#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k2f s VAL 94 N 0.00 4.82 -0.19 -3.33 1.01 -1.26 -5.03 120.40 116.42 1k2f s VAL 94 Ca 0.00 1.01 -0.13 0.00 0.00 0.00 0.00 61.98 62.86 1k2f s VAL 94 Cb 0.00 -4.12 -0.05 0.00 0.00 0.00 0.00 36.38 32.21 1k2f s VAL 94 CO 0.00 -0.27 0.28 -0.76 0.00 0.00 0.00 175.10 174.35 1k2f s LEU 95 N 2.89 4.20 0.00 3.92 1.43 -1.26 -4.17 118.68 125.69 1k2f s LEU 95 Ca 0.30 0.42 0.00 0.00 -1.03 0.00 0.00 54.13 53.82 1k2f s LEU 95 Cb -0.14 -2.33 0.00 0.00 0.03 0.00 0.00 46.19 43.75 1k2f s LEU 95 CO 0.13 0.07 0.00 2.22 0.23 0.00 0.00 176.35 179.00 1k2f n PHE 96 N 3.86 -0.32 0.00 0.29 1.16 0.19 -4.77 117.46 117.88 1k2f n PHE 96 Ca -0.12 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.46 1k2f n PHE 96 Cb 0.52 0.08 0.00 0.00 -1.61 0.00 0.00 39.48 38.47 1k2f n PHE 96 CO 0.00 0.00 0.00 -0.35 -1.87 0.00 0.00 176.76 174.54 1k2f n PRO 97 N -1.66 0.64 -2.66 3.97 -0.04 -1.24 -4.90 135.00 129.11 1k2f n PRO 97 Ca 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.41 1k2f n PRO 97 Cb 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.42 1k2f n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1k2f n LYS 99 N 1.83 0.92 0.00 0.00 2.85 -1.26 -3.78 118.16 118.73 1k2f n LYS 99 Ca -0.38 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 56.88 1k2f n LYS 99 Cb 0.59 -1.36 0.00 0.00 -0.65 0.00 0.00 35.03 33.61 1k2f n LYS 99 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1k2f n TYR 100 N 0.16 0.00 -0.07 5.58 0.53 -1.26 -4.74 117.16 117.35 1k2f n TYR 100 Ca 0.00 -0.23 0.17 0.00 -1.02 0.00 0.00 57.90 56.82 1k2f n TYR 100 Cb 0.28 -0.02 0.59 0.00 -1.03 0.00 0.00 39.34 39.16 1k2f n TYR 100 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1k2f h ALA 101 N 0.00 2.29 -0.26 -0.72 0.00 -1.72 -0.20 119.26 118.64 1k2f h ALA 101 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1k2f h ALA 101 Cb 0.45 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1k2f h ALA 101 CO 0.00 -0.45 0.12 0.66 0.00 0.00 0.00 179.25 179.58 1k2f h SER 102 N 0.21 0.32 -0.25 0.00 4.64 -1.87 -1.40 113.55 115.20 1k2f h SER 102 Ca 0.30 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 1k2f h SER 102 Cb 0.87 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1k2f h SER 102 CO -0.06 0.28 0.00 -1.20 -0.87 0.00 0.00 176.83 174.98 1k2f n SER 103 N -4.45 2.88 0.00 4.97 7.64 -0.10 -4.83 113.62 119.74 1k2f n SER 103 Ca 0.01 -2.36 0.00 0.00 1.01 0.00 0.00 58.87 57.53 1k2f n SER 103 Cb 0.11 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 1k2f n SER 103 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1k2f n GLY 104 N 0.34 0.85 3.54 0.23 0.00 -0.55 -4.94 105.19 104.66 1k2f n GLY 104 Ca 0.12 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 1k2f n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k2f n GLU 106 N 7.48 1.33 -4.32 0.00 1.02 -1.26 -4.17 120.64 120.72 1k2f n GLU 106 Ca 0.44 -0.76 -0.18 0.00 -0.02 0.00 0.00 57.16 56.65 1k2f n GLU 106 Cb 0.45 -1.93 -0.14 0.00 -0.02 0.00 0.00 31.44 29.80 1k2f n GLU 106 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 1k2f s ILE 107 N 2.24 0.74 -0.07 -3.67 2.07 -1.26 -5.14 121.20 116.10 1k2f s ILE 107 Ca 0.38 -0.55 0.01 0.00 -1.41 0.00 0.00 60.65 59.07 1k2f s ILE 107 Cb 0.16 -0.65 0.02 0.00 0.13 0.00 0.00 42.46 42.12 1k2f s ILE 107 CO -0.01 0.10 -0.08 0.42 -1.91 0.00 0.00 174.94 173.46 1k2f s THR 108 N -0.44 0.89 0.17 4.00 -4.23 -1.26 -4.91 115.64 109.87 1k2f s THR 108 Ca 0.02 -0.29 0.02 0.00 -1.18 0.00 0.00 61.69 60.26 1k2f s THR 108 Cb -0.05 -0.88 -0.05 0.00 1.34 0.00 0.00 72.50 72.87 1k2f s THR 108 CO 0.00 0.32 -0.00 -0.76 -0.54 0.00 0.00 174.62 173.63 1k2f s LEU 109 N 1.13 2.14 0.92 4.79 1.43 -1.26 -4.83 118.68 123.00 1k2f s LEU 109 Ca -0.07 -1.16 -0.11 0.00 -1.03 0.00 0.00 54.13 51.76 1k2f s LEU 109 Cb -0.14 -0.08 0.14 0.00 0.03 0.00 0.00 46.19 46.15 1k2f s LEU 109 CO -0.01 -0.55 1.09 -2.84 0.23 0.00 0.00 176.35 174.27 1k2f s PRO 110 N -3.90 1.03 0.35 1.29 0.02 -1.26 -0.64 135.00 131.89 1k2f s PRO 110 Ca 0.24 1.02 0.27 0.00 0.02 0.00 0.00 61.00 62.54 1k2f s PRO 110 Cb 0.06 -1.77 0.95 0.00 0.02 0.00 0.00 34.50 33.76 1k2f s PRO 110 CO 0.04 -2.45 1.78 1.25 -0.33 0.00 0.00 177.00 177.29 1k2f h HIS 111 N -1.71 0.00 -0.25 6.54 2.76 -1.99 -3.17 115.15 117.33 1k2f h HIS 111 Ca -0.49 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 57.57 1k2f h HIS 111 Cb 1.28 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.23 1k2f h HIS 111 CO 0.44 0.00 -0.32 1.15 -1.30 0.00 0.00 177.93 177.90 1k2f h THR 112 N 0.00 1.28 -1.26 6.26 2.02 -1.96 -3.21 112.91 116.04 1k2f h THR 112 Ca 0.00 -1.41 -0.63 0.00 0.77 0.00 0.00 66.41 65.14 1k2f h THR 112 Cb 0.58 1.44 -0.36 0.00 -1.74 0.00 0.00 68.15 68.07 1k2f h THR 112 CO 0.00 0.45 -0.04 -1.84 0.37 0.00 0.00 175.52 174.46 1k2f n GLU 113 N -4.08 3.19 -0.04 6.66 0.28 -1.20 -4.75 120.64 120.70 1k2f n GLU 113 Ca -0.01 -3.93 -0.02 0.00 -0.16 0.00 0.00 57.16 53.04 1k2f n GLU 113 Cb 0.45 -2.27 -0.01 0.00 1.43 0.00 0.00 31.44 31.04 1k2f n GLU 113 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 177.13 176.75 1k2f h LYS 114 N 2.41 0.00 -0.82 3.44 3.64 -1.66 -3.27 116.57 120.32 1k2f h LYS 114 Ca 0.45 0.00 0.20 0.00 -1.27 0.00 0.00 60.65 60.03 1k2f h LYS 114 Cb 0.91 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 32.60 1k2f h LYS 114 CO 1.11 0.00 0.16 0.00 -2.27 0.00 0.00 179.45 178.45 1k2f h ALA 115 N -1.45 1.07 -0.17 5.00 0.00 -1.85 -1.66 119.26 120.19 1k2f h ALA 115 Ca 0.00 0.22 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1k2f h ALA 115 Cb 0.24 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1k2f h ALA 115 CO 0.00 -0.42 -0.10 0.93 0.00 0.00 0.00 179.25 179.65 1k2f h GLU 116 N 0.19 0.37 -0.82 0.00 5.08 -1.90 -3.21 114.58 114.30 1k2f h GLU 116 Ca 0.48 -0.17 0.05 0.00 -1.00 0.00 0.00 59.36 58.72 1k2f h GLU 116 Cb 0.92 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.10 1k2f h GLU 116 CO -0.63 0.70 0.51 1.25 -1.00 0.00 0.00 179.01 179.84 1k2f h HIS 117 N 0.05 0.94 -0.39 4.33 2.76 -1.38 -3.11 115.15 118.35 1k2f h HIS 117 Ca 0.04 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.21 1k2f h HIS 117 Cb 0.60 -0.31 -0.02 0.00 1.55 0.00 0.00 27.41 29.24 1k2f h HIS 117 CO 0.07 0.50 0.14 0.93 -1.30 0.00 0.00 177.93 178.28 1k2f h GLU 118 N 0.95 