#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3igl n SER 95 N 0.00 3.51 -0.81 4.04 2.88 -1.26 -4.91 113.62 117.08 3igl n SER 95 Ca 0.00 1.19 0.09 0.00 -1.33 0.00 0.00 58.87 58.83 3igl n SER 95 Cb 0.00 -1.60 0.11 0.00 -0.75 0.00 0.00 64.21 61.97 3igl n SER 95 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3igl n SER 96 N 0.30 2.73 -4.60 -3.46 3.41 -1.26 -4.89 113.62 105.84 3igl n SER 96 Ca 0.03 -1.82 -0.41 0.00 -0.26 0.00 0.00 58.87 56.41 3igl n SER 96 Cb 0.39 -0.06 -0.06 0.00 -0.26 0.00 0.00 64.21 64.22 3igl n SER 96 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3igl s VAL 97 N -1.48 4.91 0.45 -3.33 1.01 -1.26 -4.93 120.40 115.76 3igl s VAL 97 Ca 0.25 0.91 -0.20 0.00 0.00 0.00 0.00 61.98 62.93 3igl s VAL 97 Cb 0.16 -4.03 -0.10 0.00 0.00 0.00 0.00 36.38 32.41 3igl s VAL 97 CO 0.24 -0.17 0.96 -2.84 0.00 0.00 0.00 175.10 173.30 3igl s PRO 98 N 2.68 4.14 0.38 2.72 0.02 -1.26 -4.97 135.00 138.70 3igl s PRO 98 Ca 0.26 1.12 -0.28 0.00 0.02 0.00 0.00 61.00 62.13 3igl s PRO 98 Cb -0.15 -2.16 -0.11 0.00 0.02 0.00 0.00 34.50 32.10 3igl s PRO 98 CO 0.12 -0.11 1.46 0.45 -0.33 0.00 0.00 177.00 178.59 3igl s SER 99 N -2.30 6.34 0.00 2.53 0.15 -1.26 -4.91 113.70 114.25 3igl s SER 99 Ca 0.62 3.00 0.07 0.00 0.70 0.00 0.00 55.95 60.34 3igl s SER 99 Cb -0.10 -2.66 0.09 0.00 -1.71 0.00 0.00 66.02 61.64 3igl s SER 99 CO 0.17 -0.87 0.83 0.00 1.20 0.00 0.00 173.24 174.56 3igl n GLN 100 N 0.42 0.65 -1.76 5.44 10.64 -1.26 -5.03 117.38 126.48 3igl n GLN 100 Ca 0.01 -1.14 -0.42 0.00 -1.83 0.00 0.00 57.00 53.62 3igl n GLN 100 Cb 0.40 -1.15 -0.03 0.00 -0.86 0.00 0.00 30.24 28.60 3igl n GLN 100 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.06 175.44 3igl s LYS 101 N -0.69 4.15 0.21 2.61 2.47 -1.26 -4.68 119.74 122.55 3igl s LYS 101 Ca 0.10 2.55 -0.32 0.00 -1.56 0.00 0.00 55.97 56.74 3igl s LYS 101 Cb 0.06 -3.55 -0.14 0.00 -1.46 0.00 0.00 37.83 32.74 3igl s LYS 101 CO 0.09 -0.81 1.29 2.41 0.16 0.00 0.00 175.35 178.50 3igl n THR 102 N 4.67 0.96 -3.47 3.43 -1.04 -1.26 -4.79 114.28 112.78 3igl n THR 102 Ca 0.17 -0.24 -0.29 0.00 -2.04 0.00 0.00 64.05 61.65 3igl n THR 102 Cb 0.38 -1.20 -0.12 0.00 -1.82 0.00 0.00 70.33 67.57 3igl n THR 102 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 3igl s TYR 103 N -0.15 0.69 0.17 -1.42 6.14 0.30 -4.96 117.35 118.11 3igl s TYR 103 Ca 0.70 -1.55 0.17 0.00 0.64 0.00 0.00 57.07 57.04 3igl s TYR 103 Cb -0.73 -0.92 0.61 0.00 0.42 0.00 0.00 41.96 41.33 3igl s TYR 103 CO 0.51 -0.83 1.70 1.96 0.64 0.00 0.00 175.55 179.53 3igl h GLN 104 N 7.17 0.00 0.00 4.97 4.20 -1.81 0.11 115.11 129.74 3igl h GLN 104 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3igl h GLN 104 Cb 0.97 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.75 3igl h GLN 104 CO 0.28 0.41 0.00 0.41 -0.67 0.00 0.00 178.83 179.27 3igl n GLY 105 N 0.29 -0.91 0.05 3.46 0.00 -1.26 -1.15 105.19 105.66 3igl n GLY 105 Ca -0.00 -1.12 0.12 0.00 0.00 0.00 0.00 46.02 45.02 3igl n GLY 105 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3igl n SER 106 N -1.52 0.33 -0.83 1.61 7.64 -1.26 -2.83 113.62 116.76 3igl n SER 106 Ca 0.00 0.55 0.13 0.00 1.01 0.00 0.00 58.87 60.55 3igl n SER 106 Cb 0.00 -0.63 0.21 0.00 -1.01 0.00 0.00 64.21 62.79 3igl n SER 106 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3igl n TYR 107 N -1.82 0.00 -3.60 1.43 4.01 -1.26 -4.76 117.16 111.16 3igl n TYR 107 Ca 0.05 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.57 3igl n TYR 107 Cb 0.31 -0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.39 3igl n TYR 107 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3igl n GLY 108 N 1.30 -0.58 3.69 2.72 0.00 -1.13 -0.77 105.19 110.42 3igl n GLY 108 Ca 0.15 0.27 -0.42 0.00 0.00 0.00 0.00 46.02 46.02 3igl n GLY 108 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3igl s PHE 109 N -3.56 3.19 0.06 1.61 5.36 -0.30 -3.31 117.98 121.02 3igl s PHE 109 Ca 0.17 1.21 -0.01 0.00 -0.96 0.00 0.00 56.93 57.34 3igl s PHE 109 Cb -0.04 -3.43 -0.04 0.00 -0.34 0.00 0.00 43.02 39.17 3igl s PHE 109 CO 0.80 -1.34 -0.03 -0.98 -1.46 0.00 0.00 175.22 172.20 3igl s ARG 110 N 2.19 0.63 0.08 10.12 1.70 0.38 -4.60 118.95 129.45 3igl s ARG 110 Ca 0.56 -1.23 -0.00 0.00 -0.47 0.00 0.00 55.73 54.59 3igl s ARG 110 Cb -0.25 0.16 -0.04 0.00 -0.57 0.00 0.00 34.95 34.25 3igl s ARG 110 CO 0.22 -0.10 0.24 -0.51 -1.08 0.00 0.00 175.30 174.07 3igl s LEU 111 N -2.92 4.35 0.19 -1.89 1.43 -1.26 -0.65 118.68 117.92 3igl s LEU 111 Ca 0.07 0.30 0.08 0.00 -1.03 0.00 0.00 54.13 53.55 3igl s LEU 111 Cb 0.07 -3.00 -0.04 0.00 0.03 0.00 0.00 46.19 43.25 3igl s LEU 111 CO -0.09 0.14 -0.17 -0.83 0.23 0.00 0.00 176.35 175.63 3igl s GLY 112 N -2.58 1.43 0.01 -3.19 0.00 0.87 -4.91 107.32 98.94 3igl s GLY 112 Ca 0.36 -1.58 0.02 0.00 0.00 0.00 0.00 44.72 43.52 3igl s GLY 112 CO 0.28 -1.66 -0.08 -1.36 0.00 0.00 0.00 173.10 170.28 3igl s PHE 113 N -2.48 0.71 0.55 1.90 0.08 -1.26 -0.38 117.98 117.09 3igl s PHE 113 Ca 0.19 -0.20 -0.18 0.00 0.12 0.00 0.00 56.93 56.86 3igl s PHE 113 Cb -0.03 -0.45 -0.06 0.00 -0.57 0.00 0.00 43.02 41.91 3igl s PHE 113 CO 0.07 -0.02 1.08 -0.51 -0.10 0.00 0.00 175.22 175.74 3igl s LEU 114 N -0.48 3.69 0.62 -0.37 1.43 -1.26 -5.04 118.68 117.27 3igl s LEU 114 Ca 0.01 2.00 -0.13 0.00 -1.03 0.00 0.00 54.13 54.97 3igl s LEU 114 Cb -0.04 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 41.59 3igl s LEU 114 CO -0.00 -1.10 1.04 -1.00 0.23 0.00 0.00 176.35 175.52 3igl s HIS 115 N -2.05 3.24 0.28 0.29 3.76 -1.26 -4.55 115.29 115.00 3igl s HIS 115 Ca 0.68 1.43 0.02 0.00 -0.15 0.00 0.00 55.06 57.04 3igl s HIS 115 Cb -0.19 -2.87 -0.05 0.00 1.11 0.00 0.00 32.58 30.58 3igl s HIS 115 CO 0.28 -0.95 0.11 -1.54 -0.85 0.00 0.00 174.74 171.80 3igl s SER 116 N -3.47 1.41 1.04 1.40 1.04 -1.26 -5.05 113.70 108.81 3igl s SER 116 Ca 0.59 -1.44 -0.18 0.00 0.48 0.00 0.00 55.95 55.40 3igl s SER 116 Cb -0.13 0.23 0.24 0.00 0.10 0.00 0.00 66.02 66.45 3igl s SER 116 CO 0.46 -0.78 1.31 -0.83 0.98 0.00 0.00 173.24 174.38 3igl s GLY 117 N -3.35 1.78 0.00 7.32 0.00 -1.26 -5.00 107.32 106.81 3igl s GLY 117 Ca 0.37 -1.27 0.26 0.00 0.00 0.00 0.00 44.72 44.08 3igl s GLY 117 CO 0.15 -0.42 1.56 -1.30 0.00 0.00 0.00 173.10 173.09 3igl n THR 118 N -4.06 0.00 -1.84 0.90 -2.24 -1.26 -4.94 114.28 100.85 3igl n THR 118 Ca 0.16 -0.35 -0.39 0.00 -2.27 0.00 0.00 64.05 61.20 3igl n THR 118 Cb 0.59 0.88 0.02 0.00 -2.10 0.00 0.00 70.33 69.72 3igl n