#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aof s GLN 102 N 0.00 2.67 -0.27 0.54 0.74 -1.26 -5.10 119.66 116.97 2aof s GLN 102 Ca 0.00 -1.08 -0.06 0.00 0.05 0.00 0.00 55.36 54.27 2aof s GLN 102 Cb 0.00 -2.92 0.00 0.00 1.10 0.00 0.00 33.01 31.19 2aof s GLN 102 CO 0.00 -0.44 0.05 0.42 -0.55 0.00 0.00 175.29 174.77 2aof s ILE 103 N 1.26 3.86 0.87 -2.34 1.01 -1.26 -5.10 121.20 119.49 2aof s ILE 103 Ca -0.02 -0.61 -0.13 0.00 0.00 0.00 0.00 60.65 59.89 2aof s ILE 103 Cb -0.17 -2.93 0.13 0.00 0.01 0.00 0.00 42.46 39.50 2aof s ILE 103 CO -0.06 0.17 1.23 0.42 0.00 0.00 0.00 174.94 176.71 2aof s THR 104 N 1.50 2.02 -0.12 2.92 -4.23 -1.26 -5.03 115.64 111.45 2aof s THR 104 Ca 0.03 -0.04 0.15 0.00 -1.18 0.00 0.00 61.69 60.66 2aof s THR 104 Cb -0.16 -2.99 0.27 0.00 1.34 0.00 0.00 72.50 70.96 2aof s THR 104 CO 0.01 0.00 1.14 0.18 -0.54 0.00 0.00 174.62 175.41 2aof n LEU 105 N -3.48 2.04 0.21 4.79 4.77 -1.26 -4.62 117.00 119.44 2aof n LEU 105 Ca 0.11 -2.89 0.05 0.00 -0.03 0.00 0.00 56.01 53.25 2aof n LEU 105 Cb 0.60 -0.37 0.45 0.00 -2.33 0.00 0.00 43.42 41.77 2aof n LEU 105 CO 0.51 0.74 0.81 -0.50 -1.33 0.00 0.00 177.39 177.62 2aof h TRP 106 N 0.18 0.00 -1.87 -1.77 4.06 -2.06 -3.43 115.95 111.06 2aof h TRP 106 Ca -0.01 0.00 -0.61 0.00 2.06 0.00 0.00 58.89 60.33 2aof h TRP 106 Cb 1.08 0.00 -0.12 0.00 -1.00 0.00 0.00 29.16 29.12 2aof h TRP 106 CO 0.13 0.28 -0.64 -1.59 -3.56 0.00 0.00 178.44 173.06 2aof s LYS 107 N -4.31 1.93 0.31 0.49 -2.85 -1.26 -5.11 119.74 108.94 2aof s LYS 107 Ca -0.03 -1.92 -0.29 0.00 -1.00 0.00 0.00 55.97 52.73 2aof s LYS 107 Cb 0.15 -1.76 -0.11 0.00 -2.06 0.00 0.00 37.83 34.04 2aof s LYS 107 CO 0.70 0.09 1.54 1.03 0.10 0.00 0.00 175.35 178.81 2aof s ARG 108 N -3.67 4.14 -1.36 1.78 0.52 -1.26 -4.86 118.95 114.24 2aof s ARG 108 Ca 0.34 2.54 -0.16 0.00 -0.52 0.00 0.00 55.73 57.93 2aof s ARG 108 Cb 0.03 -3.02 0.04 0.00 0.52 0.00 0.00 34.95 32.53 2aof s ARG 108 CO 0.18 -0.57 2.02 -0.35 0.02 0.00 0.00 175.30 176.60 2aof n PRO 109 N 1.64 2.90 -3.18 3.54 -0.04 -1.26 -4.94 135.00 133.66 2aof n PRO 109 Ca 0.06 -2.83 -0.39 0.00 -0.04 0.00 0.00 63.50 60.30 2aof n PRO 109 Cb 0.38 -3.37 -0.06 0.00 -0.04 0.00 0.00 33.50 30.42 2aof n PRO 109 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2aof s LEU 110 N 3.18 4.46 0.17 1.53 1.43 -1.26 -0.99 118.68 127.21 2aof s LEU 110 Ca 0.51 1.26 0.01 0.00 -1.03 0.00 0.00 54.13 54.88 2aof s LEU 110 Cb 0.10 -2.98 -0.05 0.00 0.03 0.00 0.00 46.19 43.29 2aof s LEU 110 CO -0.01 0.14 0.02 0.68 0.23 0.00 0.00 176.35 177.41 2aof s VAL 111 N -0.48 0.58 -0.00 -1.59 -7.23 -0.20 -4.96 120.40 106.52 2aof s VAL 111 Ca 0.32 -1.97 -0.18 0.00 -1.81 0.00 0.00 61.98 58.33 2aof s VAL 111 Cb -0.19 -2.15 -0.06 0.00 0.56 0.00 0.00 36.38 34.54 2aof s VAL 111 CO 0.19 -0.43 0.52 -0.89 -0.31 0.00 0.00 175.10 174.18 2aof s THR 112 N -3.72 4.93 0.27 5.32 2.01 -1.26 -1.17 115.64 122.02 2aof s THR 112 Ca 0.25 1.10 0.11 0.00 0.31 0.00 0.00 61.69 63.46 2aof s THR 112 Cb 0.06 -3.85 -0.05 0.00 0.01 0.00 0.00 72.50 68.67 2aof s THR 112 CO 0.04 0.48 -0.13 0.27 -0.69 0.00 0.00 174.62 174.59 2aof s ILE 113 N -0.52 2.83 -0.08 1.82 -4.36 0.65 -0.90 121.20 120.63 2aof s ILE 113 Ca 0.28 -2.21 0.01 0.00 -0.26 0.00 0.00 60.65 58.47 2aof s ILE 113 Cb -0.18 -2.49 0.02 0.00 1.25 