0.59 -0.55 5.26 5.08 -1.41 -0.20 114.58 124.30 1k2f h GLU 118 Ca 0.34 -0.11 0.09 0.00 -1.00 0.00 0.00 59.36 58.68 1k2f h GLU 118 Cb 0.11 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.19 1k2f h GLU 118 CO -0.15 0.57 0.15 0.93 -1.00 0.00 0.00 179.01 179.51 1k2f h GLU 119 N 0.48 0.29 -0.62 2.33 5.08 -1.55 -2.32 114.58 118.29 1k2f h GLU 119 Ca 0.13 -0.02 -0.17 0.00 -1.00 0.00 0.00 59.36 58.30 1k2f h GLU 119 Cb 0.21 -0.07 -0.10 0.00 0.50 0.00 0.00 28.75 29.29 1k2f h GLU 119 CO -0.01 0.19 0.19 1.47 -1.00 0.00 0.00 179.01 179.85 1k2f n LEU 120 N -5.07 5.54 -4.78 1.33 -0.00 -1.19 -5.00 117.00 107.83 1k2f n LEU 120 Ca 0.07 -3.25 -0.36 0.00 -0.00 0.00 0.00 56.01 52.47 1k2f n LEU 120 Cb 0.26 -0.70 -0.02 0.00 -0.00 0.00 0.00 43.42 42.96 1k2f n LEU 120 CO 0.21 0.84 0.78 0.00 -0.00 0.00 0.00 177.39 179.21 1k2f h GLU 122 N 1.86 0.30 -0.84 0.00 4.39 -1.90 -3.21 114.58 115.18 1k2f h GLU 122 Ca -0.49 -0.16 -0.18 0.00 0.34 0.00 0.00 59.36 58.86 1k2f h GLU 122 Cb 1.24 0.01 -0.11 0.00 -0.10 0.00 0.00 28.75 29.79 1k2f h GLU 122 CO 0.60 0.72 0.23 1.19 -1.16 0.00 0.00 179.01 180.58 1k2f n PHE 123 N -3.97 1.88 -2.89 4.33 3.01 -1.26 -4.90 117.46 113.65 1k2f n PHE 123 Ca -0.02 -0.98 -0.41 0.00 1.01 0.00 0.00 57.45 57.05 1k2f n PHE 123 Cb 0.54 -0.57 -0.04 0.00 -0.01 0.00 0.00 39.48 39.39 1k2f n PHE 123 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 1k2f s ARG 124 N -2.35 4.44 -0.26 -1.08 3.52 -1.21 -4.83 118.95 117.18 1k2f s ARG 124 Ca 0.41 1.10 -0.34 0.00 -0.13 0.00 0.00 55.73 56.77 1k2f s ARG 124 Cb 0.33 -3.49 -0.11 0.00 -1.56 0.00 0.00 34.95 30.12 1k2f s ARG 124 CO 0.10 -0.08 2.09 -2.30 -0.81 0.00 0.00 175.30 174.30 1k2f n PRO 125 N 4.22 1.47 -1.96 5.12 -0.02 -1.26 -4.93 135.00 137.64 1k2f n PRO 125 Ca 0.03 0.45 -0.40 0.00 -2.02 0.00 0.00 63.50 61.56 1k2f n PRO 125 Cb 0.50 -2.60 -0.01 0.00 -0.02 0.00 0.00 33.50 31.38 1k2f n PRO 125 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1k2f s TYR 126 N 6.46 2.78 0.74 6.00 1.51 -0.24 -4.75 117.35 129.85 1k2f s TYR 126 Ca 1.04 1.31 -0.01 0.00 -1.01 0.00 0.00 57.07 58.39 1k2f s TYR 126 Cb -0.75 -3.83 0.13 0.00 -0.11 0.00 0.00 41.96 37.41 1k2f s TYR 126 CO 0.49 -2.41 1.02 -1.12 -1.11 0.00 0.00 175.55 172.41 1k2f s SER 127 N -0.41 4.25 -0.27 2.29 0.01 -1.26 -1.66 113.70 116.65 1k2f s SER 127 Ca 0.53 -0.36 -0.29 0.00 1.31 0.00 0.00 55.95 57.14 1k2f s SER 127 Cb -0.42 0.01 0.01 0.00 0.21 0.00 0.00 66.02 65.83 1k2f s SER 127 CO 0.56 -1.93 1.11 0.00 0.41 0.00 0.00 173.24 173.39 1k2f h PRO 129 N 8.04 0.00 -6.89 0.00 0.13 -1.95 -3.44 132.00 127.88 1k2f h PRO 129 Ca -0.21 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.38 1k2f h PRO 129 Cb 1.07 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.29 1k2f h PRO 129 CO 1.01 0.00 0.80 0.00 -0.23 0.00 0.00 178.00 179.58 1k2f s PRO 131 N -1.53 3.76 0.00 0.00 0.04 -1.26 -4.85 135.00 131.16 1k2f s PRO 131 Ca 0.56 1.84 0.00 0.00 0.04 0.00 0.00 61.00 63.43 1k2f s PRO 131 Cb -0.46 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 31.63 1k2f s PRO 131 CO 0.57 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 177.45 1k2f n GLY 132 N 0.50 2.05 0.25 0.56 0.00 -1.26 -4.82 105.19 102.47 1k2f n GLY 132 Ca 0.07 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1k2f n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k2f n ALA 133 N 2.51 2.18 -0.10 4.61 0.00 -1.26 -3.83 120.51 124.62 1k2f n ALA 133 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1k2f n ALA 133 Cb 0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.41 1k2f n ALA 133 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1k2f h SER 134 N 0.13 0.67 -3.58 0.00 0.02 -1.94 -3.41 113.55 105.43 1k2f h SER 134 Ca 0.00 -0.42 -0.66 0.00 -0.84 0.00 0.00 61.79 59.87 1k2f h SER 134 Cb 0.18 -0.18 -0.16 0.00 0.14 0.00 0.00 62.40 62.38 1k2f h SER 134 CO 0.00 0.94 0.03 0.00 -1.14 0.00 0.00 176.83 176.66 1k2f n LYS 136 N 6.04 1.33 -1.42 0.00 4.01 -1.26 -4.70 118.16 122.16 1k2f n LYS 136 Ca -0.03 -0.57 -0.38 0.00 -0.51 0.00 0.00 58.31 56.81 1k2f n LYS 136 Cb 0.48 -1.49 0.03 0.00 -0.51 0.00 0.00 35.03 33.54 1k2f n LYS 136 CO 0.00 0.00 0.00 1.87 -1.11 0.00 0.00 177.40 178.16 1k2f n TRP 137 N -0.33 -1.15 -3.71 2.13 -0.00 -1.26 -4.93 117.44 108.18 1k2f n TRP 137 Ca 0.20 0.45 -0.14 0.00 -0.00 0.00 0.00 57.50 58.01 1k2f n TRP 137 Cb 0.27 -1.90 -0.09 0.00 -0.00 0.00 0.00 31.31 29.59 1k2f n TRP 137 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 177.69 176.55 1k2f s GLN 138 N -1.84 0.65 0.00 5.87 0.74 -1.26 -3.43 119.66 120.39 1k2f s GLN 138 Ca 0.66 0.28 0.00 0.00 0.05 0.00 0.00 55.36 56.35 1k2f s GLN 138 Cb -0.46 0.31 0.00 0.00 1.10 0.00 0.00 33.01 33.96 1k2f s GLN 138 CO 0.57 -0.14 0.00 0.41 -0.55 0.00 0.00 175.29 175.57 1k2f n GLY 139 N 2.00 -1.28 3.83 2.59 0.00 -0.66 -5.00 105.19 106.66 1k2f n GLY 139 Ca -0.17 -0.92 -0.30 0.00 0.00 0.00 0.00 46.02 44.63 1k2f n GLY 139 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1k2f s SER 140 N -2.78 4.77 0.17 1.61 1.04 -1.26 -1.08 113.70 116.17 1k2f s SER 140 Ca 0.00 1.25 -0.16 0.00 0.48 0.00 0.00 55.95 57.52 1k2f s SER 140 Cb 0.00 -1.99 0.12 0.00 0.10 0.00 0.00 66.02 64.25 1k2f s SER 140 CO 0.00 -1.79 1.69 0.25 0.98 0.00 0.00 173.24 174.37 1k2f h LEU 141 N -0.96 -0.20 0.00 2.42 5.85 -1.94 -1.16 115.31 119.32 1k2f h LEU 141 Ca -0.46 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.36 1k2f h LEU 141 Cb 1.27 0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.48 1k2f h LEU 141 CO 0.61 -0.06 0.00 -0.90 -0.34 0.00 0.00 178.44 177.75 1k2f n ASP 142 N -5.21 0.00 0.06 1.25 5.75 -1.26 -2.25 116.55 114.89 1k2f n ASP 142 Ca 0.03 0.40 0.11 0.00 -0.01 0.00 0.00 54.79 55.33 1k2f n ASP 142 Cb 0.22 -0.45 -0.00 0.00 -1.03 0.00 0.00 41.12 39.86 1k2f n ASP 142 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1k2f n ALA 143 N -1.45 2.81 0.10 2.12 0.00 -0.45 -4.54 120.51 119.10 1k2f n ALA 143 Ca 0.05 -0.32 -0.09 0.00 0.00 0.00 0.00 53.44 53.08 1k2f n ALA 143 Cb 0.17 -1.03 -0.05 0.00 0.00 0.00 0.00 19.45 18.53 1k2f n ALA 143 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1k2f h VAL 144 N 0.00 0.00 -0.46 0.00 2.07 -1.27 -1.01 116.25 115.59 1k2f h VAL 144 Ca 0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 1k2f h VAL 144 Cb 0.91 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.58 