#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ekj n SER 111 N 0.00 0.00 -2.69 8.00 2.88 -1.26 -4.62 113.62 115.94 1ekj n SER 111 Ca 0.00 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.47 1ekj n SER 111 Cb 0.00 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 63.50 1ekj n SER 111 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1ekj n SER 112 N 0.00 1.91 -3.41 -3.46 7.64 -1.22 -4.66 113.62 110.42 1ekj n SER 112 Ca 0.00 -2.54 -0.16 0.00 1.01 0.00 0.00 58.87 57.18 1ekj n SER 112 Cb 0.00 -0.49 -0.10 0.00 -1.01 0.00 0.00 64.21 62.61 1ekj n SER 112 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ekj s SER 113 N -3.47 1.38 -1.48 6.43 1.04 -1.13 -4.90 113.70 111.58 1ekj s SER 113 Ca 0.30 -0.51 -0.02 0.00 0.48 0.00 0.00 55.95 56.20 1ekj s SER 113 Cb 0.39 0.58 0.02 0.00 0.10 0.00 0.00 66.02 67.11 1ekj s SER 113 CO -0.01 -0.36 0.33 0.47 0.98 0.00 0.00 173.24 174.64 1ekj n ASP 114 N 5.32 -0.18 0.00 7.02 8.00 -1.26 -1.15 116.55 134.30 1ekj n ASP 114 Ca -0.03 -1.09 0.00 0.00 0.71 0.00 0.00 54.79 54.38 1ekj n ASP 114 Cb 0.48 -2.59 0.00 0.00 -0.02 0.00 0.00 41.12 38.99 1ekj n ASP 114 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ekj n GLY 115 N -2.10 2.52 3.62 0.44 0.00 -1.26 -5.01 105.19 103.40 1ekj n GLY 115 Ca -0.28 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.39 1ekj n GLY 115 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ekj s ILE 116 N -3.21 4.90 0.58 -0.61 1.01 -0.30 -4.93 121.20 118.64 1ekj s ILE 116 Ca 0.00 0.01 -0.18 0.00 0.00 0.00 0.00 60.65 60.48 1ekj s ILE 116 Cb 0.00 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 39.19 1ekj s ILE 116 CO 0.00 0.41 1.13 -2.16 0.00 0.00 0.00 174.94 174.32 1ekj s PRO 117 N 0.72 3.16 -0.01 2.79 0.04 -1.26 -2.86 135.00 137.58 1ekj s PRO 117 Ca 0.05 1.57 0.04 0.00 0.04 0.00 0.00 61.00 62.69 1ekj s PRO 117 Cb -0.13 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 1ekj s PRO 117 CO 0.02 -1.00 -0.12 -1.59 0.04 0.00 0.00 177.00 174.35 1ekj s LYS 118 N -3.52 0.97 -0.34 4.56 -2.85 -1.26 -4.76 119.74 112.53 1ekj s LYS 118 Ca 0.71 -0.45 -0.22 0.00 -1.00 0.00 0.00 55.97 55.02 1ekj s LYS 118 Cb -0.23 -0.94 0.00 0.00 -2.06 0.00 0.00 37.83 34.60 1ekj s LYS 118 CO 0.32 0.26 0.71 0.45 0.10 0.00 0.00 175.35 177.18 1ekj s SER 119 N -0.33 6.52 0.11 0.03 0.15 -1.26 -1.29 113.70 117.63 1ekj s SER 119 Ca 0.04 0.34 -0.29 0.00 0.70 0.00 0.00 55.95 56.74 1ekj s SER 119 Cb -0.05 -2.36 -0.10 0.00 -1.71 0.00 0.00 66.02 61.80 1ekj s SER 119 CO -0.00 -0.63 1.61 -0.33 1.20 0.00 0.00 173.24 175.08 1ekj h GLU 120 N 8.38 -0.59 -0.37 5.44 5.08 -1.99 -0.38 114.58 130.15 1ekj h GLU 120 Ca -0.25 0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.22 1ekj h GLU 120 Cb 1.10 0.13 -0.09 0.00 0.50 0.00 0.00 28.75 30.40 1ekj h GLU 120 CO 0.87 -0.39 -0.39 0.00 -1.00 0.00 0.00 179.01 178.10 1ekj h ALA 121 N -0.03 -0.35 -0.60 3.43 0.00 -1.99 0.37 119.26 120.09 1ekj h ALA 121 Ca 0.02 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ekj h ALA 121 Cb 0.62 0.81 -0.03 0.00 0.00 0.00 0.00 17.79 19.19 1ekj h ALA 121 CO -0.18 -0.82 0.37 0.77 0.00 0.00 0.00 179.25 179.39 1ekj h SER 122 N -0.32 0.70 -0.30 0.00 0.02 -1.93 -1.19 113.55 110.53 1ekj h SER 122 Ca 0.14 -0.03 -0.15 0.00 -0.84 0.00 0.00 61.79 60.92 1ekj h SER 122 Cb 0.57 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.93 1ekj h SER 122 CO -0.54 0.53 -0.38 -0.08 -1.14 0.00 0.00 176.83 175.22 1ekj h GLU 123 N 0.82 0.79 -0.70 3.45 4.57 0.26 -1.61 114.58 122.16 1ekj h GLU 123 Ca 0.22 -0.45 -0.01 0.00 -1.18 0.00 0.00 59.36 57.94 1ekj h GLU 123 Cb -0.05 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.53 1ekj h GLU 123 CO -0.04 1.08 0.41 -0.09 -1.18 0.00 0.00 179.01 179.19 1ekj h ARG 124 N 0.56 0.96 -0.26 1.92 9.65 0.22 -0.60 114.38 126.82 1ekj h ARG 124 Ca 0.04 -0.09 -0.01 0.00 -1.10 0.00 0.00 59.98 58.81 1ekj h ARG 124 Cb 0.97 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 29.34 1ekj h ARG 124 CO 0.09 0.69 0.11 0.82 2.80 0.00 0.00 179.97 184.48 1ekj h ILE 125 N 0.96 1.17 0.82 1.20 2.04 -1.14 -0.72 117.51 121.83 1ekj h ILE 125 Ca 0.25 -0.50 -0.04 0.00 1.00 0.00 0.00 64.86 65.57 1ekj h ILE 125 Cb -0.01 1.01 0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1ekj h ILE 125 CO -0.04 0.17 -0.42 0.50 0.00 0.00 0.00 178.15 178.36 1ekj h LYS 126 N 0.28 -1.09 -0.67 2.37 3.64 -0.96 -0.69 116.57 119.46 1ekj h LYS 126 Ca 0.09 0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.58 1ekj h LYS 126 Cb 0.17 0.25 -0.05 0.00 -0.41 0.00 0.00 32.23 32.19 1ekj h LYS 126 CO -0.01 -0.73 0.40 1.79 -2.27 0.00 0.00 179.45 178.64 1ekj h THR 127 N -1.13 1.04 -0.60 1.00 1.35 -1.15 -0.71 112.91 112.71 1ekj h THR 127 Ca -0.11 -0.26 0.07 0.00 -0.55 0.00 0.00 66.41 65.55 1ekj h THR 127 Cb 0.88 0.21 -0.06 0.00 -1.73 0.00 0.00 68.15 67.45 1ekj h THR 127 CO 0.17 0.14 0.30 1.23 -0.25 0.00 0.00 175.52 177.10 1ekj h GLY 128 N 0.76 0.86 1.10 5.82 0.00 -0.98 0.11 103.07 110.75 1ekj h GLY 128 Ca 0.28 -0.19 -0.11 0.00 0.00 0.00 0.00 47.33 47.31 1ekj h GLY 128 CO -0.14 0.09 -0.08 -2.75 0.00 0.00 0.00 176.54 173.66 1ekj h PHE 129 N 0.55 1.17 -0.47 5.60 3.57 -0.53 -2.09 116.94 124.74 1ekj h PHE 129 Ca 0.28 -0.23 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1ekj h PHE 129 Cb 0.23 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.65 1ekj h PHE 129 CO -0.11 1.07 0.23 -0.07 -2.23 0.00 0.00 178.31 177.20 1ekj h LEU 130 N 0.94 0.58 -0.19 0.59 3.38 -0.35 0.12 115.31 120.38 1ekj h LEU 130 Ca 0.15 -0.05 -0.21 0.00 0.09 0.00 0.00 57.88 57.87 1ekj h LEU 130 Cb 0.65 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.26 1ekj h LEU 130 CO 0.05 0.49 -0.70 -0.74 0.09 0.00 0.00 178.44 177.62 1ekj h HIS 131 N 0.65 1.07 -0.66 1.13 2.76 -0.84 -2.02 115.15 117.25 1ekj h HIS 131 Ca 0.17 -0.45 -0.08 0.00 -2.20 0.00 0.00 60.37 57.81 1ekj h HIS 131 Cb 0.06 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 28.81 1ekj h HIS 131 CO 0.00 1.28 0.09 0.35 -1.30 0.00 0.00 177.93 178.36 1ekj h PHE 132 N 0.56 1.18 0.50 5.26 3.57 -0.92 -0.80 116.94 126.30 1ekj h PHE 132 Ca -0.03 -0.17 -0.02 0.00 3.53 0.00 0.00 57.97 61.28 1ekj h PHE 132 Cb 1.32 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.74 1ekj h PHE 132 CO 0.08 0.99 -0.27 -0.22 -2.23 0.00 0.00 178.31 176.67 1ekj h LYS 133 N 1.02 -0.68 0.12 1.11 3.11 -0.74 -0.74 116.57 119.78 1ekj h LYS 133 Ca 0.20 0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 58.08 1ekj h LYS 133 Cb 0.46 0.16 0.00 0.00 -1.00 0.00 0.00 32.23 31.84 1ekj h LYS 133 CO 0.02 -0.46 -0.06 -0.22 -2.81 0.00 0.00 179.45 175.92 1ekj h LYS 134 N -0.71 -0.16 0.00 1.90 3.64 -1.35 0.31 116.57 120.20 1ekj h LYS 134 Ca -0.06 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1ekj h LYS 134 Cb 0.56 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1ekj h LYS 134 CO 0.09 0.07 -0.76 0.93 -2.27 0.00 0.00 179.45 177.52 1ekj h GLU 135 N -0.38 0.00 0.00 1.90 4.39 -1.23 -3.38 114.58 115.88 1ekj h GLU 135 Ca -0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1ekj h GLU 135 Cb 0.