#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uol s VAL 97 N 0.00 -0.51 0.29 0.44 1.01 -1.26 -4.70 120.40 115.67 1uol s VAL 97 Ca 0.00 -0.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.43 1uol s VAL 97 Cb 0.00 -0.90 -0.14 0.00 0.00 0.00 0.00 36.38 35.35 1uol s VAL 97 CO 0.00 -0.28 1.17 -2.65 0.00 0.00 0.00 175.10 173.33 1uol n PRO 98 N 5.34 1.68 -2.07 2.72 -0.02 -1.26 -4.91 135.00 136.48 1uol n PRO 98 Ca -0.02 0.59 -0.37 0.00 -2.02 0.00 0.00 63.50 61.67 1uol n PRO 98 Cb 0.49 -2.08 0.01 0.00 -0.02 0.00 0.00 33.50 31.90 1uol n PRO 98 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1uol s SER 99 N -0.32 5.78 -0.06 2.55 0.15 -1.26 -4.92 113.70 115.61 1uol s SER 99 Ca 0.60 2.48 0.09 0.00 0.70 0.00 0.00 55.95 59.83 1uol s SER 99 Cb -0.66 -2.61 0.14 0.00 -1.71 0.00 0.00 66.02 61.18 1uol s SER 99 CO 0.59 -1.20 1.07 0.00 1.20 0.00 0.00 173.24 174.89 1uol n GLN 100 N -0.76 2.06 -2.26 5.44 10.64 -1.26 -5.04 117.38 126.21 1uol n GLN 100 Ca 0.09 -2.02 -0.42 0.00 -1.83 0.00 0.00 57.00 52.82 1uol n GLN 100 Cb 0.47 -1.23 -0.03 0.00 -0.86 0.00 0.00 30.24 28.59 1uol n GLN 100 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 1uol s LYS 101 N -1.91 4.31 0.23 2.61 -0.14 -1.26 -4.78 119.74 118.80 1uol s LYS 101 Ca 0.16 1.93 -0.31 0.00 -1.36 0.00 0.00 55.97 56.39 1uol s LYS 101 Cb 0.14 -3.50 -0.11 0.00 -1.68 0.00 0.00 37.83 32.68 1uol s LYS 101 CO 0.01 -0.51 1.59 0.99 -0.76 0.00 0.00 175.35 176.68 1uol s THR 102 N 2.06 2.31 -0.26 2.17 2.01 -1.26 -4.68 115.64 117.99 1uol s THR 102 Ca 0.62 0.24 -0.02 0.00 0.31 0.00 0.00 61.69 62.85 1uol s THR 102 Cb -0.31 -3.15 0.13 0.00 0.01 0.00 0.00 72.50 69.17 1uol s THR 102 CO 0.27 0.03 0.30 -0.47 -0.69 0.00 0.00 174.62 174.06 1uol s TYR 103 N 0.60 -0.54 0.29 4.92 5.04 -0.18 -4.95 117.35 122.52 1uol s TYR 103 Ca 0.67 0.18 0.13 0.00 -2.44 0.00 0.00 57.07 55.61 1uol s TYR 103 Cb -0.46 -0.31 0.54 0.00 0.35 0.00 0.00 41.96 42.08 1uol s TYR 103 CO 0.39 -0.81 1.71 1.96 -1.34 0.00 0.00 175.55 177.46 1uol h GLN 104 N 8.25 0.00 0.00 4.97 4.20 -1.78 0.23 115.11 130.98 1uol h GLN 104 Ca -0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.56 1uol h GLN 104 Cb 1.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.90 1uol h GLN 104 CO 0.30 0.50 0.00 0.41 -0.67 0.00 0.00 178.83 179.37 1uol n GLY 105 N 0.00 -1.14 0.25 3.46 0.00 -1.26 -1.06 105.19 105.45 1uol n GLY 105 Ca -0.01 -1.08 0.09 0.00 0.00 0.00 0.00 46.02 45.01 1uol n GLY 105 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1uol h SER 106 N 0.00 0.00 -0.13 1.61 0.02 -1.95 -2.90 113.55 110.20 1uol h SER 106 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1uol h SER 106 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1uol h SER 106 CO 0.00 0.10 0.00 -1.22 -1.14 0.00 0.00 176.83 174.57 1uol n TYR 107 N -4.16 0.15 -3.23 3.45 4.01 -1.26 -4.87 117.16 111.26 1uol n TYR 107 Ca -0.03 -0.07 -0.15 0.00 -0.16 0.00 0.00 57.90 57.49 1uol n TYR 107 Cb 0.18 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.29 1uol n TYR 107 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1uol n GLY 108 N 1.30 -0.32 3.73 2.72 0.00 -1.10 -0.22 105.19 111.31 1uol n GLY 108 Ca 0.17 0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1uol n GLY 108 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1uol s PHE 109 N -3.32 3.73 0.09 1.61 5.36 -0.22 -3.17 117.98 122.06 1uol s PHE 109 Ca 0.04 1.63 -0.25 0.00 -0.96 0.00 0.00 56.93 57.38 1uol s PHE 109 Cb -0.00 -2.98 0.08 0.00 -0.34 0.00 0.00 43.02 39.77 1uol s PHE 109 CO 0.64 0.15 0.67 -0.98 -1.46 0.00 0.00 175.22 174.24 1uol s ARG 110 N 0.33 1.15 0.54 10.12 3.03 -0.62 -4.27 118.95 129.24 1uol s ARG 110 Ca 0.45 -0.30 -0.04 0.00 2.03 0.00 0.00 55.73 57.87 1uol s ARG 110 Cb -0.21 0.53 0.00 0.00 -1.03 0.00 0.00 34.95 34.24 1uol s ARG 110 CO 0.26 -0.48 0.83 -0.51 -1.13 0.00 0.00 175.30 174.28 1uol s LEU 111 N -2.39 3.38 -0.03 -1.89 1.43 -1.26 -0.77 118.68 117.15 1uol s LEU 111 Ca -0.01 0.63 -0.08 0.00 -1.03 0.00 0.00 54.13 53.64 1uol s LEU 111 Cb -0.01 -3.48 0.01 0.00 0.03 0.00 0.00 46.19 42.74 1uol s LEU 111 CO -0.08 -0.92 0.19 -0.83 0.23 0.00 0.00 176.35 174.94 1uol s GLY 112 N -4.26 -0.07 0.06 -3.19 0.00 -0.39 -4.83 107.32 94.63 1uol s GLY 112 Ca 0.52 0.24 0.06 0.00 0.00 0.00 0.00 44.72 45.54 1uol s GLY 112 CO 0.43 0.12 -0.18 -1.36 0.00 0.00 0.00 173.10 172.12 1uol s PHE 113 N -0.73 1.52 0.87 1.90 0.08 -1.26 -0.45 117.98 119.92 1uol s PHE 113 Ca -0.08 -0.39 -0.12 0.00 0.12 0.00 0.00 56.93 56.47 1uol s PHE 113 Cb -0.05 -0.88 0.12 0.00 -0.57 0.00 0.00 43.02 41.64 1uol s PHE 113 CO 0.01 0.09 1.09 -0.51 -0.10 0.00 0.00 175.22 175.81 1uol s LEU 114 N -1.38 2.33 -0.55 -0.37 1.43 -1.26 -4.99 118.68 113.88 1uol s LEU 114 Ca 0.04 1.44 -0.09 0.00 -1.03 0.00 0.00 54.13 54.49 1uol s LEU 114 Cb -0.09 -3.90 0.14 0.00 0.03 0.00 0.00 46.19 42.37 1uol s LEU 114 CO 0.02 -2.49 0.42 -1.00 0.23 0.00 0.00 176.35 173.53 1uol s HIS 115 N -2.99 3.47 -1.14 0.29 3.76 -1.26 -4.56 115.29 112.86 1uol s HIS 115 Ca 0.63 -2.04 0.24 0.00 -0.15 0.00 0.00 55.06 53.74 1uol s HIS 115 Cb -0.17 -3.49 0.25 0.00 1.11 0.00 0.00 32.58 30.28 1uol s HIS 115 CO 0.56 -0.97 1.24 0.43 -0.85 0.00 0.00 174.74 175.15 1uol n SER 116 N 4.54 0.82 0.00 1.40 7.64 -1.26 -5.09 113.62 121.67 1uol n SER 116 Ca -0.02 -0.64 0.00 0.00 1.01 0.00 0.00 58.87 59.21 1uol n SER 116 Cb 0.41 0.51 0.00 0.00 -1.01 0.00 0.00 64.21 64.12 1uol n SER 116 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uol n GLY 117 N 1.48 -2.37 1.24 0.23 0.00 -1.26 -4.68 105.19 99.83 1uol n GLY 117 Ca 0.06 -1.56 -0.04 0.00 0.00 0.00 0.00 46.02 44.47 1uol n GLY 117 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uol n THR 118 N -0.87 2.08 -2.16 2.61 -2.24 -1.26 -4.79 114.28 107.64 1uol n THR 118 Ca 0.00 -3.35 -0.41 0.00 -2.27 0.00 0.00 64.05 58.02 1uol n THR 118 Cb 0.00 -0.34 -0.03 0.00 -2.10 0.00 0.00 70.33 67.86 1uol n THR 118 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uol s ALA 119 N -3.10 3.56 0.06 6.98 0.00 -1.26 -4.28 121.76 123.72 1uol s ALA 119 Ca 0.41 1.16 0.10 0.00 0.00 0.00 0.00 51.96 53.64 1uol s ALA 119 Cb 0.38 -3.51 0.56 0.00 0.00 0.00 0.00 23.12 20.55 1uol s ALA 119 CO -0.04 -0.60 1.18 1.63 0.00 0.00 0.00 175.76 177.93 1uol n LYS 120 N 2.80 0.07 0.00 0.00 5.02 -1.26 0.87 118.16 125.67 1uol n LYS 120 Ca 0.07 0.54 0.11 0.00 -2.02 0.00 0.00 58.31 57.02 1uol n LYS 120 