1k2f h VAL 144 CO 0.00 0.00 -0.18 0.24 0.02 0.00 0.00 177.57 177.65 1k2f h MET 145 N -0.47 -0.07 -0.94 1.57 2.86 -1.80 -0.10 114.93 115.97 1k2f h MET 145 Ca -0.02 0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.70 1k2f h MET 145 Cb 0.45 0.02 -0.07 0.00 0.06 0.00 0.00 31.60 32.05 1k2f h MET 145 CO -0.11 -0.05 0.60 -1.35 1.06 0.00 0.00 176.91 177.06 1k2f h PRO 146 N -0.08 1.02 -0.82 -0.22 0.11 -1.78 -1.03 132.00 129.22 1k2f h PRO 146 Ca 0.22 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.26 1k2f h PRO 146 Cb 0.41 -0.23 -0.04 0.00 0.11 0.00 0.00 31.00 31.25 1k2f h PRO 146 CO -0.51 0.68 0.48 1.25 -0.21 0.00 0.00 178.00 179.69 1k2f h HIS 147 N 1.06 1.09 -0.27 0.65 -0.00 0.32 -1.54 115.15 116.46 1k2f h HIS 147 Ca 0.42 -0.01 -0.15 0.00 -0.00 0.00 0.00 60.37 60.64 1k2f h HIS 147 Cb 0.23 -0.36 -0.01 0.00 -0.00 0.00 0.00 27.41 27.28 1k2f h HIS 147 CO -0.02 0.73 -0.43 -0.07 -0.00 0.00 0.00 177.93 178.14 1k2f h LEU 148 N 1.13 0.71 0.22 0.26 3.38 0.06 -1.94 115.31 119.13 1k2f h LEU 148 Ca 0.29 -0.33 -0.32 0.00 0.09 0.00 0.00 57.88 57.62 1k2f h LEU 148 Cb -0.03 -0.20 0.04 0.00 0.09 0.00 0.00 40.66 40.56 1k2f h LEU 148 CO -0.05 1.04 -1.38 0.24 0.09 0.00 0.00 178.44 178.38 1k2f h MET 149 N 0.53 0.55 0.12 1.13 2.86 -1.04 -3.28 114.93 115.81 1k2f h MET 149 Ca 0.04 -0.88 -0.33 0.00 -2.06 0.00 0.00 59.70 56.47 1k2f h MET 149 Cb 0.96 0.32 -0.01 0.00 0.06 0.00 0.00 31.60 32.93 1k2f h MET 149 CO 0.09 1.42 -1.73 0.45 1.06 0.00 0.00 176.91 178.20 1k2f h HIS 150 N 0.15 0.46 -0.60 -0.22 3.86 -1.38 -3.40 115.15 114.01 1k2f h HIS 150 Ca -0.23 -0.33 -0.29 0.00 -1.16 0.00 0.00 60.37 58.35 1k2f h HIS 150 Cb 2.07 -0.02 -0.17 0.00 1.06 0.00 0.00 27.41 30.35 1k2f h HIS 150 CO 0.13 1.68 0.21 1.04 0.86 0.00 0.00 177.93 181.85 1k2f n GLN 151 N -3.72 2.17 -3.72 2.45 6.02 -0.73 -4.94 117.38 114.91 1k2f n GLN 151 Ca -0.29 -3.10 -0.14 0.00 -0.01 0.00 0.00 57.00 53.46 1k2f n GLN 151 Cb 0.97 -1.97 -0.08 0.00 1.02 0.00 0.00 30.24 30.18 1k2f n GLN 151 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1k2f s HIS 152 N -3.23 -0.25 1.15 1.08 3.76 -1.24 -4.93 115.29 111.64 1k2f s HIS 152 Ca 0.50 0.38 -0.15 0.00 -0.15 0.00 0.00 55.06 55.64 1k2f s HIS 152 Cb 0.43 0.15 0.23 0.00 1.11 0.00 0.00 32.58 34.50 1k2f s HIS 152 CO 0.05 -0.43 0.69 1.63 -0.85 0.00 0.00 174.74 175.83 1k2f n LYS 153 N 1.17 -2.14 -1.94 1.40 5.02 -1.26 -4.68 118.16 115.73 1k2f n LYS 153 Ca -0.21 -0.60 -0.40 0.00 -2.02 0.00 0.00 58.31 55.09 1k2f n LYS 153 Cb 0.56 -2.02 -0.03 0.00 -0.02 0.00 0.00 35.03 33.52 1k2f n LYS 153 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1k2f s SER 154 N -2.22 5.33 0.16 4.39 0.01 -1.26 -4.92 113.70 115.19 1k2f s SER 154 Ca 0.64 0.80 -0.22 0.00 1.31 0.00 0.00 55.95 58.49 1k2f s SER 154 Cb -0.21 -2.52 -0.08 0.00 0.21 0.00 0.00 66.02 63.42 1k2f s SER 154 CO 0.65 -2.24 0.70 -0.63 0.41 0.00 0.00 173.24 172.13 1k2f s ILE 155 N 8.90 4.54 0.33 1.44 1.01 -1.26 -5.03 121.20 131.13 1k2f s ILE 155 Ca 0.77 1.42 -0.29 0.00 0.00 0.00 0.00 60.65 62.55 1k2f s ILE 155 Cb -0.17 -3.98 -0.10 0.00 0.01 0.00 0.00 42.46 38.22 1k2f s ILE 155 CO 0.26 0.43 1.36 -0.89 0.00 0.00 0.00 174.94 176.09 1k2f s THR 156 N -1.26 2.60 -0.03 2.92 2.01 -1.26 -4.87 115.64 115.73 1k2f s THR 156 Ca 0.36 0.58 0.03 0.00 0.31 0.00 0.00 61.69 62.98 1k2f s THR 156 Cb -0.20 -3.37 -0.00 0.00 0.01 0.00 0.00 72.50 68.94 1k2f s THR 156 CO 0.22 0.13 -0.13 -0.89 -0.69 0.00 0.00 174.62 173.26 1k2f s THR 157 N -0.95 1.11 -0.02 -0.82 2.01 -1.26 -1.54 115.64 114.17 1k2f s THR 157 Ca 0.51 -0.54 0.04 0.00 0.31 0.00 0.00 61.69 62.01 1k2f s THR 157 Cb -0.41 -0.97 -0.01 0.00 0.01 0.00 0.00 72.50 71.12 1k2f s THR 157 CO 0.53 0.33 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.89 1k2f s LEU 158 N 0.11 1.95 -0.03 4.42 1.43 -0.34 -4.98 118.68 121.25 1k2f s LEU 158 Ca -0.03 -0.27 -0.14 0.00 -1.03 0.00 0.00 54.13 52.66 1k2f s LEU 158 Cb -0.10 -0.76 -0.05 0.00 0.03 0.00 0.00 46.19 45.30 1k2f s LEU 158 CO 0.01 0.15 0.38 -1.10 0.23 0.00 0.00 176.35 176.02 1k2f s GLN 159 N -0.14 3.90 0.00 1.70 -1.52 -1.26 -1.42 119.66 120.92 1k2f s GLN 159 Ca 0.02 0.34 0.00 0.00 -1.95 0.00 0.00 55.36 53.76 1k2f s GLN 159 Cb -0.08 -3.24 0.00 0.00 -0.22 0.00 0.00 33.01 29.48 1k2f s GLN 159 CO 0.00 0.65 0.00 0.41 -0.25 0.00 0.00 175.29 176.10 1k2f n GLY 160 N 1.99 3.19 0.09 3.09 0.00 0.05 -4.87 105.19 108.74 1k2f n GLY 160 Ca -0.14 -1.91 0.13 0.00 0.00 0.00 0.00 46.02 44.10 1k2f n GLY 160 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1k2f n GLU 161 N -0.72 0.40 -3.59 1.61 0.28 -1.26 -4.52 120.64 112.84 1k2f n GLU 161 Ca 0.00 -0.19 -0.27 0.00 -0.16 0.00 0.00 57.16 56.54 1k2f n GLU 161 Cb 0.00 -1.50 -0.16 0.00 1.43 0.00 0.00 31.44 31.21 1k2f n GLU 161 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1k2f s ASP 162 N -2.73 2.79 0.34 -1.84 2.15 -1.26 -0.08 116.67 116.03 1k2f s ASP 162 Ca 0.20 -0.86 0.06 0.00 0.43 0.00 0.00 52.55 52.37 1k2f s ASP 162 Cb 0.19 -0.30 -0.03 0.00 -0.30 0.00 0.00 42.92 42.48 1k2f s ASP 162 CO 0.57 -0.38 0.23 0.27 -0.17 0.00 0.00 175.17 175.69 1k2f s ILE 163 N 2.11 0.16 -0.15 4.11 -5.25 -0.41 -5.01 121.20 116.75 1k2f s ILE 163 Ca 0.04 -2.00 -0.00 0.00 -0.99 0.00 0.00 60.65 57.70 1k2f s ILE 163 Cb -0.16 -2.46 0.04 0.00 2.95 0.00 0.00 42.46 42.83 1k2f s ILE 163 CO -0.18 0.00 -0.06 -0.69 -1.79 0.00 0.00 174.94 172.21 1k2f s VAL 164 N -3.45 1.13 -0.12 8.37 1.01 -1.26 -0.97 120.40 125.12 1k2f s VAL 164 Ca 0.36 -0.56 -0.18 0.00 0.00 0.00 0.00 61.98 61.60 1k2f s VAL 164 Cb 0.03 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 1k2f s VAL 164 CO 0.23 0.20 0.46 0.12 0.00 0.00 0.00 175.10 176.12 1k2f s PHE 165 N 1.63 3.51 -0.44 5.22 5.36 0.70 -4.88 117.98 129.08 1k2f s PHE 165 Ca 0.02 0.87 -0.11 0.00 -0.96 0.00 0.00 56.93 56.75 1k2f s PHE 165 Cb -0.14 -2.53 0.08 0.00 -0.34 0.00 0.00 43.02 40.08 1k2f s PHE 165 CO -0.08 0.18 0.30 -1.17 -1.46 0.00 0.00 175.22 172.99 1k2f s LEU 166 N 0.59 5.31 -0.50 6.12 2.96 -1.26 -0.17 118.68 131.74 1k2f s LEU 166 Ca 0.25 -1.46 -0.23 0.00 -0.22 0.00 0.00 54.13 52.47 1k2f s LEU 166 Cb -0.15 -2.05 0.04 0.00 0.50 0.00 0.00 46.19 44.53 1k2f s LEU 166 CO 0.10 -0.58 0.83 0.00 -1.32 0.00 0.00 176.35 175.38 1k2f s ALA 167 N 1.49 3.25 0.37 5.97 0.00 0.19 -4.91 121.76 128.12 1k2f s ALA 