0.00 0.00 42.46 41.06 2aof s ILE 113 CO 0.16 -0.37 -0.09 -0.75 0.24 0.00 0.00 174.94 174.12 2aof s LYS 114 N -3.52 1.51 -0.06 0.37 2.20 0.05 -1.16 119.74 119.14 2aof s LYS 114 Ca 0.30 -0.30 -0.03 0.00 -0.36 0.00 0.00 55.97 55.57 2aof s LYS 114 Cb -0.06 -1.41 0.03 0.00 -1.51 0.00 0.00 37.83 34.89 2aof s LYS 114 CO 0.16 -0.11 0.14 -1.50 -0.36 0.00 0.00 175.35 173.69 2aof s ILE 115 N 1.14 -0.04 -1.73 5.43 2.07 -0.65 -1.08 121.20 126.33 2aof s ILE 115 Ca -0.06 0.14 0.00 0.00 -1.41 0.00 0.00 60.65 59.32 2aof s ILE 115 Cb -0.14 -0.23 0.00 0.00 0.13 0.00 0.00 42.46 42.22 2aof s ILE 115 CO -0.02 0.06 0.00 0.61 -1.91 0.00 0.00 174.94 173.68 2aof n GLY 116 N 3.94 0.23 2.93 1.50 0.00 -1.26 -1.39 105.19 111.14 2aof n GLY 116 Ca -0.23 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.69 2aof n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aof n GLY 117 N -0.91 0.90 3.42 -0.02 0.00 -1.26 -5.00 105.19 102.32 2aof n GLY 117 Ca -0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 2aof n GLY 117 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2aof s GLN 118 N -0.05 2.37 0.11 1.61 -0.21 -0.48 -5.11 119.66 117.90 2aof s GLN 118 Ca 0.00 -0.77 -0.27 0.00 0.02 0.00 0.00 55.36 54.34 2aof s GLN 118 Cb 0.00 -2.27 -0.06 0.00 1.00 0.00 0.00 33.01 31.68 2aof s GLN 118 CO 0.00 0.60 0.83 -0.51 -2.12 0.00 0.00 175.29 174.10 2aof s LEU 119 N -0.69 4.52 0.08 2.90 1.43 -1.26 -1.64 118.68 124.01 2aof s LEU 119 Ca 0.11 1.63 -0.01 0.00 -1.03 0.00 0.00 54.13 54.83 2aof s LEU 119 Cb -0.10 -3.37 -0.04 0.00 0.03 0.00 0.00 46.19 42.70 2aof s LEU 119 CO -0.00 0.05 -0.01 -0.54 0.23 0.00 0.00 176.35 176.08 2aof s LYS 120 N -0.40 0.74 -0.01 1.70 1.02 -0.31 -4.98 119.74 117.49 2aof s LYS 120 Ca 0.40 -1.31 -0.12 0.00 0.02 0.00 0.00 55.97 54.97 2aof s LYS 120 Cb -0.22 0.15 -0.05 0.00 -0.52 0.00 0.00 37.83 37.18 2aof s LYS 120 CO 0.26 -0.14 0.33 -1.21 -0.92 0.00 0.00 175.35 173.68 2aof s GLU 121 N -3.94 3.76 0.06 1.68 0.41 -1.26 -0.25 118.70 119.14 2aof s GLU 121 Ca 0.13 0.21 -0.10 0.00 -0.41 0.00 0.00 54.97 54.80 2aof s GLU 121 Cb 0.07 -3.17 0.00 0.00 -1.78 0.00 0.00 34.13 29.26 2aof s GLU 121 CO -0.06 0.69 0.21 0.00 -0.49 0.00 0.00 175.26 175.61 2aof s ALA 122 N -1.13 -0.37 -0.21 5.21 0.00 -0.32 -4.57 121.76 120.37 2aof s ALA 122 Ca 0.23 -0.34 -0.16 0.00 0.00 0.00 0.00 51.96 51.69 2aof s ALA 122 Cb -0.15 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.28 2aof s ALA 122 CO 0.12 -0.41 0.43 -0.51 0.00 0.00 0.00 175.76 175.39 2aof s LEU 123 N -2.31 4.13 -0.30 0.00 1.43 0.01 -1.03 118.68 120.61 2aof s LEU 123 Ca -0.02 0.52 -0.29 0.00 -1.03 0.00 0.00 54.13 53.31 2aof s LEU 123 Cb 0.01 -2.56 -0.00 0.00 0.03 0.00 0.00 46.19 43.67 2aof s LEU 123 CO -0.06 -0.13 1.38 -0.76 0.23 0.00 0.00 176.35 177.01 2aof s LEU 124 N 1.57 3.85 -0.37 1.79 1.43 -0.16 -0.88 118.68 125.91 2aof s LEU 124 Ca 0.20 1.25 0.02 0.00 -1.03 0.00 0.00 54.13 54.56 2aof s LEU 124 Cb -0.15 -3.54 0.11 0.00 0.03 0.00 0.00 46.19 42.64 2aof s LEU 124 CO 0.09 -1.16 0.12 -0.62 0.23 0.00 0.00 176.35 175.00 2aof s ASP 125 N 3.23 4.29 0.31 2.29 -1.08 0.08 -4.78 116.67 121.01 2aof s ASP 125 Ca 0.60 -2.15 0.25 0.00 -0.52 0.00 0.00 52.55 50.73 2aof s ASP 125 Cb -0.18 -1.28 1.04 0.00 -1.46 0.00 0.00 42.92 41.05 2aof s ASP 125 CO 0.25 -0.36 1.76 0.71 0.52 0.00 