Cb 0.42 -2.12 0.07 0.00 -0.02 0.00 0.00 35.03 33.38 1uol n LYS 120 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1uol n SER 121 N -1.97 1.30 -4.78 4.39 3.41 -1.26 -4.76 113.62 109.95 1uol n SER 121 Ca -0.01 -1.05 -0.41 0.00 -0.26 0.00 0.00 58.87 57.14 1uol n SER 121 Cb 0.40 0.54 -0.01 0.00 -0.26 0.00 0.00 64.21 64.88 1uol n SER 121 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1uol s VAL 122 N -2.72 2.19 -0.14 -3.33 0.11 0.25 -4.92 120.40 111.85 1uol s VAL 122 Ca 0.15 0.19 0.21 0.00 -2.93 0.00 0.00 61.98 59.61 1uol s VAL 122 Cb 0.18 -3.12 -0.17 0.00 -1.53 0.00 0.00 36.38 31.74 1uol s VAL 122 CO 0.67 0.05 0.73 0.35 -3.33 0.00 0.00 175.10 173.56 1uol n THR 123 N 0.56 0.55 -3.67 5.04 -2.24 -1.26 -4.41 114.28 108.85 1uol n THR 123 Ca 0.01 -0.58 -0.09 0.00 -2.27 0.00 0.00 64.05 61.12 1uol n THR 123 Cb 0.40 -0.29 -0.09 0.00 -2.10 0.00 0.00 70.33 68.25 1uol n THR 123 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uol s THR 125 N 1.35 0.00 -0.08 0.00 -1.32 -0.20 -4.73 115.64 110.67 1uol s THR 125 Ca -0.08 -0.02 -0.00 0.00 -1.21 0.00 0.00 61.69 60.38 1uol s THR 125 Cb -0.06 -0.61 -0.03 0.00 -1.51 0.00 0.00 72.50 70.29 1uol s THR 125 CO -0.14 -0.01 -0.06 -0.47 -2.21 0.00 0.00 174.62 171.73 1uol s TYR 126 N 0.16 2.97 -0.38 9.09 5.04 -1.26 -0.94 117.35 132.02 1uol s TYR 126 Ca -0.01 -0.01 -0.08 0.00 -2.44 0.00 0.00 57.07 54.54 1uol s TYR 126 Cb -0.03 -1.75 0.06 0.00 0.35 0.00 0.00 41.96 40.59 1uol s TYR 126 CO 0.01 0.30 0.19 0.45 -1.34 0.00 0.00 175.55 175.16 1uol s SER 127 N -0.66 5.49 0.33 4.32 0.15 -0.01 -4.91 113.70 118.42 1uol s SER 127 Ca 0.10 -1.37 0.05 0.00 0.70 0.00 0.00 55.95 55.43 1uol s SER 127 Cb -0.11 -1.93 0.60 0.00 -1.71 0.00 0.00 66.02 62.86 1uol s SER 127 CO 0.02 -0.45 1.85 -0.65 1.20 0.00 0.00 173.24 175.22 1uol h PRO 128 N 8.31 0.47 -0.16 5.44 0.11 -1.96 0.27 132.00 144.48 1uol h PRO 128 Ca -0.22 -0.11 -0.06 0.00 0.11 0.00 0.00 66.00 65.71 1uol h PRO 128 Cb 1.08 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 1uol h PRO 128 CO 0.69 0.55 -0.17 0.00 -0.21 0.00 0.00 178.00 178.85 1uol h ALA 129 N 1.49 1.43 -0.01 -0.75 0.00 -1.96 -2.93 119.26 116.53 1uol h ALA 129 Ca 0.09 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1uol h ALA 129 Cb 0.40 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1uol h ALA 129 CO 0.02 0.40 -0.62 1.28 0.00 0.00 0.00 179.25 180.33 1uol n LEU 130 N -4.23 1.24 -3.83 0.00 4.77 -1.04 -4.97 117.00 108.94 1uol n LEU 130 Ca -0.01 -0.62 -0.23 0.00 -0.03 0.00 0.00 56.01 55.12 1uol n LEU 130 Cb 0.30 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.40 1uol n LEU 130 CO 0.39 0.26 -0.14 -3.20 -1.33 0.00 0.00 177.39 173.36 1uol n ASN 131 N -0.82 -0.83 -3.87 -1.43 4.05 0.89 -4.80 115.26 108.45 1uol n ASN 131 Ca 0.05 -0.91 -0.17 0.00 0.45 0.00 0.00 54.58 54.00 1uol n ASN 131 Cb 0.32 -3.56 -0.16 0.00 1.23 0.00 0.00 39.78 37.61 1uol n ASN 131 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 177.26 173.46 1uol s LYS 132 N -6.27 0.44 -0.14 1.20 2.20 -0.77 -1.01 119.74 115.39 1uol s LYS 132 Ca 0.02 -0.03 -0.12 0.00 -0.36 0.00 0.00 55.97 55.48 1uol s LYS 132 Cb -0.01 -0.52 -0.05 0.00 -1.51 0.00 0.00 37.83 35.74 1uol s LYS 132 CO 0.85 -0.06 0.26 -1.17 -0.36 0.00 0.00 175.35 174.87 1uol s LEU 133 N 0.67 4.30 -0.17 5.43 2.96 0.13 -0.83 118.68 131.17 1uol s LEU 133 Ca -0.07 0.52 -0.01 0.00 -0.22 0.00 0.00 54.13 54.35 1uol s LEU 133 Cb -0.10 -2.31 -0.00 0.00 0.50 0.00 0.00 46.19 44.28 1uol s LEU 133 CO -0.01 0.20 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.73 1uol s PHE 134 N -0.04 2.82 0.10 5.38 0.40 -0.12 -0.85 117.98 125.68 1uol s PHE 134 Ca 0.16 -1.00 -0.07 0.00 -0.60 0.00 0.00 56.93 55.42 1uol s PHE 134 Cb -0.13 -1.93 -0.01 0.00 0.51 0.00 0.00 43.02 41.46 1uol s PHE 134 CO 0.04 -0.47 0.17 0.00 0.70 0.00 0.00 175.22 175.66 1uol s GLN 136 N -3.91 3.41 0.06 0.00 -0.21 -0.37 -0.35 119.66 118.28 1uol s GLN 136 Ca 0.09 0.12 -0.33 0.00 0.02 0.00 0.00 55.36 55.26 1uol s GLN 136 Cb 0.05 -2.37 -0.12 0.00 1.00 0.00 0.00 33.01 31.57 1uol s GLN 136 CO -0.08 -0.29 1.75 -0.11 -2.12 0.00 0.00 175.29 174.44 1uol n LEU 137 N -2.30 3.43 -1.22 2.90 7.94 -1.26 -2.68 117.00 123.80 1uol n LEU 137 Ca 0.01 1.02 -0.14 0.00 -1.11 0.00 0.00 56.01 55.79 1uol n LEU 137 Cb 0.56 -1.43 -0.06 0.00 0.53 0.00 0.00 43.42 43.02 1uol n LEU 137 CO 0.53 -0.10 -0.13 0.00 -1.11 0.00 0.00 177.39 176.57 1uol n ALA 138 N 5.11 -0.21 -2.39 1.96 0.00 0.20 -4.97 120.51 120.21 1uol n ALA 138 Ca 0.19 0.23 -0.27 0.00 0.00 0.00 0.00 53.44 53.59 1uol n ALA 138 Cb 0.31 -1.63 -0.01 0.00 0.00 0.00 0.00 19.45 18.12 1uol n ALA 138 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1uol s LYS 139 N -3.11 3.57 0.12 0.00 -0.14 -1.09 -4.84 119.74 114.24 1uol s LYS 139 Ca 0.00 0.08 -0.31 0.00 -1.36 0.00 0.00 55.97 54.38 1uol s LYS 139 Cb 0.00 -2.48 -0.09 0.00 -1.68 0.00 0.00 37.83 33.57 1uol s LYS 139 CO 0.00 -0.04 1.67 0.99 -0.76 0.00 0.00 175.35 177.21 1uol s THR 140 N -2.50 2.75 -0.37 2.17 2.01 -1.26 -4.42 115.64 114.02 1uol s THR 140 Ca 0.46 0.35 0.04 0.00 0.31 0.00 0.00 61.69 62.85 1uol s THR 140 Cb -0.10 -3.23 0.11 0.00 0.01 0.00 0.00 72.50 69.29 1uol s THR 140 CO 0.39 0.01 0.09 0.00 -0.69 0.00 0.00 174.62 174.42 1uol s PRO 142 N 0.74 4.36 -0.08 0.00 0.02 -1.26 -1.30 135.00 137.48 1uol s PRO 142 Ca 0.12 1.82 0.02 0.00 0.02 0.00 0.00 61.00 62.99 1uol s PRO 142 Cb -0.20 -3.45 0.01 0.00 0.02 0.00 0.00 34.50 30.88 1uol s PRO 142 CO -0.08 -0.41 -0.14 0.08 -0.33 0.00 0.00 177.00 176.13 1uol s VAL 143 N 1.72 1.30 0.14 3.83 1.01 -0.21 -4.61 120.40 123.57 1uol s VAL 143 Ca 0.60 -0.56 -0.09 0.00 0.00 0.00 0.00 61.98 61.92 1uol s VAL 143 Cb -0.29 -1.18 -0.06 0.00 0.00 0.00 0.00 36.38 34.84 1uol s VAL 143 CO 0.27 0.39 0.45 -1.10 0.00 0.00 0.00 175.10 175.11 1uol s GLN 144 N 0.74 3.77 -0.17 2.72 -0.21 0.41 -0.98 119.66 125.93 1uol s GLN 144 Ca -0.13 0.19 0.00 0.00 0.02 0.00 0.00 55.36 55.44 1uol s GLN 144 Cb -0.16 -2.88 0.01 0.00 1.00 0.00 0.00 33.01 30.98 1uol s GLN 144 CO 0.03 0.47 -0.16 -0.51 -2.12 0.00 0.00 175.29 173.00 1uol s LEU 145 N -2.28 2.37 -0.07 2.90 1.43 0.79 -1.27 118.68 122.57 1uol s LEU 145 Ca 0.39 -0.54 0.04 0.00 -1.03 0.00 0.00 54.13 52.99 1uol s LEU 145 Cb -0.13 -1.55 -0.02 0.00 0.03 0.00 0.00 46.19 44.53 1uol s LEU 145 CO 0.20 0.03 -0.20 0.26 0.23 0.00 0.00 176.35 176.88 1uol s TRP 146 N 1.11 2.57 0.02 0.29 