THR 118 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3igl s ALA 119 N -2.00 3.13 0.27 6.98 0.00 -1.26 -4.90 121.76 123.99 3igl s ALA 119 Ca 0.34 1.39 0.01 0.00 0.00 0.00 0.00 51.96 53.69 3igl s ALA 119 Cb 0.21 -3.56 0.59 0.00 0.00 0.00 0.00 23.12 20.36 3igl s ALA 119 CO 0.32 -1.18 1.75 -0.22 0.00 0.00 0.00 175.76 176.44 3igl h LYS 120 N 2.14 0.58 -0.99 0.00 3.64 -1.93 -2.90 116.57 117.10 3igl h LYS 120 Ca -0.51 -0.03 -0.55 0.00 -1.27 0.00 0.00 60.65 58.28 3igl h LYS 120 Cb 1.27 -0.13 -0.43 0.00 -0.41 0.00 0.00 32.23 32.53 3igl h LYS 120 CO 0.60 0.38 -0.80 0.43 -2.27 0.00 0.00 179.45 177.79 3igl n SER 121 N -4.89 4.75 -4.54 4.20 7.64 -1.26 -1.19 113.62 118.34 3igl n SER 121 Ca 0.19 -3.69 -0.41 0.00 1.01 0.00 0.00 58.87 55.97 3igl n SER 121 Cb 0.49 -0.38 0.02 0.00 -1.01 0.00 0.00 64.21 63.33 3igl n SER 121 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 3igl n VAL 122 N -0.63 2.32 0.14 0.44 3.14 -1.10 -4.78 118.33 117.86 3igl n VAL 122 Ca 0.41 -0.50 -0.01 0.00 -2.96 0.00 0.00 64.34 61.28 3igl n VAL 122 Cb 0.87 -0.88 0.17 0.00 -1.06 0.00 0.00 33.84 32.94 3igl n VAL 122 CO 0.00 0.00 0.00 0.71 -6.46 0.00 0.00 176.83 171.08 3igl h THR 123 N 1.03 1.42 -2.09 1.55 1.35 -1.94 -3.36 112.91 110.86 3igl h THR 123 Ca -0.43 -2.13 -0.06 0.00 -0.55 0.00 0.00 66.41 63.24 3igl h THR 123 Cb 1.37 2.15 -0.21 0.00 -1.73 0.00 0.00 68.15 69.74 3igl h THR 123 CO 0.53 0.60 0.10 0.00 -0.25 0.00 0.00 175.52 176.51 3igl s THR 125 N -0.14 -0.01 -0.15 0.00 -1.32 0.39 -4.74 115.64 109.66 3igl s THR 125 Ca -0.04 0.05 -0.03 0.00 -1.21 0.00 0.00 61.69 60.46 3igl s THR 125 Cb -0.03 -0.51 -0.02 0.00 -1.51 0.00 0.00 72.50 70.42 3igl s THR 125 CO 0.04 0.02 -0.05 -0.47 -2.21 0.00 0.00 174.62 171.94 3igl s TYR 126 N 0.68 2.98 -0.52 9.09 5.04 -1.26 -0.75 117.35 132.60 3igl s TYR 126 Ca -0.04 -0.40 -0.18 0.00 -2.44 0.00 0.00 57.07 54.02 3igl s TYR 126 Cb -0.05 -1.95 0.08 0.00 0.35 0.00 0.00 41.96 40.39 3igl s TYR 126 CO -0.04 -0.10 0.58 0.45 -1.34 0.00 0.00 175.55 175.10 3igl s SER 127 N 0.43 6.19 0.25 4.32 0.15 0.00 -4.97 113.70 120.06 3igl s SER 127 Ca -0.05 -1.22 -0.06 0.00 0.70 0.00 0.00 55.95 55.32 3igl s SER 127 Cb -0.15 -2.26 0.26 0.00 -1.71 0.00 0.00 66.02 62.17 3igl s SER 127 CO 0.03 -0.88 1.91 -0.65 1.20 0.00 0.00 173.24 174.85 3igl h PRO 128 N 8.97 1.24 -0.92 5.44 0.11 -1.97 0.20 132.00 145.08 3igl h PRO 128 Ca -0.28 -0.07 0.09 0.00 0.11 0.00 0.00 66.00 65.84 3igl h PRO 128 Cb 1.10 -0.28 -0.07 0.00 0.11 0.00 0.00 31.00 31.85 3igl h PRO 128 CO 0.98 0.82 0.56 0.00 -0.21 0.00 0.00 178.00 180.16 3igl h ALA 129 N 1.37 1.31 -0.01 -0.75 0.00 -1.97 -2.27 119.26 116.95 3igl h ALA 129 Ca 0.36 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.28 3igl h ALA 129 Cb -0.10 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.48 3igl h ALA 129 CO -0.09 0.23 -0.49 1.28 0.00 0.00 0.00 179.25 180.18 3igl n LEU 130 N -4.64 1.53 -3.83 0.00 4.77 -0.99 -4.97 117.00 108.87 3igl n LEU 130 Ca 0.15 -0.54 -0.29 0.00 -0.03 0.00 0.00 56.01 55.30 3igl n LEU 130 Cb 0.26 -0.05 0.01 0.00 -2.33 0.00 0.00 43.42 41.32 3igl n LEU 130 CO 0.29 0.30 -0.15 -3.20 -1.33 0.00 0.00 177.39 173.29 3igl n ASN 131 N -0.48 -2.73 -3.74 -1.43 4.05 0.65 -4.82 115.26 106.76 3igl n ASN 131 Ca 0.09 -1.02 -0.13 0.00 0.45 0.00 0.00 54.58 53.97 3igl n ASN 131 Cb 0.41 -3.17 -0.14 0.00 1.23 0.00 0.00 39.78 38.11 3igl n ASN 131 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 177.26 173.46 3igl s LYS 132 N -6.32 0.15 -0.12 1.20 2.20 -0.90 -1.26 119.74 114.69 3igl s LYS 132 Ca 0.23 0.44 -0.14 0.00 -0.36 0.00 0.00 55.97 56.14 3igl s LYS 132 Cb -0.09 -0.14 -0.05 0.00 -1.51 0.00 0.00 37.83 36.05 3igl s LYS 132 CO 0.88 -0.16 0.34 1.41 -0.36 0.00 0.00 175.35 177.46 3igl s MET 133 N 1.16 4.15 -0.19 4.03 -2.45 0.08 -0.82 119.30 125.27 3igl s MET 133 Ca -0.09 0.21 -0.03 0.00 -1.25 0.00 0.00 55.69 54.53 3igl s MET 133 Cb -0.10 -3.37 -0.01 0.00 1.25 0.00 0.00 34.83 32.59 3igl s MET 133 CO -0.07 0.35 -0.05 -0.06 1.05 0.00 0.00 175.02 176.23 3igl s PHE 134 N 0.09 2.95 0.14 4.11 0.40 0.07 -0.32 117.98 125.42 3igl s PHE 134 Ca 0.20 -0.76 -0.12 0.00 -0.60 0.00 0.00 56.93 55.65 3igl s PHE 134 Cb -0.14 -2.04 0.01 0.00 0.51 0.00 0.00 43.02 41.36 3igl s PHE 134 CO 0.07 -0.39 0.32 0.00 0.70 0.00 0.00 175.22 175.92 3igl s GLN 136 N -3.88 3.66 0.42 0.00 -0.21 -0.37 0.15 119.66 119.44 3igl s GLN 136 Ca 0.09 0.16 -0.25 0.00 0.02 0.00 0.00 55.36 55.38 3igl s GLN 136 Cb 0.03 -2.53 -0.08 0.00 1.00 0.00 0.00 33.01 31.42 3igl s GLN 136 CO -0.06 0.08 1.20 -0.48 -2.12 0.00 0.00 175.29 173.90 3igl s LEU 137 N -3.82 4.14 -1.55 2.90 2.34 -1.26 -3.05 118.68 118.38 3igl s LEU 137 Ca 0.46 2.40 0.00 0.00 0.06 0.00 0.00 54.13 57.05 3igl s LEU 137 Cb -0.10 -4.07 0.00 0.00 -0.56 0.00 0.00 46.19 41.46 3igl s LEU 137 CO 0.32 -0.79 0.00 0.00 -1.06 0.00 0.00 176.35 174.82 3igl n ALA 138 N -0.09 -0.22 -2.63 1.48 0.00 0.34 -4.97 120.51 114.42 3igl n ALA 138 Ca 0.05 0.24 -0.23 0.00 0.00 0.00 0.00 53.44 53.50 3igl n ALA 138 Cb 0.46 -1.75 -0.07 0.00 0.00 0.00 0.00 19.45 18.09 3igl n ALA 138 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3igl s LYS 139 N -3.19 2.24 0.15 0.00 1.02 -1.17 -4.95 119.74 113.84 3igl s LYS 139 Ca 0.00 -1.45 -0.33 0.00 0.02 0.00 0.00 55.97 54.21 3igl s LYS 139 Cb 0.00 -2.13 -0.13 0.00 -0.52 0.00 0.00 37.83 35.05 3igl s LYS 139 CO 0.00 0.36 1.65 2.41 -0.92 0.00 0.00 175.35 178.86 3igl n THR 140 N -0.85 0.07 -3.85 2.17 -1.04 -1.26 -4.46 114.28 105.06 3igl n THR 140 Ca -0.06 -0.01 -0.30 0.00 -2.04 0.00 0.00 64.05 61.63 3igl n THR 140 Cb 0.59 -1.70 -0.14 0.00 -1.82 0.00 0.00 70.33 67.26 3igl n THR 140 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3igl s PRO 142 N 0.36 4.36 -0.05 0.00 0.05 -1.26 -1.93 135.00 136.54 3igl s PRO 142 Ca 0.15 2.09 0.02 0.00 0.05 0.00 0.00 61.00 63.31 3igl s PRO 142 Cb -0.23 -3.19 0.02 0.00 0.05 0.00 0.00 34.50 31.14 3igl s PRO 142 CO -0.04 -0.30 -0.08 0.08 0.05 0.00 0.00 177.00 176.72 3igl s VAL 143 N 0.22 0.76 -0.03 -0.36 1.01 0.21 -4.63 120.40 117.57 3igl s VAL 143 Ca 0.58 -0.28 -0.13 0.00 0.00 0.00 0.00 61.98 62.15 3igl s VAL 143 Cb -0.37 -0.73 -0.05 0.00 0.00 0.00 0.00 36.38 35.23 3igl s VAL 143 CO 0.38 0.27 0.34 -1.10 0.00 0.00 0.00 175.10 174.98 3igl s GLN 144 N 0.67 3.80 -0.24 2.72 -0.21 0.49 -0.83 119.66 126.05 3igl s GLN 144 Ca -0.11 0.26 -0.07 0.00 0.02 0.00 0.00 55.36 55.47 3igl s GLN 144 Cb -0.14 -3.22 -0.03 0.00 1.00 0.00 0.00 33.01 30.63 