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1ekj h GLU 135 CO 0.03 0.00 0.00 1.63 -1.16 0.00 0.00 179.01 179.51 1ekj n LYS 136 N -2.56 0.00 0.12 2.33 4.76 -0.41 -4.57 118.16 117.83 1ekj n LYS 136 Ca 0.02 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.33 1ekj n LYS 136 Cb 0.51 -0.36 -0.06 0.00 -1.84 0.00 0.00 35.03 33.29 1ekj n LYS 136 CO 0.00 0.00 0.00 -0.92 -1.37 0.00 0.00 177.40 175.11 1ekj h TYR 137 N 0.00 -0.62 0.00 2.13 3.20 -1.18 -2.42 116.97 118.08 1ekj h TYR 137 Ca 0.00 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 1ekj h TYR 137 Cb 0.00 0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.52 1ekj h TYR 137 CO 0.00 -0.33 -0.09 -0.44 -1.64 0.00 0.00 178.16 175.65 1ekj h ASP 138 N -0.44 0.00 -0.13 -2.11 5.19 -0.57 -3.01 116.42 115.35 1ekj h ASP 138 Ca 0.02 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 1ekj h ASP 138 Cb 0.45 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.96 1ekj h ASP 138 CO -0.11 0.09 0.00 0.29 -3.12 0.00 0.00 179.24 176.39 1ekj n LYS 139 N -3.34 1.79 -3.08 3.56 5.02 -0.94 -4.36 118.16 116.81 1ekj n LYS 139 Ca -0.01 -1.18 -0.17 0.00 -2.02 0.00 0.00 58.31 54.94 1ekj n LYS 139 Cb 0.28 -1.43 -0.01 0.00 -0.02 0.00 0.00 35.03 33.85 1ekj n LYS 139 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1ekj n ASN 140 N 0.40 -0.01 0.27 4.39 2.85 -1.08 -4.94 115.26 117.16 1ekj n ASN 140 Ca 0.17 -3.12 0.13 0.00 -0.11 0.00 0.00 54.58 51.66 1ekj n ASN 140 Cb 0.37 -0.04 0.78 0.00 1.24 0.00 0.00 39.78 42.14 1ekj n ASN 140 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1ekj h PRO 141 N 3.16 0.00 0.66 1.20 0.13 -1.76 -1.63 132.00 133.76 1ekj h PRO 141 Ca 0.05 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.15 1ekj h PRO 141 Cb 0.99 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.12 1ekj h PRO 141 CO 0.42 0.09 -0.32 0.00 -0.23 0.00 0.00 178.00 177.96 1ekj h ALA 142 N 1.91 -0.89 0.15 -0.56 0.00 -1.93 0.16 119.26 118.11 1ekj h ALA 142 Ca -0.00 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.71 1ekj h ALA 142 Cb 0.24 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1ekj h ALA 142 CO 0.01 -0.89 -0.26 1.25 0.00 0.00 0.00 179.25 179.36 1ekj h LEU 143 N -1.10 -0.73 -1.33 0.00 6.46 -1.88 -2.41 115.31 114.33 1ekj h LEU 143 Ca -0.09 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 1ekj h LEU 143 Cb 0.72 0.27 0.00 0.00 -0.73 0.00 0.00 40.66 40.92 1ekj h LEU 143 CO 0.15 -0.35 0.00 1.88 -0.62 0.00 0.00 178.44 179.49 1ekj h TYR 144 N -0.48 0.00 -0.13 1.25 -1.99 -1.37 0.71 116.97 114.95 1ekj h TYR 144 Ca 0.02 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.58 1ekj h TYR 144 Cb 0.50 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.22 1ekj h TYR 144 CO -0.22 0.00 -0.65 0.78 -0.00 0.00 0.00 178.16 178.07 1ekj h GLY 145 N 2.06 0.56 1.37 3.88 0.00 -0.21 -2.23 103.07 108.50 1ekj h GLY 145 Ca 0.00 -0.72 -0.31 0.00 0.00 0.00 0.00 47.33 46.30 1ekj h GLY 145 CO 0.00 0.64 -1.42 0.83 0.00 0.00 0.00 176.54 176.59 1ekj h GLU 146 N 0.37 0.42 0.00 4.80 4.39 -0.91 -3.26 114.58 120.38 1ekj h GLU 146 Ca -0.02 -0.71 -0.03 0.00 0.34 0.00 0.00 59.36 58.94 1ekj h GLU 146 Cb 1.22 0.27 -0.00 0.00 -0.10 0.00 0.00 28.75 30.13 1ekj h GLU 146 CO 0.12 1.33 -0.16 -0.07 -1.16 0.00 0.00 179.01 179.07 1ekj h LEU 147 N 0.11 0.00 -2.31 1.33 3.38 -0.89 -2.03 115.31 114.90 1ekj h LEU 147 Ca -0.22 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1ekj h LEU 147 Cb 2.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.84 1ekj h LEU 147 CO 0.24 0.16 -0.03 0.00 0.09 0.00 0.00 178.44 178.89 1ekj h ALA 148 N 1.84 1.13 0.00 1.53 0.00 -1.44 -2.77 119.26 119.56 1ekj h ALA 148 Ca -0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1ekj h ALA 148 Cb 0.35 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1ekj h ALA 148 CO 0.02 0.04 -1.49 1.63 0.00 0.00 0.00 179.25 179.45 1ekj n LYS 149 N -3.32 0.63 0.00 0.00 5.02 -0.77 -5.06 118.16 114.66 1ekj n LYS 149 Ca -0.02 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 1ekj n LYS 149 Cb 0.17 -1.71 0.00 0.00 -0.02 0.00 0.00 35.03 33.47 1ekj n LYS 149 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ekj n GLY 150 N 1.29 0.70 3.09 0.72 0.00 -1.05 -5.15 105.19 104.78 1ekj n GLY 150 Ca -0.05 -0.98 -0.20 0.00 0.00 0.00 0.00 46.02 44.79 1ekj n GLY 150 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1ekj s GLN 151 N -2.00 0.91 -0.38 1.61 -2.07 -1.26 -4.42 119.66 112.04 1ekj s GLN 151 Ca 0.00 -0.52 0.11 0.00 -1.82 0.00 0.00 55.36 53.12 1ekj s GLN 151 Cb 0.00 -0.88 0.32 0.00 -1.09 0.00 0.00 33.01 31.36 1ekj s GLN 151 CO 0.00 0.23 0.69 -1.13 -1.32 0.00 0.00 175.29 173.76 1ekj n SER 152 N 2.48 0.53 -4.73 12.60 3.41 -1.26 -5.00 113.62 121.65 1ekj n SER 152 Ca -0.15 -2.95 -0.42 0.00 -0.26 0.00 0.00 58.87 55.09 1ekj n SER 152 Cb 0.56 -0.53 -0.03 0.00 -0.26 0.00 0.00 64.21 63.95 1ekj n SER 152 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1ekj s PRO 153 N -2.00 4.25 0.07 4.33 0.04 -1.21 -4.89 135.00 135.59 1ekj s PRO 153 Ca 0.38 2.31 0.27 0.00 0.04 0.00 0.00 61.00 64.00 1ekj s PRO 153 Cb 0.30 -3.14 1.05 0.00 0.04 0.00 0.00 34.50 32.75 1ekj s PRO 153 CO -0.09 -0.50 1.83 -0.35 0.04 0.00 0.00 177.00 177.93 1ekj n PRO 154 N 3.12 0.08 -4.55 0.56 -0.04 -1.10 -4.32 135.00 128.75 1ekj n PRO 154 Ca 0.10 0.10 -0.29 0.00 -0.04 0.00 0.00 63.50 63.37 1ekj n PRO 154 Cb 0.40 -1.60 -0.14 0.00 -0.04 0.00 0.00 33.50 32.12 1ekj n PRO 154 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1ekj s PHE 155 N -3.04 2.31 -0.09 0.54 0.40 -1.12 -1.42 117.98 115.56 1ekj s PHE 155 Ca 0.12 -0.39 0.04 0.00 -0.60 0.00 0.00 56.93 56.10 1ekj s PHE 155 Cb 0.16 -1.29 0.00 0.00 0.51 0.00 0.00 43.02 42.39 1ekj s PHE 155 CO 0.52 0.27 -0.23 1.41 0.70 0.00 0.00 175.22 177.90 1ekj s MET 156 N -1.81 2.85 -0.03 0.44 -2.45 -0.36 -0.04 119.30 117.90 1ekj s MET 156 Ca 0.13 -0.82 0.04 0.00 -1.25 0.00 0.00 55.69 53.79 1ekj s MET 156 Cb -0.10 -2.18 -0.00 0.00 1.25 0.00 0.00 34.83 33.80 1ekj s MET 156 CO 0.05 0.18 -0.14 0.08 1.05 0.00 0.00 175.02 176.23 1ekj s VAL 157 N 0.34 1.18 -0.19 10.11 1.01 0.84 -0.93 120.40 132.76 1ekj s VAL 157 Ca -0.17 -0.58 -0.06 0.00 0.00 0.00 0.00 61.98 61.17 1ekj s VAL 157 Cb -0.17 -1.02 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 1ekj s VAL 157 CO 0.08 0.35 0.02 -0.36 0.00 0.00 0.00 175.10 175.18 1ekj s PHE 158 N 0.07 3.10 0.06 5.22 0.40 -0.02 -0.66 117.98 126.14 1ekj s PHE 158 Ca -0.03 -0.27 -0.02 0.00 -0.60 0.00 0.00 56.93 56.01 1ekj s PHE 158 Cb -0.10 -2.07 -0.03 0.00 0.51 0.00 0.00 43.02 41.33 1ekj s PHE 158 CO 0.01 -0.10 0.01 0.00 0.70 0.00 0.00 175.22 175.85 1ekj s ALA 159 N 0.74 0.43 0.53 5.36 0.00 -0.39 -1.01 121.76 127.43 1ekj s ALA 159 Ca 0.01 -1.15 -0.20 0.00 0.00 0.00 0.00 51.96 50.62 1ekj s ALA 159 Cb -0.14 0.35 -0.06 0.00 0.00 0.00 0.00 23.12 23.27 1ekj s ALA 159 CO 0.02 -0.40 1.12 0.00 0.00 0.00 0.00 175.76 176.50 1ekj n SER 161 N -1.23 0.51 -4.62 0.00 7.64 0.02 -4.70 113.62 111.23 1ekj n SER 161 Ca 0.11 0.63 -0.63 0.00 1.01 0.00 0.00 58.87 59.99 1ekj n SER 161 Cb 0.51 -0.74 -0.09 0.00 -1.01 0.00 0.00 64.21 62.88 1ekj n SER 161 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1ekj n ASP 162 N -2.07 0.62 0.01 6.43 -0.08 -1.26 -4.79 116.55 115.41 1ekj n ASP 162 Ca 0.02 1.17 0.03 0.00 -1.51 0.00 0.00 54.79 54.51 1ekj n ASP 162 Cb 0.20 -0.91 0.14 0.00 2.34 0.00 0.00 41.12 42.89 1ekj n ASP 162 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1ekj n SER 163 N 2.76 0.03 -0.52 1.67 3.41 -1.26 -2.25 113.62 117.47 1ekj n SER 163 Ca 0.25 0.51 0.12 0.00 -0.26 0.00 0.00 58.87 59.50 1ekj n SER 163 Cb 0.01 -0.52 0.15 0.00 -0.26 0.00 0.00 64.21 63.60 1ekj n SER 163 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ekj n ARG 164 N -1.54 1.35 -0.51 4.33 1.74 -1.26 -4.51 116.66 116.27 1ekj n ARG 164 Ca 0.01 -1.04 0.06 0.00 -0.77 0.00 0.00 57.85 56.11 1ekj n ARG 164 Cb 0.07 -1.48 0.19 0.00 -1.02 0.00 0.00 32.46 30.22 1ekj n ARG 164 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1ekj n VAL 165 N 0.08 2.19 -1.48 1.55 0.24 -0.95 -5.03 118.33 114.92 1ekj n VAL 165 Ca 0.12 -2.93 -0.60 0.00 -2.04 0.00 0.00 64.34 58.88 1ekj n VAL 165 Cb 0.45 -0.25 -0.10 0.00 -1.47 0.00 0.00 33.84 32.47 1ekj n VAL 165 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ekj h PRO 167 N 8.22 0.00 -0.12 0.00 0.13 -1.96 -1.55 132.00 136.72 1ekj h PRO 167 Ca -0.27 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.83 1ekj h PRO 167 Cb 1.38 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.50 1ekj h PRO 167 CO 1.03 0.00 -0.03 0.77 -0.23 0.00 0.00 178.00 179.54 1ekj h SER 168 N 0.00 0.23 0.37 1.44 0.02 -1.91 -2.55 113.55 111.14 1ekj h SER 168 Ca 0.00 -0.36 -0.02 0.00 -0.84 0.00 0.00 61.79 60.57 1ekj h SER 168 Cb 0.15 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1ekj h SER 168 CO 0.00 0.54 -0.18 0.45 -1.14 0.00 0.00 176.83 176.50 1ekj h HIS 169 N -0.09 -0.46 -0.87 3.45 3.86 -1.73 -1.56 115.15 117.75 1ekj h HIS 169 Ca 0.03 -0.01 0.20 0.00 -1.16 0.00 0.00 60.37 59.43 1ekj h HIS 169 Cb 0.44 0.15 -0.12 0.00 1.06 0.00 0.00 27.41 28.94 1ekj h HIS 169 CO 0.05 -0.26 0.37 0.28 0.86 0.00 0.00 177.93 179.23 1ekj h VAL 170 N -1.12 0.51 -0.43 2.45 2.07 -1.41 -1.43 116.25 116.88 1ekj h VAL 170 Ca -0.05 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.33 1ekj h VAL 170 Cb 0.40 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.23 1ekj h VAL 170 CO 0.08 0.07 0.00 0.18 0.02 0.00 0.00 177.57 177.93 1ekj n LEU 171 N -5.04 3.35 -3.72 2.57 4.77 -0.96 -5.00 117.00 112.97 1ekj n LEU 171 Ca 0.21 -2.13 -0.31 0.00 -0.03 0.00 0.00 56.01 53.74 1ekj n LEU 171 Cb 0.61 -0.34 0.03 0.00 -2.33 0.00 0.00 43.42 41.39 1ekj n LEU 171 CO 0.14 0.78 -0.08 -0.67 -1.33 0.00 0.00 177.39 176.23 1ekj n ASP 172 N 0.67 -5.27 -4.73 -1.43 4.64 -0.54 -4.94 116.55 104.95 1ekj n ASP 172 Ca 0.16 -0.99 -0.39 0.00 -1.38 0.00 0.00 54.79 52.19 1ekj n ASP 172 Cb 0.54 -3.01 -0.06 0.00 -1.04 0.00 0.00 41.12 37.56 1ekj n ASP 172 CO 0.00 0.00 0.00 -0.36 -0.82 0.00 0.00 177.20 176.02 1ekj s PHE 173 N -3.38 3.57 0.77 -0.67 2.99 -0.64 -5.04 117.98 115.59 1ekj s PHE 173 Ca 0.39 1.06 -0.12 0.00 0.00 0.00 0.00 56.93 58.26 1ekj s PHE 173 Cb -0.15 -2.63 0.06 0.00 0.00 0.00 0.00 43.02 40.29 1ekj s PHE 173 CO 0.88 0.20 1.14 -0.65 -0.00 0.00 0.00 175.22 176.78 1ekj s GLN 174 N 0.46 2.28 0.26 0.44 -1.52 -1.26 -4.90 119.66 115.43 1ekj s GLN 174 Ca 0.30 0.30 -0.29 0.00 -1.95 0.00 0.00 55.36 53.72 1ekj s GLN 174 Cb -0.17 -1.97 -0.09 0.00 -0.22 0.00 0.00 33.01 30.56 1ekj s GLN 174 CO 0.14 -1.41 1.14 -1.25 -0.25 0.00 0.00 175.29 173.67 1ekj s PRO 175 N -5.44 4.58 0.00 2.91 0.04 -1.26 -2.40 135.00 133.42 1ekj s PRO 175 Ca 0.60 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.51 1ekj s PRO 175 Cb -0.11 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1ekj s PRO 175 CO 0.51 0.10 0.00 0.41 0.04 0.00 0.00 177.00 178.06 1ekj n GLY 176 N 1.36 0.76 0.13 0.56 0.00 -1.26 -4.96 105.19 101.78 1ekj n GLY 176 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1ekj n GLY 176 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ekj n GLU 177 N -2.11 0.59 -4.23 1.61 2.13 -1.01 -3.33 120.64 114.29 1ekj n GLU 177 Ca 0.00 0.15 -0.22 0.00 0.66 0.00 0.00 57.16 57.75 1ekj n GLU 177 Cb 0.00 -1.47 -0.16 0.00 0.27 0.00 0.00 31.44 30.07 1ekj n GLU 177 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ekj s ALA 178 N -2.48 0.86 -0.20 4.31 0.00 -1.26 -2.71 121.76 120.28 1ekj s ALA 178 Ca -0.33 -0.18 -0.21 0.00 0.00 0.00 0.00 51.96 51.25 1ekj s ALA 178 Cb 0.09 -0.51 -0.03 0.00 0.00 0.00 0.00 23.12 22.68 1ekj s ALA 178 CO 0.54 -0.03 0.62 0.12 0.00 0.00 0.00 175.76 177.01 1ekj s PHE 179 N 0.96 3.37 -0.01 0.00 5.36 0.94 -4.93 117.98 123.67 1ekj s PHE 179 Ca -0.10 0.91 0.07 0.00 -0.96 0.00 0.00 56.93 56.85 1ekj s PHE 179 Cb -0.14 -2.79 -0.02 0.00 -0.34 0.00 0.00 43.02 39.72 1ekj s PHE 179 CO 0.00 -0.17 -0.21 0.08 -1.46 0.00 0.00 175.22 173.46 1ekj s VAL 180 N 1.91 2.50 -0.10 3.12 1.01 -1.26 -0.11 120.40 127.47 1ekj s VAL 180 Ca 0.28 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 61.26 1ekj s VAL 180 Cb -0.16 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.28 1ekj s VAL 180 CO 0.10 0.52 -0.18 -0.69 0.00 0.00 0.00 175.10 174.85 1ekj s VAL 181 N -0.73 1.66 -0.11 2.92 1.01 0.16 -4.96 120.40 120.36 1ekj s VAL 181 Ca 0.11 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.33 1ekj s VAL 181 Cb -0.10 -1.48 0.02 0.00 0.00 0.00 0.00 36.38 34.82 1ekj s VAL 181 CO 0.01 0.47 -0.11 -0.13 0.00 0.00 0.00 175.10 175.34 1ekj s ARG 182 N 0.63 1.86 0.29 2.72 0.52 -1.26 -1.26 118.95 122.46 1ekj s ARG 182 Ca -0.14 -0.41 0.02 0.00 -0.52 0.00 0.00 55.73 54.68 1ekj s ARG 182 Cb -0.16 -1.71 -0.01 0.00 0.52 0.00 0.00 34.95 33.59 1ekj s ARG 182 CO 0.04 -0.16 0.34 0.27 0.02 0.00 0.00 175.30 175.82 1ekj n ASN 183 N 4.52 -0.93 -4.65 0.23 0.23 -1.14 -4.73 115.26 108.79 1ekj n ASN 183 Ca -0.17 -2.72 -0.43 0.00 -0.53 0.00 0.00 54.58 50.74 1ekj n ASN 183 Cb 0.51 1.86 -0.02 0.00 -2.08 0.00 0.00 39.78 40.05 1ekj n ASN 183 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1ekj s VAL 184 N -2.92 3.81 -1.15 3.53 1.01 -1.26 -0.80 120.40 122.62 1ekj s VAL 184 Ca 0.29 0.95 -0.00 0.00 0.00 0.00 0.00 61.98 63.22 1ekj s VAL 184 Cb 0.00 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1ekj s VAL 184 CO 0.20 -0.19 0.02 0.00 0.00 0.00 0.00 175.10 175.13 1ekj n ALA 185 N 7.55 -0.41 -4.03 5.51 0.00 -1.26 -3.79 120.51 124.08 1ekj n ALA 185 Ca 0.17 0.11 -0.29 0.00 0.00 0.00 0.00 53.44 53.43 1ekj n ALA 185 Cb 0.44 -1.64 -0.08 0.00 0.00 0.00 0.00 19.45 18.17 1ekj n ALA 185 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1ekj n ASN 186 N -0.59 0.01 -4.82 0.00 6.94 -1.18 -4.87 115.26 110.75 1ekj n ASN 186 Ca -0.16 -1.06 -0.37 0.00 -0.02 0.00 0.00 54.58 52.97 1ekj n ASN 186 Cb 0.62 -1.33 -0.06 0.00 -2.36 0.00 0.00 39.78 36.65 1ekj n ASN 186 