0.00 175.17 178.06 2aof h THR 126 N 6.23 0.00 -0.18 1.71 1.35 -1.94 -2.05 112.91 118.04 2aof h THR 126 Ca -0.07 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.51 2aof h THR 126 Cb 0.99 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 2aof h THR 126 CO 0.52 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.40 2aof n GLY 127 N 0.03 0.19 3.42 5.82 0.00 -1.26 -4.82 105.19 108.56 2aof n GLY 127 Ca 0.02 -0.37 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 2aof n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aof s ALA 128 N -1.77 2.89 0.24 4.61 0.00 -0.77 -5.00 121.76 121.96 2aof s ALA 128 Ca 0.29 -0.94 -0.03 0.00 0.00 0.00 0.00 51.96 51.28 2aof s ALA 128 Cb 0.15 -1.55 0.27 0.00 0.00 0.00 0.00 23.12 21.99 2aof s ALA 128 CO 0.23 0.02 1.73 -0.44 0.00 0.00 0.00 175.76 177.30 2aof h ASP 129 N 7.13 0.81 -2.94 0.00 3.32 -1.88 0.87 116.42 123.74 2aof h ASP 129 Ca -0.33 -0.21 -0.50 0.00 0.02 0.00 0.00 57.03 56.01 2aof h ASP 129 Cb 1.19 -0.22 -0.14 0.00 0.22 0.00 0.00 39.33 40.38 2aof h ASP 129 CO 0.60 0.89 -0.65 -1.81 -1.72 0.00 0.00 179.24 176.56 2aof s ASP 130 N -6.64 2.72 -0.21 6.45 1.01 -1.26 -2.46 116.67 116.27 2aof s ASP 130 Ca -0.10 -1.26 -0.12 0.00 0.71 0.00 0.00 52.55 51.78 2aof s ASP 130 Cb 0.14 -0.16 -0.05 0.00 1.01 0.00 0.00 42.92 43.87 2aof s ASP 130 CO 0.82 -0.44 0.23 -0.89 0.21 0.00 0.00 175.17 175.11 2aof s THR 131 N -3.08 5.32 -0.07 -1.27 2.01 -1.26 -3.03 115.64 114.26 2aof s THR 131 Ca 0.32 0.36 0.01 0.00 0.31 0.00 0.00 61.69 62.69 2aof s THR 131 Cb 0.06 -3.57 0.02 0.00 0.01 0.00 0.00 72.50 69.02 2aof s THR 131 CO 0.13 0.35 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.65 2aof s VAL 132 N 0.90 0.80 0.11 3.82 1.01 -0.44 -1.06 120.40 125.54 2aof s VAL 132 Ca 0.12 -0.24 0.09 0.00 0.00 0.00 0.00 61.98 61.94 2aof s VAL 132 Cb -0.13 -0.80 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 2aof s VAL 132 CO 0.04 0.30 -0.21 0.27 0.00 0.00 0.00 175.10 175.49 2aof s ILE 133 N 1.10 1.78 0.86 2.22 -4.36 0.32 -0.50 121.20 122.61 2aof s ILE 133 Ca -0.08 -1.60 -0.11 0.00 -0.26 0.00 0.00 60.65 58.61 2aof s ILE 133 Cb -0.14 -1.63 0.11 0.00 1.25 0.00 0.00 42.46 42.05 2aof s ILE 133 CO -0.01 -0.06 1.14 -1.83 0.24 0.00 0.00 174.94 174.42 2aof s GLU 134 N -2.00 1.46 -0.16 0.37 -1.05 -1.26 -1.86 118.70 114.21 2aof s GLU 134 Ca 0.08 1.48 -0.42 0.00 -0.15 0.00 0.00 54.97 55.96 2aof s GLU 134 Cb -0.10 -1.78 -0.19 0.00 -0.44 0.00 0.00 34.13 31.62 2aof s GLU 134 CO 0.05 -2.29 1.32 0.39 0.95 0.00 0.00 175.26 175.67 2aof n GLU 135 N -3.88 0.27 -3.84 -4.83 -0.58 -1.25 -4.70 120.64 101.81 2aof n GLU 135 Ca 0.11 0.10 -0.07 0.00 -0.42 0.00 0.00 57.16 56.88 2aof n GLU 135 Cb 0.52 -1.63 -0.02 0.00 -0.57 0.00 0.00 31.44 29.74 2aof n GLU 135 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2aof s MET 136 N 1.24 1.74 -0.10 3.49 0.23 -1.26 -5.07 119.30 119.58 2aof s MET 136 Ca 0.95 -0.96 -0.16 0.00 -1.03 0.00 0.00 55.69 54.49 2aof s MET 136 Cb -1.27 0.60 -0.05 0.00 -1.53 0.00 0.00 34.83 32.58 2aof s MET 136 CO 0.63 -0.80 0.42 0.45 -2.03 0.00 0.00 175.02 173.69 2aof s SER 137 N -2.91 6.66 0.10 -1.18 0.15 -1.26 -5.08 113.70 110.18 2aof s SER 137 Ca 0.11 0.78 0.06 0.00 0.70 0.00 0.00 55.95 57.60 2aof s SER 137 Cb -0.06 -2.25 -0.03 0.00 -1.71 0.00 0.00 66.02 61.97 2aof