3igl s GLN 144 CO 0.01 0.71 0.05 -0.51 -2.12 0.00 0.00 175.29 173.43 3igl s LEU 145 N -1.03 3.38 -0.09 2.90 1.43 0.71 -0.09 118.68 125.89 3igl s LEU 145 Ca 0.21 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.12 3igl s LEU 145 Cb -0.15 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 44.15 3igl s LEU 145 CO 0.11 -0.01 -0.12 0.26 0.23 0.00 0.00 176.35 176.82 3igl s TRP 146 N 1.44 2.81 0.05 0.29 0.52 0.17 -1.26 118.94 122.96 3igl s TRP 146 Ca 0.05 -0.32 0.02 0.00 0.02 0.00 0.00 56.10 55.88 3igl s TRP 146 Cb -0.15 -1.75 -0.02 0.00 -1.15 0.00 0.00 33.47 30.40 3igl s TRP 146 CO 0.03 0.04 -0.08 0.14 0.02 0.00 0.00 176.95 177.10 3igl s VAL 147 N -0.24 0.58 0.07 4.03 -7.23 -1.26 -0.47 120.40 115.88 3igl s VAL 147 Ca 0.02 -1.11 0.05 0.00 -1.81 0.00 0.00 61.98 59.12 3igl s VAL 147 Cb -0.13 -0.66 -0.24 0.00 0.56 0.00 0.00 36.38 35.92 3igl s VAL 147 CO 0.03 -0.38 1.10 0.44 -0.31 0.00 0.00 175.10 175.98 3igl h ASP 148 N 4.45 0.13 -3.78 4.85 3.32 -0.94 -3.47 116.42 120.98 3igl h ASP 148 Ca -0.36 -0.15 -0.46 0.00 0.02 0.00 0.00 57.03 56.08 3igl h ASP 148 Cb 1.20 -0.04 -0.18 0.00 0.22 0.00 0.00 39.33 40.53 3igl h ASP 148 CO 0.41 1.12 -0.76 -0.44 -1.72 0.00 0.00 179.24 177.85 3igl s SER 149 N -6.73 2.30 -0.25 6.45 0.01 -1.03 -5.03 113.70 109.43 3igl s SER 149 Ca -0.02 -0.86 -0.29 0.00 1.31 0.00 0.00 55.95 56.09 3igl s SER 149 Cb 0.09 -0.11 0.01 0.00 0.21 0.00 0.00 66.02 66.22 3igl s SER 149 CO 0.84 -0.11 1.05 -0.89 0.41 0.00 0.00 173.24 174.53 3igl s THR 150 N -2.24 4.64 0.68 1.44 2.01 -1.26 -4.82 115.64 116.08 3igl s THR 150 Ca 0.13 1.95 -0.17 0.00 0.31 0.00 0.00 61.69 63.91 3igl s THR 150 Cb -0.04 -4.34 -0.01 0.00 0.01 0.00 0.00 72.50 68.12 3igl s THR 150 CO 0.05 -0.26 0.99 -2.65 -0.69 0.00 0.00 174.62 172.06 3igl n PRO 151 N 6.46 0.68 -1.13 4.92 -0.02 -1.26 -4.99 135.00 139.66 3igl n PRO 151 Ca 0.12 0.28 -0.31 0.00 -2.02 0.00 0.00 63.50 61.57 3igl n PRO 151 Cb 0.46 -2.23 0.11 0.00 -0.02 0.00 0.00 33.50 31.82 3igl n PRO 151 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3igl s PRO 152 N -3.16 1.90 0.48 0.52 0.04 -1.26 -4.93 135.00 128.59 3igl s PRO 152 Ca 0.75 1.33 -0.23 0.00 0.04 0.00 0.00 61.00 62.90 3igl s PRO 152 Cb -0.37 -1.84 -0.08 0.00 0.04 0.00 0.00 34.50 32.25 3igl s PRO 152 CO 0.48 -1.94 1.21 -2.30 0.04 0.00 0.00 177.00 174.49 3igl n PRO 153 N -3.63 1.63 -0.22 0.56 -0.02 -1.26 -2.28 135.00 129.78 3igl n PRO 153 Ca 0.10 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 3igl n PRO 153 Cb 0.52 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 3igl n PRO 153 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3igl n GLY 154 N 0.92 0.91 3.78 -1.23 0.00 -1.26 -4.71 105.19 103.60 3igl n GLY 154 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 3igl n GLY 154 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3igl s THR 155 N -2.62 3.29 0.18 2.61 2.01 -0.96 -2.88 115.64 117.27 3igl s THR 155 Ca 0.00 0.74 0.08 0.00 0.31 0.00 0.00 61.69 62.82 3igl s THR 155 Cb 0.00 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 3igl s THR 155 CO 0.00 -0.23 -0.16 -0.13 -0.69 0.00 0.00 174.62 173.40 3igl s ARG 156 N -3.51 1.29 -0.18 4.92 0.52 0.72 -0.86 118.95 121.84 3igl s ARG 156 Ca 0.70 -1.48 -0.00 0.00 -0.52 0.00 0.00 55.73 54.43 3igl s ARG 156 Cb -0.22 -1.21 0.04 0.00 0.52 0.00 0.00 34.95 34.08 3igl s ARG 156 CO 0.30 0.23 -0.07 0.08 0.02 0.00 0.00 175.30 175.86 3igl s VAL 157 N -2.46 1.30 -0.10 3.52 1.01 0.11 -1.24 120.40 122.55 3igl s VAL 157 Ca 0.18 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.37 3igl s VAL 157 Cb -0.04 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 3igl s VAL 157 CO 0.07 0.11 -0.09 -0.60 0.00 0.00 0.00 175.10 174.59 3igl s ARG 158 N 1.54 3.03 -0.00 2.72 3.52 -0.56 -1.20 118.95 128.00 3igl s ARG 158 Ca -0.00 -0.60 0.07 0.00 -0.13 0.00 0.00 55.73 55.07 3igl s ARG 158 Cb -0.16 -2.63 -0.03 0.00 -1.56 0.00 0.00 34.95 30.58 3igl s ARG 158 CO -0.08 0.48 -0.22 0.00 -0.81 0.00 0.00 175.30 174.67 3igl s ALA 159 N -0.31 2.39 -0.17 6.12 0.00 -0.31 -1.06 121.76 128.42 3igl s ALA 159 Ca 0.04 -1.12 -0.15 0.00 0.00 0.00 0.00 51.96 50.73 3igl s ALA 159 Cb -0.13 -0.68 0.05 0.00 0.00 0.00 0.00 23.12 22.36 3igl s ALA 159 CO 0.02 0.55 0.45 1.41 0.00 0.00 0.00 175.76 178.19 3igl s MET 160 N -0.91 0.51 -0.02 0.00 0.00 -0.71 -1.76 119.30 116.41 3igl s MET 160 Ca 0.12 0.65 -0.12 0.00 0.00 0.00 0.00 55.69 56.33 3igl s MET 160 Cb -0.10 0.23 -0.05 0.00 0.00 0.00 0.00 34.83 34.90 3igl s MET 160 CO 0.01 -0.07 0.33 0.00 0.00 0.00 0.00 175.02 175.29 3igl s ALA 161 N 0.36 3.75 0.04 4.11 0.00 -1.26 0.01 121.76 128.78 3igl s ALA 161 Ca -0.01 -0.35 0.03 0.00 0.00 0.00 0.00 51.96 51.63 3igl s ALA 161 Cb -0.04 -2.26 -0.02 0.00 0.00 0.00 0.00 23.12 20.80 3igl s ALA 161 CO -0.01 0.53 -0.09 0.96 0.00 0.00 0.00 175.76 177.15 3igl s ILE 162 N -1.10 0.70 0.27 0.00 -4.36 -0.25 -4.53 121.20 111.93 3igl s ILE 162 Ca 0.22 -1.01 -0.30 0.00 -0.26 0.00 0.00 60.65 59.30 3igl s ILE 162 Cb -0.15 -0.71 -0.10 0.00 1.25 0.00 0.00 42.46 42.75 3igl s ILE 162 CO 0.11 -0.25 1.39 -0.31 0.24 0.00 0.00 174.94 176.12 3igl s TYR 163 N -1.15 3.03 0.12 1.37 2.02 -1.26 -0.18 117.35 121.30 3igl s TYR 163 Ca -0.06 1.17 -0.12 0.00 -0.37 0.00 0.00 57.07 57.68 3igl s TYR 163 Cb -0.09 -3.77 -0.07 0.00 -0.40 0.00 0.00 41.96 37.63 3igl s TYR 163 CO 0.01 -2.37 1.43 -0.22 -1.57 0.00 0.00 175.55 172.83 3igl h LYS 164 N 4.50 0.86 -6.65 -0.62 3.64 -1.38 -3.38 116.57 113.53 3igl h LYS 164 Ca -0.47 -0.49 -0.52 0.00 -1.27 0.00 0.00 60.65 57.91 3igl h LYS 164 Cb 1.22 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 3igl h LYS 164 CO 0.73 1.13 0.48 -0.65 -2.27 0.00 0.00 179.45 178.87 3igl s GLN 165 N -4.29 4.59 0.29 1.90 -0.21 -1.26 -4.90 119.66 115.78 3igl s GLN 165 Ca -0.11 1.71 -0.00 0.00 0.02 0.00 0.00 55.36 56.98 3igl s GLN 165 Cb 0.10 -3.28 0.66 0.00 1.00 0.00 0.00 33.01 31.49 3igl s GLN 165 CO 0.87 0.06 1.61 0.77 -2.12 0.00 0.00 175.29 176.49 3igl h SER 166 N 5.18 -0.30 0.48 5.90 0.02 -2.00 0.63 113.55 123.46 3igl h SER 166 Ca -0.44 0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 3igl h SER 166 Cb 1.21 0.38 0.00 0.00 0.14 0.00 0.00 62.40 64.13 3igl h SER 166 CO 0.73 -0.25 0.00 0.00 -1.14 0.00 0.00 176.83 176.17 3igl n GLN 167 N -5.37 0.10 0.00 3.45 10.64 -1.26 -2.82 117.38 122.12 3igl n GLN 167 Ca 0.20 0.18 0.01 0.00 -1.83 0.00 0.00 57.00 55.56 3igl n GLN 167 Cb 0.66 -1.50 -0.01 0.00 -0.86 0.00 0.00 30.24 