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1ekj s LEU 187 N -6.52 4.43 -0.36 -4.53 1.43 -1.25 -4.82 118.68 107.06 1ekj s LEU 187 Ca 0.24 1.30 -0.04 0.00 -1.03 0.00 0.00 54.13 54.60 1ekj s LEU 187 Cb -0.14 -3.25 0.07 0.00 0.03 0.00 0.00 46.19 42.91 1ekj s LEU 187 CO 0.84 0.15 0.12 -0.69 0.23 0.00 0.00 176.35 177.01 1ekj s VAL 188 N -1.34 3.36 0.69 -1.59 1.01 -1.26 -4.98 120.40 116.30 1ekj s VAL 188 Ca 0.36 -1.60 -0.11 0.00 0.00 0.00 0.00 61.98 60.63 1ekj s VAL 188 Cb -0.18 -3.08 0.01 0.00 0.00 0.00 0.00 36.38 33.12 1ekj s VAL 188 CO 0.20 -0.38 1.06 -2.16 0.00 0.00 0.00 175.10 173.82 1ekj s PRO 189 N 1.25 2.97 0.84 2.72 0.04 -1.26 -4.64 135.00 136.92 1ekj s PRO 189 Ca 0.01 0.79 -0.11 0.00 0.04 0.00 0.00 61.00 61.73 1ekj s PRO 189 Cb -0.21 -2.01 0.10 0.00 0.04 0.00 0.00 34.50 32.42 1ekj s PRO 189 CO -0.01 -1.03 1.09 -1.25 0.04 0.00 0.00 177.00 175.83 1ekj s PRO 190 N -5.14 1.72 -0.22 0.56 0.04 -1.26 -4.79 135.00 125.91 1ekj s PRO 190 Ca 0.58 0.85 -0.39 0.00 0.04 0.00 0.00 61.00 62.08 1ekj s PRO 190 Cb -0.13 -1.86 -0.15 0.00 0.04 0.00 0.00 34.50 32.40 1ekj s PRO 190 CO 0.54 -1.93 1.76 0.98 0.04 0.00 0.00 177.00 178.39 1ekj n TYR 191 N -3.67 2.09 -3.15 0.56 9.36 -1.26 -4.84 117.16 116.24 1ekj n TYR 191 Ca 0.07 0.42 0.04 0.00 3.32 0.00 0.00 57.90 61.76 1ekj n TYR 191 Cb 0.55 -2.50 -0.00 0.00 -0.63 0.00 0.00 39.34 36.76 1ekj n TYR 191 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1ekj s ASP 192 N 3.49 -1.20 0.51 2.98 -1.08 -1.26 -5.03 116.67 115.09 1ekj s ASP 192 Ca 0.96 0.23 0.26 0.00 -0.52 0.00 0.00 52.55 53.48 1ekj s ASP 192 Cb -0.98 1.80 1.39 0.00 -1.46 0.00 0.00 42.92 43.67 1ekj s ASP 192 CO 0.61 -0.22 2.06 1.56 0.52 0.00 0.00 175.17 179.70 1ekj h GLN 193 N 7.79 0.00 0.12 4.34 4.20 -1.92 0.39 115.11 130.03 1ekj h GLN 193 Ca -0.06 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.34 1ekj h GLN 193 Cb 1.18 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.95 1ekj h GLN 193 CO 0.08 0.13 -1.56 0.00 -0.67 0.00 0.00 178.83 176.81 1ekj h ALA 194 N 1.87 0.29 0.00 3.87 0.00 -2.01 -3.39 119.26 119.90 1ekj h ALA 194 Ca -0.00 -1.13 -0.23 0.00 0.00 0.00 0.00 54.91 53.55 1ekj h ALA 194 Cb 0.34 0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 1ekj h ALA 194 CO 0.02 1.15 -1.92 1.63 0.00 0.00 0.00 179.25 180.13 1ekj n LYS 195 N -3.45 1.62 -2.50 0.00 5.02 -1.18 -4.78 118.16 112.89 1ekj n LYS 195 Ca -0.17 -0.02 -0.18 0.00 -2.02 0.00 0.00 58.31 55.92 1ekj n LYS 195 Cb 1.04 -1.35 0.02 0.00 -0.02 0.00 0.00 35.03 34.72 1ekj n LYS 195 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1ekj n TYR 196 N -2.46 2.34 -0.09 2.13 0.53 0.12 -4.86 117.16 114.87 1ekj n TYR 196 Ca -0.21 -2.73 -0.02 0.00 -1.02 0.00 0.00 57.90 53.92 1ekj n TYR 196 Cb 0.89 -0.23 0.22 0.00 -1.03 0.00 0.00 39.34 39.19 1ekj n TYR 196 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1ekj h ALA 197 N 2.64 1.25 -0.71 -0.72 0.00 -1.75 -2.06 119.26 117.91 1ekj h ALA 197 Ca 0.14 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1ekj h ALA 197 Cb 1.15 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1ekj h ALA 197 CO 0.64 0.51 0.39 0.78 0.00 0.00 0.00 179.25 181.57 1ekj h GLY 198 N 0.93 1.06 0.59 0.00 0.00 -1.93 0.31 103.07 104.03 1ekj h GLY 198 Ca 0.15 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 1ekj h GLY 198 CO 0.00 0.47 -0.06 -0.84 0.00 0.00 0.00 176.54 176.11 1ekj h THR 199 N 0.98 1.07 -0.78 4.70 2.02 -1.92 -2.62 112.91 116.36 1ekj h THR 199 Ca 0.25 -0.87 0.07 0.00 0.77 0.00 0.00 66.41 66.63 1ekj h THR 199 Cb 0.04 1.60 -0.05 0.00 -1.74 0.00 0.00 68.15 68.01 1ekj h THR 199 CO -0.04 0.20 0.51 1.23 0.37 0.00 0.00 175.52 177.80 1ekj h GLY 200 N -0.57 1.07 1.21 2.16 0.00 -1.26 -1.53 103.07 104.15 1ekj h GLY 200 Ca -0.02 -0.33 -0.11 0.00 0.00 0.00 0.00 47.33 46.87 1ekj h GLY 200 CO 0.03 0.24 -0.11 0.00 0.00 0.00 0.00 176.54 176.70 1ekj h ALA 201 N 1.58 0.86 -0.32 3.60 0.00 -0.33 0.19 119.26 124.84 1ekj h ALA 201 Ca 0.34 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1ekj h ALA 201 Cb 0.27 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1ekj h ALA 201 CO -0.12 0.65 -0.13 0.00 0.00 0.00 0.00 179.25 179.65 1ekj h ALA 202 N 1.04 0.45 -0.48 0.00 0.00 -0.95 -1.58 119.26 117.75 1ekj h ALA 202 Ca 0.13 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1ekj h ALA 202 Cb 0.64 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1ekj h ALA 202 CO 0.04 0.33 -0.10 0.82 0.00 0.00 0.00 179.25 180.35 1ekj h ILE 203 N 0.43 1.27 -0.22 0.00 2.04 -1.11 -1.23 117.51 118.69 1ekj h ILE 203 Ca 0.08 -1.23 -0.01 0.00 1.00 0.00 0.00 64.86 64.70 1ekj h ILE 203 Cb 0.64 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 1ekj h ILE 203 CO 0.04 0.42 0.08 -0.08 0.00 0.00 0.00 178.15 178.62 1ekj h GLU 204 N 0.76 0.32 -0.36 2.37 4.81 -0.95 -1.23 114.58 120.31 1ekj h GLU 204 Ca 0.12 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.27 1ekj h GLU 204 Cb 0.65 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.96 1ekj h GLU 204 CO 0.04 0.38 0.12 -0.92 -0.73 0.00 0.00 179.01 177.91 1ekj h TYR 205 N 0.19 0.58 -0.05 0.92 3.20 -1.21 0.53 116.97 121.14 1ekj h TYR 205 Ca 0.07 -0.06 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1ekj h TYR 205 Cb 0.18 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.28 1ekj h TYR 205 CO -0.01 0.55 0.00 0.00 -1.64 0.00 0.00 178.16 177.07 1ekj h ALA 206 N 0.96 0.07 0.01 1.82 0.00 -1.16 0.65 119.26 121.61 1ekj h ALA 206 Ca 0.12 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1ekj h ALA 206 Cb 0.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1ekj h ALA 206 CO -0.00 -0.27 -0.01 0.28 0.00 0.00 0.00 179.25 179.24 1ekj h VAL 207 N -0.19 1.30 0.00 0.00 2.07 -1.22 0.30 116.25 118.51 1ekj h VAL 207 Ca 0.01 -0.97 -0.19 0.00 0.82 0.00 0.00 66.70 66.38 1ekj h VAL 207 Cb 0.31 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 32.00 1ekj h VAL 207 CO 0.00 0.25 -1.58 0.18 0.02 0.00 0.00 177.57 176.44 1ekj n LEU 208 N -4.90 0.71 -0.11 2.57 4.77 0.18 -3.40 117.00 116.81 1ekj n LEU 208 Ca -0.08 0.31 -0.20 0.00 -0.03 0.00 0.00 56.01 56.01 1ekj n LEU 208 Cb 0.22 0.12 -0.09 0.00 -2.33 0.00 0.00 43.42 41.34 1ekj n LEU 208 CO 0.33 0.19 -1.27 1.41 -1.33 0.00 0.00 177.39 176.73 1ekj n HIS 209 N -2.84 0.00 0.05 -1.77 8.25 -0.55 -4.59 115.22 113.78 1ekj n HIS 209 Ca -0.12 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.29 1ekj n HIS 209 Cb 0.87 -0.84 -0.09 0.00 1.12 0.00 0.00 29.99 31.04 1ekj n HIS 209 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1ekj h LEU 210 N -0.43 0.00 -1.14 2.41 3.38 -0.75 -3.49 115.31 115.30 1ekj h LEU 210 Ca -0.55 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.26 1ekj h LEU 210 Cb 1.64 0.00 0.06 0.00 0.09 0.00 0.00 40.66 42.45 1ekj h LEU 210 CO -0.22 0.83 -0.29 0.29 0.09 0.00 0.00 178.44 179.13 1ekj n LYS 211 N -3.17 -3.22 -1.34 1.13 4.76 0.99 -4.80 118.16 112.51 1ekj n LYS 211 Ca -0.05 0.35 -0.33 0.00 -2.87 0.00 0.00 58.31 55.41 1ekj n LYS 211 Cb 0.91 -3.92 0.10 0.00 -1.84 0.00 