s SER 137 CO 0.06 0.11 -0.16 -0.76 1.20 0.00 0.00 173.24 173.70 2aof s LEU 138 N 0.12 2.34 0.61 3.45 1.43 -1.26 -4.96 118.68 120.40 2aof s LEU 138 Ca 0.23 -0.72 -0.12 0.00 -1.03 0.00 0.00 54.13 52.49 2aof s LEU 138 Cb -0.15 -0.63 -0.04 0.00 0.03 0.00 0.00 46.19 45.40 2aof s LEU 138 CO 0.10 -0.07 1.03 -2.16 0.23 0.00 0.00 176.35 175.47 2aof s PRO 139 N -2.17 3.56 0.57 1.29 0.04 -1.26 -4.94 135.00 132.09 2aof s PRO 139 Ca 0.05 0.84 0.00 0.00 0.04 0.00 0.00 61.00 61.93 2aof s PRO 139 Cb -0.08 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.39 2aof s PRO 139 CO 0.03 -0.60 0.00 0.41 0.04 0.00 0.00 177.00 176.88 2aof n GLY 140 N -2.33 -1.88 3.87 0.56 0.00 -1.26 -4.94 105.19 99.21 2aof n GLY 140 Ca 0.06 -1.72 -0.31 0.00 0.00 0.00 0.00 46.02 44.05 2aof n GLY 140 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2aof s ARG 141 N 0.00 3.84 0.27 1.61 0.52 -1.26 -5.10 118.95 118.84 2aof s ARG 141 Ca 0.00 0.43 0.10 0.00 -0.52 0.00 0.00 55.73 55.74 2aof s ARG 141 Cb 0.00 -2.50 -0.05 0.00 0.52 0.00 0.00 34.95 32.92 2aof s ARG 141 CO 0.00 0.15 -0.15 1.67 0.02 0.00 0.00 175.30 176.99 2aof s TRP 142 N -2.06 2.09 0.16 -0.53 1.48 -1.26 -4.67 118.94 114.14 2aof s TRP 142 Ca 0.50 -0.48 0.10 0.00 -1.06 0.00 0.00 56.10 55.16 2aof s TRP 142 Cb -0.11 -1.01 -0.04 0.00 -1.16 0.00 0.00 33.47 31.15 2aof s TRP 142 CO 0.24 0.53 -0.21 0.15 -4.06 0.00 0.00 176.95 173.59 2aof s LYS 143 N -3.60 1.32 0.42 3.25 1.02 -0.64 -4.91 119.74 116.61 2aof s LYS 143 Ca 0.28 -1.39 -0.22 0.00 0.02 0.00 0.00 55.97 54.67 2aof s LYS 143 Cb -0.01 -1.54 -0.10 0.00 -0.52 0.00 0.00 37.83 35.65 2aof s LYS 143 CO 0.12 0.33 0.97 -1.25 -0.92 0.00 0.00 175.35 174.61 2aof s PRO 144 N -2.51 4.20 -0.13 -1.68 0.04 -1.26 -0.66 135.00 133.00 2aof s PRO 144 Ca 0.15 1.21 -0.18 0.00 0.04 0.00 0.00 61.00 62.22 2aof s PRO 144 Cb -0.08 -2.27 0.05 0.00 0.04 0.00 0.00 34.50 32.24 2aof s PRO 144 CO 0.07 -0.06 0.48 0.21 0.04 0.00 0.00 177.00 177.73 2aof s LYS 145 N -3.00 0.66 -0.15 4.56 2.20 -1.15 -4.84 119.74 118.02 2aof s LYS 145 Ca 0.61 0.45 -0.02 0.00 -0.36 0.00 0.00 55.97 56.65 2aof s LYS 145 Cb -0.12 0.31 -0.02 0.00 -1.51 0.00 0.00 37.83 36.49 2aof s LYS 145 CO 0.16 -0.13 -0.09 1.41 -0.36 0.00 0.00 175.35 176.35 2aof s MET 146 N -0.25 3.47 0.16 4.03 -2.45 -1.26 -0.95 119.30 122.05 2aof s MET 146 Ca -0.04 -0.62 0.09 0.00 -1.25 0.00 0.00 55.69 53.86 2aof s MET 146 Cb -0.03 -2.78 -0.04 0.00 1.25 0.00 0.00 34.83 33.22 2aof s MET 146 CO 0.03 0.15 -0.19 0.96 1.05 0.00 0.00 175.02 177.02 2aof s ILE 147 N 0.54 1.83 0.03 10.11 -4.36 -0.24 -4.97 121.20 124.14 2aof s ILE 147 Ca -0.06 -1.89 0.06 0.00 -0.26 0.00 0.00 60.65 58.50 2aof s ILE 147 Cb -0.15 -1.83 -0.03 0.00 1.25 0.00 0.00 42.46 41.70 2aof s ILE 147 CO 0.03 -0.29 -0.13 -0.83 0.24 0.00 0.00 174.94 173.97 2aof s GLY 148 N -2.60 1.66 0.12 6.27 0.00 -1.26 -0.90 107.32 110.62 2aof s GLY 148 Ca 0.15 -1.13 0.03 0.00 0.00 0.00 0.00 44.72 43.77 2aof s GLY 148 CO 0.06 -1.02 0.09 0.61 0.00 0.00 0.00 173.10 172.85 2aof n GLY 149 N 1.47 3.66 3.77 0.20 0.00 -0.02 -4.99 105.19 109.29 2aof n GLY 149 Ca -0.16 -1.79 -0.41 0.00 0.00 0.00 0.00 46.02 43.67 2aof n GLY 149 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2aof s ILE 150 N -2.41 2.35 0.00 -0.61 1.10 -1.26 -2.47 121.20 117.91 2aof s ILE 150 Ca 