167 Ca 0.03 -1.19 -0.11 0.00 0.00 0.00 0.00 51.96 50.69 1k2f s ALA 167 Cb -0.23 -3.56 -0.07 0.00 0.00 0.00 0.00 23.12 19.25 1k2f s ALA 167 CO 0.03 -2.12 0.74 0.95 0.00 0.00 0.00 175.76 175.36 1k2f s THR 168 N 3.47 4.78 -1.39 0.00 -4.23 -1.26 -0.51 115.64 116.49 1k2f s THR 168 Ca 0.28 0.67 -0.03 0.00 -1.18 0.00 0.00 61.69 61.43 1k2f s THR 168 Cb -0.13 -3.69 0.02 0.00 1.34 0.00 0.00 72.50 70.04 1k2f s THR 168 CO 0.20 -0.40 0.70 0.47 -0.54 0.00 0.00 174.62 175.05 1k2f n ASP 169 N -0.97 -1.78 0.10 3.99 8.00 -0.85 -4.83 116.55 120.21 1k2f n ASP 169 Ca 0.02 -0.86 0.08 0.00 0.71 0.00 0.00 54.79 54.74 1k2f n ASP 169 Cb 0.54 -3.77 0.38 0.00 -0.02 0.00 0.00 41.12 38.25 1k2f n ASP 169 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 1k2f n ILE 170 N -4.39 1.31 -0.01 0.53 -5.35 -1.02 -1.13 119.36 109.30 1k2f n ILE 170 Ca -0.22 0.59 0.11 0.00 -0.27 0.00 0.00 62.75 62.96 1k2f n ILE 170 Cb 0.64 -1.57 -0.17 0.00 -1.74 0.00 0.00 39.64 36.81 1k2f n ILE 170 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1k2f n ASN 171 N -1.98 0.02 -4.63 7.28 3.02 -1.26 -4.99 115.26 112.71 1k2f n ASN 171 Ca -0.00 0.01 -0.50 0.00 -0.03 0.00 0.00 54.58 54.05 1k2f n ASN 171 Cb 0.05 1.97 -0.05 0.00 -0.61 0.00 0.00 39.78 41.14 1k2f n ASN 171 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1k2f n LEU 172 N -2.27 2.22 -4.74 3.41 7.94 -0.29 -4.91 117.00 118.36 1k2f n LEU 172 Ca -0.04 1.10 -0.41 0.00 -1.11 0.00 0.00 56.01 55.55 1k2f n LEU 172 Cb 0.57 -1.27 -0.03 0.00 0.53 0.00 0.00 43.42 43.22 1k2f n LEU 172 CO 0.46 -0.73 1.02 -2.84 -1.11 0.00 0.00 177.39 174.19 1k2f s PRO 173 N 0.94 4.35 0.00 1.96 0.02 -1.26 -2.35 135.00 138.66 1k2f s PRO 173 Ca 0.84 2.14 0.00 0.00 0.02 0.00 0.00 61.00 64.00 1k2f s PRO 173 Cb -0.86 -3.16 0.00 0.00 0.02 0.00 0.00 34.50 30.50 1k2f s PRO 173 CO 0.45 -0.29 0.00 0.41 -0.33 0.00 0.00 177.00 177.24 1k2f n GLY 174 N 2.20 3.09 3.77 0.52 0.00 -1.26 -5.04 105.19 108.47 1k2f n GLY 174 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 1k2f n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k2f s ALA 175 N -2.88 3.39 0.00 4.61 0.00 -0.99 -4.84 121.76 121.05 1k2f s ALA 175 Ca 0.00 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.08 1k2f s ALA 175 Cb 0.00 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.70 1k2f s ALA 175 CO 0.00 -0.52 0.00 0.28 0.00 0.00 0.00 175.76 175.52 1k2f n VAL 176 N 0.71 0.00 -3.86 0.00 0.31 -1.26 -4.90 118.33 109.32 1k2f n VAL 176 Ca 0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.22 1k2f n VAL 176 Cb 0.43 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 33.23 1k2f n VAL 176 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1k2f s ASP 177 N -0.41 -0.03 -0.07 4.52 1.01 -1.26 -0.44 116.67 119.98 1k2f s ASP 177 Ca 0.00 0.06 -0.00 0.00 0.71 0.00 0.00 52.55 53.32 1k2f s ASP 177 Cb 0.00 0.10 0.02 0.00 1.01 0.00 0.00 42.92 44.06 1k2f s ASP 177 CO 0.00 -0.04 -0.04 0.26 0.21 0.00 0.00 175.17 175.55 1k2f s TRP 178 N -0.09 0.98 0.03 4.23 0.51 -0.45 -5.00 118.94 119.14 1k2f s TRP 178 Ca -0.01 -0.36 0.07 0.00 -2.12 0.00 0.00 56.10 53.67 1k2f s TRP 178 Cb -0.01 -0.90 -0.02 0.00 -0.81 0.00 0.00 33.47 31.73 1k2f s TRP 178 CO 0.00 -0.33 -0.20 0.08 -0.51 0.00 0.00 176.95 175.99 1k2f s VAL 179 N 1.45 1.59 -0.15 4.03 1.01 -1.26 -1.31 120.40 125.76 1k2f s VAL 179 Ca -0.02 -1.10 -0.12 0.00 0.00 0.00 0.00 61.98 60.75 1k2f s VAL 179 Cb -0.13 -1.37 0.04 0.00 0.00 0.00 0.00 36.38 34.92 1k2f s VAL 179 CO -0.03 0.24 0.38 -0.32 0.00 0.00 0.00 175.10 175.37 1k2f s MET 180 N -1.02 0.42 -0.20 2.72 0.00 -0.84 -4.17 119.30 116.21 1k2f s MET 180 Ca 0.07 0.61 -0.10 0.00 0.00 0.00 0.00 55.69 56.28 1k2f s MET 180 Cb -0.08 0.12 -0.05 0.00 0.00 0.00 0.00 34.83 34.82 1k2f s MET 180 CO 0.01 -0.09 0.12 -1.64 0.00 0.00 0.00 175.02 173.42 1k2f s MET 181 N 0.64 4.15 -0.19 4.11 -1.94 -0.59 -0.66 119.30 124.83 1k2f s MET 181 Ca -0.04 -0.24 -0.02 0.00 -1.71 0.00 0.00 55.69 53.68 1k2f s MET 181 Cb -0.05 -3.41 -0.01 0.00 2.01 0.00 0.00 34.83 33.38 1k2f s MET 181 CO -0.04 0.27 -0.09 -1.14 -0.01 0.00 0.00 175.02 174.01 1k2f s GLN 182 N 0.44 3.32 -0.23 2.03 0.74 0.68 -1.20 119.66 125.43 1k2f s GLN 182 Ca 0.07 -0.67 -0.08 0.00 0.05 0.00 0.00 55.36 54.73 1k2f s GLN 182 Cb -0.11 -2.83 -0.03 0.00 1.10 0.00 0.00 33.01 31.13 1k2f s GLN 182 CO -0.01 -0.08 0.08 -1.12 -0.55 0.00 0.00 175.29 173.60 1k2f s SER 183 N 1.12 5.34 -0.09 6.67 0.01 -0.51 0.29 113.70 126.54 1k2f s SER 183 Ca 0.01 -0.11 -0.31 0.00 1.31 0.00 0.00 55.95 56.86 1k2f s SER 183 Cb -0.14 -1.95 0.12 0.00 0.21 0.00 0.00 66.02 64.26 1k2f s SER 183 CO -0.02 0.03 1.00 0.00 0.41 0.00 0.00 173.24 174.65 1k2f n PHE 185 N 0.03 -0.46 -1.00 0.00 3.01 -1.26 -0.93 117.46 116.86 1k2f n PHE 185 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.39 1k2f n PHE 185 Cb 0.60 -3.23 0.00 0.00 -0.01 0.00 0.00 39.48 36.84 1k2f n PHE 185 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1k2f n GLY 186 N -0.51 0.58 3.53 1.37 0.00 -1.26 -5.01 105.19 103.88 1k2f n GLY 186 Ca -0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.58 1k2f n GLY 186 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1k2f s PHE 187 N -2.35 1.92 -0.11 1.61 0.40 -0.11 -5.15 117.98 114.18 1k2f s PHE 187 Ca 0.00 -1.07 0.03 0.00 -0.60 0.00 0.00 56.93 55.30 1k2f s PHE 187 Cb 0.00 -1.31 0.00 0.00 0.51 0.00 0.00 43.02 42.22 1k2f s PHE 187 CO 0.00 -0.05 -0.22 -1.01 0.70 0.00 0.00 175.22 174.64 1k2f s HIS 188 N -3.17 2.52 -0.17 0.36 3.76 -1.26 -1.67 115.29 115.66 1k2f s HIS 188 Ca 0.27 -1.13 -0.01 0.00 -0.15 0.00 0.00 55.06 54.04 1k2f s HIS 188 Cb 0.05 -1.71 -0.00 0.00 1.11 0.00 0.00 32.58 32.04 1k2f s HIS 188 CO 0.13 -0.49 -0.13 -0.06 -0.85 0.00 0.00 174.74 173.34 1k2f s PHE 189 N 0.56 2.82 -0.23 1.40 0.40 0.14 -1.10 117.98 121.98 1k2f s PHE 189 Ca -0.14 -1.08 -0.16 0.00 -0.60 0.00 0.00 56.93 54.94 1k2f s PHE 189 Cb -0.17 -1.94 -0.04 0.00 0.51 0.00 0.00 43.02 41.39 1k2f s PHE 189 CO 0.04 -0.52 0.43 1.41 0.70 0.00 0.00 175.22 177.28 1k2f s MET 190 N 1.00 4.12 -0.19 0.44 1.75 0.13 -0.23 119.30 126.31 1k2f s MET 190 Ca -0.02 0.22 -0.13 0.00 -1.25 0.00 0.00 55.69 54.52 1k2f s MET 190 Cb -0.15 -3.59 -0.05 0.00 2.84 0.00 0.00 34.83 33.89 1k2f s MET 190 CO -0.02 -0.17 0.27 -1.17 -0.65 0.00 0.00 175.02 173.27 1k2f s LEU 191 N 1.74 4.19 -0.08 4.11 