0.52 0.05 -2.36 118.94 121.15 1uol s TRP 146 Ca 0.00 -0.53 0.02 0.00 0.02 0.00 0.00 56.10 55.61 1uol s TRP 146 Cb -0.14 -1.64 -0.02 0.00 -1.15 0.00 0.00 33.47 30.52 1uol s TRP 146 CO -0.06 -0.09 -0.07 0.14 0.02 0.00 0.00 176.95 176.89 1uol s VAL 147 N -0.26 0.51 0.15 4.03 -7.23 -1.26 -1.58 120.40 114.75 1uol s VAL 147 Ca 0.00 -0.72 -0.00 0.00 -1.81 0.00 0.00 61.98 59.45 1uol s VAL 147 Cb -0.13 -0.52 -0.17 0.00 0.56 0.00 0.00 36.38 36.13 1uol s VAL 147 CO 0.03 -0.16 1.34 0.44 -0.31 0.00 0.00 175.10 176.44 1uol h ASP 148 N 5.15 0.36 -4.20 4.85 3.32 -0.55 -3.45 116.42 121.89 1uol h ASP 148 Ca -0.33 -0.29 -0.26 0.00 0.02 0.00 0.00 57.03 56.17 1uol h ASP 148 Cb 1.20 -0.11 -0.26 0.00 0.22 0.00 0.00 39.33 40.38 1uol h ASP 148 CO 0.45 1.10 -0.73 -0.94 -1.72 0.00 0.00 179.24 177.40 1uol s SER 149 N -6.99 0.40 -0.01 6.45 1.04 -1.12 -5.04 113.70 108.43 1uol s SER 149 Ca -0.04 -0.22 -0.30 0.00 0.48 0.00 0.00 55.95 55.87 1uol s SER 149 Cb 0.09 0.00 -0.06 0.00 0.10 0.00 0.00 66.02 66.16 1uol s SER 149 CO 0.84 -0.07 1.61 -0.89 0.98 0.00 0.00 173.24 175.72 1uol s THR 150 N -0.56 3.46 0.88 2.02 2.01 -1.26 -4.79 115.64 117.41 1uol s THR 150 Ca -0.04 0.71 -0.11 0.00 0.31 0.00 0.00 61.69 62.56 1uol s THR 150 Cb -0.04 -3.46 0.12 0.00 0.01 0.00 0.00 72.50 69.13 1uol s THR 150 CO -0.00 -0.04 1.09 -2.84 -0.69 0.00 0.00 174.62 172.14 1uol s PRO 151 N 3.43 1.41 0.65 4.92 0.02 -1.26 -5.00 135.00 139.18 1uol s PRO 151 Ca 0.72 0.97 -0.16 0.00 0.02 0.00 0.00 61.00 62.55 1uol s PRO 151 Cb -0.35 -1.81 -0.00 0.00 0.02 0.00 0.00 34.50 32.36 1uol s PRO 151 CO 0.30 -2.18 1.16 -2.14 -0.33 0.00 0.00 177.00 173.81 1uol s PRO 152 N -4.88 2.70 0.35 5.54 0.02 -1.26 -4.93 135.00 132.54 1uol s PRO 152 Ca 0.63 1.61 -0.28 0.00 0.02 0.00 0.00 61.00 62.98 1uol s PRO 152 Cb -0.18 -1.92 -0.11 0.00 0.02 0.00 0.00 34.50 32.31 1uol s PRO 152 CO 0.57 -1.37 1.43 -2.14 -0.33 0.00 0.00 177.00 175.16 1uol s PRO 153 N -3.79 4.20 0.00 5.54 0.02 -1.26 -1.71 135.00 138.00 1uol s PRO 153 Ca 0.72 2.44 0.00 0.00 0.02 0.00 0.00 61.00 64.18 1uol s PRO 153 Cb -0.25 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.25 1uol s PRO 153 CO 0.39 -0.42 0.00 0.41 -0.33 0.00 0.00 177.00 177.05 1uol n GLY 154 N 0.75 2.47 3.76 0.52 0.00 -1.26 -4.95 105.19 106.48 1uol n GLY 154 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 1uol n GLY 154 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uol s THR 155 N -2.49 2.39 0.30 2.61 2.01 -0.69 -3.50 115.64 116.26 1uol s THR 155 Ca 0.00 0.32 0.06 0.00 0.31 0.00 0.00 61.69 62.38 1uol s THR 155 Cb 0.00 -3.18 -0.06 0.00 0.01 0.00 0.00 72.50 69.27 1uol s THR 155 CO 0.00 0.03 -0.03 -0.13 -0.69 0.00 0.00 174.62 173.80 1uol s ARG 156 N -2.56 1.61 -0.14 4.92 0.52 0.45 -0.77 118.95 122.98 1uol s ARG 156 Ca 0.63 -1.84 -0.01 0.00 -0.52 0.00 0.00 55.73 53.99 1uol s ARG 156 Cb -0.39 -1.13 0.03 0.00 0.52 0.00 0.00 34.95 33.99 1uol s ARG 156 CO 0.48 -0.02 -0.06 0.08 0.02 0.00 0.00 175.30 175.80 1uol s VAL 157 N -3.05 1.05 -0.01 3.52 1.01 0.44 -1.21 120.40 122.15 1uol s VAL 157 Ca 0.32 -0.45 0.03 0.00 0.00 0.00 0.00 61.98 61.88 1uol s VAL 157 Cb 0.05 -1.16 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 1uol s VAL 157 CO 0.13 0.24 -0.09 -0.60 0.00 0.00 0.00 175.10 174.78 1uol s ARG 158 N 1.68 2.51 -0.06 2.72 3.52 -0.14 -1.56 118.95 127.61 1uol s ARG 158 Ca 0.03 -0.73 0.06 0.00 -0.13 0.00 0.00 55.73 54.95 1uol s ARG 158 Cb -0.14 -2.45 -0.01 0.00 -1.56 0.00 0.00 34.95 30.79 1uol s ARG 158 CO -0.08 0.60 -0.24 0.00 -0.81 0.00 0.00 175.30 174.77 1uol s ALA 159 N -0.93 2.19 -0.03 6.12 0.00 -0.07 -0.91 121.76 128.14 1uol s ALA 159 Ca 0.15 -1.03 -0.05 0.00 0.00 0.00 0.00 51.96 51.03 1uol s ALA 159 Cb -0.11 -0.71 0.01 0.00 0.00 0.00 0.00 23.12 22.31 1uol s ALA 159 CO 0.05 0.40 0.13 1.41 0.00 0.00 0.00 175.76 177.75 1uol s MET 160 N -0.10 0.27 -0.02 0.00 0.00 -0.57 -2.08 119.30 116.81 1uol s MET 160 Ca -0.05 -0.03 0.01 0.00 0.00 0.00 0.00 55.69 55.61 1uol s MET 160 Cb -0.14 0.12 -0.04 0.00 0.00 0.00 0.00 34.83 34.77 1uol s MET 160 CO 0.04 -0.05 -0.00 0.00 0.00 0.00 0.00 175.02 175.01 1uol s ALA 161 N -0.47 3.26 0.03 4.11 0.00 -1.26 0.14 121.76 127.58 1uol s ALA 161 Ca -0.05 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 50.96 1uol s ALA 161 Cb -0.04 -1.35 -0.03 0.00 0.00 0.00 0.00 23.12 21.71 1uol s ALA 161 CO 0.01 0.63 -0.02 0.96 0.00 0.00 0.00 175.76 177.34 1uol s ILE 162 N -1.04 0.15 0.31 0.00 -4.36 -0.67 -4.45 121.20 111.14 1uol s ILE 162 Ca 0.18 -1.24 -0.29 0.00 -0.26 0.00 0.00 60.65 59.04 1uol s ILE 162 Cb -0.11 -0.77 -0.09 0.00 1.25 0.00 0.00 42.46 42.73 1uol s ILE 162 CO 0.09 -0.69 1.12 -0.31 0.24 0.00 0.00 174.94 175.39 1uol s TYR 163 N -2.44 3.46 0.10 1.37 2.02 -1.26 -0.89 117.35 119.71 1uol s TYR 163 Ca -0.07 1.66 -0.14 0.00 -0.37 0.00 0.00 57.07 58.15 1uol s TYR 163 Cb -0.03 -3.32 -0.13 0.00 -0.40 0.00 0.00 41.96 38.08 1uol s TYR 163 CO -0.04 -0.74 1.34 -0.22 -1.57 0.00 0.00 175.55 174.31 1uol h LYS 164 N 3.55 0.77 -6.72 -0.62 3.64 -1.63 -3.37 116.57 112.19 1uol h LYS 164 Ca -0.47 -0.55 -0.52 0.00 -1.27 0.00 0.00 60.65 57.84 1uol h LYS 164 Cb 1.22 0.09 0.02 0.00 -0.41 0.00 0.00 32.23 33.15 1uol h LYS 164 CO 0.66 1.17 0.54 -0.65 -2.27 0.00 0.00 179.45 178.90 1uol s GLN 165 N -3.93 4.52 0.31 1.90 -0.21 -1.26 -4.89 119.66 116.10 1uol s GLN 165 Ca -0.11 1.88 0.06 0.00 0.02 0.00 0.00 55.36 57.21 1uol s GLN 165 Cb 0.08 -3.22 0.72 0.00 1.00 0.00 0.00 33.01 31.60 1uol s GLN 165 CO 0.88 -0.02 1.80 0.66 -2.12 0.00 0.00 175.29 176.50 1uol h SER 166 N 4.75 0.79 0.76 5.90 4.64 -2.00 0.06 113.55 128.44 1uol h SER 166 Ca -0.45 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1uol h SER 166 Cb 1.21 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1uol h SER 166 CO 0.72 0.33 0.00 0.00 -0.87 0.00 0.00 176.83 177.01 1uol n GLN 167 N -4.69 0.14 -0.00 4.77 0.00 -1.26 -3.35 117.38 112.99 1uol n GLN 167 Ca 0.22 0.33 0.03 0.00 0.00 0.00 0.00 57.00 57.57 1uol n GLN 167 Cb 0.52 -1.74 -0.04 0.00 0.00 0.00 0.00 30.24 28.98 1uol n GLN 167 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1uol n HIS 168 N -1.99 0.00 -0.06 2.61 8.25 -0.26 -4.76 115.22 119.00 1uol n HIS 168 Ca 0.03 0.00 0.24 0.00 -0.26 0.00 0.00 57.72 57.74 1uol n HIS 168 Cb 0.24 -0.06 0.72 0.00 1.12 0.00 0.00 29.99 32.01 1uol n HIS 168 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1uol h MET 169 