0.00 35.03 30.28 1ekj n LYS 211 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1ekj s VAL 212 N -3.14 2.68 -0.91 -0.18 -7.23 -0.82 -4.96 120.40 105.85 1ekj s VAL 212 Ca 0.19 0.29 0.12 0.00 -1.81 0.00 0.00 61.98 60.77 1ekj s VAL 212 Cb -0.09 -2.72 -0.04 0.00 0.56 0.00 0.00 36.38 34.09 1ekj s VAL 212 CO 0.31 -0.23 0.63 -1.20 -0.31 0.00 0.00 175.10 174.30 1ekj n SER 213 N -3.08 1.07 -3.86 4.85 7.64 -0.51 -4.75 113.62 114.99 1ekj n SER 213 Ca 0.12 -1.04 -0.12 0.00 1.01 0.00 0.00 58.87 58.84 1ekj n SER 213 Cb 0.52 0.65 -0.13 0.00 -1.01 0.00 0.00 64.21 64.23 1ekj n SER 213 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1ekj s ASN 214 N -1.72 -0.04 -0.18 6.43 0.01 -0.96 0.10 114.94 118.58 1ekj s ASN 214 Ca 0.08 0.07 0.01 0.00 -0.71 0.00 0.00 52.86 52.31 1ekj s ASN 214 Cb 0.09 0.13 0.04 0.00 0.41 0.00 0.00 41.25 41.92 1ekj s ASN 214 CO 0.36 -0.06 -0.11 -0.63 -1.51 0.00 0.00 177.10 175.15 1ekj s ILE 215 N -0.14 1.59 -0.18 0.60 1.01 -0.11 -1.22 121.20 122.77 1ekj s ILE 215 Ca -0.02 -0.86 -0.00 0.00 0.00 0.00 0.00 60.65 59.77 1ekj s ILE 215 Cb -0.01 -1.61 0.01 0.00 0.01 0.00 0.00 42.46 40.85 1ekj s ILE 215 CO 0.00 0.26 -0.15 -0.69 0.00 0.00 0.00 174.94 174.36 1ekj s VAL 216 N 1.44 2.56 -0.32 2.92 1.01 -0.11 -0.93 120.40 126.97 1ekj s VAL 216 Ca 0.01 -0.79 -0.09 0.00 0.00 0.00 0.00 61.98 61.11 1ekj s VAL 216 Cb -0.15 -2.10 -0.00 0.00 0.00 0.00 0.00 36.38 34.13 1ekj s VAL 216 CO -0.09 0.51 0.15 -0.69 0.00 0.00 0.00 175.10 174.98 1ekj s VAL 217 N 1.11 4.52 -0.25 2.92 1.01 -0.27 -0.84 120.40 128.60 1ekj s VAL 217 Ca 0.00 -0.51 -0.06 0.00 0.00 0.00 0.00 61.98 61.41 1ekj s VAL 217 Cb -0.14 -3.34 -0.01 0.00 0.00 0.00 0.00 36.38 32.89 1ekj s VAL 217 CO -0.05 0.03 0.03 -0.63 0.00 0.00 0.00 175.10 174.48 1ekj s ILE 218 N 1.59 3.87 0.54 2.22 1.01 -0.18 -0.50 121.20 129.76 1ekj s ILE 218 Ca 0.04 -0.44 0.06 0.00 0.00 0.00 0.00 60.65 60.31 1ekj s ILE 218 Cb -0.17 -2.85 0.10 0.00 0.01 0.00 0.00 42.46 39.54 1ekj s ILE 218 CO 0.06 0.30 0.75 0.61 0.00 0.00 0.00 174.94 176.65 1ekj n GLY 219 N 4.86 1.60 3.63 6.18 0.00 -0.51 -4.15 105.19 116.80 1ekj n GLY 219 Ca -0.16 -2.16 -0.09 0.00 0.00 0.00 0.00 46.02 43.60 1ekj n GLY 219 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1ekj s HIS 220 N -2.28 -0.36 0.24 1.61 -3.43 -1.26 -2.13 115.29 107.67 1ekj s HIS 220 Ca 0.54 0.04 -0.30 0.00 -0.80 0.00 0.00 55.06 54.55 1ekj s HIS 220 Cb -0.04 0.63 -0.09 0.00 -1.43 0.00 0.00 32.58 31.65 1ekj s HIS 220 CO 0.35 -1.00 1.27 -1.54 -2.00 0.00 0.00 174.74 171.82 1ekj s SER 221 N -2.82 6.94 -1.00 7.38 1.04 -0.55 -3.68 113.70 121.02 1ekj s SER 221 Ca 0.06 2.42 -0.05 0.00 0.48 0.00 0.00 55.95 58.87 1ekj s SER 221 Cb -0.03 -2.62 0.01 0.00 0.10 0.00 0.00 66.02 63.47 1ekj s SER 221 CO -0.03 -0.46 0.86 0.00 0.98 0.00 0.00 173.24 174.59 1ekj n ALA 222 N 2.03 -1.17 -2.64 5.32 0.00 -1.26 -4.78 120.51 118.02 1ekj n ALA 222 Ca 0.04 0.20 -0.43 0.00 0.00 0.00 0.00 53.44 53.25 1ekj n ALA 222 Cb 0.43 -3.59 -0.03 0.00 0.00 0.00 0.00 19.45 16.26 1ekj n ALA 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ekj h GLY 224 N 9.62 0.73 0.99 0.00 0.00 -1.94 -2.12 103.07 110.35 1ekj h GLY 224 Ca -0.21 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 46.83 1ekj h GLY 224 CO 0.96 0.27 0.30 -1.33 0.00 0.00 0.00 176.54 176.73 1ekj h GLY 225 N 0.71 0.85 1.31 4.60 0.00 -1.94 -0.81 103.07 107.79 1ekj h GLY 225 Ca 0.19 -0.40 -0.13 0.00 0.00 0.00 0.00 47.33 46.99 1ekj h GLY 225 CO -0.04 0.38 -0.32 -2.22 0.00 0.00 0.00 176.54 174.34 1ekj h ILE 226 N 0.76 1.28 -0.54 2.60 1.08 -1.85 -0.83 117.51 120.01 1ekj h ILE 226 Ca 0.20 -1.47 0.02 0.00 -0.39 0.00 0.00 64.86 63.22 1ekj h ILE 226 Cb 0.07 1.35 -0.03 0.00 -3.07 0.00 0.00 36.82 35.14 1ekj h ILE 226 CO -0.03 0.48 0.32 0.50 -0.69 0.00 0.00 178.15 178.74 1ekj h LYS 227 N 0.65 0.63 0.06 2.37 3.64 -1.17 0.11 116.57 122.86 1ekj h LYS 227 Ca 0.07 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1ekj h LYS 227 Cb 0.86 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1ekj h LYS 227 CO 0.08 0.42 -0.05 0.78 -2.27 0.00 0.00 179.45 178.40 1ekj h GLY 228 N 0.65 -0.11 0.04 5.01 0.00 -0.91 0.10 103.07 107.85 1ekj h GLY 228 Ca 0.22 0.06 0.14 0.00 0.00 0.00 0.00 47.33 47.74 1ekj h GLY 228 CO -0.09 -0.06 0.15 -2.00 0.00 0.00 0.00 176.54 174.54 1ekj h LEU 229 N -0.12 -0.00 -0.68 3.11 5.85 0.03 0.25 115.31 123.75 1ekj h LEU 229 Ca 0.00 0.13 -0.14 0.00 0.84 0.00 0.00 57.88 58.71 1ekj h LEU 229 Cb 0.11 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 1ekj h LEU 229 CO -0.01 -0.02 -0.49 -0.07 -0.34 0.00 0.00 178.44 177.52 1ekj h LEU 230 N 0.26 0.47 0.03 2.25 3.38 -0.48 -3.27 115.31 117.94 1ekj h LEU 230 Ca 0.37 -0.23 -0.27 0.00 0.09 0.00 0.00 57.88 57.84 1ekj h LEU 230 Cb 0.59 -0.13 0.02 0.00 0.09 0.00 0.00 40.66 41.23 1ekj h LEU 230 CO -0.46 0.88 -1.07 0.28 0.09 0.00 0.00 178.44 178.16 1ekj h SER 231 N 0.34 0.89 -4.08 -0.43 0.02 -0.15 -3.45 113.55 106.70 1ekj h SER 231 Ca 0.02 -0.76 -0.53 0.00 -0.84 0.00 0.00 61.79 59.68 1ekj h SER 231 Cb 0.98 -0.27 0.11 0.00 0.14 0.00 0.00 62.40 63.35 1ekj h SER 231 CO 0.09 1.54 0.49 -0.36 -1.14 0.00 0.00 176.83 177.44 1ekj s PHE 232 N -3.23 2.47 -0.15 3.45 2.99 0.81 -4.94 117.98 119.37 1ekj s PHE 232 Ca -0.10 1.50 0.18 0.00 0.00 0.00 0.00 56.93 58.52 1ekj s PHE 232 Cb 0.06 -3.49 -0.09 0.00 0.00 0.00 0.00 43.02 39.50 1ekj s PHE 232 CO 0.92 -2.14 0.90 -1.00 -0.00 0.00 0.00 175.22 173.90 1ekj h PRO 233 N 1.14 0.00 -6.59 0.24 0.13 -1.87 -3.48 132.00 121.57 1ekj h PRO 233 Ca -0.50 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.11 1ekj h PRO 233 Cb 1.29 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.30 1ekj h PRO 233 CO 0.56 0.23 -0.86 1.19 -0.23 0.00 0.00 178.00 178.89 1ekj n PHE 234 N -2.85 -1.73 -1.43 1.56 3.01 -1.26 -4.83 117.46 109.93 1ekj n PHE 234 Ca -0.07 0.78 -0.23 0.00 1.01 0.00 0.00 57.45 58.94 1ekj n PHE 234 Cb 0.77 -3.44 0.13 0.00 -0.01 0.00 0.00 39.48 36.93 1ekj n PHE 234 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1ekj n ASP 235 N -2.85 4.86 0.00 4.37 5.75 -1.26 -4.89 116.55 122.53 1ekj n ASP 235 Ca -0.14 -3.73 0.00 0.00 -0.01 0.00 0.00 54.79 50.91 1ekj n ASP 235 Cb 0.60 -0.77 0.00 0.00 -1.03 0.00 0.00 41.12 39.92 1ekj n ASP 235 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ekj n GLY 236 N -1.01 2.91 3.75 6.12 0.00 -1.26 -5.02 105.19 110.68 1ekj n GLY 236 Ca 0.52 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.19 1ekj n GLY 236 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ekj s THR 237 N -2.03 4.76 -0.02 2.61 -4.23 -1.26 -5.10 115.64 110.36 1ekj s THR 237 Ca 0.00 -0.08 0.07 0.00 -1.18 0.00 0.00 61.69 60.50 1ekj s THR 237 Cb 0.00 -3.03 -0.02 0.00 1.34 0.00 0.00 72.50 70.78 1ekj s THR 237 CO 0.00 0.61 -0.23 -0.31 -0.54 0.00 0.00 174.62 174.15 1ekj s TYR 238 N -0.90 2.44 0.00 3.99 1.51 -1.26 -4.59 117.35 118.53 1ekj s TYR 238 Ca 0.14 -0.35 0.00 0.00 -1.01 0.00 0.00 57.07 55.84 1ekj s TYR 238 Cb -0.12 -1.52 0.00 0.00 -0.11 0.00 0.00 