2.96 0.17 -0.97 118.68 130.79 1k2f s LEU 191 Ca 0.19 0.38 0.02 0.00 -0.22 0.00 0.00 54.13 54.50 1k2f s LEU 191 Cb -0.15 -2.31 0.01 0.00 0.50 0.00 0.00 46.19 44.24 1k2f s LEU 191 CO 0.09 0.06 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.36 1k2f s VAL 192 N 0.81 1.23 -0.27 1.68 1.01 -0.58 -2.00 120.40 122.29 1k2f s VAL 192 Ca 0.14 -0.51 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 1k2f s VAL 192 Cb -0.13 -1.14 0.03 0.00 0.00 0.00 0.00 36.38 35.14 1k2f s VAL 192 CO 0.04 0.38 -0.01 -0.22 0.00 0.00 0.00 175.10 175.29 1k2f s LEU 193 N 0.86 3.50 -0.10 3.92 2.96 -0.43 -1.57 118.68 127.83 1k2f s LEU 193 Ca -0.10 -0.91 0.02 0.00 -0.22 0.00 0.00 54.13 52.91 1k2f s LEU 193 Cb -0.15 -1.73 -0.01 0.00 0.50 0.00 0.00 46.19 44.80 1k2f s LEU 193 CO 0.01 -0.17 -0.17 -0.70 -1.32 0.00 0.00 176.35 174.00 1k2f s GLU 194 N 1.35 3.10 -0.30 1.98 2.12 0.12 -1.34 118.70 125.73 1k2f s GLU 194 Ca -0.00 -0.76 -0.10 0.00 0.36 0.00 0.00 54.97 54.47 1k2f s GLU 194 Cb -0.17 -2.47 -0.02 0.00 0.26 0.00 0.00 34.13 31.73 1k2f s GLU 194 CO -0.02 0.28 0.15 0.21 -0.54 0.00 0.00 175.26 175.34 1k2f s LYS 195 N 0.15 3.48 -0.10 4.30 2.20 0.41 -0.40 119.74 129.79 1k2f s LYS 195 Ca -0.09 -0.62 0.01 0.00 -0.36 0.00 0.00 55.97 54.91 1k2f s LYS 195 Cb -0.16 -3.56 -0.02 0.00 -1.51 0.00 0.00 37.83 32.59 1k2f s LYS 195 CO 0.06 -0.35 -0.12 -0.65 -0.36 0.00 0.00 175.35 173.93 1k2f s GLN 196 N 1.64 3.01 -0.21 4.03 -0.21 -0.18 -4.74 119.66 123.00 1k2f s GLN 196 Ca 0.05 -0.65 -0.20 0.00 0.02 0.00 0.00 55.36 54.58 1k2f s GLN 196 Cb -0.17 -2.56 -0.03 0.00 1.00 0.00 0.00 33.01 31.25 1k2f s GLN 196 CO 0.07 0.42 0.59 -2.00 -2.12 0.00 0.00 175.29 172.25 1k2f s GLU 197 N -0.19 4.17 -0.10 2.91 2.12 -1.26 -1.67 118.70 124.68 1k2f s GLU 197 Ca 0.01 0.52 -0.04 0.00 0.36 0.00 0.00 54.97 55.82 1k2f s GLU 197 Cb -0.13 -3.59 -0.04 0.00 0.26 0.00 0.00 34.13 30.63 1k2f s GLU 197 CO 0.03 -0.26 0.06 0.15 -0.54 0.00 0.00 175.26 174.70 1k2f s LYS 198 N 1.98 3.18 0.48 4.30 -0.14 -0.58 -5.02 119.74 123.94 1k2f s LYS 198 Ca 0.26 -0.29 0.15 0.00 -1.36 0.00 0.00 55.97 54.73 1k2f s LYS 198 Cb -0.16 -2.96 1.15 0.00 -1.68 0.00 0.00 37.83 34.18 1k2f s LYS 198 CO 0.10 0.73 2.09 0.10 -0.76 0.00 0.00 175.35 177.61 1k2f h TYR 199 N 5.06 0.19 0.00 3.18 -0.00 -1.97 -2.65 116.97 120.78 1k2f h TYR 199 Ca -0.53 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.21 1k2f h TYR 199 Cb 1.21 -0.06 0.00 0.00 0.00 0.00 0.00 36.73 37.87 1k2f h TYR 199 CO 0.69 0.11 0.00 -0.40 -0.00 0.00 0.00 178.16 178.56 1k2f n ASP 200 N -4.49 0.00 0.00 0.10 5.75 -1.26 -4.82 116.55 111.83 1k2f n ASP 200 Ca 0.02 -0.66 0.00 0.00 -0.01 0.00 0.00 54.79 54.14 1k2f n ASP 200 Cb 0.18 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 1k2f n ASP 200 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1k2f n GLY 201 N -0.06 1.16 3.20 6.12 0.00 -1.00 -5.12 105.19 109.48 1k2f n GLY 201 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.00 1k2f n GLY 201 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1k2f s HIS 202 N -2.00 0.30 -0.26 1.61 -3.43 -1.23 -5.05 115.29 105.23 1k2f s HIS 202 Ca 0.00 -0.74 -0.03 0.00 -0.80 0.00 0.00 55.06 53.49 1k2f s HIS 202 Cb 0.00 -0.15 0.02 0.00 -1.43 0.00 0.00 32.58 31.02 1k2f s HIS 202 CO 0.00 -0.53 -0.02 -0.65 -2.00 0.00 0.00 174.74 171.54 1k2f s GLN 203 N -3.90 2.90 0.18 -0.38 -0.21 -1.26 -1.53 119.66 115.46 1k2f s GLN 203 Ca 0.08 -0.95 -0.04 0.00 0.02 0.00 0.00 55.36 54.48 1k2f s GLN 203 Cb 0.05 -3.10 -0.05 0.00 1.00 0.00 0.00 33.01 30.91 1k2f s GLN 203 CO -0.09 -0.42 0.41 -0.65 -2.12 0.00 0.00 175.29 172.43 1k2f s GLN 204 N 1.37 3.60 -0.08 2.91 -0.21 -0.67 -2.25 119.66 124.33 1k2f s GLN 204 Ca 0.01 -0.14 0.03 0.00 0.02 0.00 0.00 55.36 55.29 1k2f s GLN 204 Cb -0.17 -2.81 -0.02 0.00 1.00 0.00 0.00 33.01 31.01 1k2f s GLN 204 CO -0.02 0.41 -0.18 -0.06 -2.12 0.00 0.00 175.29 173.31 1k2f s PHE 205 N -1.78 2.63 -0.13 0.91 0.40 0.20 -1.01 117.98 119.20 1k2f s PHE 205 Ca 0.41 -0.54 0.01 0.00 -0.60 0.00 0.00 56.93 56.20 1k2f s PHE 205 Cb -0.12 -1.68 0.02 0.00 0.51 0.00 0.00 43.02 41.75 1k2f s PHE 205 CO 0.26 -0.10 -0.12 -0.06 0.70 0.00 0.00 175.22 175.90 1k2f s PHE 206 N -0.17 1.90 -0.12 0.36 0.40 0.46 -1.92 117.98 118.89 1k2f s PHE 206 Ca -0.02 -0.99 0.02 0.00 -0.60 0.00 0.00 56.93 55.35 1k2f s PHE 206 Cb -0.14 -1.43 0.00 0.00 0.51 0.00 0.00 43.02 41.97 1k2f s PHE 206 CO 0.03 -0.56 -0.21 0.00 0.70 0.00 0.00 175.22 175.18 1k2f s ALA 207 N 1.39 2.30 0.07 5.36 0.00 -0.59 0.14 121.76 130.43 1k2f s ALA 207 Ca 0.01 -1.01 -0.11 0.00 0.00 0.00 0.00 51.96 50.86 1k2f s ALA 207 Cb -0.13 -0.98 0.01 0.00 0.00 0.00 0.00 23.12 22.02 1k2f s ALA 207 CO -0.07 0.14 0.24 -1.50 0.00 0.00 0.00 175.76 174.57 1k2f s ILE 208 N 0.55 0.11 -0.08 0.00 2.07 -0.61 -1.42 121.20 121.82 1k2f s ILE 208 Ca -0.12 -0.94 0.05 0.00 -1.41 0.00 0.00 60.65 58.23 1k2f s ILE 208 Cb -0.17 -1.15 -0.00 0.00 0.13 0.00 0.00 42.46 41.27 1k2f s ILE 208 CO 0.04 -0.52 -0.24 -0.69 -1.91 0.00 0.00 174.94 171.62 1k2f s VAL 209 N -3.33 2.10 -0.07 4.00 1.01 -1.26 -1.52 120.40 121.32 1k2f s VAL 209 Ca 0.01 -1.02 0.05 0.00 0.00 0.00 0.00 61.98 61.01 1k2f s VAL 209 Cb 0.02 -1.78 -0.00 0.00 0.00 0.00 0.00 36.38 34.61 1k2f s VAL 209 CO -0.08 0.56 -0.23 -1.10 0.00 0.00 0.00 175.10 174.25 1k2f s GLN 210 N 0.14 2.60 0.01 2.72 -0.21 -0.14 -2.66 119.66 122.12 1k2f s GLN 210 Ca -0.13 -0.83 -0.21 0.00 0.02 0.00 0.00 55.36 54.22 1k2f s GLN 210 Cb -0.16 -2.09 -0.06 0.00 1.00 0.00 0.00 33.01 31.70 1k2f s GLN 210 CO 0.07 0.26 0.61 -1.17 -2.12 0.00 0.00 175.29 172.94 1k2f s LEU 211 N 0.12 4.44 -1.23 2.90 2.96 0.09 0.17 118.68 128.13 1k2f s LEU 211 Ca -0.11 1.21 -0.19 0.00 -0.22 0.00 0.00 54.13 54.82 1k2f s LEU 211 Cb -0.15 -2.95 0.07 0.00 0.50 0.00 0.00 46.19 43.65 1k2f s LEU 211 CO 0.06 0.12 1.66 -0.63 -1.32 0.00 0.00 176.35 176.24 1k2f s ILE 212 N -0.32 4.07 -0.35 6.68 -1.09 -0.26 -2.29 121.20 127.65 1k2f s ILE 212 Ca 0.31 -1.62 0.00 0.00 -2.23 0.00 0.00 60.65 57.11 1k2f s ILE 212 Cb -0.19 -5.16 0.00 0.00 -1.58 0.00 0.00 42.46 35.53 1k2f s ILE 212 CO 0.18 -2.00 0.00 0.61 -1.23 0.00 0.00 174.94 172.50 1k2f n GLY 213 N 5.78 -0.90 3.95 6.18 0.00 -1.26 -4.66 105.19 114.28 1k2f n GLY 213 Ca 0.45 -0.73 -0.26 0.00 0.00 0.00 0.00 46.02 45.48 1k2f n GLY 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1k2f