0.13 0.36 0.00 0.00 -0.51 0.00 0.00 60.65 60.63 2aof s ILE 150 Cb 0.01 -3.23 0.00 0.00 0.15 0.00 0.00 42.46 39.39 2aof s ILE 150 CO 0.09 0.08 0.00 0.61 -2.11 0.00 0.00 174.94 173.62 2aof n GLY 151 N 0.64 3.08 0.00 1.50 0.00 -1.26 -4.92 105.19 104.23 2aof n GLY 151 Ca 0.01 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.14 2aof n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aof n GLY 152 N 0.00 0.81 3.51 -0.02 0.00 -1.03 -5.12 105.19 103.34 2aof n GLY 152 Ca 0.00 -1.82 -0.30 0.00 0.00 0.00 0.00 46.02 43.89 2aof n GLY 152 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2aof s PHE 153 N -2.91 2.63 0.08 1.61 0.40 -1.26 -0.84 117.98 117.69 2aof s PHE 153 Ca 0.00 -0.21 0.03 0.00 -0.60 0.00 0.00 56.93 56.15 2aof s PHE 153 Cb 0.00 -1.44 -0.03 0.00 0.51 0.00 0.00 43.02 42.06 2aof s PHE 153 CO 0.00 0.34 -0.09 0.96 0.70 0.00 0.00 175.22 177.13 2aof s ILE 154 N -1.06 0.79 0.06 0.64 -4.36 -0.08 -4.98 121.20 112.22 2aof s ILE 154 Ca 0.17 -1.55 -0.21 0.00 -0.26 0.00 0.00 60.65 58.80 2aof s ILE 154 Cb -0.11 -1.23 -0.06 0.00 1.25 0.00 0.00 42.46 42.30 2aof s ILE 154 CO 0.09 -0.58 0.63 -0.54 0.24 0.00 0.00 174.94 174.78 2aof s LYS 155 N -2.69 4.32 0.27 0.37 1.02 -1.26 -1.08 119.74 120.69 2aof s LYS 155 Ca 0.03 0.83 0.02 0.00 0.02 0.00 0.00 55.97 56.87 2aof s LYS 155 Cb -0.03 -3.28 -0.05 0.00 -0.52 0.00 0.00 37.83 33.94 2aof s LYS 155 CO -0.01 0.52 0.08 0.14 -0.92 0.00 0.00 175.35 175.16 2aof s VAL 156 N -0.77 0.74 -0.25 3.17 -7.23 -0.13 -4.54 120.40 111.39 2aof s VAL 156 Ca 0.31 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.38 2aof s VAL 156 Cb -0.20 -2.63 -0.05 0.00 0.56 0.00 0.00 36.38 34.07 2aof s VAL 156 CO 0.20 -0.05 0.17 -0.13 -0.31 0.00 0.00 175.10 174.98 2aof s ARG 157 N -3.98 4.05 -0.27 4.82 0.52 0.01 -2.92 118.95 121.17 2aof s ARG 157 Ca 0.36 -0.27 -0.15 0.00 -0.52 0.00 0.00 55.73 55.15 2aof s ARG 157 Cb 0.08 -3.56 -0.04 0.00 0.52 0.00 0.00 34.95 31.95 2aof s ARG 157 CO 0.13 0.02 0.37 -1.14 0.02 0.00 0.00 175.30 174.70 2aof s GLN 158 N 1.18 3.99 -0.14 3.54 0.74 0.17 -0.76 119.66 128.38 2aof s GLN 158 Ca 0.08 0.01 -0.02 0.00 0.05 0.00 0.00 55.36 55.48 2aof s GLN 158 Cb -0.14 -3.66 -0.02 0.00 1.10 0.00 0.00 33.01 30.29 2aof s GLN 158 CO 0.06 -0.28 -0.09 0.71 -0.55 0.00 0.00 175.29 175.13 2aof s TYR 159 N 2.06 2.89 0.18 1.67 1.51 -0.48 -1.62 117.35 123.55 2aof s TYR 159 Ca 0.15 -0.52 0.04 0.00 -1.01 0.00 0.00 57.07 55.73 2aof s TYR 159 Cb -0.16 -1.89 -0.03 0.00 -0.11 0.00 0.00 41.96 39.77 2aof s TYR 159 CO 0.10 -0.15 0.28 -0.51 -1.11 0.00 0.00 175.55 174.17 2aof s ASP 160 N 0.37 6.22 -1.38 2.29 1.01 -1.26 -0.81 116.67 123.11 2aof s ASP 160 Ca -0.08 0.10 -0.07 0.00 0.71 0.00 0.00 52.55 53.20 2aof s ASP 160 Cb -0.15 -1.83 0.03 0.00 1.01 0.00 0.00 42.92 41.98 2aof s ASP 160 CO 0.05 0.02 1.00 1.67 0.21 0.00 0.00 175.17 178.12 2aof n GLN 161 N -0.77 -6.40 -3.28 8.23 7.27 -1.15 -4.90 117.38 116.38 2aof n GLN 161 Ca -0.08 0.72 -0.38 0.00 0.07 0.00 0.00 57.00 57.33 2aof n GLN 161 Cb 0.55 -5.62 -0.06 0.00 2.41 0.00 0.00 30.24 27.52 2aof n GLN 161 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2aof s ILE 162 N -3.39 5.05 -0.03 1.69 -1.09 -0.10 -4.66 121.20 118.67 2aof s ILE 162 Ca 0.41 1.08 -0.30 0.00 -2.23 0.00 0.00 60.65 59.60 2aof s ILE 162 Cb -0.19 -3.86 -0.03 