41.96 40.21 1ekj s TYR 238 CO 0.03 0.05 0.86 -1.13 -1.11 0.00 0.00 175.55 174.25 1ekj n SER 239 N 2.29 1.61 -4.35 2.29 3.41 -1.26 -5.03 113.62 112.58 1ekj n SER 239 Ca -0.16 -1.74 -0.21 0.00 -0.26 0.00 0.00 58.87 56.50 1ekj n SER 239 Cb 0.51 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.36 1ekj n SER 239 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1ekj s THR 240 N -0.74 1.87 0.03 6.66 -4.23 -1.26 -5.07 115.64 112.91 1ekj s THR 240 Ca 0.00 -2.07 -0.19 0.00 -1.18 0.00 0.00 61.69 58.25 1ekj s THR 240 Cb 0.00 -1.96 -0.17 0.00 1.34 0.00 0.00 72.50 71.71 1ekj s THR 240 CO 0.00 -0.41 1.25 0.44 -0.54 0.00 0.00 174.62 175.36 1ekj h ASP 241 N 2.92 0.49 0.00 3.99 5.19 -2.04 -3.44 116.42 123.54 1ekj h ASP 241 Ca -0.41 -0.60 0.00 0.00 -0.62 0.00 0.00 57.03 55.41 1ekj h ASP 241 Cb 1.22 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.58 1ekj h ASP 241 CO 0.55 1.00 -0.56 0.49 -3.12 0.00 0.00 179.24 177.61 1ekj n PHE 242 N -4.38 0.00 -0.24 4.55 3.01 -1.26 -4.86 117.46 114.28 1ekj n PHE 242 Ca -0.07 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.34 1ekj n PHE 242 Cb 0.50 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 39.98 1ekj n PHE 242 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 1ekj h ILE 243 N 0.00 0.13 -0.71 4.37 2.04 -2.00 0.33 117.51 121.67 1ekj h ILE 243 Ca 0.00 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.79 1ekj h ILE 243 Cb 0.56 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 1ekj h ILE 243 CO 0.00 0.00 0.17 -0.33 0.00 0.00 0.00 178.15 177.99 1ekj h GLU 244 N -0.13 1.14 -0.91 2.37 5.08 -1.92 -0.33 114.58 119.88 1ekj h GLU 244 Ca 0.26 -0.27 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1ekj h GLU 244 Cb 0.56 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 1ekj h GLU 244 CO -0.75 1.00 0.60 1.49 -1.00 0.00 0.00 179.01 180.35 1ekj h GLU 245 N 1.07 1.14 0.05 2.33 4.57 -1.35 -1.86 114.58 120.53 1ekj h GLU 245 Ca 0.22 -0.07 -0.00 0.00 -1.18 0.00 0.00 59.36 58.33 1ekj h GLU 245 Cb 0.38 -0.26 0.00 0.00 -0.16 0.00 0.00 28.75 28.71 1ekj h GLU 245 CO 0.00 0.75 -0.02 2.35 -1.18 0.00 0.00 179.01 180.91 1ekj h TRP 246 N 1.17 -0.06 0.00 0.92 2.91 -0.77 -3.29 115.95 116.82 1ekj h TRP 246 Ca 0.35 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.37 1ekj h TRP 246 Cb -0.03 0.02 0.00 0.00 -0.51 0.00 0.00 29.16 28.64 1ekj h TRP 246 CO -0.00 0.57 0.00 1.33 -1.03 0.00 0.00 178.44 179.31 1ekj n VAL 247 N -4.77 1.02 0.26 2.65 0.24 -0.16 -1.93 118.33 115.64 1ekj n VAL 247 Ca -0.08 0.26 0.13 0.00 -2.04 0.00 0.00 64.34 62.60 1ekj n VAL 247 Cb 0.32 -1.06 0.63 0.00 -1.47 0.00 0.00 33.84 32.27 1ekj n VAL 247 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 1ekj h LYS 248 N 0.00 0.00 -0.71 7.34 2.10 -1.41 -0.01 116.57 123.87 1ekj h LYS 248 Ca 0.00 0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.70 1ekj h LYS 248 Cb 0.17 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.46 1ekj h LYS 248 CO 0.00 0.00 0.47 0.82 -2.00 0.00 0.00 179.45 178.74 1ekj h ILE 249 N 0.00 1.05 -0.09 0.07 2.04 -1.61 -1.19 117.51 117.77 1ekj h ILE 249 Ca 0.00 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.59 1ekj h ILE 249 Cb 0.14 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 1ekj h ILE 249 CO 0.00 0.14 0.00 0.61 0.00 0.00 0.00 178.15 178.90 1ekj n GLY 250 N -1.45 -0.48 0.29 5.37 0.00 -0.02 -4.43 105.19 104.48 1ekj n GLY 250 Ca 0.10 -0.17 0.08 0.00 0.00 0.00 0.00 46.02 46.02 1ekj n GLY 250 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ekj h LEU 251 N 0.74 0.33 -1.46 0.99 3.38 -1.34 -1.65 115.31 116.31 1ekj h LEU 251 Ca 0.00 0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 1ekj h LEU 251 Cb 0.17 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1ekj h LEU 251 CO 0.00 0.10 -0.26 1.55 0.09 0.00 0.00 178.44 179.92 1ekj h PRO 252 N 0.47 0.00 -0.26 1.13 0.13 -1.83 0.10 132.00 131.74 1ekj h PRO 252 Ca 0.46 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.40 1ekj h PRO 252 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1ekj h PRO 252 CO -0.43 0.26 -0.58 0.00 -0.23 0.00 0.00 178.00 177.01 1ekj h ALA 253 N 1.74 0.42 -0.15 -0.56 0.00 -1.64 -1.16 119.26 117.90 1ekj h ALA 253 Ca -0.00 -0.53 -0.00 0.00 0.00 0.00 0.00 54.91 54.38 1ekj h ALA 253 Cb 0.56 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1ekj h ALA 253 CO 0.03 0.66 0.10 -0.22 0.00 0.00 0.00 179.25 179.82 1ekj h LYS 254 N 0.62 0.21 -0.86 0.00 3.64 -0.82 -0.86 116.57 118.50 1ekj h LYS 254 Ca 0.00 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1ekj h LYS 254 Cb 1.20 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.93 1ekj h LYS 254 CO 0.13 0.17 0.57 0.00 -2.27 0.00 0.00 179.45 178.05 1ekj h ALA 255 N 1.03 1.09 0.41 5.00 0.00 -0.92 -1.28 119.26 124.59 1ekj h ALA 255 Ca 0.06 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1ekj h ALA 255 Cb 0.01 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.46 1ekj h ALA 255 CO -0.01 0.49 -0.20 -0.22 0.00 0.00 0.00 179.25 179.31 1ekj h LYS 256 N 1.16 -0.53 -0.87 0.00 3.64 -0.93 -1.61 116.57 117.43 1ekj h LYS 256 Ca 0.32 0.04 0.14 0.00 -1.27 0.00 0.00 60.65 59.87 1ekj h LYS 256 Cb -0.13 0.12 -0.07 0.00 -0.41 0.00 0.00 32.23 31.74 1ekj h LYS 256 CO -0.07 -0.23 0.56 0.28 -2.27 0.00 0.00 179.45 177.72 1ekj h VAL 257 N -0.83 0.85 -0.02 2.00 2.07 -1.07 -0.32 116.25 118.93 1ekj h VAL 257 Ca -0.06 -0.23 -0.17 0.00 0.82 0.00 0.00 66.70 67.06 1ekj h VAL 257 Cb 0.54 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1ekj h VAL 257 CO 0.09 0.12 -0.77 0.11 0.02 0.00 0.00 177.57 177.15 1ekj h LYS 258 N 0.68 0.18 0.00 1.57 1.57 -1.18 -1.29 116.57 118.10 1ekj h LYS 258 Ca 0.43 -0.16 -0.09 0.00 -1.87 0.00 0.00 60.65 58.96 1ekj h LYS 258 Cb 0.69 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 1ekj h LYS 258 CO -0.19 0.86 -0.42 0.00 -0.57 0.00 0.00 179.45 179.13 1ekj h ALA 259 N 1.09 0.86 0.00 3.86 0.00 -0.22 -3.02 119.26 121.83 1ekj h ALA 259 Ca -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1ekj h ALA 259 Cb 1.35 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1ekj h ALA 259 CO 0.12 0.52 -1.30 1.04 0.00 0.00 0.00 179.25 179.62 1ekj n GLN 260 N -3.39 0.52 -3.12 0.00 6.02 -0.24 -4.43 117.38 112.73 1ekj n GLN 260 Ca 0.01 -0.01 -0.20 0.00 -0.01 0.00 0.00 57.00 56.78 1ekj n GLN 260 Cb 0.59 -1.66 -0.03 0.00 1.02 0.00 0.00 30.24 30.16 1ekj n GLN 260 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1ekj n HIS 261 N -2.32 1.25 -0.41 1.08 8.25 -0.49 -4.98 115.22 117.59 1ekj n HIS 261 Ca -0.01 -3.86 0.34 0.00 -0.26 0.00 0.00 57.72 53.93 1ekj n HIS 261 Cb 0.52 -0.44 0.64 0.00 1.12 0.00 0.00 29.99 31.83 1ekj n HIS 261 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1ekj h GLY 262 N 2.99 0.99 -0.03 -1.41 0.00 -1.74 -2.23 103.07 101.64 1ekj h GLY 262 Ca 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1ekj h GLY 262 CO 0.59 -0.23 -0.01 2.09 0.00 0.00 0.00 176.54 178.97 1ekj n ASP 263 N -4.54 2.10 -4.76 0.19 5.68 -1.26 -5.06 