s THR 214 N -3.00 2.17 -0.00 2.61 -4.23 -1.26 -3.93 115.64 108.00 1k2f s THR 214 Ca 0.00 -0.29 -0.25 0.00 -1.18 0.00 0.00 61.69 59.97 1k2f s THR 214 Cb 0.00 -2.88 -0.19 0.00 1.34 0.00 0.00 72.50 70.77 1k2f s THR 214 CO 0.00 0.00 1.32 0.03 -0.54 0.00 0.00 174.62 175.43 1k2f h ARG 215 N -0.84 0.06 -0.31 3.99 3.08 -1.97 -1.12 114.38 117.28 1k2f h ARG 215 Ca -0.42 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 59.64 1k2f h ARG 215 Cb 1.28 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.32 1k2f h ARG 215 CO 0.49 0.49 0.21 0.87 -1.07 0.00 0.00 179.97 180.97 1k2f h LYS 216 N -0.37 0.22 -0.16 0.04 1.57 -1.99 -0.41 116.57 115.48 1k2f h LYS 216 Ca 0.01 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 1k2f h LYS 216 Cb 0.48 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 1k2f h LYS 216 CO 0.01 0.15 -0.21 1.96 -0.57 0.00 0.00 179.45 180.78 1k2f h GLN 217 N 0.23 0.42 -0.67 3.15 4.20 -1.91 -3.17 115.11 117.35 1k2f h GLN 217 Ca 0.13 -0.24 0.01 0.00 0.06 0.00 0.00 58.65 58.61 1k2f h GLN 217 Cb 0.25 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 1k2f h GLN 217 CO -0.02 0.82 0.44 0.00 -0.67 0.00 0.00 178.83 179.40 1k2f h ALA 218 N 0.59 1.51 0.00 3.87 0.00 0.04 -2.05 119.26 123.21 1k2f h ALA 218 Ca 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1k2f h ALA 218 Cb 0.77 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1k2f h ALA 218 CO 0.05 0.45 0.01 0.93 0.00 0.00 0.00 179.25 180.69 1k2f h GLU 219 N 0.92 0.00 -0.00 0.00 4.39 -1.10 -1.35 114.58 117.44 1k2f h GLU 219 Ca 0.25 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.95 1k2f h GLU 219 Cb -0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.55 1k2f h GLU 219 CO -0.05 0.00 -0.33 0.09 -1.16 0.00 0.00 179.01 177.56 1k2f n ASN 220 N -2.49 0.45 -4.78 1.42 3.02 -0.77 -4.92 115.26 107.18 1k2f n ASN 220 Ca -0.02 -0.19 -0.26 0.00 -0.03 0.00 0.00 54.58 54.08 1k2f n ASN 220 Cb 0.05 0.05 -0.06 0.00 -0.61 0.00 0.00 39.78 39.21 1k2f n ASN 220 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1k2f s PHE 221 N -2.90 2.31 -0.13 3.10 0.40 -0.51 -0.60 117.98 119.66 1k2f s PHE 221 Ca 0.15 -0.68 -0.15 0.00 -0.60 0.00 0.00 56.93 55.64 1k2f s PHE 221 Cb 0.18 -1.92 0.04 0.00 0.51 0.00 0.00 43.02 41.83 1k2f s PHE 221 CO 0.62 0.03 0.41 0.00 0.70 0.00 0.00 175.22 176.98 1k2f s ALA 222 N -2.66 -1.02 0.15 5.36 0.00 -0.42 -4.45 121.76 118.72 1k2f s ALA 222 Ca 0.36 1.05 0.08 0.00 0.00 0.00 0.00 51.96 53.45 1k2f s ALA 222 Cb 0.02 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 1k2f s ALA 222 CO 0.20 -0.21 -0.19 1.52 0.00 0.00 0.00 175.76 177.08 1k2f s TYR 223 N -0.08 1.80 -0.04 0.00 -0.85 -0.01 -1.06 117.35 117.10 1k2f s TYR 223 Ca -0.03 -0.46 0.02 0.00 -0.52 0.00 0.00 57.07 56.08 1k2f s TYR 223 Cb -0.03 -0.91 0.01 0.00 0.38 0.00 0.00 41.96 41.41 1k2f s TYR 223 CO 0.02 0.30 -0.08 0.50 -1.52 0.00 0.00 175.55 174.76 1k2f s ARG 224 N -2.62 1.13 -0.12 -3.49 3.52 0.14 -1.81 118.95 115.70 1k2f s ARG 224 Ca 0.14 -0.26 0.01 0.00 -0.13 0.00 0.00 55.73 55.49 1k2f s ARG 224 Cb -0.06 -1.02 -0.01 0.00 -1.56 0.00 0.00 34.95 32.29 1k2f s ARG 224 CO 0.06 0.01 -0.15 -0.51 -0.81 0.00 0.00 175.30 173.90 1k2f s LEU 225 N 0.61 2.59 -0.02 -0.88 1.43 0.62 -0.56 118.68 122.47 1k2f s LEU 225 Ca -0.10 -0.37 0.04 0.00 -1.03 0.00 0.00 54.13 52.67 1k2f s LEU 225 Cb -0.13 -1.57 -0.01 0.00 0.03 0.00 0.00 46.19 44.51 1k2f s LEU 225 CO 0.01 0.17 -0.15 -1.61 0.23 0.00 0.00 176.35 175.01 1k2f s GLU 226 N 0.30 1.30 -0.27 1.70 2.02 0.82 -1.32 118.70 123.25 1k2f s GLU 226 Ca -0.12 -0.53 -0.02 0.00 0.02 0.00 0.00 54.97 54.32 1k2f s GLU 226 Cb -0.16 -1.22 0.03 0.00 0.10 0.00 0.00 34.13 32.88 1k2f s GLU 226 CO 0.06 0.29 -0.02 -0.51 0.02 0.00 0.00 175.26 175.10 1k2f s LEU 227 N -0.24 3.51 -0.17 1.80 1.43 -0.51 0.03 118.68 124.53 1k2f s LEU 227 Ca 0.03 -1.00 -0.04 0.00 -1.03 0.00 0.00 54.13 52.09 1k2f s LEU 227 Cb -0.07 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.42 1k2f s LEU 227 CO -0.00 -0.18 -0.02 0.20 0.23 0.00 0.00 176.35 176.58 1k2f s ASN 228 N 1.32 4.84 0.19 2.29 0.01 -1.26 -2.16 114.94 120.16 1k2f s ASN 228 Ca -0.02 -0.15 0.03 0.00 -0.71 0.00 0.00 52.86 52.02 1k2f s ASN 228 Cb -0.18 -1.80 -0.01 0.00 0.41 0.00 0.00 41.25 39.66 1k2f s ASN 228 CO -0.02 0.13 0.12 0.61 -1.51 0.00 0.00 177.10 176.43 1k2f n GLY 229 N 3.79 3.52 3.60 0.66 0.00 -0.64 -4.98 105.19 111.14 1k2f n GLY 229 Ca -0.17 -1.87 -0.43 0.00 0.00 0.00 0.00 46.02 43.55 1k2f n GLY 229 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1k2f s HIS 230 N -2.57 1.69 -1.42 1.61 3.76 -1.26 -2.90 115.29 114.20 1k2f s HIS 230 Ca 0.17 0.63 -0.04 0.00 -0.15 0.00 0.00 55.06 55.67 1k2f s HIS 230 Cb 0.01 -4.09 0.02 0.00 1.11 0.00 0.00 32.58 29.63 1k2f s HIS 230 CO 0.12 -3.12 0.34 0.54 -0.85 0.00 0.00 174.74 171.77 1k2f n ARG 231 N 8.51 -3.38 -3.81 1.40 1.74 -1.26 -4.96 116.66 114.91 1k2f n ARG 231 Ca 0.24 0.75 -0.12 0.00 -0.77 0.00 0.00 57.85 57.95 1k2f n ARG 231 Cb 0.47 -5.49 -0.09 0.00 -1.02 0.00 0.00 32.46 26.33 1k2f n ARG 231 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1k2f s ARG 232 N -5.51 0.56 -0.26 5.56 0.52 -1.14 -5.16 118.95 113.51 1k2f s ARG 232 Ca 0.21 -0.22 -0.14 0.00 -0.52 0.00 0.00 55.73 55.05 1k2f s ARG 232 Cb -0.10 0.24 0.08 0.00 0.52 0.00 0.00 34.95 35.70 1k2f s ARG 232 CO 0.25 -0.14 0.63 0.50 0.02 0.00 0.00 175.30 176.57 1k2f s ARG 233 N -1.21 0.64 -0.20 3.54 3.52 -1.26 -1.62 118.95 122.35 1k2f s ARG 233 Ca -0.13 1.17 0.00 0.00 -0.13 0.00 0.00 55.73 56.65 1k2f s ARG 233 Cb -0.06 0.18 0.02 0.00 -1.56 0.00 0.00 34.95 33.53 1k2f s ARG 233 CO 0.03 -0.16 -0.16 -1.17 -0.81 0.00 0.00 175.30 173.03 1k2f s LEU 234 N 1.73 2.49 -0.00 -0.88 2.96 -0.92 -5.00 118.68 119.05 1k2f s LEU 234 Ca -0.09 -0.72 0.07 0.00 -0.22 0.00 0.00 54.13 53.16 1k2f s LEU 234 Cb -0.06 -1.54 -0.02 0.00 0.50 0.00 0.00 46.19 45.07 1k2f s LEU 234 CO -0.19 -0.04 -0.21 -0.89 -1.32 0.00 0.00 176.35 173.71 1k2f s THR 235 N 1.30 1.63 -0.09 3.68 2.01 -1.26 -1.43 115.64 121.48 1k2f s THR 235 Ca 0.03 -0.94 0.01 0.00 0.31 0.00 0.00 61.69 61.10 1k2f s THR 235 Cb -0.14 -1.37 0.02 0.00 0.01 0.00 0.00 72.50 71.02 1k2f s THR 235 CO -0.10 0.41 -0.09 0.86 -0.69 0.00 0.00 174.62 175.01 1k2f s TRP 236 N -0.54 1.40 -0.06 4.92 -0.11 -0.43 -4.99 118.94 119.13 1k2f s TRP 236 Ca 