N 0.00 0.00 -0.00 -0.41 -0.00 -1.06 0.90 114.93 114.35 1uol h MET 169 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1uol h MET 169 Cb 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.79 1uol h MET 169 CO 0.00 0.00 -0.03 0.25 -0.00 0.00 0.00 176.91 177.13 1uol n THR 170 N -4.08 0.00 -3.20 -0.10 -2.24 -1.26 -4.58 114.28 98.82 1uol n THR 170 Ca 0.13 -0.01 -0.39 0.00 -2.27 0.00 0.00 64.05 61.52 1uol n THR 170 Cb 0.81 -0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 68.55 1uol n THR 170 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1uol s GLU 171 N -2.67 4.32 0.20 -0.78 2.12 0.31 -4.98 118.70 117.21 1uol s GLU 171 Ca 0.25 0.59 -0.32 0.00 0.36 0.00 0.00 54.97 55.85 1uol s GLU 171 Cb 0.20 -3.49 -0.12 0.00 0.26 0.00 0.00 34.13 30.99 1uol s GLU 171 CO 0.49 0.01 1.71 0.08 -0.54 0.00 0.00 175.26 177.00 1uol s VAL 172 N 1.08 2.13 -0.12 3.70 1.01 -1.26 -4.57 120.40 122.38 1uol s VAL 172 Ca 0.29 0.08 -0.30 0.00 0.00 0.00 0.00 61.98 62.05 1uol s VAL 172 Cb -0.16 -3.05 -0.01 0.00 0.00 0.00 0.00 36.38 33.16 1uol s VAL 172 CO 0.12 0.01 1.06 -0.69 0.00 0.00 0.00 175.10 175.60 1uol s VAL 173 N 1.26 4.64 0.22 2.92 1.01 -1.26 -5.00 120.40 124.17 1uol s VAL 173 Ca 0.74 1.93 -0.07 0.00 0.00 0.00 0.00 61.98 64.58 1uol s VAL 173 Cb -0.49 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 31.63 1uol s VAL 173 CO 0.32 -0.03 0.29 0.00 0.00 0.00 0.00 175.10 175.68 1uol s ARG 174 N 2.30 1.34 0.52 2.72 1.70 -1.26 -4.75 118.95 121.51 1uol s ARG 174 Ca 0.49 -1.43 -0.19 0.00 -0.47 0.00 0.00 55.73 54.13 1uol s ARG 174 Cb -0.19 0.36 -0.07 0.00 -0.57 0.00 0.00 34.95 34.48 1uol s ARG 174 CO 0.17 -0.50 1.07 1.03 -1.08 0.00 0.00 175.30 175.99 1uol s ARG 175 N -4.08 3.60 0.99 3.89 0.52 -0.64 -4.37 118.95 118.85 1uol s ARG 175 Ca 0.30 1.41 -0.12 0.00 -0.52 0.00 0.00 55.73 56.80 1uol s ARG 175 Cb 0.03 -2.06 0.18 0.00 0.52 0.00 0.00 34.95 33.63 1uol s ARG 175 CO 0.09 -0.61 1.08 0.00 0.02 0.00 0.00 175.30 175.89 1uol h PRO 177 N -1.93 0.00 0.00 0.00 0.11 -1.79 -1.65 132.00 126.73 1uol h PRO 177 Ca -0.53 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.53 1uol h PRO 177 Cb 1.30 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 1uol h PRO 177 CO 0.53 0.00 -0.31 1.25 -0.21 0.00 0.00 178.00 179.26 1uol h HIS 178 N 0.00 0.00 -0.00 0.65 -0.00 -1.91 -3.37 115.15 110.52 1uol h HIS 178 Ca 0.20 0.00 -0.09 0.00 -0.00 0.00 0.00 60.37 60.48 1uol h HIS 178 Cb 0.97 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.36 1uol h HIS 178 CO 0.00 0.76 -0.40 0.45 -0.00 0.00 0.00 177.93 178.73 1uol h HIS 179 N -1.00 0.01 0.00 5.26 3.86 -1.86 -2.43 115.15 118.99 1uol h HIS 179 Ca -0.07 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.14 1uol h HIS 179 Cb 0.77 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.24 1uol h HIS 179 CO 0.13 0.41 0.00 -0.85 0.86 0.00 0.00 177.93 178.47 1uol n GLU 180 N -4.06 0.16 -0.15 2.45 0.28 -0.64 -2.54 120.64 116.13 1uol n GLU 180 Ca -0.02 0.44 0.05 0.00 -0.16 0.00 0.00 57.16 57.47 1uol n GLU 180 Cb 0.43 -1.84 0.12 0.00 1.43 0.00 0.00 31.44 31.59 1uol n GLU 180 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1uol n ARG 181 N -2.15 2.85 -0.34 3.44 1.74 -0.93 -4.65 116.66 116.62 1uol n ARG 181 Ca 0.02 -2.01 0.05 0.00 -0.77 0.00 0.00 57.85 55.13 1uol n ARG 181 Cb 0.19 -1.27 0.19 0.00 -1.02 0.00 0.00 32.46 30.55 1uol n ARG 181 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1uol n SER 183 N 0.47 -0.60 -1.08 0.00 2.88 -1.26 -4.89 113.62 109.14 1uol n SER 183 Ca 0.14 -1.03 -0.01 0.00 -1.33 0.00 0.00 58.87 56.64 1uol n SER 183 Cb 0.54 -2.88 0.21 0.00 -0.75 0.00 0.00 64.21 61.34 1uol n SER 183 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1uol n ASP 184 N -2.93 2.90 -4.73 -3.46 5.68 -1.26 -5.03 116.55 107.72 1uol n ASP 184 Ca -0.26 -3.54 -0.31 0.00 -0.50 0.00 0.00 54.79 50.18 1uol n ASP 184 Cb 0.66 -0.61 0.12 0.00 -1.14 0.00 0.00 41.12 40.15 1uol n ASP 184 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 1uol s SER 185 N -2.35 3.85 -0.06 -1.12 0.15 -1.26 -4.94 113.70 107.97 1uol s SER 185 Ca 0.44 1.90 0.13 0.00 0.70 0.00 0.00 55.95 59.11 1uol s SER 185 Cb 0.39 -2.50 0.40 0.00 -1.71 0.00 0.00 66.02 62.59 1uol s SER 185 CO 0.03 -2.47 1.33 -0.90 1.20 0.00 0.00 173.24 172.43 1uol n ASP 186 N -3.80 3.31 0.00 5.45 5.75 -1.26 -4.94 116.55 121.06 1uol n ASP 186 Ca 0.10 -2.34 0.00 0.00 -0.01 0.00 0.00 54.79 52.54 1uol n ASP 186 Cb 0.53 -0.35 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 1uol n ASP 186 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1uol n GLY 187 N 0.23 3.12 0.31 6.12 0.00 -1.26 -4.80 105.19 108.91 1uol n GLY 187 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 1uol n GLY 187 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uol n LEU 188 N 0.00 1.59 -4.69 0.99 4.32 -1.26 -4.99 117.00 112.97 1uol n LEU 188 Ca 0.00 0.27 -0.42 0.00 -0.02 0.00 0.00 56.01 55.84 1uol n LEU 188 Cb 0.00 -0.66 -0.03 0.00 -1.62 0.00 0.00 43.42 41.12 1uol n LEU 188 CO 0.00 0.35 0.98 0.00 -1.22 0.00 0.00 177.39 177.50 1uol s ALA 189 N -2.45 3.50 0.47 -1.18 0.00 -1.26 -4.79 121.76 116.05 1uol s ALA 189 Ca -0.30 0.71 -0.24 0.00 0.00 0.00 0.00 51.96 52.13 1uol s ALA 189 Cb 0.11 -3.52 -0.07 0.00 0.00 0.00 0.00 23.12 19.63 1uol s ALA 189 CO 0.38 -0.75 1.32 -2.14 0.00 0.00 0.00 175.76 174.57 1uol s PRO 190 N 2.10 3.62 0.39 0.00 0.02 -1.26 -4.48 135.00 135.38 1uol s PRO 190 Ca 0.58 2.16 0.27 0.00 0.02 0.00 0.00 61.00 64.03 1uol s PRO 190 Cb -0.27 -2.52 1.39 0.00 0.02 0.00 0.00 34.50 33.13 1uol s PRO 190 CO 0.24 -0.78 1.82 -1.00 -0.33 0.00 0.00 177.00 176.94 1uol h PRO 191 N 2.11 0.00 0.00 5.54 0.13 -1.95 -2.37 132.00 135.47 1uol h PRO 191 Ca -0.50 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.60 1uol h PRO 191 Cb 1.27 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.39 1uol h PRO 191 CO 0.60 0.00 -0.29 1.96 -0.23 0.00 0.00 178.00 180.04 1uol h GLN 192 N 0.00 0.00 -6.39 0.86 7.50 -1.89 -3.37 115.11 111.81 1uol h GLN 192 Ca 0.00 0.00 -0.54 0.00 0.50 0.00 0.00 58.65 58.61 1uol h GLN 192 Cb 0.08 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.61 1uol h GLN 192 CO 0.00 0.11 0.73 -1.01 -1.50 0.00 0.00 178.83 177.16 1uol s HIS 193 N -3.17 3.11 0.01 2.96 3.76 -0.89 -1.62 115.29 119.44 1uol s HIS 193 Ca 0.05 1.05 -0.25 0.00 -0.15 0.00 0.00 55.06 55.76 1uol s HIS 193 Cb 0.06 -3.54 -0.18 0.00 