116.55 108.90 1ekj n ASP 263 Ca 0.33 -2.59 -0.36 0.00 -0.50 0.00 0.00 54.79 51.67 1ekj n ASP 263 Cb 1.29 -0.25 0.02 0.00 -1.14 0.00 0.00 41.12 41.04 1ekj n ASP 263 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ekj s ALA 264 N -2.00 2.65 0.38 2.12 0.00 -0.84 -4.98 121.76 119.08 1ekj s ALA 264 Ca 0.18 0.94 -0.26 0.00 0.00 0.00 0.00 51.96 52.82 1ekj s ALA 264 Cb 0.16 -3.41 -0.09 0.00 0.00 0.00 0.00 23.12 19.78 1ekj s ALA 264 CO 0.02 -0.97 1.12 -1.25 0.00 0.00 0.00 175.76 174.68 1ekj s PRO 265 N -3.25 4.19 0.20 0.00 0.04 -1.26 -4.74 135.00 130.17 1ekj s PRO 265 Ca 0.74 1.74 -0.08 0.00 0.04 0.00 0.00 61.00 63.45 1ekj s PRO 265 Cb -0.28 -2.73 0.30 0.00 0.04 0.00 0.00 34.50 31.84 1ekj s PRO 265 CO 0.31 -0.18 1.16 0.34 0.04 0.00 0.00 177.00 178.67 1ekj n PHE 266 N 0.23 0.21 -0.29 0.56 7.35 -1.26 0.91 117.46 125.16 1ekj n PHE 266 Ca 0.04 0.91 0.05 0.00 -0.76 0.00 0.00 57.45 57.69 1ekj n PHE 266 Cb 0.47 -0.90 0.27 0.00 0.35 0.00 0.00 39.48 39.67 1ekj n PHE 266 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1ekj h ALA 267 N 1.38 1.57 -0.14 3.13 0.00 -2.00 -1.29 119.26 121.92 1ekj h ALA 267 Ca 0.33 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 1ekj h ALA 267 Cb 0.52 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1ekj h ALA 267 CO -0.76 0.28 -0.12 0.93 0.00 0.00 0.00 179.25 179.58 1ekj h GLU 268 N 0.96 0.32 -0.93 0.00 5.08 0.17 -2.87 114.58 117.31 1ekj h GLU 268 Ca 0.40 -0.16 0.17 0.00 -1.00 0.00 0.00 59.36 58.76 1ekj h GLU 268 Cb 0.29 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.46 1ekj h GLU 268 CO -0.16 0.70 0.59 -0.07 -1.00 0.00 0.00 179.01 179.07 1ekj h LEU 269 N -0.06 0.64 -0.17 1.33 4.07 -0.44 -1.73 115.31 118.95 1ekj h LEU 269 Ca 0.02 0.05 -0.04 0.00 0.08 0.00 0.00 57.88 58.00 1ekj h LEU 269 Cb 0.63 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.30 1ekj h LEU 269 CO 0.03 0.29 -0.06 0.00 -1.08 0.00 0.00 178.44 177.62 1ekj h THR 271 N 0.02 0.88 -0.61 0.00 2.02 -1.16 0.94 112.91 115.01 1ekj h THR 271 Ca 0.04 -0.03 0.02 0.00 0.77 0.00 0.00 66.41 67.21 1ekj h THR 271 Cb 0.51 0.79 -0.04 0.00 -1.74 0.00 0.00 68.15 67.68 1ekj h THR 271 CO 0.02 0.02 0.39 0.45 0.37 0.00 0.00 175.52 176.76 1ekj h HIS 272 N 0.08 0.73 0.00 3.16 -0.00 -1.32 -2.45 115.15 115.36 1ekj h HIS 272 Ca 0.09 0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 60.41 1ekj h HIS 272 Cb 0.10 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.41 27.26 1ekj h HIS 272 CO -0.16 0.43 -0.36 0.00 -0.00 0.00 0.00 177.93 177.84 1ekj h GLU 274 N 0.00 0.04 0.10 0.00 5.08 -0.35 0.56 114.58 120.02 1ekj h GLU 274 Ca -0.00 -0.02 -0.25 0.00 -1.00 0.00 0.00 59.36 58.09 1ekj h GLU 274 Cb 0.69 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 1ekj h GLU 274 CO 0.05 0.41 -1.26 0.87 -1.00 0.00 0.00 179.01 178.08 1ekj h LYS 275 N 0.04 0.20 0.00 2.33 1.57 -1.24 -3.30 116.57 116.17 1ekj h LYS 275 Ca 0.00 -0.35 -0.03 0.00 -1.87 0.00 0.00 60.65 58.40 1ekj h LYS 275 Cb 0.68 0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.12 1ekj h LYS 275 CO 0.05 1.17 -0.15 1.49 -0.57 0.00 0.00 179.45 181.44 1ekj h GLU 276 N -0.43 0.00 -0.13 3.15 4.57 -0.97 -2.13 114.58 118.64 1ekj h GLU 276 Ca -0.28 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 57.76 1ekj h GLU 276 Cb 1.65 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.23 1ekj h GLU 276 CO 0.03 0.15 -0.53 0.00 -1.18 0.00 0.00 179.01 177.48 1ekj h ALA 277 N 1.85 0.84 -0.55 2.92 0.00 -1.00 -1.35 119.26 121.97 1ekj h ALA 277 Ca -0.00 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 1ekj h ALA 277 Cb 0.40 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1ekj h ALA 277 CO 0.02 0.68 0.29 0.28 0.00 0.00 0.00 179.25 180.52 1ekj h VAL 278 N 0.30 1.19 -0.60 0.00 2.07 -1.47 -0.83 116.25 116.90 1ekj h VAL 278 Ca 0.01 -0.49 -0.06 0.00 0.82 0.00 0.00 66.70 66.97 1ekj h VAL 278 Cb 1.03 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 1ekj h VAL 278 CO 0.09 0.21 0.13 0.78 0.02 0.00 0.00 177.57 178.80 1ekj h ASN 279 N 0.73 0.89 -0.77 0.57 2.35 -1.34 -0.07 115.58 117.94 1ekj h ASN 279 Ca 0.19 -0.18 -0.04 0.00 -0.55 0.00 0.00 56.30 55.73 1ekj h ASN 279 Cb 0.07 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.17 1ekj h ASN 279 CO -0.03 0.88 0.35 0.00 -1.65 0.00 0.00 177.43 176.98 1ekj h ALA 280 N 1.23 1.13 -0.55 -0.83 0.00 -0.80 -0.47 119.26 118.98 1ekj h ALA 280 Ca 0.19 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1ekj h ALA 280 Cb 0.34 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1ekj h ALA 280 CO 0.00 0.64 0.05 0.77 0.00 0.00 0.00 179.25 180.71 1ekj h SER 281 N 1.13 0.85 -0.30 0.00 0.02 -0.41 -0.59 113.55 114.25 1ekj h SER 281 Ca 0.27 -0.20 -0.10 0.00 -0.84 0.00 0.00 61.79 60.92 1ekj h SER 281 Cb 0.16 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 1ekj h SER 281 CO -0.03 0.89 -0.17 -0.07 -1.14 0.00 0.00 176.83 176.31 1ekj h LEU 282 N 0.84 0.76 -0.93 5.07 3.38 -0.46 -1.04 115.31 122.92 1ekj h LEU 282 Ca 0.17 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1ekj h LEU 282 Cb 0.43 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1ekj h LEU 282 CO 0.01 0.93 -0.05 1.23 0.09 0.00 0.00 178.44 180.65 1ekj h GLY 283 N 0.97 0.78 2.00 0.83 0.00 -0.44 -2.76 103.07 104.46 1ekj h GLY 283 Ca 0.10 -0.54 -0.10 0.00 0.00 0.00 0.00 47.33 46.79 1ekj h GLY 283 CO 0.05 0.50 -0.48 3.43 0.00 0.00 0.00 176.54 180.04 1ekj h ASN 284 N 0.67 0.00 0.22 0.19 2.35 -0.55 -2.61 115.58 115.86 1ekj h ASN 284 Ca 0.13 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.86 1ekj h ASN 284 Cb 0.49 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.85 1ekj h ASN 284 CO 0.03 0.48 -0.09 -0.07 -1.65 0.00 0.00 177.43 176.13 1ekj h LEU 285 N 0.00 0.00 0.00 1.61 3.38 -0.91 -1.35 115.31 118.04 1ekj h LEU 285 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ekj h LEU 285 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1ekj h LEU 285 CO 0.06 0.09 0.00 0.18 0.09 0.00 0.00 178.44 178.86 1ekj n LEU 286 N -3.82 0.00 -0.06 1.67 4.77 -0.98 -2.28 117.00 116.29 1ekj n LEU 286 Ca -0.02 0.33 0.14 0.00 -0.03 0.00 0.00 56.01 56.43 1ekj n LEU 286 Cb 0.19 -0.33 0.63 0.00 -2.33 0.00 0.00 43.42 41.58 1ekj n LEU 286 CO 0.30 -0.06 0.90 0.35 -1.33 0.00 0.00 177.39 177.55 1ekj n THR 287 N -1.33 0.00 -3.41 -5.08 -2.24 -0.51 -4.74 114.28 96.97 1ekj n THR 287 Ca 0.11 -0.03 -0.40 0.00 -2.27 0.00 0.00 64.05 61.45 1ekj n THR 287 Cb 0.21 -0.24 -0.09 0.00 -2.10 0.00 0.00 70.33 68.10 1ekj n THR 287 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1ekj s TYR 288 N -2.60 3.22 0.25 4.78 1.51 -0.97 -4.60 117.35 118.94 1ekj s TYR 288 Ca 0.26 0.06 -0.04 0.00 -1.01 0.00 0.00 57.07 56.33 1ekj s TYR 288 Cb 0.20 -2.63 0.41 0.00 -0.11 0.00 0.00 41.96 39.82 1ekj s TYR 288 CO 0.49 -0.38 1.80 -1.35 -1.11 0.00 0.00 175.55 175.01 1ekj h PRO 289 N 8.41 0.74 0.00 -1.71 0.11 -1.88 -0.21 132.00 137.46 1ekj h PRO 289 Ca -0.30 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1ekj h PRO 289 Cb 1.15 