0.08 -0.61 0.04 0.00 1.22 0.00 0.00 56.10 56.83 1k2f s TRP 236 Cb -0.08 -1.12 -0.00 0.00 -1.50 0.00 0.00 33.47 30.77 1k2f s TRP 236 CO -0.00 -0.39 -0.20 -1.21 -4.62 0.00 0.00 176.95 170.53 1k2f s GLU 237 N 1.24 2.23 0.18 5.86 2.02 -1.26 -0.28 118.70 128.68 1k2f s GLU 237 Ca -0.04 -0.71 -0.23 0.00 0.02 0.00 0.00 54.97 54.01 1k2f s GLU 237 Cb -0.14 -1.84 0.08 0.00 0.10 0.00 0.00 34.13 32.33 1k2f s GLU 237 CO -0.03 0.23 1.04 0.00 0.02 0.00 0.00 175.26 176.52 1k2f s ALA 238 N 0.15 -1.63 -0.02 5.21 0.00 -0.75 -5.01 121.76 119.71 1k2f s ALA 238 Ca -0.09 -0.27 -0.22 0.00 0.00 0.00 0.00 51.96 51.38 1k2f s ALA 238 Cb -0.14 0.75 -0.05 0.00 0.00 0.00 0.00 23.12 23.68 1k2f s ALA 238 CO 0.04 -1.06 0.63 0.99 0.00 0.00 0.00 175.76 176.36 1k2f s THR 239 N -2.27 4.94 0.39 0.00 2.01 -1.26 -0.83 115.64 118.62 1k2f s THR 239 Ca 0.21 1.32 -0.26 0.00 0.31 0.00 0.00 61.69 63.27 1k2f s THR 239 Cb -0.02 -3.97 -0.09 0.00 0.01 0.00 0.00 72.50 68.43 1k2f s THR 239 CO 0.05 0.36 1.23 -2.84 -0.69 0.00 0.00 174.62 172.73 1k2f s PRO 240 N 0.14 4.06 0.44 4.92 0.02 -1.26 -4.93 135.00 138.39 1k2f s PRO 240 Ca 0.33 1.98 -0.08 0.00 0.02 0.00 0.00 61.00 63.25 1k2f s PRO 240 Cb -0.18 -2.76 -0.05 0.00 0.02 0.00 0.00 34.50 31.53 1k2f s PRO 240 CO 0.18 -0.35 0.79 1.03 -0.33 0.00 0.00 177.00 178.31 1k2f s ARG 241 N -2.20 3.67 0.18 5.54 1.81 -1.09 -4.66 118.95 122.20 1k2f s ARG 241 Ca 0.56 0.37 -0.17 0.00 -1.72 0.00 0.00 55.73 54.77 1k2f s ARG 241 Cb -0.34 -2.37 -0.08 0.00 -0.45 0.00 0.00 34.95 31.71 1k2f s ARG 241 CO 0.43 -0.13 0.63 0.45 -0.68 0.00 0.00 175.30 176.01 1k2f s SER 242 N -3.59 6.93 0.65 0.23 0.15 -1.26 -0.73 113.70 116.07 1k2f s SER 242 Ca 0.50 1.23 0.39 0.00 0.70 0.00 0.00 55.95 58.78 1k2f s SER 242 Cb -0.10 -2.35 2.20 0.00 -1.71 0.00 0.00 66.02 64.06 1k2f s SER 242 CO 0.38 0.07 2.30 0.16 1.20 0.00 0.00 173.24 177.34 1k2f h ILE 243 N 2.76 0.14 0.18 6.45 3.07 -1.58 -1.14 117.51 127.40 1k2f h ILE 243 Ca -0.48 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.93 1k2f h ILE 243 Cb 1.19 0.96 -0.01 0.00 -0.27 0.00 0.00 36.82 38.69 1k2f h ILE 243 CO 0.65 0.00 -0.17 -0.74 -1.05 0.00 0.00 178.15 176.84 1k2f h HIS 244 N 0.00 -0.46 -0.69 0.16 2.76 -1.87 -2.48 115.15 112.58 1k2f h HIS 244 Ca 0.01 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.11 1k2f h HIS 244 Cb 0.08 0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.19 1k2f h HIS 244 CO 0.00 -0.26 0.17 1.49 -1.30 0.00 0.00 177.93 178.03 1k2f h GLU 245 N -0.38 1.10 0.00 5.26 4.81 -1.60 -3.47 114.58 120.29 1k2f h GLU 245 Ca 0.00 -0.26 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 1k2f h GLU 245 Cb 0.36 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1k2f h GLU 245 CO -0.04 0.97 0.00 0.41 -0.73 0.00 0.00 179.01 179.62 1k2f n GLY 246 N -0.67 1.01 0.04 1.92 0.00 -0.93 -4.80 105.19 101.76 1k2f n GLY 246 Ca 0.05 -2.05 0.03 0.00 0.00 0.00 0.00 46.02 44.05 1k2f n GLY 246 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1k2f n ILE 247 N 1.22 0.46 0.00 -0.61 -5.35 -1.26 -4.65 119.36 109.18 1k2f n ILE 247 Ca 0.00 -0.55 -0.12 0.00 -0.27 0.00 0.00 62.75 61.81 1k2f n ILE 247 Cb 0.00 -0.16 -0.06 0.00 -1.74 0.00 0.00 39.64 37.68 1k2f n ILE 247 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1k2f h ALA 248 N 1.40 -0.54 -0.43 -1.28 0.00 -1.99 -0.04 119.26 116.38 1k2f h ALA 248 Ca -0.18 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.75 1k2f h ALA 248 Cb 1.33 0.74 -0.03 0.00 0.00 0.00 0.00 17.79 19.83 1k2f h ALA 248 CO 0.01 -0.90 0.23 1.79 0.00 0.00 0.00 179.25 180.38 1k2f h THR 249 N -0.48 1.00 -0.54 0.00 1.35 -1.87 0.18 112.91 112.56 1k2f h THR 249 Ca 0.08 -0.16 0.01 0.00 -0.55 0.00 0.00 66.41 65.79 1k2f h THR 249 Cb 0.61 0.50 -0.03 0.00 -1.73 0.00 0.00 68.15 67.50 1k2f h THR 249 CO -0.38 0.08 0.35 0.00 -0.25 0.00 0.00 175.52 175.32 1k2f h ALA 250 N 1.21 0.69 -0.23 6.62 0.00 -1.75 -1.50 119.26 124.30 1k2f h ALA 250 Ca 0.18 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1k2f h ALA 250 Cb 0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1k2f h ALA 250 CO -0.11 0.11 -0.13 0.82 0.00 0.00 0.00 179.25 179.94 1k2f h ILE 251 N 0.72 1.21 -0.34 0.00 2.04 -0.59 -0.04 117.51 120.50 1k2f h ILE 251 Ca 0.20 -0.93 -0.08 0.00 1.00 0.00 0.00 64.86 65.06 1k2f h ILE 251 Cb -0.06 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1k2f h ILE 251 CO -0.05 0.30 -0.10 -0.03 0.00 0.00 0.00 178.15 178.26 1k2f h MET 252 N 0.35 0.59 -0.68 2.37 4.05 -0.12 -2.49 114.93 119.01 1k2f h MET 252 Ca 0.07 -0.17 0.00 0.00 -0.28 0.00 0.00 59.70 59.32 1k2f h MET 252 Cb 0.45 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.18 1k2f h MET 252 CO 0.03 0.68 0.00 0.09 0.23 0.00 0.00 176.91 177.94 1k2f n ASN 253 N -4.20 4.11 -2.13 1.39 3.02 -0.65 -4.93 115.26 111.87 1k2f n ASN 253 Ca 0.01 -2.20 -0.18 0.00 -0.03 0.00 0.00 54.58 52.17 1k2f n ASN 253 Cb 0.33 -0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 38.95 1k2f n ASN 253 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1k2f n SER 254 N 1.31 -5.21 -3.94 6.41 7.64 -0.70 -4.88 113.62 114.25 1k2f n SER 254 Ca 0.24 0.18 -0.43 0.00 1.01 0.00 0.00 58.87 59.87 1k2f n SER 254 Cb 0.71 -4.45 0.00 0.00 -1.01 0.00 0.00 64.21 59.47 1k2f n SER 254 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1k2f n ASP 255 N -1.68 4.91 0.00 6.43 -0.08 -0.11 -4.81 116.55 121.21 1k2f n ASP 255 Ca -0.21 -3.05 0.00 0.00 -1.51 0.00 0.00 54.79 50.02 1k2f n ASP 255 Cb 0.65 -1.53 0.00 0.00 2.34 0.00 0.00 41.12 42.58 1k2f n ASP 255 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1k2f s LEU 257 N 0.00 4.21 -0.17 0.00 2.96 -0.51 -4.92 118.68 120.25 1k2f s LEU 257 Ca 0.00 1.66 0.01 0.00 -0.22 0.00 0.00 54.13 55.58 1k2f s LEU 257 Cb 0.00 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 43.17 1k2f s LEU 257 CO 0.00 -0.64 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.55 1k2f s VAL 258 N 2.79 1.74 0.14 1.68 1.01 -1.26 -1.55 120.40 124.95 1k2f s VAL 258 Ca 0.52 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.73 1k2f s VAL 258 Cb -0.21 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 1k2f s VAL 258 CO 0.16 0.43 0.13 2.22 0.00 0.00 0.00 175.10 178.05 1k2f n PHE 259 N 4.71 -0.41 -4.15 5.22 1.16 -0.81 -4.98 117.46 118.20 1k2f n PHE 259 Ca -0.18 -1.18 -0.14 0.00 -1.87 0.00 0.00 57.45 