1.11 0.00 0.00 32.58 30.02 1uol s HIS 193 CO 0.71 -1.86 1.39 1.25 -0.85 0.00 0.00 174.74 175.37 1uol h LEU 194 N 7.84 0.03 -9.24 0.89 5.85 -1.89 -3.44 115.31 115.35 1uol h LEU 194 Ca -0.38 -0.37 -0.59 0.00 0.84 0.00 0.00 57.88 57.38 1uol h LEU 194 Cb 1.18 -0.01 -0.10 0.00 0.37 0.00 0.00 40.66 42.10 1uol h LEU 194 CO 0.87 0.39 -0.26 -0.63 -0.34 0.00 0.00 178.44 178.48 1uol s ILE 195 N -4.73 5.25 0.17 4.05 1.01 -1.26 -0.86 121.20 124.83 1uol s ILE 195 Ca -0.15 0.66 0.10 0.00 0.00 0.00 0.00 60.65 61.25 1uol s ILE 195 Cb 0.03 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 1uol s ILE 195 CO 0.68 0.33 -0.21 -0.13 0.00 0.00 0.00 174.94 175.60 1uol s ARG 196 N 0.82 1.35 -0.16 2.79 0.52 -0.51 -4.71 118.95 119.04 1uol s ARG 196 Ca 0.19 -1.42 -0.07 0.00 -0.52 0.00 0.00 55.73 53.91 1uol s ARG 196 Cb -0.14 -1.54 -0.04 0.00 0.52 0.00 0.00 34.95 33.75 1uol s ARG 196 CO 0.06 0.33 0.07 0.08 0.02 0.00 0.00 175.30 175.86 1uol s VAL 197 N -1.78 4.85 -0.08 3.52 1.01 -1.26 -0.86 120.40 125.81 1uol s VAL 197 Ca 0.16 -0.02 -0.12 0.00 0.00 0.00 0.00 61.98 62.00 1uol s VAL 197 Cb -0.07 -3.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.10 1uol s VAL 197 CO 0.07 0.50 0.30 -0.70 0.00 0.00 0.00 175.10 175.28 1uol s GLU 198 N -0.00 3.87 -1.26 2.72 2.12 0.61 -4.59 118.70 122.17 1uol s GLU 198 Ca 0.06 0.18 -0.06 0.00 0.36 0.00 0.00 54.97 55.51 1uol s GLU 198 Cb -0.12 -3.27 0.01 0.00 0.26 0.00 0.00 34.13 31.01 1uol s GLU 198 CO 0.01 0.60 1.09 0.41 -0.54 0.00 0.00 175.26 176.82 1uol n GLY 199 N 2.27 -0.44 2.75 -1.50 0.00 -1.26 -4.53 105.19 102.48 1uol n GLY 199 Ca -0.15 0.18 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 1uol n GLY 199 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1uol s ASN 200 N -3.62 1.71 0.00 1.61 3.84 -1.26 -5.01 114.94 112.21 1uol s ASN 200 Ca 0.39 -0.70 0.10 0.00 0.21 0.00 0.00 52.86 52.86 1uol s ASN 200 Cb -0.17 0.47 0.48 0.00 -0.55 0.00 0.00 41.25 41.47 1uol s ASN 200 CO 0.70 -0.38 1.25 0.18 -2.79 0.00 0.00 177.10 176.06 1uol n LEU 201 N 5.31 0.00 -1.18 3.21 4.77 -1.26 -1.74 117.00 126.11 1uol n LEU 201 Ca -0.03 0.36 0.11 0.00 -0.03 0.00 0.00 56.01 56.42 1uol n LEU 201 Cb 0.47 -0.36 0.28 0.00 -2.33 0.00 0.00 43.42 41.48 1uol n LEU 201 CO 0.02 -0.24 0.74 0.54 -1.33 0.00 0.00 177.39 177.12 1uol n ARG 202 N -1.36 2.49 -2.16 3.23 1.74 -1.26 -4.94 116.66 114.39 1uol n ARG 202 Ca 0.04 -2.31 -0.41 0.00 -0.77 0.00 0.00 57.85 54.40 1uol n ARG 202 Cb 0.09 -1.51 -0.03 0.00 -1.02 0.00 0.00 32.46 30.00 1uol n ARG 202 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1uol s ALA 203 N -1.21 3.53 -0.02 7.54 0.00 -0.71 -4.59 121.76 126.30 1uol s ALA 203 Ca 0.43 1.18 0.07 0.00 0.00 0.00 0.00 51.96 53.64 1uol s ALA 203 Cb 0.23 -3.48 -0.02 0.00 0.00 0.00 0.00 23.12 19.85 1uol s ALA 203 CO 0.30 -0.58 -0.23 -1.21 0.00 0.00 0.00 175.76 174.04 1uol s GLU 204 N -0.80 1.90 -0.19 0.00 2.02 -0.06 -4.97 118.70 116.61 1uol s GLU 204 Ca 0.54 -0.81 -0.03 0.00 0.02 0.00 0.00 54.97 54.68 1uol s GLU 204 Cb -0.38 -1.81 -0.01 0.00 0.10 0.00 0.00 34.13 32.02 1uol s GLU 204 CO 0.44 0.47 -0.06 0.71 0.02 0.00 0.00 175.26 176.85 1uol s TYR 205 N -0.48 2.95 -0.09 1.61 1.51 -1.26 -0.83 117.35 120.75 1uol s TYR 205 Ca 0.07 -0.71 -0.01 0.00 -1.01 0.00 0.00 57.07 55.42 1uol s TYR 205 Cb -0.09 -2.02 -0.03 0.00 -0.11 0.00 0.00 41.96 39.71 1uol s TYR 205 CO -0.00 -0.35 -0.05 -1.17 -1.11 0.00 0.00 175.55 172.86 1uol s LEU 206 N 0.99 3.23 -0.35 -1.29 2.96 -0.05 -4.99 118.68 119.18 1uol s LEU 206 Ca -0.00 -0.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.88 1uol s LEU 206 Cb -0.15 -1.73 0.09 0.00 0.50 0.00 0.00 46.19 44.91 1uol s LEU 206 CO 0.00 0.31 0.09 -1.81 -1.32 0.00 0.00 176.35 173.62 1uol s ASP 207 N -0.50 4.95 -0.09 3.68 1.11 -1.26 -2.01 116.67 122.55 1uol s ASP 207 Ca 0.08 -1.87 -0.30 0.00 0.18 0.00 0.00 52.55 50.63 1uol s ASP 207 Cb -0.12 -1.72 -0.08 0.00 1.07 0.00 0.00 42.92 42.07 1uol s ASP 207 CO 0.02 -0.40 2.06 -0.67 1.18 0.00 0.00 175.17 177.36 1uol n ASP 208 N 4.47 3.62 0.22 0.27 -0.08 -0.35 -4.84 116.55 119.87 1uol n ASP 208 Ca -0.03 0.65 0.15 0.00 -1.51 0.00 0.00 54.79 54.04 1uol n ASP 208 Cb 0.42 -1.49 0.77 0.00 2.34 0.00 0.00 41.12 43.16 1uol n ASP 208 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 1uol h ARG 209 N 12.00 0.00 0.00 -0.67 0.11 -1.96 0.32 114.38 124.18 1uol h ARG 209 Ca -0.45 0.00 -0.23 0.00 0.10 0.00 0.00 59.98 59.39 1uol h ARG 209 Cb 1.25 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.30 1uol h ARG 209 CO 0.95 0.00 -1.70 0.09 0.10 0.00 0.00 179.97 179.41 1uol n ASN 210 N -2.53 1.69 0.13 0.08 5.03 -1.26 -4.71 115.26 113.69 1uol n ASN 210 Ca -0.02 0.29 0.12 0.00 0.87 0.00 0.00 54.58 55.84 1uol n ASN 210 Cb 0.07 -0.67 0.11 0.00 -1.02 0.00 0.00 39.78 38.27 1uol n ASN 210 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.26 176.14 1uol h THR 211 N -0.83 0.00 0.00 3.41 1.35 -1.97 -3.48 112.91 111.40 1uol h THR 211 Ca -0.35 -0.86 0.00 0.00 -0.55 0.00 0.00 66.41 64.65 1uol h THR 211 Cb 1.24 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 69.21 1uol h THR 211 CO -0.21 0.00 0.00 0.49 -0.25 0.00 0.00 175.52 175.55 1uol n PHE 212 N -2.65 0.00 -2.26 4.73 3.72 0.11 -4.83 117.46 116.29 1uol n PHE 212 Ca 0.02 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.09 1uol n PHE 212 Cb 0.51 -0.87 -0.01 0.00 -0.94 0.00 0.00 39.48 38.18 1uol n PHE 212 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1uol s ARG 213 N -0.82 3.47 0.04 -1.08 1.81 -1.26 -4.62 118.95 116.49 1uol s ARG 213 Ca 0.00 1.35 0.01 0.00 -1.72 0.00 0.00 55.73 55.37 1uol s ARG 213 Cb 0.00 -2.05 -0.04 0.00 -0.45 0.00 0.00 34.95 32.42 1uol s ARG 213 CO 0.00 -0.70 0.09 -1.01 -0.68 0.00 0.00 175.30 173.00 1uol s HIS 214 N -2.14 3.27 0.14 -0.53 3.76 -1.26 -1.21 115.29 117.32 1uol s HIS 214 Ca 0.67 0.16 -0.21 0.00 -0.15 0.00 0.00 55.06 55.52 1uol s HIS 214 Cb -0.18 -1.69 0.06 0.00 1.11 0.00 0.00 32.58 31.88 1uol s HIS 214 CO 0.29 0.54 0.54 -1.54 -0.85 0.00 0.00 174.74 173.72 1uol s SER 215 N -2.09 -0.47 -0.05 1.40 1.04 -0.85 -4.46 113.70 108.21 1uol s SER 215 Ca 0.27 -0.05 0.03 0.00 0.48 0.00 0.00 55.95 56.68 1uol s SER 215 Cb -0.12 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.56 1uol s SER 215 CO 0.19 -0.91 -0.14 0.54 0.98 0.00 0.00 173.24 173.90 1uol s VAL 216 N -3.59 1.24 0.02 5.02 0.11 -0.88 -0.87 120.40 121.45 1uol s VAL 216 Ca 0.01 -0.58 0.04 0.00 -2.93 0.00 0.00 61.98 58.52 1uol s VAL 216 Cb -0.00 -1.10 -0.02 0.00 -1.53 0.00 0.00 36.38 33.74 1uol s VAL 216 CO -0.11 0.37 -0.13 0.54 -3.33 0.00 0.00 175.10 172.44 1uol s VAL 217 N 0.31 1.04 0.13 2.04 0.11 -0.01 -0.89 120.40 123.13 1uol s VAL 217 Ca -0.08 -0.83 0.03 0.00 -2.93 0.00 0.00 61.98 58.17 1uol s VAL 217 Cb -0.13 -0.92 -0.04 0.00 -1.53 0.00 0.00 36.38 33.75 1uol s VAL 217 CO 0.03 0.09 -0.06 0.68 -3.33 0.00 0.00 175.10 172.51 1uol s VAL 218 N -0.66 0.83 0.33 2.04 -7.23 -0.60 -0.88 120.40 114.23 1uol s VAL 218 Ca 0.02 -1.98 -0.28 0.00 -1.81 0.00 0.00 61.98 57.93 1uol s VAL 218 Cb -0.07 -1.83 -0.10 0.00 0.56 0.00 0.00 36.38 34.94 1uol s VAL 218 CO 0.01 -0.74 1.22 -2.84 -0.31 0.00 0.00 175.10 172.43 1uol s PRO 219 N -3.83 4.36 0.11 4.82 0.02 -1.26 -0.42 135.00 138.80 1uol s PRO 219 Ca 0.16 2.02 -0.30 0.00 0.02 0.00 0.00 61.00 62.90 1uol s PRO 219 Cb 0.05 -3.01 -0.06 0.00 0.02 0.00 0.00 34.50 31.50 1uol s PRO 219 CO -0.01 -0.11 1.01 -0.47 -0.33 0.00 0.00 177.00 177.08 1uol s TYR 220 N -1.21 3.72 -0.06 6.54 5.04 0.05 -4.76 117.35 126.68 1uol s TYR 220 Ca 0.50 1.71 0.05 0.00 -2.44 0.00 0.00 57.07 56.89 1uol s TYR 220 Cb -0.36 -3.13 -0.00 0.00 0.35 0.00 0.00 41.96 38.82 1uol s TYR 220 CO 0.46 -0.09 -0.21 -1.21 -1.34 0.00 0.00 175.55 173.16 1uol s GLU 221 N 0.14 2.35 0.92 4.97 0.41 -1.26 -4.79 118.70 121.45 1uol s GLU 221 Ca 0.49 -0.77 -0.10 0.00 -0.41 0.00 0.00 54.97 54.18 1uol s GLU 221 Cb -0.25 -1.94 0.15 0.00 -1.78 0.00 0.00 34.13 30.31 1uol s GLU 221 CO 0.31 0.26 1.14 -2.14 -0.49 0.00 0.00 175.26 174.34 1uol s PRO 222 N 0.09 0.96 0.45 0.39 0.02 -1.26 -4.74 135.00 130.90 1uol s PRO 222 Ca -0.08 1.51 -0.25 0.00 0.02 0.00 0.00 61.00 62.20 1uol s PRO 222 Cb -0.14 -1.72 -0.09 0.00 0.02 0.00 0.00 34.50 32.57 1uol s PRO 222 CO 0.04 -2.66 1.39 -2.30 -0.33 0.00 0.00 177.00 173.15 1uol n PRO 223 N -4.25 2.16 -1.54 5.54 -0.02 -1.26 -4.89 135.00 130.74 1uol n PRO 223 Ca 0.11 0.77 -0.32 0.00 -2.02 0.00 0.00 63.50 62.04 1uol n PRO 223 Cb 0.52 -2.57 0.07 0.00 -0.02 0.00 0.00 33.50 31.50 1uol n PRO 223 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1uol s GLU 224 N -2.41 2.57 0.19 -0.52 2.02 -1.26 -4.88 118.70 114.41 1uol s GLU 224 Ca 0.61 1.29 -0.33 0.00 0.02 0.00 0.00 54.97 56.56 1uol s GLU 224 Cb -0.46 -1.93 -0.13 0.00 0.10 0.00 0.00 34.13 31.71 1uol s GLU 224 CO 0.57 -1.42 1.69 0.28 0.02 0.00 0.00 175.26 176.40 1uol n VAL 225 N -2.91 0.02 -0.19 2.63 0.31 -1.26 -1.23 118.33 115.70 1uol n VAL 225 Ca 0.10 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.42 1uol n VAL 225 Cb 0.52 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 31.59 1uol n VAL 225 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1uol n GLY 226 N 3.82 0.84 3.04 2.92 0.00 -1.26 -5.07 105.19 109.49 1uol n GLY 226 Ca 0.16 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 1uol n GLY 226 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uol s SER 227 N -2.20 0.45 0.00 1.61 0.15 -0.36 -5.06 113.70 108.28 1uol s SER 227 Ca 0.00 -0.73 0.13 0.00 0.70 0.00 0.00 55.95 56.06 1uol s SER 227 Cb 0.00 0.13 0.06 0.00 -1.71 0.00 0.00 66.02 64.50 1uol s SER 227 CO 0.00 -0.41 0.84 0.47 1.20 0.00 0.00 173.24 175.34 1uol n ASP 228 N 0.92 1.81 -4.03 5.45 8.00 -1.26 -4.55 116.55 122.88 1uol n ASP 228 Ca -0.19 -1.40 -0.11 0.00 0.71 0.00 0.00 54.79 53.79 1uol n ASP 228 Cb 0.58 0.22 -0.08 0.00 -0.02 0.00 0.00 41.12 41.82 1uol n ASP 228 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1uol s THR 230 N -4.01 4.15 -0.08 0.00 2.01 -0.99 -4.50 115.64 112.23 1uol s THR 230 Ca 0.32 -0.30 0.04 0.00 0.31 0.00 0.00 61.69 62.05 1uol s THR 230 Cb 0.03 -2.75 -0.01 0.00 0.01 0.00 0.00 72.50 69.78 1uol s THR 230 CO 0.12 0.59 -0.20 -0.89 -0.69 0.00 0.00 174.62 173.54 1uol s THR 231 N -0.71 2.45 -0.04 -0.82 2.01 -1.26 -0.15 115.64 117.13 1uol s THR 231 Ca 0.11 -0.91 0.05 0.00 0.31 0.00 0.00 61.69 61.25 1uol s THR 231 Cb -0.12 -1.95 -0.02 0.00 0.01 0.00 0.00 72.50 70.42 1uol s THR 231 CO 0.02 0.56 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.71 1uol s ILE 232 N -0.05 2.84 -0.27 1.82 1.01 -0.15 -4.95 121.20 121.45 1uol s ILE 232 Ca -0.05 -0.81 -0.09 0.00 0.00 0.00 0.00 60.65 59.70 1uol s ILE 232 Cb -0.14 -2.09 -0.03 0.00 0.01 0.00 0.00 42.46 40.21 1uol s ILE 232 CO 0.05 0.59 0.11 -1.00 0.00 0.00 0.00 174.94 174.68 1uol s HIS 233 N -0.71 3.13 0.17 3.97 3.76 -1.26 -1.05 115.29 123.30 1uol s HIS 233 Ca 0.11 -0.37 0.06 0.00 -0.15 0.00 0.00 55.06 54.72 1uol s HIS 233 Cb -0.10 -2.29 -0.04 0.00 1.11 0.00 0.00 32.58 31.25 1uol s HIS 233 CO 0.00 -0.35 0.04 0.71 -0.85 0.00 0.00 174.74 174.30 1uol s TYR 234 N 1.64 2.95 -0.03 1.40 2.02 -0.42 -0.28 117.35 124.63 1uol s TYR 234 Ca 0.06 -0.09 0.03 0.00 -0.37 0.00 0.00 57.07 56.69 1uol s TYR 234 Cb -0.16 -1.43 0.00 0.00 -0.40 0.00 0.00 41.96 39.98 1uol s TYR 234 CO 0.06 0.52 -0.10 -0.80 -1.57 0.00 0.00 175.55 173.65 1uol s ASN 235 N -2.97 1.35 -0.23 2.29 0.01 -0.04 -0.51 114.94 114.85 1uol s ASN 235 Ca 0.28 -0.21 -0.07 0.00 -0.71 0.00 0.00 52.86 52.15 1uol s ASN 235 Cb -0.10 -0.39 -0.03 0.00 0.41 0.00 0.00 41.25 41.14 1uol s ASN 235 CO 0.20 0.07 0.07 -0.31 -1.51 0.00 0.00 177.10 175.61 1uol s TYR 236 N 0.24 3.13 -1.55 2.20 1.51 -1.26 -1.43 117.35 120.19 1uol s TYR 236 Ca -0.04 -0.26 0.13 0.00 -1.01 0.00 0.00 57.07 55.89 1uol s TYR 236 Cb -0.10 -2.18 0.46 0.00 -0.11 0.00 0.00 41.96 40.03 1uol s TYR 236 CO 0.01 -0.20 1.34 -1.33 -1.11 0.00 0.00 175.55 174.27 1uol n MET 237 N 4.48 2.55 -3.83 -0.62 2.81 -0.04 -0.63 117.12 121.83 1uol n MET 237 Ca -0.16 -1.83 -0.12 0.00 -1.81 0.00 0.00 57.70 53.78 1uol n MET 237 Cb 0.52 -1.56 -0.09 0.00 -0.71 0.00 0.00 33.22 31.37 1uol n MET 237 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1uol s TYR 239 N -1.71 3.36 0.52 0.00 2.02 -1.26 -4.76 117.35 115.51 1uol s TYR 239 Ca -0.12 1.46 0.28 0.00 -0.37 0.00 0.00 57.07 58.33 1uol s TYR 239 Cb -0.05 -2.83 1.66 0.00 -0.40 0.00 0.00 41.96 40.33 1uol s TYR 239 CO 0.01 -0.58 2.18 0.77 -1.57 0.00 0.00 175.55 176.36 1uol h SER 240 N 0.67 0.00 0.11 2.29 0.02 -1.53 -2.36 113.55 112.76 1uol h SER 240 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 1uol h SER 240 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1uol h SER 240 CO 0.61 0.05 -0.11 -1.54 -1.14 0.00 0.00 176.83 174.69 1uol n SER 241 N -3.77 1.22 -4.68 3.07 3.41 -1.26 0.67 