28.54 3igl n GLN 167 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 3igl n HIS 168 N -1.41 0.00 -0.08 2.61 8.25 0.14 -4.77 115.22 119.96 3igl n HIS 168 Ca 0.06 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.59 3igl n HIS 168 Cb 0.17 0.00 0.43 0.00 1.12 0.00 0.00 29.99 31.72 3igl n HIS 168 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 3igl h MET 169 N 0.12 0.54 -0.00 -0.41 2.86 -1.20 0.06 114.93 116.89 3igl h MET 169 Ca 0.00 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 3igl h MET 169 Cb 0.06 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.60 3igl h MET 169 CO 0.00 0.35 -0.01 0.25 1.06 0.00 0.00 176.91 178.57 3igl n THR 170 N -4.47 0.00 -3.50 2.22 -2.24 -1.26 -4.63 114.28 100.40 3igl n THR 170 Ca 0.08 -0.02 -0.37 0.00 -2.27 0.00 0.00 64.05 61.47 3igl n THR 170 Cb 0.22 -0.41 -0.07 0.00 -2.10 0.00 0.00 70.33 67.98 3igl n THR 170 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3igl s GLU 171 N -2.11 4.22 0.21 -0.78 2.12 0.01 -5.00 118.70 117.35 3igl s GLU 171 Ca 0.43 0.19 -0.31 0.00 0.36 0.00 0.00 54.97 55.64 3igl s GLU 171 Cb 0.22 -3.40 -0.10 0.00 0.26 0.00 0.00 34.13 31.10 3igl s GLU 171 CO 0.39 0.28 1.52 0.08 -0.54 0.00 0.00 175.26 176.99 3igl s VAL 172 N 0.32 2.60 -0.19 3.70 1.01 -1.26 -4.58 120.40 121.99 3igl s VAL 172 Ca 0.19 0.46 -0.29 0.00 0.00 0.00 0.00 61.98 62.34 3igl s VAL 172 Cb -0.14 -3.29 -0.00 0.00 0.00 0.00 0.00 36.38 32.95 3igl s VAL 172 CO 0.06 0.05 1.15 -0.69 0.00 0.00 0.00 175.10 175.68 3igl s VAL 173 N 0.62 4.47 0.10 2.92 1.01 -1.26 -5.03 120.40 123.23 3igl s VAL 173 Ca 0.65 1.78 0.02 0.00 0.00 0.00 0.00 61.98 64.44 3igl s VAL 173 Cb -0.43 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 31.76 3igl s VAL 173 CO 0.37 -0.15 -0.07 -0.13 0.00 0.00 0.00 175.10 175.12 3igl s ARG 174 N 3.30 0.85 0.38 2.72 0.52 -1.26 -4.72 118.95 120.74 3igl s ARG 174 Ca 0.50 -1.31 -0.26 0.00 -0.52 0.00 0.00 55.73 54.14 3igl s ARG 174 Cb -0.19 -0.30 -0.11 0.00 0.52 0.00 0.00 34.95 34.87 3igl s ARG 174 CO 0.11 0.01 1.16 -2.13 0.02 0.00 0.00 175.30 174.47 3igl n ARG 175 N 0.05 1.73 -1.31 3.54 3.00 -0.36 -4.38 116.66 118.94 3igl n ARG 175 Ca -0.13 0.61 -0.31 0.00 -0.00 0.00 0.00 57.85 58.03 3igl n ARG 175 Cb 0.60 -2.20 0.09 0.00 0.00 0.00 0.00 32.46 30.95 3igl n ARG 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3igl h PRO 177 N -1.08 0.81 0.90 0.00 0.11 -1.82 -1.02 132.00 129.91 3igl h PRO 177 Ca -0.44 -0.09 -0.04 0.00 0.11 0.00 0.00 66.00 65.54 3igl h PRO 177 Cb 1.23 -0.16 0.01 0.00 0.11 0.00 0.00 31.00 32.18 3igl h PRO 177 CO 0.52 0.61 -0.45 1.25 -0.21 0.00 0.00 178.00 179.72 3igl h HIS 178 N 0.82 -1.17 0.00 0.65 -0.00 -1.92 -1.43 115.15 112.10 3igl h HIS 178 Ca 0.21 -0.03 -0.04 0.00 -0.00 0.00 0.00 60.37 60.51 3igl h HIS 178 Cb 0.04 0.39 -0.01 0.00 -0.00 0.00 0.00 27.41 27.83 3igl h HIS 178 CO 0.01 -0.72 -0.19 0.45 -0.00 0.00 0.00 177.93 177.47 3igl h HIS 179 N -1.23 0.00 -0.58 5.26 3.86 -1.87 -1.35 115.15 119.23 3igl h HIS 179 Ca -0.12 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 58.99 3igl h HIS 179 Cb 0.95 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.40 3igl h HIS 179 CO -0.02 0.19 0.00 1.49 0.86 0.00 0.00 177.93 180.46 3igl h GLU 180 N 0.00 1.03 -0.04 2.45 4.81 -1.11 -2.67 114.58 119.05 3igl h GLU 180 Ca -0.00 -0.32 -0.18 0.00 -0.13 0.00 0.00 59.36 58.72 3igl h GLU 180 Cb 0.48 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 3igl h GLU 180 CO 0.03 1.01 -0.76 -0.09 -0.73 0.00 0.00 179.01 178.46 3igl h ARG 181 N 0.92 0.27 -0.71 1.92 2.43 -0.68 -2.88 114.38 115.65 3igl h ARG 181 Ca 0.17 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3igl h ARG 181 Cb 0.55 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 3igl h ARG 181 CO 0.03 0.91 0.00 0.00 -1.51 0.00 0.00 179.97 179.40 3igl s SER 183 N -0.51 5.42 0.00 0.00 0.15 -1.01 -5.04 113.70 112.71 3igl s SER 183 Ca 0.29 -0.35 0.00 0.00 0.70 0.00 0.00 55.95 56.59 3igl s SER 183 Cb 0.21 -0.58 0.00 0.00 -1.71 0.00 0.00 66.02 63.94 3igl s SER 183 CO 0.10 -0.99 0.00 0.61 1.20 0.00 0.00 173.24 174.16 3igl n GLY 187 N -2.09 -2.00 0.19 9.45 0.00 -1.26 -5.10 105.19 104.38 3igl n GLY 187 Ca 0.09 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.18 3igl n GLY 187 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 3igl h LEU 188 N 0.00 0.00 -9.40 0.99 8.10 -2.00 -3.46 115.31 109.54 3igl h LEU 188 Ca 0.00 0.00 -0.54 0.00 0.11 0.00 0.00 57.88 57.45 3igl h LEU 188 Cb 0.00 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.23 3igl h LEU 188 CO 0.00 0.33 0.88 0.00 -4.11 0.00 0.00 178.44 175.54 3igl s ALA 189 N -3.48 3.61 0.51 0.17 0.00 -1.26 -4.92 121.76 116.39 3igl s ALA 189 Ca 0.01 0.99 -0.23 0.00 0.00 0.00 0.00 51.96 52.73 3igl s ALA 189 Cb 0.10 -3.62 -0.06 0.00 0.00 0.00 0.00 23.12 19.53 3igl s ALA 189 CO 0.68 -0.96 1.37 -2.14 0.00 0.00 0.00 175.76 174.70 3igl s PRO 190 N 2.43 3.35 0.58 0.00 0.02 -1.26 -4.88 135.00 135.24 3igl s PRO 190 Ca 0.67 2.27 0.35 0.00 0.02 0.00 0.00 61.00 64.31 3igl s PRO 190 Cb -0.34 -2.39 1.79 0.00 0.02 0.00 0.00 34.50 33.57 3igl s PRO 190 CO 0.28 -1.03 2.16 -1.00 -0.33 0.00 0.00 177.00 177.08 3igl h PRO 191 N 1.77 0.00 0.00 5.54 0.13 -1.93 -2.09 132.00 135.42 3igl h PRO 191 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3igl h PRO 191 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 3igl h PRO 191 CO 0.59 0.04 0.00 1.96 -0.23 0.00 0.00 178.00 180.36 3igl h GLN 192 N 0.00 0.00 -6.46 0.86 7.50 -1.89 -3.39 115.11 111.73 3igl h GLN 192 Ca -0.00 0.00 -0.54 0.00 0.50 0.00 0.00 58.65 58.61 3igl h GLN 192 Cb 0.26 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.79 3igl h GLN 192 CO 0.01 0.00 0.63 -1.01 -1.50 0.00 0.00 178.83 176.95 3igl s HIS 193 N -3.40 3.32 0.05 2.96 3.76 -0.79 -1.22 115.29 119.96 3igl s HIS 193 Ca 0.04 1.19 -0.16 0.00 -0.15 0.00 0.00 55.06 55.98 3igl s HIS 193 Cb 0.09 -3.49 -0.21 0.00 1.11 0.00 0.00 32.58 30.08 3igl s HIS 193 CO 0.54 -1.57 1.18 1.25 -0.85 0.00 0.00 174.74 175.29 3igl h LEU 194 N 7.13 0.76 -9.19 0.89 5.85 -1.88 -3.42 115.31 115.45 3igl h LEU 194 Ca -0.40 -0.71 -0.61 0.00 0.84 0.00 0.00 57.88 56.99 3igl h LEU 194 Cb 1.20 -0.23 -0.14 0.00 0.37 0.00 0.00 40.66 41.87 3igl h LEU 194 CO 0.84 1.37 -0.52 -0.63 -0.34 0.00 0.00 178.44 179.16 3igl s ILE 195 N -3.40 5.19 0.25 4.05 1.01 -1.26 -1.19 121.20 125.85 3igl s ILE 195 Ca -0.11 0.11 0.11 0.00 0.00 0.00 0.00 60.65 60.76 3igl s ILE 195 Cb 0.06 -3.