54.09 1k2f n PHE 259 Cb 0.49 0.14 -0.05 0.00 -1.61 0.00 0.00 39.48 38.45 1k2f n PHE 259 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 1k2f n ASP 260 N -2.37 -0.64 -0.20 5.98 3.85 -1.26 0.59 116.55 122.50 1k2f n ASP 260 Ca 0.03 -2.57 -0.03 0.00 -0.71 0.00 0.00 54.79 51.51 1k2f n ASP 260 Cb 0.26 1.39 0.03 0.00 -1.35 0.00 0.00 41.12 41.45 1k2f n ASP 260 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.20 176.93 1k2f h THR 261 N 1.78 0.26 -0.73 2.12 2.02 -1.81 0.35 112.91 116.89 1k2f h THR 261 Ca -0.18 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 66.95 1k2f h THR 261 Cb 0.88 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 1k2f h THR 261 CO 0.26 0.00 0.26 0.77 0.37 0.00 0.00 175.52 177.18 1k2f h SER 262 N -0.10 1.03 -0.38 4.18 4.64 -1.97 -1.32 113.55 119.64 1k2f h SER 262 Ca 0.27 -0.19 -0.10 0.00 -0.47 0.00 0.00 61.79 61.30 1k2f h SER 262 Cb 0.52 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.32 1k2f h SER 262 CO -0.66 0.94 -0.13 0.40 -0.87 0.00 0.00 176.83 176.51 1k2f h ILE 263 N 1.07 1.26 -0.05 0.95 2.04 -1.63 -2.70 117.51 118.44 1k2f h ILE 263 Ca 0.24 -1.22 -0.06 0.00 1.00 0.00 0.00 64.86 64.82 1k2f h ILE 263 Cb 0.25 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 1k2f h ILE 263 CO -0.01 0.42 -0.24 0.00 0.00 0.00 0.00 178.15 178.31 1k2f h ALA 264 N 1.10 1.50 0.00 1.87 0.00 0.16 -2.31 119.26 121.58 1k2f h ALA 264 Ca 0.12 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.64 1k2f h ALA 264 Cb 0.64 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1k2f h ALA 264 CO 0.04 0.37 -0.68 1.96 0.00 0.00 0.00 179.25 180.94 1k2f h GLN 265 N 0.08 0.00 -0.18 0.00 1.08 -0.95 -0.53 115.11 114.62 1k2f h GLN 265 Ca 0.01 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.15 1k2f h GLN 265 Cb 0.48 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.90 1k2f h GLN 265 CO 0.03 0.68 -0.16 1.25 -0.95 0.00 0.00 178.83 179.69 1k2f h LEU 266 N 0.00 0.28 0.00 1.46 5.85 -1.16 -3.22 115.31 118.52 1k2f h LEU 266 Ca -0.01 -0.07 -0.18 0.00 0.84 0.00 0.00 57.88 58.47 1k2f h LEU 266 Cb 1.25 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.17 1k2f h LEU 266 CO 0.09 0.46 -2.06 0.49 -0.34 0.00 0.00 178.44 177.08 1k2f n PHE 267 N -4.23 0.00 -1.92 1.25 3.01 -1.17 -4.88 117.46 109.51 1k2f n PHE 267 Ca -0.00 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.13 1k2f n PHE 267 Cb 0.30 -0.68 0.03 0.00 -0.01 0.00 0.00 39.48 39.12 1k2f n PHE 267 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1k2f s ALA 268 N -2.83 2.63 -0.04 4.37 0.00 -0.21 -4.80 121.76 120.88 1k2f s ALA 268 Ca -0.08 0.45 -0.02 0.00 0.00 0.00 0.00 51.96 52.32 1k2f s ALA 268 Cb 0.08 -3.27 0.03 0.00 0.00 0.00 0.00 23.12 19.97 1k2f s ALA 268 CO 0.76 -1.00 0.09 -1.21 0.00 0.00 0.00 175.76 174.39 1k2f s GLU 269 N -4.09 0.03 -1.52 0.00 2.02 -0.55 -4.84 118.70 109.75 1k2f s GLU 269 Ca 0.65 0.27 -0.06 0.00 0.02 0.00 0.00 54.97 55.85 1k2f s GLU 269 Cb -0.18 -0.19 0.01 0.00 0.10 0.00 0.00 34.13 33.87 1k2f s GLU 269 CO 0.39 -0.16 0.65 0.09 0.02 0.00 0.00 175.26 176.25 1k2f n ASN 270 N 4.11 -5.91 0.00 -0.19 3.02 -1.26 -1.37 115.26 113.66 1k2f n ASN 270 Ca -0.26 -0.32 0.00 0.00 -0.03 0.00 0.00 54.58 53.97 1k2f n ASN 270 Cb 0.52 -4.77 0.00 0.00 -0.61 0.00 0.00 39.78 34.92 1k2f n ASN 270 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k2f n GLY 271 N -1.53 0.53 3.62 7.41 0.00 -1.26 -4.87 105.19 109.08 1k2f n GLY 271 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.62 1k2f n GLY 271 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1k2f s ASN 272 N -2.43 4.68 -0.15 1.61 0.01 -0.47 -2.01 114.94 116.19 1k2f s ASN 272 Ca 0.00 -0.21 0.01 0.00 -0.71 0.00 0.00 52.86 51.95 1k2f s ASN 272 Cb 0.00 -1.05 0.02 0.00 0.41 0.00 0.00 41.25 40.62 1k2f s ASN 272 CO 0.00 0.23 -0.18 -0.22 -1.51 0.00 0.00 177.10 175.41 1k2f s LEU 273 N -1.87 1.95 -0.15 0.60 2.96 0.33 -1.49 118.68 121.01 1k2f s LEU 273 Ca 0.21 -0.56 -0.16 0.00 -0.22 0.00 0.00 54.13 53.40 1k2f s LEU 273 Cb -0.11 -1.33 -0.04 0.00 0.50 0.00 0.00 46.19 45.21 1k2f s LEU 273 CO 0.12 0.02 0.38 -0.83 -1.32 0.00 0.00 176.35 174.72 1k2f s GLY 274 N 1.12 2.25 -0.20 7.98 0.00 -1.26 -0.63 107.32 116.56 1k2f s GLY 274 Ca -0.01 -0.37 0.01 0.00 0.00 0.00 0.00 44.72 44.35 1k2f s GLY 274 CO -0.07 0.65 -0.15 -0.42 0.00 0.00 0.00 173.10 173.11 1k2f s ILE 275 N 0.72 1.96 0.01 0.90 1.01 0.76 -4.40 121.20 122.17 1k2f s ILE 275 Ca 0.21 -1.13 -0.30 0.00 0.00 0.00 0.00 60.65 59.42 1k2f s ILE 275 Cb -0.14 -1.92 -0.04 0.00 0.01 0.00 0.00 42.46 40.37 1k2f s ILE 275 CO 0.07 0.29 1.10 0.20 0.00 0.00 0.00 174.94 176.60 1k2f s ASN 276 N 1.27 7.21 -0.14 3.58 -0.87 0.10 -0.22 114.94 125.88 1k2f s ASN 276 Ca -0.00 1.81 0.00 0.00 -1.57 0.00 0.00 52.86 53.10 1k2f s ASN 276 Cb -0.16 -2.57 0.02 0.00 -0.02 0.00 0.00 41.25 38.52 1k2f s ASN 276 CO -0.10 -0.40 -0.13 -0.69 -2.57 0.00 0.00 177.10 173.22 1k2f s VAL 277 N 1.24 1.49 -0.12 1.60 1.01 -0.14 -0.13 120.40 125.35 1k2f s VAL 277 Ca 0.55 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.96 1k2f s VAL 277 Cb -0.25 -1.41 0.02 0.00 0.00 0.00 0.00 36.38 34.74 1k2f s VAL 277 CO 0.27 0.45 -0.16 -0.89 0.00 0.00 0.00 175.10 174.76 1k2f s THR 278 N 1.47 1.62 -0.05 3.92 2.01 0.28 -1.29 115.64 123.59 1k2f s THR 278 Ca 0.04 -0.70 0.04 0.00 0.31 0.00 0.00 61.69 61.37 1k2f s THR 278 Cb -0.13 -1.48 -0.02 0.00 0.01 0.00 0.00 72.50 70.88 1k2f s THR 278 CO -0.09 0.46 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.52 1k2f s ILE 279 N 1.05 3.01 0.05 1.82 1.01 0.88 0.24 121.20 129.26 1k2f s ILE 279 Ca -0.04 -0.74 -0.04 0.00 0.00 0.00 0.00 60.65 59.83 1k2f s ILE 279 Cb -0.15 -2.18 -0.02 0.00 0.01 0.00 0.00 42.46 40.12 1k2f s ILE 279 CO -0.03 0.59 0.05 -0.94 0.00 0.00 0.00 174.94 174.60 1k2f s SER 280 N -0.64 0.29 0.20 3.58 1.04 -0.22 -4.76 113.70 113.19 1k2f s SER 280 Ca 0.09 -0.73 -0.07 0.00 0.48 0.00 0.00 55.95 55.72 1k2f s SER 280 Cb -0.11 0.23 -0.06 0.00 0.10 0.00 0.00 66.02 66.17 1k2f s SER 280 CO 0.01 -0.57 0.48 -0.04 0.98 0.00 0.00 173.24 174.10 1k2f s MET 281 N -3.23 3.72 0.00 4.02 -1.94 -1.26 -1.30 119.30 119.30 1k2f s MET 281 Ca 0.00 0.11 0.31 0.00 -1.71 0.00 0.00 55.69 54.41 1k2f s MET 281 Cb 0.03 -2.73 1.78 0.00 2.01 0.00 0.00 34.83 35.92 1k2f s MET 281 CO -0.07 0.37 2.16 0.00 -0.01 0.00 0.00 175.02 177.46