0.00 -1.58 0.00 0.00 42.46 36.79 2aof s ILE 162 CO 0.78 0.39 1.15 -0.63 -1.23 0.00 0.00 174.94 175.40 2aof s ILE 163 N 0.10 4.36 -0.13 2.92 1.01 -1.26 -1.27 121.20 126.93 2aof s ILE 163 Ca 0.28 1.68 -0.09 0.00 0.00 0.00 0.00 60.65 62.52 2aof s ILE 163 Cb -0.17 -4.08 0.04 0.00 0.01 0.00 0.00 42.46 38.27 2aof s ILE 163 CO 0.14 0.04 0.32 -0.51 0.00 0.00 0.00 174.94 174.93 2aof s ILE 164 N 1.83 -0.02 -0.13 2.92 2.07 -0.56 -4.48 121.20 122.83 2aof s ILE 164 Ca 0.55 0.06 -0.04 0.00 -1.41 0.00 0.00 60.65 59.80 2aof s ILE 164 Cb -0.24 -0.46 -0.03 0.00 0.13 0.00 0.00 42.46 41.85 2aof s ILE 164 CO 0.23 0.02 0.02 -0.70 -1.91 0.00 0.00 174.94 172.61 2aof s GLU 165 N 0.70 3.44 -0.25 3.50 2.12 -0.24 -0.93 118.70 127.03 2aof s GLU 165 Ca -0.04 -0.39 0.01 0.00 0.36 0.00 0.00 54.97 54.91 2aof s GLU 165 Cb -0.06 -2.97 0.07 0.00 0.26 0.00 0.00 34.13 31.43 2aof s GLU 165 CO -0.05 0.50 -0.04 0.42 -0.54 0.00 0.00 175.26 175.55 2aof s ILE 166 N -0.30 1.61 -1.45 -3.70 1.01 0.23 -0.77 121.20 117.82 2aof s ILE 166 Ca 0.07 -1.37 -0.11 0.00 0.00 0.00 0.00 60.65 59.25 2aof s ILE 166 Cb -0.12 -1.91 0.07 0.00 0.01 0.00 0.00 42.46 40.51 2aof s ILE 166 CO 0.02 -0.17 0.72 0.00 0.00 0.00 0.00 174.94 175.51 2aof n ALA 167 N 4.62 -1.14 -0.34 9.38 0.00 -0.08 -0.89 120.51 132.06 2aof n ALA 167 Ca -0.10 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2aof n ALA 167 Cb 0.44 -3.70 0.00 0.00 0.00 0.00 0.00 19.45 16.18 2aof n ALA 167 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aof n GLY 168 N -1.45 1.48 3.73 0.00 0.00 -1.26 -5.03 105.19 102.66 2aof n GLY 168 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 2aof n GLY 168 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2aof s HIS 169 N -3.04 3.42 0.10 1.61 4.02 -0.07 -5.07 115.29 116.26 2aof s HIS 169 Ca 0.00 0.35 -0.28 0.00 1.02 0.00 0.00 55.06 56.15 2aof s HIS 169 Cb 0.00 -2.17 -0.06 0.00 -1.02 0.00 0.00 32.58 29.33 2aof s HIS 169 CO 0.00 0.29 0.90 0.15 1.02 0.00 0.00 174.74 177.10 2aof s LYS 170 N 0.35 4.65 0.07 1.40 1.02 -1.26 -0.60 119.74 125.36 2aof s LYS 170 Ca 0.09 1.33 0.01 0.00 0.02 0.00 0.00 55.97 57.42 2aof s LYS 170 Cb -0.11 -3.36 -0.04 0.00 -0.52 0.00 0.00 37.83 33.80 2aof s LYS 170 CO -0.01 0.27 -0.05 0.00 -0.92 0.00 0.00 175.35 174.63 2aof s ALA 171 N -0.14 0.72 -0.15 5.17 0.00 -0.11 -4.83 121.76 122.43 2aof s ALA 171 Ca 0.44 -1.21 -0.04 0.00 0.00 0.00 0.00 51.96 51.14 2aof s ALA 171 Cb -0.23 0.20 0.06 0.00 0.00 0.00 0.00 23.12 23.15 2aof s ALA 171 CO 0.28 -0.27 0.14 0.42 0.00 0.00 0.00 175.76 176.33 2aof s ILE 172 N -3.47 -0.20 0.00 0.00 1.01 -1.26 -1.50 121.20 115.77 2aof s ILE 172 Ca 0.07 0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.76 2aof s ILE 172 Cb 0.05 -0.49 0.00 0.00 0.01 0.00 0.00 42.46 42.02 2aof s ILE 172 CO -0.06 -0.11 0.00 0.61 0.00 0.00 0.00 174.94 175.38 2aof n GLY 173 N 5.30 1.08 3.72 6.18 0.00 -0.40 -4.78 105.19 116.29 2aof n GLY 173 Ca -0.06 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 2aof n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2aof s THR 174 N -2.29 4.64 -0.09 2.61 2.01 -1.26 -0.92 115.64 120.34 2aof s THR 174 Ca 0.00 2.02 0.03 0.00 0.31 0.00 0.00 61.69 64.05 2aof s THR 174 Cb 0.00 -4.29 0.01 0.00 0.01 0.00 0.00 72.50 68.23 2aof s THR 174 CO 0.00 0.23 