113.62 112.28 1uol n SER 241 Ca -0.02 -1.18 -0.49 0.00 -0.26 0.00 0.00 58.87 56.92 1uol n SER 241 Cb 0.15 0.05 -0.05 0.00 -0.26 0.00 0.00 64.21 64.10 1uol n SER 241 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1uol s MET 243 N 2.94 4.40 0.00 0.00 -1.94 -1.26 -1.13 119.30 122.30 1uol s MET 243 Ca 0.89 2.12 0.00 0.00 -1.71 0.00 0.00 55.69 56.99 1uol s MET 243 Cb -0.74 -3.13 0.00 0.00 2.01 0.00 0.00 34.83 32.97 1uol s MET 243 CO 0.49 -0.18 0.00 0.41 -0.01 0.00 0.00 175.02 175.73 1uol n GLY 244 N 1.50 2.61 0.00 -0.03 0.00 -1.26 -4.39 105.19 103.62 1uol n GLY 244 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1uol n GLY 244 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uol n GLY 245 N -2.00 1.37 0.33 -0.02 0.00 -0.99 -4.52 105.19 99.36 1uol n GLY 245 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.18 1uol n GLY 245 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1uol h MET 246 N 0.00 0.00 -6.34 1.61 2.07 -1.76 -3.46 114.93 107.05 1uol h MET 246 Ca 0.00 0.00 -0.47 0.00 -2.07 0.00 0.00 59.70 57.16 1uol h MET 246 Cb 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 31.60 29.70 1uol h MET 246 CO 0.00 0.00 -0.83 -1.71 1.07 0.00 0.00 176.91 175.44 1uol n ASN 247 N -4.22 -1.92 -0.07 1.22 5.15 -0.28 -0.53 115.26 114.61 1uol n ASN 247 Ca 0.03 -0.89 -0.01 0.00 -0.60 0.00 0.00 54.58 53.11 1uol n ASN 247 Cb 0.36 -3.56 -0.00 0.00 -0.53 0.00 0.00 39.78 36.05 1uol n ASN 247 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1uol n ARG 248 N -4.42 -1.17 -3.32 1.20 1.74 0.21 -4.95 116.66 105.94 1uol n ARG 248 Ca -0.19 0.34 -0.38 0.00 -0.77 0.00 0.00 57.85 56.86 1uol n ARG 248 Cb 0.63 -4.25 -0.06 0.00 -1.02 0.00 0.00 32.46 27.76 1uol n ARG 248 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1uol s ARG 249 N -1.33 4.28 0.52 5.56 0.52 0.31 -4.96 118.95 123.85 1uol s ARG 249 Ca 0.00 0.48 -0.21 0.00 -0.52 0.00 0.00 55.73 55.49 1uol s ARG 249 Cb 0.00 -3.39 -0.06 0.00 0.52 0.00 0.00 34.95 32.01 1uol s ARG 249 CO 0.00 0.26 1.14 -1.25 0.02 0.00 0.00 175.30 175.47 1uol s PRO 250 N 0.29 3.49 0.27 3.54 0.04 -1.26 -4.92 135.00 136.44 1uol s PRO 250 Ca 0.26 1.67 0.06 0.00 0.04 0.00 0.00 61.00 63.03 1uol s PRO 250 Cb -0.16 -2.14 -0.06 0.00 0.04 0.00 0.00 34.50 32.19 1uol s PRO 250 CO 0.12 -0.75 -0.05 0.96 0.04 0.00 0.00 177.00 177.31 1uol s ILE 251 N -1.69 1.56 0.08 0.56 -4.36 -1.25 -1.72 121.20 114.38 1uol s ILE 251 Ca 0.70 -2.12 0.09 0.00 -0.26 0.00 0.00 60.65 59.06 1uol s ILE 251 Cb -0.26 -2.42 -0.03 0.00 1.25 0.00 0.00 42.46 41.01 1uol s ILE 251 CO 0.30 -0.32 -0.22 -0.76 0.24 0.00 0.00 174.94 174.17 1uol s LEU 252 N -3.42 2.25 -0.13 0.37 1.43 -0.07 -1.73 118.68 117.39 1uol s LEU 252 Ca 0.29 -0.64 -0.03 0.00 -1.03 0.00 0.00 54.13 52.71 1uol s LEU 252 Cb 0.04 -1.01 -0.03 0.00 0.03 0.00 0.00 46.19 45.22 1uol s LEU 252 CO 0.11 0.13 -0.01 -0.89 0.23 0.00 0.00 176.35 175.92 1uol s THR 253 N -1.00 4.14 -0.18 5.49 2.01 0.86 -1.67 115.64 125.29 1uol s THR 253 Ca 0.09 -0.28 -0.04 0.00 0.31 0.00 0.00 61.69 61.77 1uol s THR 253 Cb -0.10 -2.80 -0.02 0.00 0.01 0.00 0.00 72.50 69.60 1uol s THR 253 CO 0.04 0.53 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.82 1uol s ILE 254 N -0.06 3.63 -0.19 1.82 1.01 0.12 -1.80 121.20 125.74 1uol s ILE 254 Ca 0.03 -0.43 -0.04 0.00 0.00 0.00 0.00 60.65 60.21 1uol s ILE 254 Cb -0.13 -2.62 -0.02 0.00 0.01 0.00 0.00 42.46 39.71 1uol s ILE 254 CO 0.02 0.46 -0.03 -0.63 0.00 0.00 0.00 174.94 174.76 1uol s ILE 255 N 0.86 3.70 -0.03 2.92 -1.09 -0.47 -1.51 121.20 125.58 1uol s ILE 255 Ca -0.01 -0.41 0.07 0.00 -2.23 0.00 0.00 60.65 58.08 1uol s ILE 255 Cb -0.15 -2.65 -0.02 0.00 -1.58 0.00 0.00 42.46 38.07 1uol s ILE 255 CO 0.01 0.45 -0.25 0.42 -1.23 0.00 0.00 174.94 174.35 1uol s THR 256 N 0.89 1.96 -0.19 2.92 -4.23 -0.08 -1.57 115.64 115.34 1uol s THR 256 Ca -0.00 -1.05 -0.13 0.00 -1.18 0.00 0.00 61.69 59.33 1uol s THR 256 Cb -0.15 -1.64 -0.05 0.00 1.34 0.00 0.00 72.50 72.01 1uol s THR 256 CO 0.01 0.55 0.26 -0.22 -0.54 0.00 0.00 174.62 174.69 1uol s LEU 257 N -0.44 4.19 0.06 4.79 2.96 0.53 -0.97 118.68 129.80 1uol s LEU 257 Ca 0.05 0.38 0.01 0.00 -0.22 0.00 0.00 54.13 54.35 1uol s LEU 257 Cb -0.11 -2.30 -0.03 0.00 0.50 0.00 0.00 46.19 44.24 1uol s LEU 257 CO 0.00 0.06 -0.05 -1.83 -1.32 0.00 0.00 176.35 173.21 1uol s GLU 258 N 0.78 0.61 0.73 1.98 -1.05 -0.35 -0.41 118.70 120.99 1uol s GLU 258 Ca 0.14 -1.03 -0.12 0.00 -0.15 0.00 0.00 54.97 53.80 1uol s GLU 258 Cb -0.13 -0.07 0.17 0.00 -0.44 0.00 0.00 34.13 33.66 1uol s GLU 258 CO 0.04 -0.03 0.94 -0.40 0.95 0.00 0.00 175.26 176.76 1uol n ASP 259 N 0.67 -0.15 0.30 0.83 5.68 -0.45 -0.41 116.55 123.02 1uol n ASP 259 Ca -0.17 -1.30 0.20 0.00 -0.50 0.00 0.00 54.79 53.01 1uol n ASP 259 Cb 0.58 -0.73 1.03 0.00 -1.14 0.00 0.00 41.12 40.85 1uol n ASP 259 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1uol h SER 260 N -1.38 0.00 0.44 -1.12 4.64 -1.91 -1.01 113.55 113.22 1uol h SER 260 Ca -0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1uol h SER 260 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 1uol h SER 260 CO 0.22 0.00 -0.63 -1.20 -0.87 0.00 0.00 176.83 174.35 1uol n SER 261 N -2.94 0.60 0.00 4.97 7.64 -1.26 -4.94 113.62 117.68 1uol n SER 261 Ca -0.02 -0.33 0.00 0.00 1.01 0.00 0.00 58.87 59.53 1uol n SER 261 Cb 0.11 0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 1uol n SER 261 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uol n GLY 262 N 1.48 0.71 3.78 0.23 0.00 -0.38 -5.07 105.19 105.93 1uol n GLY 262 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1uol n GLY 262 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1uol s ASN 263 N -2.58 6.37 0.08 1.61 0.01 -1.26 -4.74 114.94 114.43 1uol s ASN 263 Ca 0.00 2.17 -0.31 0.00 -0.71 0.00 0.00 52.86 54.02 1uol s ASN 263 Cb 0.00 -2.59 -0.07 0.00 0.41 0.00 0.00 41.25 39.00 1uol s ASN 263 CO 0.00 -0.77 1.39 -0.22 -1.51 0.00 0.00 177.10 175.99 1uol s LEU 264 N -2.97 4.36 -0.03 0.60 2.96 -1.26 -1.35 118.68 120.99 1uol s LEU 264 Ca 0.62 2.26 0.04 0.00 -0.22 0.00 0.00 54.13 56.83 1uol s LEU 264 Cb -0.25 -3.58 -0.06 0.00 0.50 0.00 0.00 46.19 42.80 1uol s LEU 264 CO 0.31 -0.67 0.05 0.18 -1.32 0.00 0.00 176.35 174.90 1uol n LEU 265 N 4.39 0.00 -3.58 -0.68 4.77 0.45 -4.89 117.00 117.46 1uol n LEU 265 Ca 0.12 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 56.05 1uol n LEU 265 