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.11 3igl s ILE 195 CO 0.88 0.44 -0.19 -0.13 0.00 0.00 0.00 174.94 175.94 3igl s ARG 196 N 0.44 1.72 -0.11 2.79 0.52 -0.18 -4.78 118.95 119.35 3igl s ARG 196 Ca 0.06 -1.63 -0.01 0.00 -0.52 0.00 0.00 55.73 53.64 3igl s ARG 196 Cb -0.12 -1.86 -0.02 0.00 0.52 0.00 0.00 34.95 33.47 3igl s ARG 196 CO -0.01 0.36 -0.08 0.08 0.02 0.00 0.00 175.30 175.67 3igl s VAL 197 N -2.18 3.54 0.16 3.52 1.01 -1.26 -0.90 120.40 124.28 3igl s VAL 197 Ca 0.27 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.78 3igl s VAL 197 Cb -0.06 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 3igl s VAL 197 CO 0.14 0.54 0.18 -1.83 0.00 0.00 0.00 175.10 174.13 3igl s GLU 198 N -0.09 3.07 -1.12 2.72 -1.05 -0.54 -4.68 118.70 117.01 3igl s GLU 198 Ca 0.00 -0.78 -0.02 0.00 -0.15 0.00 0.00 54.97 54.02 3igl s GLU 198 Cb -0.13 -2.75 0.00 0.00 -0.44 0.00 0.00 34.13 30.81 3igl s GLU 198 CO 0.03 0.50 0.31 0.41 0.95 0.00 0.00 175.26 177.46 3igl n GLY 199 N -0.40 -0.17 2.73 -3.83 0.00 -1.26 -4.47 105.19 97.79 3igl n GLY 199 Ca -0.08 -0.19 -0.18 0.00 0.00 0.00 0.00 46.02 45.58 3igl n GLY 199 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3igl s ASN 200 N -2.69 0.64 0.00 1.61 3.84 -1.26 -5.02 114.94 112.07 3igl s ASN 200 Ca 0.16 0.09 0.28 0.00 0.21 0.00 0.00 52.86 53.60 3igl s ASN 200 Cb -0.07 -0.07 1.17 0.00 -0.55 0.00 0.00 41.25 41.73 3igl s ASN 200 CO 0.19 -0.20 1.82 0.18 -2.79 0.00 0.00 177.10 176.30 3igl n LEU 201 N 4.82 0.71 -1.08 3.21 4.77 -1.26 -3.63 117.00 124.55 3igl n LEU 201 Ca -0.14 -0.14 -0.04 0.00 -0.03 0.00 0.00 56.01 55.66 3igl n LEU 201 Cb 0.50 -0.12 0.15 0.00 -2.33 0.00 0.00 43.42 41.62 3igl n LEU 201 CO 0.13 0.13 0.34 0.54 -1.33 0.00 0.00 177.39 177.19 3igl n ARG 202 N -0.70 2.23 -2.59 3.23 1.74 -1.26 -5.05 116.66 114.26 3igl n ARG 202 Ca 0.16 -3.56 -0.39 0.00 -0.77 0.00 0.00 57.85 53.29 3igl n ARG 202 Cb 0.29 -1.84 -0.05 0.00 -1.02 0.00 0.00 32.46 29.84 3igl n ARG 202 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3igl s VAL 203 N -3.67 3.75 -0.04 1.55 0.11 -1.24 -4.54 120.40 116.32 3igl s VAL 203 Ca 0.43 1.61 0.05 0.00 -2.93 0.00 0.00 61.98 61.14 3igl s VAL 203 Cb 0.39 -3.97 -0.01 0.00 -1.53 0.00 0.00 36.38 31.26 3igl s VAL 203 CO -0.03 0.27 -0.19 -1.61 -3.33 0.00 0.00 175.10 170.21 3igl s GLU 204 N -1.73 1.94 -0.15 1.54 2.02 -0.14 -4.99 118.70 117.19 3igl s GLU 204 Ca 0.48 -0.68 -0.03 0.00 0.02 0.00 0.00 54.97 54.75 3igl s GLU 204 Cb -0.27 -1.69 -0.03 0.00 0.10 0.00 0.00 34.13 32.25 3igl s GLU 204 CO 0.34 0.29 -0.04 0.71 0.02 0.00 0.00 175.26 176.58 3igl s TYR 205 N -0.05 3.02 -0.03 1.61 2.02 -1.26 -0.45 117.35 122.21 3igl s TYR 205 Ca -0.03 -0.29 0.07 0.00 -0.37 0.00 0.00 57.07 56.45 3igl s TYR 205 Cb -0.12 -1.95 -0.02 0.00 -0.40 0.00 0.00 41.96 39.48 3igl s TYR 205 CO 0.02 -0.02 -0.24 -0.51 -1.57 0.00 0.00 175.55 173.23 3igl s LEU 206 N 0.32 2.04 -0.29 -1.29 1.43 0.38 -4.99 118.68 116.29 3igl s LEU 206 Ca -0.04 -0.44 0.02 0.00 -1.03 0.00 0.00 54.13 52.64 3igl s LEU 206 Cb -0.14 -1.24 0.08 0.00 0.03 0.00 0.00 46.19 44.92 3igl s LEU 206 CO 0.03 0.27 -0.02 -1.81 0.23 0.00 0.00 176.35 175.06 3igl s ASP 207 N -0.43 4.35 0.19 2.29 1.11 -1.26 -1.62 116.67 121.29 3igl s ASP 207 Ca 0.05 -1.62 -0.32 0.00 0.18 0.00 0.00 52.55 50.84 3igl s ASP 207 Cb -0.10 -1.40 -0.11 0.00 1.07 0.00 0.00 42.92 42.38 3igl s ASP 207 CO 0.00 -0.29 1.70 -0.62 1.18 0.00 0.00 175.17 177.14 3igl s ASP 208 N 1.17 6.43 0.50 0.27 -1.08 -0.32 -4.89 116.67 118.75 3igl s ASP 208 Ca 0.01 2.80 0.30 0.00 -0.52 0.00 0.00 52.55 55.13 3igl s ASP 208 Cb -0.19 -2.59 1.00 0.00 -1.46 0.00 0.00 42.92 39.67 3igl s ASP 208 CO -0.09 -0.94 1.85 0.08 0.52 0.00 0.00 175.17 176.59 3igl h ARG 209 N 7.05 0.00 0.01 4.34 0.11 -1.96 -1.83 114.38 122.10 3igl h ARG 209 Ca -0.43 0.00 -0.37 0.00 0.10 0.00 0.00 59.98 59.28 3igl h ARG 209 Cb 1.20 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 32.23 3igl h ARG 209 CO 0.95 0.00 -2.05 0.09 0.10 0.00 0.00 179.97 179.06 3igl n ASN 210 N -3.05 1.94 0.02 0.08 3.02 -1.26 -4.65 115.26 111.36 3igl n ASN 210 Ca 0.02 0.31 0.11 0.00 -0.03 0.00 0.00 54.58 54.99 3igl n ASN 210 Cb 0.38 -0.84 0.10 0.00 -0.61 0.00 0.00 39.78 38.81 3igl n ASN 210 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3igl n THR 211 N -4.16 0.13 -0.89 3.41 -2.24 -1.25 -4.96 114.28 104.32 3igl n THR 211 Ca -0.44 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 3igl n THR 211 Cb 0.84 0.25 0.00 0.00 -2.10 0.00 0.00 70.33 69.32 3igl n THR 211 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3igl n PHE 212 N -1.80 0.00 -2.53 4.78 3.72 -0.69 -4.95 117.46 115.99 3igl n PHE 212 Ca 0.03 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.05 3igl n PHE 212 Cb 0.40 -0.95 -0.04 0.00 -0.94 0.00 0.00 39.48 37.94 3igl n PHE 212 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3igl s ARG 213 N -0.84 4.39 0.13 -1.08 0.52 -1.26 -4.57 118.95 116.24 3igl s ARG 213 Ca 0.00 1.62 -0.10 0.00 -0.52 0.00 0.00 55.73 56.74 3igl s ARG 213 Cb 0.00 -2.84 -0.06 0.00 0.52 0.00 0.00 34.95 32.57 3igl s ARG 213 CO 0.00 0.03 0.45 -1.01 0.02 0.00 0.00 175.30 174.79 3igl s HIS 214 N -1.44 3.53 0.10 -0.53 3.76 -1.26 -1.17 115.29 118.28 3igl s HIS 214 Ca 0.52 0.80 -0.14 0.00 -0.15 0.00 0.00 55.06 56.09 3igl s HIS 214 Cb -0.26 -2.18 0.02 0.00 1.11 0.00 0.00 32.58 31.27 3igl s HIS 214 CO 0.33 0.44 0.32 -1.54 -0.85 0.00 0.00 174.74 173.44 3igl s SER 215 N -2.00 -0.11 -0.05 1.40 1.04 -0.64 -4.52 113.70 108.81 3igl s SER 215 Ca 0.38 -0.40 0.02 0.00 0.48 0.00 0.00 55.95 56.43 3igl s SER 215 Cb -0.13 0.42 0.01 0.00 0.10 0.00 0.00 66.02 66.42 3igl s SER 215 CO 0.20 -0.78 -0.11 0.54 0.98 0.00 0.00 173.24 174.07 3igl s VAL 216 N -3.66 0.98 -0.03 5.02 0.11 -0.72 -0.47 120.40 121.64 3igl s VAL 216 Ca 0.03 -0.40 0.05 0.00 -2.93 0.00 0.00 61.98 58.72 3igl s VAL 216 Cb 0.02 -0.91 -0.01 0.00 -1.53 0.00 0.00 36.38 33.96 3igl s VAL 216 CO -0.11 0.32 -0.16 -0.69 -3.33 0.00 0.00 175.10 171.13 3igl s VAL 217 N 0.62 1.33 0.13 2.04 1.01 0.40 -1.16 120.40 124.78 3igl s VAL 217 Ca -0.12 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.21 3igl s VAL 217 Cb -0.14 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 3igl s VAL 217 CO 0.03 0.38 -0.09 0.68 0.00 0.00 0.00 175.10 176.09 3igl s VAL 218 N -0.13 1.07 0.48 2.92 -7.23 -0.34 -0.97 120.40 116.20 3igl s VAL 218 Ca 0.01 -2.02 -0.22 0.00 -1.81 0.00 0.00 61.98 57.94 3igl s VAL 218 Cb -0.09 -1.79 -0.07 0.00 0.56 0.00 0.00 36.38 34.99 3igl s VAL 218 CO 0.01 -0.76 1.17 -2.84 -0.31 0.00 0.00 175.10 172.37 3igl s PRO 219 N -3.71 3.64 0.02 4.82 0.02 -1.26 0.06 135.00 138.59 3igl s PRO 219 Ca 0.15 1.77 -0.30 0.00 0.02 0.00 0.00 61.00 62.64 3igl s PRO 219 Cb 0.03 -2.32 -0.06 0.00 0.02 0.00 0.00 34.50 32.16 3igl s PRO 219 CO -0.01 -0.65 1.43 -0.47 -0.33 0.00 0.00 177.00 176.97 3igl s TYR 220 N -1.57 2.85 -0.09 6.54 5.04 -0.04 -4.70 117.35 125.38 3igl s TYR 220 Ca 0.66 0.78 0.02 0.00 -2.44 0.00 0.00 57.07 56.09 3igl s TYR 220 Cb -0.28 -3.70 -0.02 0.00 0.35 0.00 0.00 41.96 38.31 3igl s TYR 220 CO 0.34 -2.61 -0.15 -1.21 -1.34 0.00 0.00 175.55 170.58 3igl s GLU 221 N 2.25 2.93 0.69 4.97 2.02 -1.26 -4.81 118.70 125.48 3igl s GLU 221 Ca 0.65 -0.72 -0.12 0.00 0.02 0.00 0.00 54.97 54.80 3igl s GLU 221 Cb -0.33 -2.47 0.01 0.00 0.10 0.00 0.00 34.13 31.44 3igl s GLU 221 CO 0.28 0.40 1.07 -1.25 0.02 0.00 0.00 175.26 175.77 3igl s PRO 222 N -0.14 2.87 0.57 0.39 0.04 -1.26 -4.79 135.00 132.68 3igl s PRO 222 Ca -0.01 1.07 -0.20 0.00 0.04 0.00 0.00 61.00 61.90 3igl s PRO 222 Cb -0.14 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.37 3igl s PRO 222 CO 0.03 -1.16 1.00 -2.30 0.04 0.00 0.00 177.00 174.62 3igl n PRO 223 N -2.95 1.03 -1.96 0.56 -0.02 -1.26 -4.92 135.00 125.48 3igl n PRO 223 Ca 0.08 0.39 -0.39 0.00 -2.02 0.00 0.00 63.50 61.57 3igl n PRO 223 Cb 0.53 -2.18 0.01 0.00 -0.02 0.00 0.00 33.50 31.84 3igl n PRO 223 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 3igl s GLU 224 N -2.66 3.62 0.09 -0.52 -1.05 -1.26 -4.85 118.70 112.06 3igl s GLU 224 Ca 0.74 2.16 -0.05 0.00 -0.15 0.00 0.00 54.97 57.67 3igl s GLU 224 Cb -0.44 -2.52 0.12 0.00 -0.44 0.00 0.00 34.13 30.85 3igl s GLU 224 CO 0.49 -0.78 0.53 1.33 0.95 0.00 0.00 175.26 177.77 3igl n VAL 225 N -0.41 -0.16 0.96 1.83 0.24 -1.26 -0.25 118.33 119.27 3igl n VAL 225 Ca 0.07 0.79 0.00 0.00 -2.04 0.00 0.00 64.34 63.16 3igl n VAL 225 Cb 0.44 -1.07 0.00 0.00 -1.47 0.00 0.00 33.84 31.74 3igl n VAL 225 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3igl n GLY 226 N -1.19 1.46 3.10 7.63 0.00 -1.26 -4.92 105.19 110.01 3igl n GLY 226 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 3igl n GLY 226 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3igl s SER 227 N 0.00 1.33 0.02 1.61 0.15 0.65 -5.55 113.70 111.91 3igl s SER 227 Ca 0.00 -0.44 0.23 0.00 0.70 0.00 0.00 55.95 56.44 3igl s SER 227 Cb 0.00 -0.06 0.10 0.00 -1.71 0.00 0.00 66.02 64.35 3igl s SER 227 CO 0.00 -0.03 1.09 0.47 1.20 0.00 0.00 173.24 175.98 3igl n ASP 228 N 1.90 0.66 -4.02 5.45 8.00 -1.26 -4.76 116.55 122.52 3igl n ASP 228 Ca -0.19 -0.40 -0.09 0.00 0.71 0.00 0.00 54.79 54.82 3igl n ASP 228 Cb 0.55 0.71 -0.06 0.00 -0.02 0.00 0.00 41.12 42.30 3igl n ASP 228 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3igl s THR 230 N -4.04 2.17 -0.15 0.00 2.01 -0.39 -4.45 115.64 110.79 3igl s THR 230 Ca 0.25 -1.02 -0.02 0.00 0.31 0.00 0.00 61.69 61.21 3igl s THR 230 Cb 0.00 -1.80 -0.02 0.00 0.01 0.00 0.00 72.50 70.69 3igl s THR 230 CO 0.09 0.57 -0.08 -0.89 -0.69 0.00 0.00 174.62 173.61 3igl s THR 231 N -0.07 3.38 -0.03 -0.82 2.01 -1.26 -0.21 115.64 118.64 3igl s THR 231 Ca -0.06 -0.53 0.01 0.00 0.31 0.00 0.00 61.69 61.42 3igl s THR 231 Cb -0.14 -2.46 -0.03 0.00 0.01 0.00 0.00 72.50 69.87 3igl s THR 231 CO 0.05 0.50 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.81 3igl s ILE 232 N 0.56 3.96 -0.49 1.82 1.01 -0.01 -4.93 121.20 123.13 3igl s ILE 232 Ca -0.06 -0.54 -0.15 0.00 0.00 0.00 0.00 60.65 59.91 3igl s ILE 232 Cb -0.15 -2.70 0.09 0.00 0.01 0.00 0.00 42.46 39.71 3igl s ILE 232 CO 0.03 0.48 0.41 -1.00 0.00 0.00 0.00 174.94 174.86 3igl s HIS 233 N -0.96 3.27 0.24 3.97 3.76 -1.26 -0.62 115.29 123.68 3igl s HIS 233 Ca 0.16 -1.16 -0.01 0.00 -0.15 0.00 0.00 55.06 53.89 3igl s HIS 233 Cb -0.11 -3.36 -0.04 0.00 1.11 0.00 0.00 32.58 30.17 3igl s HIS 233 CO 0.06 -0.88 0.45 0.71 -0.85 0.00 0.00 174.74 174.22 3igl s TYR 234 N 1.59 3.48 -0.01 1.40 2.02 -0.81 -1.46 117.35 123.56 3igl s TYR 234 Ca 0.04 0.40 0.03 0.00 -0.37 0.00 0.00 57.07 57.17 3igl s TYR 234 Cb -0.26 -1.91 -0.01 0.00 -0.40 0.00 0.00 41.96 39.38 3igl s TYR 234 CO 0.05 0.30 -0.11 -0.80 -1.57 0.00 0.00 175.55 173.42 3igl s ASN 235 N -3.29 1.30 -0.18 2.29 0.02 -0.08 -0.03 114.94 114.97 3igl s ASN 235 Ca 0.40 -0.20 -0.04 0.00 -1.02 0.00 0.00 52.86 52.00 3igl s ASN 235 Cb -0.11 -0.16 -0.02 0.00 0.02 0.00 0.00 41.25 40.99 3igl s ASN 235 CO 0.30 0.13 -0.03 -0.31 0.02 0.00 0.00 177.10 177.21 3igl s TYR 236 N -0.24 3.00 -2.14 2.20 1.51 -1.26 -1.01 117.35 119.41 3igl s TYR 236 Ca 0.04 -0.49 0.20 0.00 -1.01 0.00 0.00 57.07 55.81 3igl s TYR 236 Cb -0.04 -2.02 0.54 0.00 -0.11 0.00 0.00 41.96 40.33 3igl s TYR 236 CO -0.00 -0.20 1.45 -1.33 -1.11 0.00 0.00 175.55 174.35 3igl n MET 237 N 3.98 2.38 -4.12 -0.62 2.81 -0.33 -0.50 117.12 120.72 3igl n MET 237 Ca -0.17 -2.12 -0.10 0.00 -1.81 0.00 0.00 57.70 53.49 3igl n MET 237 Cb 0.52 -1.48 -0.10 0.00 -0.71 0.00 0.00 33.22 31.45 3igl n MET 237 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3igl s ASN 239 N -2.60 5.72 0.40 0.00 0.02 -1.26 -4.76 114.94 112.46 3igl s ASN 239 Ca 0.05 1.94 0.15 0.00 -1.02 0.00 0.00 52.86 53.98 3igl s ASN 239 Cb 0.01 -2.55 1.02 0.00 0.02 0.00 0.00 41.25 39.76 3igl s ASN 239 CO -0.04 -1.21 1.85 0.28 0.02 0.00 0.00 177.10 178.00 3igl h SER 240 N 0.67 0.47 0.50 -1.22 0.02 -1.01 -1.76 113.55 111.22 3igl h SER 240 Ca -0.48 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 3igl h SER 240 Cb 1.23 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.73 3igl h SER 240 CO 0.57 0.19 0.00 -1.54 -1.14 0.00 0.00 176.83 174.91 3igl n SER 241 N -4.54 0.00 -4.66 3.07 3.41 -1.26 0.71 113.62 110.35 3igl n SER 241 Ca 0.19 -0.15 -0.54 0.00 -0.26 0.00 0.00 58.87 58.11 3igl n SER 241 Cb 0.65 -0.27 -0.06 0.00 -0.26 0.00 0.00 64.21 64.27 3igl n SER 241 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3igl s MET 243 N 2.34 4.23 0.00 0.00 -2.45 -1.26 -1.17 119.30 120.99 3igl s MET 243 Ca 0.92 2.38 0.00 0.00 -1.25 0.00 0.00 55.69 57.74 3igl s MET 243 Cb -0.98 -3.08 0.00 0.00 1.25 0.00 0.00 34.83 32.03 3igl s MET 243 CO 0.56 -0.47 0.00 0.41 1.05 0.00 0.00 175.02 176.57 3igl n GLY 244 N 2.02 1.40 0.00 2.11 0.00 -1.26 -4.62 105.19 104.83 3igl n GLY 244 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3igl n GLY 244 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3igl n GLY 