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.30 2aof s VAL 175 N 0.54 1.51 -0.10 3.82 1.01 0.01 -4.52 120.40 122.67 2aof s VAL 175 Ca 0.50 -0.69 -0.13 0.00 0.00 0.00 0.00 61.98 61.67 2aof s VAL 175 Cb -0.23 -1.35 -0.05 0.00 0.00 0.00 0.00 36.38 34.76 2aof s VAL 175 CO 0.29 0.44 0.30 -0.76 0.00 0.00 0.00 175.10 175.37 2aof s LEU 176 N 0.64 4.35 -0.11 3.92 1.43 -0.22 -1.38 118.68 127.31 2aof s LEU 176 Ca -0.14 0.65 0.03 0.00 -1.03 0.00 0.00 54.13 53.64 2aof s LEU 176 Cb -0.16 -2.38 0.00 0.00 0.03 0.00 0.00 46.19 43.69 2aof s LEU 176 CO 0.04 0.24 -0.23 -0.69 0.23 0.00 0.00 176.35 175.94 2aof s VAL 177 N -0.36 2.01 -0.29 -1.59 1.01 0.06 -0.53 120.40 120.71 2aof s VAL 177 Ca 0.19 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.19 2aof s VAL 177 Cb -0.14 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.49 2aof s VAL 177 CO 0.07 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.32 2aof n GLY 178 N 3.75 -1.20 2.40 4.51 0.00 -0.78 -0.81 105.19 113.06 2aof n GLY 178 Ca -0.19 -0.81 -0.40 0.00 0.00 0.00 0.00 46.02 44.62 2aof n GLY 178 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2aof n PRO 179 N 0.00 3.81 -2.74 1.61 -0.04 -1.26 -3.96 135.00 132.42 2aof n PRO 179 Ca 0.00 -2.52 -0.39 0.00 -0.04 0.00 0.00 63.50 60.55 2aof n PRO 179 Cb 0.00 -2.81 -0.06 0.00 -0.04 0.00 0.00 33.50 30.59 2aof n PRO 179 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2aof s THR 180 N 1.55 4.07 -0.83 0.52 -1.32 -1.26 -4.96 115.64 113.41 2aof s THR 180 Ca 0.64 1.93 0.18 0.00 -1.21 0.00 0.00 61.69 63.23 2aof s THR 180 Cb 0.18 -4.17 0.17 0.00 -1.51 0.00 0.00 72.50 67.17 2aof s THR 180 CO -0.07 0.34 1.57 -2.65 -2.21 0.00 0.00 174.62 171.60 2aof n PRO 181 N 1.08 0.07 -3.58 7.08 -0.02 -1.26 -4.77 135.00 133.60 2aof n PRO 181 Ca -0.00 0.30 -0.16 0.00 -2.02 0.00 0.00 63.50 61.61 2aof n PRO 181 Cb 0.48 -1.62 -0.06 0.00 -0.02 0.00 0.00 33.50 32.27 2aof n PRO 181 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2aof s ALA 182 N -3.10 -1.49 0.04 3.55 0.00 -1.26 -5.11 121.76 114.38 2aof s ALA 182 Ca 0.06 0.97 -0.30 0.00 0.00 0.00 0.00 51.96 52.69 2aof s ALA 182 Cb 0.10 0.10 -0.06 0.00 0.00 0.00 0.00 23.12 23.26 2aof s ALA 182 CO 0.32 -0.38 1.35 -0.80 0.00 0.00 0.00 175.76 176.25 2aof s ASN 183 N -1.39 6.89 -0.05 0.00 0.01 -1.26 -4.74 114.94 114.40 2aof s ASN 183 Ca -0.10 2.14 0.03 0.00 -0.71 0.00 0.00 52.86 54.21 2aof s ASN 183 Cb -0.01 -2.57 0.01 0.00 0.41 0.00 0.00 41.25 39.09 2aof s ASN 183 CO 0.06 -0.65 -0.13 -0.63 -1.51 0.00 0.00 177.10 174.24 2aof s ILE 184 N 1.81 1.16 -0.36 0.60 1.01 0.34 -0.81 121.20 124.96 2aof s ILE 184 Ca 0.63 -0.52 -0.14 0.00 0.00 0.00 0.00 60.65 60.61 2aof s ILE 184 Cb -0.32 -1.04 -0.01 0.00 0.01 0.00 0.00 42.46 41.11 2aof s ILE 184 CO 0.28 0.35 0.31 -0.63 0.00 0.00 0.00 174.94 175.25 2aof s ILE 185 N 0.44 5.22 0.34 2.92 -1.09 -0.06 -1.32 121.20 127.65 2aof s ILE 185 Ca -0.10 -0.21 0.03 0.00 -2.23 0.00 0.00 60.65 58.14 2aof s ILE 185 Cb -0.14 -3.82 0.06 0.00 -1.58 0.00 0.00 42.46 36.99 2aof s ILE 185 CO 0.03 -0.13 0.47 0.61 -1.23 0.00 0.00 174.94 174.69 2aof n GLY 186 N 5.06 1.53 0.25 6.18 0.00 -1.17 -0.74 105.19 116.31 2aof n GLY 186 Ca -0.11 -2.12 0.11 0.00 0.00 0.00 0.00 46.02 43.90 2aof n GLY 186 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2aof h ARG 187 N 0.00 0.00 -0.64 1.61 3.08 -0.75 -0.39 114.38 117.28 2aof h ARG 187 Ca -0.16 0.00 0.03 0.00 0.07 0.00 0.00 59.98 59.92 2aof h ARG 187 Cb 0.67 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.69 2aof h ARG 187 CO 0.20 0.13 0.43 -2.95 -1.07 0.00 0.00 179.97 176.71 2aof h ASN 188 N 0.00 0.67 0.09 7.04 -1.07 -1.75 -1.76 115.58 118.80 2aof h ASN 188 Ca -0.00 -0.01 -0.28 0.00 0.07 0.00 0.00 56.30 56.07 2aof h ASN 188 Cb 0.30 -0.16 -0.05 0.00 -2.07 0.00 0.00 38.32 36.34 2aof h ASN 188 CO 0.02 0.47 -2.20 0.18 0.07 0.00 0.00 177.43 175.97 2aof n LEU 189 N -4.46 0.13 -0.25 6.14 4.77 -0.70 -3.97 117.00 118.66 2aof n LEU 189 Ca 0.08 0.06 0.04 0.00 -0.03 0.00 0.00 56.01 56.16 2aof n LEU 189 Cb 0.12 0.36 0.28 0.00 -2.33 0.00 0.00 43.42 41.84 2aof n LEU 189 CO 0.35 0.38 1.24 -0.07 -1.33 0.00 0.00 177.39 177.95 2aof h LEU 190 N 0.00 0.82 -0.92 2.23 3.38 -0.90 -1.29 115.31 118.63 2aof h LEU 190 Ca -0.41 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.48 2aof h LEU 190 Cb 1.96 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.52 2aof h LEU 190 CO 0.03 0.53 -0.12 0.71 0.09 0.00 0.00 178.44 179.68 2aof h THR 191 N 0.93 1.25 0.00 0.22 1.35 -1.50 -1.04 112.91 114.11 2aof h THR 191 Ca 0.35 -1.13 -0.06 0.00 -0.55 0.00 0.00 66.41 65.03 2aof h THR 191 Cb 0.18 1.10 -0.01 0.00 -1.73 0.00 0.00 68.15 67.70 2aof h THR 191 CO -0.12 0.38 -0.27 1.56 -0.25 0.00 0.00 175.52 176.81 2aof h GLN 192 N 0.60 0.00 -0.21 4.72 4.20 -1.38 -2.39 115.11 120.65 2aof h GLN 192 Ca 0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 2aof h GLN 192 Cb 0.56 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2aof h GLN 192 CO 0.04 0.27 0.00 0.44 -0.67 0.00 0.00 178.83 178.91 2aof n ILE 193 N -4.11 0.26 -1.29 2.54 -5.35 -0.94 -4.94 119.36 105.53 2aof n ILE 193 Ca -0.02 -0.53 0.00 0.00 -0.27 0.00 0.00 62.75 61.93 2aof n ILE 193 Cb 0.33 0.87 0.00 0.00 -1.74 0.00 0.00 39.64 39.10 2aof n ILE 193 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2aof n GLY 194 N 1.33 0.57 3.74 3.28 0.00 -0.90 -5.02 105.19 108.19 2aof n GLY 194 Ca 0.17 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.96 2aof n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aof s ALA 195 N -2.00 3.32 0.14 4.61 0.00 -0.44 -5.02 121.76 122.37 2aof s ALA 195 Ca 0.00 0.70 0.05 0.00 0.00 0.00 0.00 51.96 52.71 2aof s ALA 195 Cb 0.00 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 2aof s ALA 195 CO 0.00 -0.08 -0.12 0.95 0.00 0.00 0.00 175.76 176.51 2aof s THR 196 N -0.30 1.28 -0.08 0.00 -4.23 -1.26 -4.68 115.64 106.36 2aof s THR 196 Ca 0.47 -1.92 -0.12 0.00 -1.18 0.00 0.00 61.69 58.95 2aof s THR 196 Cb -0.27 -1.71 -0.05 0.00 1.34 0.00 0.00 72.50 71.81 2aof s THR 196 CO 0.33 -0.59 0.28 -0.76 -0.54 0.00 0.00 174.62 173.33 2aof s LEU 197 N -2.87 4.39 -0.01 4.79 1.43 -1.26 -5.09 118.68 120.06 2aof s LEU 197 Ca 0.14 0.67 0.01 0.00 -1.03 0.00 0.00 54.13 53.92 2aof s LEU 197 Cb -0.01 -2.34 -0.00 0.00 0.03 0.00 0.00 46.19 43.87 2aof s LEU 197 CO 0.02 0.31 -0.04 0.20 0.23 0.00 0.00 176.35 177.06 2aof s ASN 198 N -0.70 0.54 0.00 2.29 0.01 -1.26 -5.29 114.94 110.54 2aof s ASN 198 Ca 0.19 -0.08 0.00 0.00 -0.71 0.00 0.00 52.86 52.25 2aof s ASN 198 Cb -0.14 -0.08 0.00 0.00 0.41 0.00 0.00 41.25 41.44 2aof s ASN 198 CO 0.08 0.05 0.00 2.22 -1.51 0.00 0.00 177.10 177.93