Cb 0.43 0.06 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 1uol n LEU 265 CO 0.59 0.06 0.95 -0.83 -1.33 0.00 0.00 177.39 176.83 1uol s GLY 266 N -3.09 -0.28 -0.06 -0.72 0.00 -0.85 -4.10 107.32 98.22 1uol s GLY 266 Ca -0.02 1.68 -0.15 0.00 0.00 0.00 0.00 44.72 46.23 1uol s GLY 266 CO 0.17 0.61 0.35 -1.60 0.00 0.00 0.00 173.10 172.63 1uol s ARG 267 N -2.25 0.59 0.25 2.90 3.52 0.82 -0.34 118.95 124.44 1uol s ARG 267 Ca 0.08 0.10 -0.12 0.00 -0.13 0.00 0.00 55.73 55.66 1uol s ARG 267 Cb -0.01 0.27 -0.01 0.00 -1.56 0.00 0.00 34.95 33.65 1uol s ARG 267 CO -0.05 -0.14 0.45 0.34 -0.81 0.00 0.00 175.30 175.09 1uol s ASP 268 N -0.74 -0.05 0.16 -2.12 -1.08 -0.61 -1.02 116.67 111.22 1uol s ASP 268 Ca -0.08 -0.98 -0.24 0.00 -0.52 0.00 0.00 52.55 50.73 1uol s ASP 268 Cb -0.04 0.57 0.06 0.00 -1.46 0.00 0.00 42.92 42.05 1uol s ASP 268 CO 0.03 -1.12 0.73 -0.94 0.52 0.00 0.00 175.17 174.38 1uol s SER 269 N -3.04 -0.40 -0.01 -0.34 1.04 -1.26 -1.36 113.70 108.33 1uol s SER 269 Ca 0.24 -0.21 -0.28 0.00 0.48 0.00 0.00 55.95 56.18 1uol s SER 269 Cb -0.00 0.58 0.06 0.00 0.10 0.00 0.00 66.02 66.77 1uol s SER 269 CO 0.10 -1.00 0.62 0.72 0.98 0.00 0.00 173.24 174.66 1uol s PHE 270 N -3.63 -0.58 0.52 5.02 -0.71 -0.74 -4.98 117.98 112.88 1uol s PHE 270 Ca 0.06 0.88 -0.17 0.00 -1.04 0.00 0.00 56.93 56.66 1uol s PHE 270 Cb -0.02 0.40 -0.08 0.00 -1.21 0.00 0.00 43.02 42.11 1uol s PHE 270 CO -0.05 -0.63 0.99 -2.00 -1.34 0.00 0.00 175.22 172.19 1uol s GLU 271 N -1.69 3.91 -0.01 1.99 2.12 -0.18 -0.10 118.70 124.75 1uol s GLU 271 Ca -0.09 0.98 0.01 0.00 0.36 0.00 0.00 54.97 56.23 1uol s GLU 271 Cb -0.01 -2.13 0.00 0.00 0.26 0.00 0.00 34.13 32.26 1uol s GLU 271 CO 0.05 -0.30 -0.03 0.08 -0.54 0.00 0.00 175.26 174.52 1uol s VAL 272 N -2.60 0.26 -0.11 3.70 1.01 -0.70 0.22 120.40 122.17 1uol s VAL 272 Ca 0.59 -0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.46 1uol s VAL 272 Cb -0.10 -0.24 0.03 0.00 0.00 0.00 0.00 36.38 36.06 1uol s VAL 272 CO 0.31 0.09 -0.06 -0.60 0.00 0.00 0.00 175.10 174.84 1uol s ARG 273 N 0.08 1.37 -0.30 2.72 3.52 -0.03 -3.96 118.95 122.36 1uol s ARG 273 Ca -0.00 -0.20 -0.12 0.00 -0.13 0.00 0.00 55.73 55.27 1uol s ARG 273 Cb -0.03 -1.51 -0.04 0.00 -1.56 0.00 0.00 34.95 31.82 1uol s ARG 273 CO -0.00 -0.28 0.24 0.08 -0.81 0.00 0.00 175.30 174.52 1uol s VAL 274 N 1.75 5.28 0.24 7.11 1.01 -1.26 -1.51 120.40 133.02 1uol s VAL 274 Ca 0.05 0.07 -0.06 0.00 0.00 0.00 0.00 61.98 62.04 1uol s VAL 274 Cb -0.13 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 1uol s VAL 274 CO -0.08 0.13 0.33 0.00 0.00 0.00 0.00 175.10 175.48 1uol h ALA 276 N 2.39 0.67 -2.78 0.00 0.00 -1.97 -3.32 119.26 114.25 1uol h ALA 276 Ca -0.30 -0.45 -0.61 0.00 0.00 0.00 0.00 54.91 53.55 1uol h ALA 276 Cb 1.25 -0.12 -0.40 0.00 0.00 0.00 0.00 17.79 18.52 1uol h ALA 276 CO 0.43 0.67 -0.76 0.00 0.00 0.00 0.00 179.25 179.59 1uol h PRO 278 N 5.65 0.28 -0.25 0.00 0.11 -1.78 -1.38 132.00 134.62 1uol h PRO 278 Ca 0.18 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.30 1uol h PRO 278 Cb 0.84 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.86 1uol h PRO 278 CO 0.55 0.18 0.07 0.78 -0.21 0.00 0.00 178.00 179.37 1uol h GLY 279 N 0.28 0.30 0.97 -0.55 0.00 -1.77 0.73 103.07 103.04 1uol h GLY 279 Ca 0.38 -0.04 -0.09 0.00 0.00 0.00 0.00 47.33 47.59 1uol h GLY 279 CO -0.47 0.01 -0.09 -0.09 0.00 0.00 0.00 176.54 175.91 1uol h ARG 280 N 0.17 0.76 -0.23 4.80 2.43 -1.63 -2.24 114.38 118.44 1uol h ARG 280 Ca 0.11 -0.29 -0.09 0.00 -0.81 0.00 0.00 59.98 58.90 1uol h ARG 280 Cb 0.10 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1uol h ARG 280 CO -0.13 0.89 -0.25 -0.44 -1.51 0.00 0.00 179.97 178.53 1uol h ASP 281 N 0.57 0.44 -0.03 -3.80 3.32 -1.05 -1.34 116.42 114.52 1uol h ASP 281 Ca 0.10 -0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 1uol h ASP 281 Cb 0.61 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.04 1uol h ASP 281 CO 0.04 0.69 0.00 -0.09 -1.72 0.00 0.00 179.24 178.16 1uol h ARG 282 N 0.39 0.06 -0.51 3.56 2.43 -0.77 -1.62 114.38 117.92 1uol h ARG 282 Ca 0.06 -0.02 0.09 0.00 -0.81 0.00 0.00 59.98 59.30 1uol h ARG 282 Cb 0.65 -0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 30.12 1uol h ARG 282 CO 0.05 0.34 0.08 0.00 -1.51 0.00 0.00 179.97 178.93 1uol h ARG 283 N -0.24 0.20 0.43 0.20 3.08 -1.17 -1.26 114.38 115.63 1uol h ARG 283 Ca 0.01 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1uol h ARG 283 Cb 0.31 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1uol h ARG 283 CO 0.00 0.13 -0.34 1.15 -1.07 0.00 0.00 179.97 179.85 1uol h THR 284 N 0.21 0.30 -0.57 2.04 2.02 -1.11 -0.85 112.91 114.95 1uol h THR 284 Ca 0.26 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.43 1uol h THR 284 Cb 0.37 0.30 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 1uol h THR 284 CO -0.36 0.00 0.31 -0.33 0.37 0.00 0.00 175.52 175.51 1uol h GLU 285 N -0.77 0.78 -0.27 6.66 5.08 -1.08 -1.95 114.58 123.03 1uol h GLU 285 Ca -0.04 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 58.09 1uol h GLU 285 Cb 0.66 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 1uol h GLU 285 CO -0.01 0.57 -0.42 0.93 -1.00 0.00 0.00 179.01 179.08 1uol h GLU 286 N 0.78 0.77 -0.44 2.33 5.08 -1.11 -2.75 114.58 119.25 1uol h GLU 286 Ca 0.20 -0.46 0.06 0.00 -1.00 0.00 0.00 59.36 58.16 1uol h GLU 286 Cb 0.02 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 1uol h GLU 286 CO -0.03 1.09 0.29 1.49 -1.00 0.00 0.00 179.01 180.85 1uol h GLU 287 N 0.52 0.35 -0.56 2.33 4.57 -0.70 -1.25 114.58 119.84 1uol h GLU 287 Ca 0.03 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.15 1uol h GLU 287 Cb 1.02 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.51 1uol h GLU 287 CO 0.10 0.23 0.23 -0.91 -1.18 0.00 0.00 179.01 177.48 1uol h ASN 288 N 0.36 0.76 -0.76 1.04 -0.26 -1.07 -2.81 115.58 112.84 1uol h ASN 288 Ca 0.19 -0.16 0.17 0.00 -0.56 0.00 0.00 56.30 55.94 1uol h ASN 288 Cb 0.29 -0.20 -0.12 0.00 -1.06 0.00 0.00 38.32 37.24 1uol h ASN 288 CO -0.04 0.71 0.15 -0.07 -1.06 0.00 0.00 177.43 177.12 1uol h LEU 289 N 0.76 -0.07 0.00 1.61 3.38 -1.07 -3.52 115.31 116.40 1uol h LEU 289 Ca 0.19 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1uol h LEU 289 Cb 0.18 0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1uol h LEU 289 CO -0.02 -0.09 0.00 -1.14 0.09 0.00 0.00 178.44 177.28