245 N -2.00 2.11 0.29 -0.02 0.00 -0.66 -4.37 105.19 100.54 3igl n GLY 245 Ca 0.00 -0.04 0.11 0.00 0.00 0.00 0.00 46.02 46.09 3igl n GLY 245 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3igl h MET 246 N 0.00 0.00 -6.14 1.61 2.07 -1.76 -3.46 114.93 107.25 3igl h MET 246 Ca 0.00 0.00 -0.44 0.00 -2.07 0.00 0.00 59.70 57.19 3igl h MET 246 Cb 0.00 0.00 0.03 0.00 -1.87 0.00 0.00 31.60 29.76 3igl h MET 246 CO 0.00 0.00 -0.77 -1.71 1.07 0.00 0.00 176.91 175.50 3igl n ASN 247 N -4.48 -3.89 0.00 1.22 5.15 -0.31 -0.95 115.26 112.00 3igl n ASN 247 Ca 0.00 -0.75 0.00 0.00 -0.60 0.00 0.00 54.58 53.24 3igl n ASN 247 Cb 0.23 -4.17 0.00 0.00 -0.53 0.00 0.00 39.78 35.31 3igl n ASN 247 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3igl n ARG 248 N -4.59 0.00 -2.55 1.20 1.74 0.22 -4.93 116.66 107.75 3igl n ARG 248 Ca -0.08 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.58 3igl n ARG 248 Cb 0.58 -2.15 -0.02 0.00 -1.02 0.00 0.00 32.46 29.85 3igl n ARG 248 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3igl s ARG 249 N -0.03 4.27 0.44 5.56 0.52 -0.13 -4.88 118.95 124.70 3igl s ARG 249 Ca 0.00 1.51 -0.26 0.00 -0.52 0.00 0.00 55.73 56.47 3igl s ARG 249 Cb 0.00 -3.68 -0.09 0.00 0.52 0.00 0.00 34.95 31.70 3igl s ARG 249 CO 0.00 -0.63 1.41 -2.30 0.02 0.00 0.00 175.30 173.80 3igl n PRO 250 N 6.27 2.25 -4.32 3.54 -0.02 -1.26 -4.91 135.00 136.55 3igl n PRO 250 Ca 0.13 0.80 -0.24 0.00 -2.02 0.00 0.00 63.50 62.16 3igl n PRO 250 Cb 0.46 -2.59 -0.08 0.00 -0.02 0.00 0.00 33.50 31.26 3igl n PRO 250 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 3igl s ILE 251 N -1.18 3.20 -0.09 4.25 -4.36 -1.25 -1.02 121.20 120.75 3igl s ILE 251 Ca 0.60 -1.92 -0.02 0.00 -0.26 0.00 0.00 60.65 59.05 3igl s ILE 251 Cb -0.46 -2.67 -0.03 0.00 1.25 0.00 0.00 42.46 40.54 3igl s ILE 251 CO 0.58 -0.30 0.01 -0.76 0.24 0.00 0.00 174.94 174.71 3igl s LEU 252 N -3.38 3.60 -0.22 0.37 1.43 0.75 -1.01 118.68 120.23 3igl s LEU 252 Ca 0.29 0.15 -0.18 0.00 -1.03 0.00 0.00 54.13 53.36 3igl s LEU 252 Cb -0.07 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 3igl s LEU 252 CO 0.18 0.37 0.50 -0.89 0.23 0.00 0.00 176.35 176.73 3igl s THR 253 N -0.83 5.11 -0.27 5.49 2.01 0.88 -1.09 115.64 126.94 3igl s THR 253 Ca 0.13 0.89 -0.11 0.00 0.31 0.00 0.00 61.69 62.91 3igl s THR 253 Cb -0.11 -3.82 -0.05 0.00 0.01 0.00 0.00 72.50 68.53 3igl s THR 253 CO 0.02 0.16 0.18 -0.63 -0.69 0.00 0.00 174.62 173.66 3igl s ILE 254 N 1.79 5.28 -0.23 1.82 1.01 0.10 -1.51 121.20 129.46 3igl s ILE 254 Ca 0.22 0.16 -0.05 0.00 0.00 0.00 0.00 60.65 60.98 3igl s ILE 254 Cb -0.15 -3.50 -0.02 0.00 0.01 0.00 0.00 42.46 38.80 3igl s ILE 254 CO 0.09 0.28 0.00 -0.63 0.00 0.00 0.00 174.94 174.69 3igl s ILE 255 N 1.54 3.77 -0.03 2.92 -1.09 0.01 -1.73 121.20 126.59 3igl s ILE 255 Ca 0.07 -0.36 0.07 0.00 -2.23 0.00 0.00 60.65 58.20 3igl s ILE 255 Cb -0.15 -2.73 -0.02 0.00 -1.58 0.00 0.00 42.46 37.97 3igl s ILE 255 CO 0.09 0.39 -0.23 0.42 -1.23 0.00 0.00 174.94 174.38 3igl s THR 256 N 1.48 2.28 -0.19 2.92 -4.23 -0.22 -1.15 115.64 116.52 3igl s THR 256 Ca 0.05 -1.02 -0.09 0.00 -1.18 0.00 0.00 61.69 59.46 3igl s THR 256 Cb -0.15 -1.82 -0.05 0.00 1.34 0.00 0.00 72.50 71.83 3igl s THR 256 CO -0.00 0.58 0.11 -0.22 -0.54 0.00 0.00 174.62 174.55 3igl s LEU 257 N -0.60 4.08 -0.01 4.79 2.96 -0.13 -1.50 118.68 128.28 3igl s LEU 257 Ca 0.09 0.19 0.01 0.00 -0.22 0.00 0.00 54.13 54.19 3igl s LEU 257 Cb -0.10 -2.05 0.00 0.00 0.50 0.00 0.00 46.19 44.54 3igl s LEU 257 CO -0.00 0.18 -0.01 -1.61 -1.32 0.00 0.00 176.35 173.59 3igl s GLU 258 N 0.33 0.17 0.98 1.98 2.02 -0.37 -1.00 118.70 122.82 3igl s GLU 258 Ca 0.06 -0.04 -0.16 0.00 0.02 0.00 0.00 54.97 54.86 3igl s GLU 258 Cb -0.11 -0.21 0.20 0.00 0.10 0.00 0.00 34.13 34.11 3igl s GLU 258 CO -0.01 0.01 1.26 0.16 0.02 0.00 0.00 175.26 176.70 3igl s ASP 259 N 0.17 2.90 0.56 -0.19 1.47 -0.19 -0.20 116.67 121.20 3igl s ASP 259 Ca -0.01 0.42 0.34 0.00 1.18 0.00 0.00 52.55 54.47 3igl s ASP 259 Cb -0.03 -0.57 1.64 0.00 -0.34 0.00 0.00 42.92 43.61 3igl s ASP 259 CO -0.00 -2.88 2.11 0.77 0.68 0.00 0.00 175.17 175.84 3igl h SER 260 N -1.74 0.00 1.42 2.11 4.64 -1.81 -1.73 113.55 116.44 3igl h SER 260 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3igl h SER 260 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3igl h SER 260 CO 0.42 0.06 0.00 -1.20 -0.87 0.00 0.00 176.83 175.23 3igl n SER 261 N -3.31 0.77 0.00 4.97 7.64 -1.26 -4.93 113.62 117.50 3igl n SER 261 Ca -0.01 0.58 0.00 0.00 1.01 0.00 0.00 58.87 60.44 3igl n SER 261 Cb 0.23 -0.78 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 3igl n SER 261 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3igl n GLY 262 N 1.25 0.99 3.77 0.23 0.00 -0.65 -5.08 105.19 105.70 3igl n GLY 262 Ca 0.05 -0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 3igl n GLY 262 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3igl s ASN 263 N -2.00 6.60 -0.40 1.61 0.01 -1.26 -4.79 114.94 114.71 3igl s ASN 263 Ca 0.00 2.49 -0.29 0.00 -0.71 0.00 0.00 52.86 54.35 3igl s ASN 263 Cb 0.00 -2.63 0.02 0.00 0.41 0.00 0.00 41.25 39.05 3igl s ASN 263 CO 0.00 -0.63 1.12 -0.22 -1.51 0.00 0.00 177.10 175.86 3igl s LEU 264 N -2.21 3.77 -0.07 0.60 2.96 -1.26 -1.02 118.68 121.44 3igl s LEU 264 Ca 0.54 0.75 0.00 0.00 -0.22 0.00 0.00 54.13 55.20 3igl s LEU 264 Cb -0.35 -3.55 -0.25 0.00 0.50 0.00 0.00 46.19 42.54 3igl s LEU 264 CO 0.45 -1.09 0.55 -0.07 -1.32 0.00 0.00 176.35 174.86 3igl h LEU 265 N 10.73 0.27 -7.00 -0.68 3.38 -1.43 -3.49 115.31 117.10 3igl h LEU 265 Ca -0.22 -0.57 -0.03 0.00 0.09 0.00 0.00 57.88 57.15 3igl h LEU 265 Cb 1.06 -0.09 -0.18 0.00 0.09 0.00 0.00 40.66 41.55 3igl h LEU 265 CO 1.08 1.50 0.23 -0.83 0.09 0.00 0.00 178.44 180.52 3igl s GLY 266 N -5.32 -0.56 -0.06 0.83 0.00 -1.06 -4.23 107.32 96.92 3igl s GLY 266 Ca -0.14 1.17 -0.03 0.00 0.00 0.00 0.00 44.72 45.72 3igl s GLY 266 CO 0.80 0.76 0.14 -1.60 0.00 0.00 0.00 173.10 173.20 3igl s ARG 267 N -1.85 0.09 0.14 2.90 3.52 0.38 -0.96 118.95 123.17 3igl s ARG 267 Ca -0.07 0.34 0.01 0.00 -0.13 0.00 0.00 55.73 55.88 3igl s ARG 267 Cb -0.00 -0.16 -0.04 0.00 -1.56 0.00 0.00 34.95 33.18 3igl s ARG 267 CO 0.03 -0.15 0.01 -0.80 -0.81 0.00 0.00 175.30 173.58 3igl s ASN 268 N 1.06 0.86 0.07 -2.12 0.01 -0.30 -0.54 114.94 113.98 3igl s ASN 268 Ca -0.08 -1.15 -0.12 0.00 -0.71 0.00 0.00 52.86 50.80 3igl s ASN 268 Cb -0.11 0.18 0.01 0.00 0.41 0.00 0.00 41.25 