cb -0.92 -2.33 0.04 0.00 0.01 0.00 0.00 42.46 39.26 3fx5 s ILE 184 CO 0.49 0.47 0.43 -0.63 0.00 0.00 0.00 174.94 175.70 3fx5 s ILE 185 N 1.22 5.13 0.29 2.92 -1.09 0.05 -1.45 121.20 128.27 3fx5 s ILE 185 Ca 0.02 -0.65 0.03 0.00 -2.23 0.00 0.00 60.65 57.82 3fx5 s ILE 185 Cb -0.14 -4.09 0.05 0.00 -1.58 0.00 0.00 42.46 36.69 3fx5 s ILE 185 CO -0.04 -0.52 0.39 0.61 -1.23 0.00 0.00 174.94 174.15 3fx5 n GLY 186 N 5.16 1.62 0.24 6.18 0.00 -1.19 -0.91 105.19 116.29 3fx5 n GLY 186 Ca -0.09 -2.13 0.08 0.00 0.00 0.00 0.00 46.02 43.87 3fx5 n GLY 186 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3fx5 h ARG 187 N 0.00 0.00 -0.48 1.61 3.08 -0.79 -0.52 114.38 117.27 3fx5 h ARG 187 Ca -0.13 0.00 0.07 0.00 0.07 0.00 0.00 59.98 59.98 3fx5 h ARG 187 Cb 0.57 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.60 3fx5 h ARG 187 CO 0.17 0.15 0.32 -2.95 -1.07 0.00 0.00 179.97 176.60 3fx5 h ASN 188 N 0.00 0.33 0.05 7.04 -1.07 -1.72 -1.49 115.58 118.71 3fx5 h ASN 188 Ca -0.00 0.00 -0.34 0.00 0.07 0.00 0.00 56.30 56.03 3fx5 h ASN 188 Cb 0.29 -0.07 -0.06 0.00 -2.07 0.00 0.00 38.32 36.41 3fx5 h ASN 188 CO 0.02 0.22 -2.30 0.18 0.07 0.00 0.00 177.43 175.62 3fx5 n LEU 189 N -4.47 0.08 -0.22 6.14 4.77 -0.67 -4.06 117.00 118.58 3fx5 n LEU 189 Ca 0.07 0.04 0.02 0.00 -0.03 0.00 0.00 56.01 56.11 3fx5 n LEU 189 Cb 0.27 0.44 0.27 0.00 -2.33 0.00 0.00 43.42 42.07 3fx5 n LEU 189 CO 0.34 0.46 1.24 -0.07 -1.33 0.00 0.00 177.39 178.03 3fx5 h LEU 190 N 0.00 0.82 -0.99 2.23 3.38 -0.90 -1.49 115.31 118.36 3fx5 h LEU 190 Ca -0.49 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.40 3fx5 h LEU 190 Cb 2.15 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 42.68 3fx5 h LEU 190 CO 0.03 0.58 0.00 0.71 0.09 0.00 0.00 178.44 179.85 3fx5 h THR 191 N 0.96 1.23 -0.22 0.22 1.35 -1.46 -1.44 112.91 113.55 3fx5 h THR 191 Ca 0.29 -0.95 -0.05 0.00 -0.55 0.00 0.00 66.41 65.15 3fx5 h THR 191 Cb -0.01 0.89 -0.01 0.00 -1.73 0.00 0.00 68.15 67.28 3fx5 h THR 191 CO -0.08 0.33 -0.07 1.56 -0.25 0.00 0.00 175.52 177.01 3fx5 h GLN 192 N 0.69 0.34 -0.07 4.72 4.20 -1.43 -2.28 115.11 121.28 3fx5 h GLN 192 Ca 0.14 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.77 3fx5 h GLN 192 Cb 0.42 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.15 3fx5 h GLN 192 CO 0.02 0.43 0.00 0.44 -0.67 0.00 0.00 178.83 179.05 3fx5 n ILE 193 N -4.29 0.08 -1.37 2.54 -5.35 -0.97 -4.94 119.36 105.06 3fx5 n ILE 193 Ca 0.00 -0.31 0.00 0.00 -0.27 0.00 0.00 62.75 62.17 3fx5 n ILE 193 Cb 0.25 0.53 0.00 0.00 -1.74 0.00 0.00 39.64 38.69 3fx5 n ILE 193 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3fx5 n GLY 194 N 1.18 0.43 3.76 3.28 0.00 -0.86 -5.02 105.19 107.96 3fx5 n GLY 194 Ca 0.18 -0.96 -0.39 0.00 0.00 0.00 0.00 46.02 44.85 3fx5 n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fx5 s ALA 195 N -2.00 3.31 0.12 4.61 0.00 -0.58 -5.03 121.76 122.19 3fx5 s ALA 195 Ca 0.00 0.64 0.03 0.00 0.00 0.00 0.00 51.96 52.63 3fx5 s ALA 195 Cb 0.00 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 3fx5 s ALA 195 CO 0.00 0.13 -0.08 0.95 0.00 0.00 0.00 175.76 176.76 3fx5 s THR 196 N -1.30 0.93 -0.08 0.00 -4.23 -1.26 -4.71 115.64 104.98 3fx5 s THR 196 Ca 0.44 -1.96 -0.12 0.00 -1.18 0.00 0.00 61.69 58.88 3fx5 s THR 196 Cb -0.25 -1.71 -0.05 0.00 1.34 0.00 0.00 72.50 71.83 3fx5 s THR 196 CO 0.31 -0.78 0.30 -0.22 -0.54 0.00 0.00 174.62 173.68 3fx5 s LEU 197 N -3.03 4.38 -0.02 4.79 2.96 -1.26 -5.09 118.68 121.41 3fx5 s LEU 197 Ca 0.13 0.68 0.01 0.00 -0.22 0.00 0.00 54.13 54.73 3fx5 s LEU 197 Cb 0.03 -2.37 0.01 0.00 0.50 0.00 0.00 46.19 44.36 3fx5 s LEU 197 CO -0.02 0.28 -0.01 0.20 -1.32 0.00 0.00 176.35 175.48 3fx5 s ASN 198 N -0.57 0.33 0.00 3.68 0.01 -1.26 -5.29 114.94 111.84 3fx5 s ASN 198 Ca 0.19 -0.03 0.00 0.00 -0.71 0.00 0.00 52.86 52.31 3fx5 s ASN 198 Cb -0.14 -0.12 0.00 0.00 0.41 0.00 0.00 41.25 41.40 3fx5 s ASN 198 CO 0.08 -0.04 0.00 2.22 -1.51 0.00 0.00 177.10 177.85