41.74 3igl s ASN 268 CO -0.05 -0.61 0.27 -0.94 -1.51 0.00 0.00 177.10 174.26 3igl s SER 269 N -3.09 -0.04 -0.01 -1.22 1.04 -1.26 -0.81 113.70 108.31 3igl s SER 269 Ca 0.21 -0.40 -0.04 0.00 0.48 0.00 0.00 55.95 56.20 3igl s SER 269 Cb 0.07 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.55 3igl s SER 269 CO 0.01 -0.69 0.09 0.72 0.98 0.00 0.00 173.24 174.35 3igl s PHE 270 N -3.25 0.03 0.54 5.02 -0.71 -0.57 -4.97 117.98 114.07 3igl s PHE 270 Ca -0.00 -0.05 -0.16 0.00 -1.04 0.00 0.00 56.93 55.68 3igl s PHE 270 Cb 0.02 -0.04 -0.07 0.00 -1.21 0.00 0.00 43.02 41.72 3igl s PHE 270 CO -0.08 -0.18 1.00 -2.00 -1.34 0.00 0.00 175.22 172.63 3igl s GLU 271 N -0.85 3.80 -0.01 1.99 2.12 -0.39 -0.08 118.70 125.28 3igl s GLU 271 Ca -0.09 0.98 0.01 0.00 0.36 0.00 0.00 54.97 56.23 3igl s GLU 271 Cb -0.06 -2.11 -0.00 0.00 0.26 0.00 0.00 34.13 32.22 3igl s GLU 271 CO 0.00 -0.40 -0.05 0.08 -0.54 0.00 0.00 175.26 174.36 3igl s VAL 272 N -2.65 0.39 -0.22 3.70 1.01 -0.18 -0.74 120.40 121.72 3igl s VAL 272 Ca 0.59 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 62.38 3igl s VAL 272 Cb -0.11 -0.34 0.05 0.00 0.00 0.00 0.00 36.38 35.98 3igl s VAL 272 CO 0.34 0.12 -0.07 -0.60 0.00 0.00 0.00 175.10 174.89 3igl s ARG 273 N -0.04 1.80 -0.19 2.72 3.52 0.56 -3.75 118.95 123.57 3igl s ARG 273 Ca 0.01 -0.92 -0.18 0.00 -0.13 0.00 0.00 55.73 54.51 3igl s ARG 273 Cb -0.03 -2.50 -0.03 0.00 -1.56 0.00 0.00 34.95 30.83 3igl s ARG 273 CO -0.00 -0.52 0.49 0.08 -0.81 0.00 0.00 175.30 174.54 3igl s VAL 274 N 1.40 5.13 0.17 7.11 1.01 -1.26 -1.62 120.40 132.34 3igl s VAL 274 Ca -0.04 0.92 -0.18 0.00 0.00 0.00 0.00 61.98 62.67 3igl s VAL 274 Cb -0.18 -3.82 0.04 0.00 0.00 0.00 0.00 36.38 32.42 3igl s VAL 274 CO -0.07 0.21 0.51 0.00 0.00 0.00 0.00 175.10 175.75 3igl h ALA 276 N 2.19 1.29 -2.42 0.00 0.00 -1.96 -3.32 119.26 115.05 3igl h ALA 276 Ca -0.31 -0.12 -0.59 0.00 0.00 0.00 0.00 54.91 53.89 3igl h ALA 276 Cb 1.27 -0.30 -0.41 0.00 0.00 0.00 0.00 17.79 18.35 3igl h ALA 276 CO 0.40 0.57 -0.77 0.00 0.00 0.00 0.00 179.25 179.45 3igl h PRO 278 N 4.71 0.57 -0.12 0.00 0.11 -1.70 -0.76 132.00 134.81 3igl h PRO 278 Ca 0.17 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.17 3igl h PRO 278 Cb 0.78 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.76 3igl h PRO 278 CO 0.64 0.38 -0.20 0.78 -0.21 0.00 0.00 178.00 179.39 3igl h GLY 279 N 0.59 0.39 0.99 -0.55 0.00 -1.26 -0.50 103.07 102.73 3igl h GLY 279 Ca 0.38 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.27 3igl h GLY 279 CO -0.14 0.39 0.20 -0.09 0.00 0.00 0.00 176.54 176.90 3igl h ARG 280 N -0.06 0.41 0.00 4.80 2.43 -1.12 -2.03 114.38 118.82 3igl h ARG 280 Ca 0.01 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.00 3igl h ARG 280 Cb 0.77 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.21 3igl h ARG 280 CO 0.05 0.29 -0.72 -0.44 -1.51 0.00 0.00 179.97 177.63 3igl h ASP 281 N 0.41 0.00 -0.16 -3.80 5.19 -1.03 -0.82 116.42 116.21 3igl h ASP 281 Ca 0.11 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.46 3igl h ASP 281 Cb -0.03 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.48 3igl h ASP 281 CO -0.02 0.72 -0.14 -0.09 -3.12 0.00 0.00 179.24 176.59 3igl h ARG 282 N 0.00 0.37 -0.74 3.56 2.43 -0.99 -1.69 114.38 117.32 3igl h ARG 282 Ca -0.01 -0.19 -0.04 0.00 -0.81 0.00 0.00 59.98 58.94 3igl h ARG 282 Cb 1.39 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.91 3igl h ARG 282 CO 0.09 0.73 0.32 0.00 -1.51 0.00 0.00 179.97 179.61 3igl h ARG 283 N 0.01 1.08 -0.49 0.20 3.08 -1.10 -0.44 114.38 116.72 3igl h ARG 283 Ca 0.03 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 59.88 3igl h ARG 283 Cb 0.66 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 3igl h ARG 283 CO 0.03 0.86 0.21 1.15 -1.07 0.00 0.00 179.97 181.15 3igl h THR 284 N 1.06 1.20 -0.01 2.04 2.02 -0.99 -0.57 112.91 117.65 3igl h THR 284 Ca 0.25 -0.61 -0.17 0.00 0.77 0.00 0.00 66.41 66.65 3igl h THR 284 Cb 0.16 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 3igl h THR 284 CO -0.03 0.23 -0.78 -0.33 0.37 0.00 0.00 175.52 174.99 3igl h GLU 285 N 0.64 0.13 -0.56 6.66 5.08 -1.01 -0.19 114.58 125.34 3igl h GLU 285 Ca 0.16 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.33 3igl h GLU 285 Cb 0.16 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 3igl h GLU 285 CO -0.02 0.84 0.09 0.93 -1.00 0.00 0.00 179.01 179.86 3igl h GLU 286 N 0.08 0.89 -0.24 2.33 5.08 -0.95 -0.79 114.58 120.97 3igl h GLU 286 Ca -0.02 -0.21 -0.13 0.00 -1.00 0.00 0.00 59.36 57.99 3igl h GLU 286 Cb 1.36 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.50 3igl h GLU 286 CO 0.11 0.83 -0.37 1.49 -1.00 0.00 0.00 179.01 180.07 3igl h GLU 287 N 0.84 0.68 -0.80 2.33 4.57 -0.79 -1.84 114.58 119.56 3igl h GLU 287 Ca 0.17 -0.41 0.07 0.00 -1.18 0.00 0.00 59.36 58.02 3igl h GLU 287 Cb 0.37 0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 28.94 3igl h GLU 287 CO 0.01 1.02 0.48 -0.91 -1.18 0.00 0.00 179.01 178.43 3igl h ASN 288 N 0.40 0.73 -0.40 1.04 2.35 -0.91 -0.04 115.58 118.75 3igl h ASN 288 Ca 0.02 0.03 0.02 0.00 -0.55 0.00 0.00 56.30 55.82 3igl h ASN 288 Cb 0.96 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 39.18 3igl h ASN 288 CO 0.09 0.46 0.22 0.25 -1.65 0.00 0.00 177.43 176.80 3igl h LEU 289 N 0.86 0.35 -0.30 1.61 5.85 -0.88 0.45 115.31 123.25 3igl h LEU 289 Ca 0.36 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 59.04 3igl h LEU 289 Cb 0.22 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 3igl h LEU 289 CO -0.19 0.25 0.02 0.03 -0.34 0.00 0.00 178.44 178.21 3igl h ARG 290 N 0.45 0.53 0.01 1.25 3.08 -0.67 0.07 114.38 119.10 3igl h ARG 290 Ca 0.16 -0.16 -0.20 0.00 0.07 0.00 0.00 59.98 59.85 3igl h ARG 290 Cb 0.03 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 3igl h ARG 290 CO -0.09 0.66 -0.89 0.87 -1.07 0.00 0.00 179.97 179.44 3igl h LYS 291 N 0.33 0.16 0.00 0.04 1.57 -0.90 -3.40 116.57 114.37 3igl h LYS 291 Ca 0.09 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3igl h LYS 291 Cb 0.41 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.77 3igl h LYS 291 CO 0.01 0.95 0.00 1.63 -0.57 0.00 0.00 179.45 181.47 3igl n LYS 292 N -3.62 0.64 0.00 3.15 5.02 0.13 -5.09 118.16 118.38 3igl n LYS 292 Ca -0.03 -0.09 0.16 0.00 -2.02 0.00 0.00 58.31 56.32 3igl n LYS 292 Cb 0.82 -0.46 0.90 0.00 -0.02 0.00 0.00 35.03 36.27 3igl n LYS 292 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29