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1ekj h PRO 289 CO 0.67 0.49 0.00 1.97 -0.21 0.00 0.00 178.00 180.93 1ekj n PHE 290 N -4.76 0.42 -0.06 0.65 1.16 -1.26 -0.91 117.46 112.69 1ekj n PHE 290 Ca 0.14 0.17 -0.19 0.00 -1.87 0.00 0.00 57.45 55.70 1ekj n PHE 290 Cb 0.29 -0.77 -0.13 0.00 -1.61 0.00 0.00 39.48 37.26 1ekj n PHE 290 CO 0.00 0.00 0.00 0.28 -1.87 0.00 0.00 176.76 175.17 1ekj h VAL 291 N 0.00 1.25 -0.91 1.97 2.07 -1.34 -2.99 116.25 116.29 1ekj h VAL 291 Ca 0.00 -2.30 0.06 0.00 0.82 0.00 0.00 66.70 65.28 1ekj h VAL 291 Cb 0.26 2.75 -0.06 0.00 -1.52 0.00 0.00 31.29 32.72 1ekj h VAL 291 CO 0.00 0.51 0.57 0.03 0.02 0.00 0.00 177.57 178.71 1ekj h ARG 292 N -0.82 1.02 -0.71 1.57 3.08 -0.83 -0.91 114.38 116.78 1ekj h ARG 292 Ca -0.22 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.75 1ekj h ARG 292 Cb 1.32 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 31.11 1ekj h ARG 292 CO -0.07 0.67 0.36 1.49 -1.07 0.00 0.00 179.97 181.36 1ekj h GLU 293 N 1.05 1.01 -0.66 0.04 4.81 -1.15 0.11 114.58 119.79 1ekj h GLU 293 Ca 0.39 -0.13 -0.07 0.00 -0.13 0.00 0.00 59.36 59.42 1ekj h GLU 293 Cb 0.16 -0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 1ekj h GLU 293 CO -0.17 0.77 0.15 0.78 -0.73 0.00 0.00 179.01 179.81 1ekj h GLY 294 N 0.98 1.12 0.92 1.92 0.00 -1.18 0.78 103.07 107.61 1ekj h GLY 294 Ca 0.25 -0.70 -0.06 0.00 0.00 0.00 0.00 47.33 46.82 1ekj h GLY 294 CO -0.04 0.65 -0.01 1.41 0.00 0.00 0.00 176.54 178.55 1ekj h LEU 295 N 0.99 0.62 -0.98 3.11 3.38 -0.75 -0.18 115.31 121.50 1ekj h LEU 295 Ca 0.21 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 1ekj h LEU 295 Cb 0.37 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1ekj h LEU 295 CO 0.00 0.78 0.07 0.58 0.09 0.00 0.00 178.44 179.97 1ekj h VAL 296 N 0.43 1.23 -0.06 1.22 2.07 -0.65 -2.20 116.25 118.28 1ekj h VAL 296 Ca 0.10 -0.90 0.00 0.00 0.82 0.00 0.00 66.70 66.72 1ekj h VAL 296 Cb 0.48 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1ekj h VAL 296 CO 0.02 0.33 0.00 0.59 0.02 0.00 0.00 177.57 178.53 1ekj n ASN 297 N -4.25 0.85 -2.99 0.57 3.02 0.24 -4.91 115.26 107.78 1ekj n ASN 297 Ca 0.03 -1.48 -0.21 0.00 -0.03 0.00 0.00 54.58 52.88 1ekj n ASN 297 Cb 0.26 -0.04 0.02 0.00 -0.61 0.00 0.00 39.78 39.40 1ekj n ASN 297 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1ekj n LYS 298 N -0.26 -3.88 -0.10 3.52 5.02 -0.41 -4.85 118.16 117.20 1ekj n LYS 298 Ca 0.17 0.77 0.06 0.00 -2.02 0.00 0.00 58.31 57.29 1ekj n LYS 298 Cb 0.21 -5.54 0.11 0.00 -0.02 0.00 0.00 35.03 29.79 1ekj n LYS 298 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1ekj n THR 299 N -4.19 0.50 -3.77 -0.18 -2.24 -0.21 -4.97 114.28 99.22 1ekj n THR 299 Ca -0.10 -0.75 -0.13 0.00 -2.27 0.00 0.00 64.05 60.80 1ekj n THR 299 Cb 0.61 0.88 -0.10 0.00 -2.10 0.00 0.00 70.33 69.61 1ekj n THR 299 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1ekj s LEU 300 N -1.03 0.89 0.01 3.22 2.96 -1.07 -4.31 118.68 119.35 1ekj s LEU 300 Ca 0.21 0.45 0.04 0.00 -0.22 0.00 0.00 54.13 54.61 1ekj s LEU 300 Cb 0.12 1.06 -0.01 0.00 0.50 0.00 0.00 46.19 47.86 1ekj s LEU 300 CO 0.17 -0.19 -0.12 0.00 -1.32 0.00 0.00 176.35 174.89 1ekj s ALA 301 N -0.23 0.96 -0.13 5.97 0.00 0.11 -4.31 121.76 124.13 1ekj s ALA 301 Ca -0.04 -0.61 -0.03 0.00 0.00 0.00 0.00 51.96 51.28 1ekj s ALA 301 Cb -0.03 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 22.87 1ekj s ALA 301 CO 0.01 0.20 -0.02 -0.51 0.00 0.00 0.00 175.76 175.44 1ekj s LEU 302 N -0.67 3.37 0.06 0.00 1.43 -1.26 -0.93 118.68 120.68 1ekj s LEU 302 Ca 0.02 -0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.11 1ekj s LEU 302 Cb -0.06 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 1ekj s LEU 302 CO 0.00 0.25 -0.06 -0.54 0.23 0.00 0.00 176.35 176.23 1ekj s LYS 303 N -0.13 0.60 0.08 1.70 1.02 -0.11 -0.93 119.74 121.98 1ekj s LYS 303 Ca 0.03 -0.98 0.08 0.00 0.02 0.00 0.00 55.97 55.12 1ekj s LYS 303 Cb -0.13 -0.12 -0.03 0.00 -0.52 0.00 0.00 37.83 37.03 1ekj s LYS 303 CO 0.02 -0.01 -0.22 0.20 -0.92 0.00 0.00 175.35 174.42 1ekj s GLY 304 N -2.22 1.25 0.14 -3.33 0.00 0.45 -1.11 107.32 102.49 1ekj s GLY 304 Ca -0.02 -1.21 0.01 0.00 0.00 0.00 0.00 44.72 43.51 1ekj s GLY 304 CO -0.03 -1.17 -0.02 -0.32 0.00 0.00 0.00 173.10 171.56 1ekj s GLY 305 N -1.62 1.00 -0.21 0.20 0.00 0.35 -0.78 107.32 106.25 1ekj s GLY 305 Ca 0.08 -1.47 -0.04 0.00 0.00 0.00 0.00 44.72 43.29 1ekj s GLY 305 CO 0.03 -1.47 0.29 -0.47 0.00 0.00 0.00 173.10 171.48 1ekj s TYR 306 N -3.70 -0.52 -0.32 1.90 5.04 0.48 -1.43 117.35 118.79 1ekj s TYR 306 Ca 0.19 0.58 -0.13 0.00 -2.44 0.00 0.00 57.07 55.26 1ekj s TYR 306 Cb 0.06 -0.16 -0.02 0.00 0.35 0.00 0.00 41.96 42.19 1ekj s TYR 306 CO -0.00 -0.62 0.28 -0.47 -1.34 0.00 0.00 175.55 173.40 1ekj s TYR 307 N 2.43 3.22 -0.50 4.97 5.04 -0.91 -0.77 117.35 130.84 1ekj s TYR 307 Ca 0.08 -0.04 -0.13 0.00 -2.44 0.00 0.00 57.07 54.55 1ekj s TYR 307 Cb -0.15 -2.53 0.12 0.00 0.35 0.00 0.00 41.96 39.74 1ekj s TYR 307 CO -0.13 -0.34 0.42 0.34 -1.34 0.00 0.00 175.55 174.50 1ekj s ASP 308 N 1.73 5.96 0.14 4.32 -1.08 0.36 -1.49 116.67 126.61 1ekj s ASP 308 Ca 0.09 -1.78 0.26 0.00 -0.52 0.00 0.00 52.55 50.61 1ekj s ASP 308 Cb -0.17 -2.12 0.78 0.00 -1.46 0.00 0.00 42.92 39.96 1ekj s ASP 308 CO 0.11 -0.76 1.69 2.22 0.52 0.00 0.00 175.17 178.95 1ekj n PHE 309 N 5.09 0.61 0.24 -5.34 1.16 -1.26 -0.82 117.46 117.14 1ekj n PHE 309 Ca -0.11 0.18 -0.11 0.00 -1.87 0.00 0.00 57.45 55.54 1ekj n PHE 309 Cb 0.41 -0.75 -0.05 0.00 -1.61 0.00 0.00 39.48 37.47 1ekj n PHE 309 CO 0.00 0.00 0.00 0.28 -1.87 0.00 0.00 176.76 175.17 1ekj h VAL 310 N 0.00 0.04 0.00 1.97 2.07 -1.92 -3.31 116.25 115.10 1ekj h VAL 310 Ca 0.00 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.01 1ekj h VAL 310 Cb 0.68 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1ekj h VAL 310 CO 0.00 0.01 0.00 0.11 0.02 0.00 0.00 177.57 177.71 1ekj h LYS 311 N -1.17 0.00 -1.04 1.57 6.56 -2.00 -3.47 116.57 117.02 1ekj h LYS 311 Ca -0.07 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 1ekj h LYS 311 Cb 0.53 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.19 1ekj h LYS 311 CO 0.11 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.91 1ekj n GLY 312 N 0.80 0.85 3.27 3.86 0.00 -0.00 -5.09 105.19 108.87 1ekj n GLY 312 Ca 0.03 -0.54 -0.15 0.00 0.00 0.00 0.00 46.02 45.37 1ekj n GLY 312 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ekj s SER 313 N -2.81 1.21 -0.02 1.61 1.04 -0.14 -5.00 113.70 109.59 1ekj s SER 313 Ca 0.00 -1.26 0.01 0.00 0.48 0.00 0.00 55.95 55.18 1ekj s SER 313 Cb 0.00 0.13 0.02 0.00 0.10 0.00 0.00 66.02 66.27 1ekj s SER 313 CO 0.00 -0.63 -0.01 0.12 0.98 0.00 0.00 173.24 173.70 1ekj s PHE 314 N -3.69 0.31 -0.11 5.02 5.36 -1.26 -0.48 117.98 123.13 1ekj s PHE 314 Ca 0.29 -0.01 0.01 0.00 -0.96 0.00 0.00 56.93 56.26 1ekj s PHE 314 Cb 0.07 -0.37 -0.02 0.00 -0.34 0.00 0.00 43.02 42.37 1ekj s PHE 314 CO 0.08 -0.10 -0.15 -1.21 -1.46 0.00 0.00 175.22 172.37 1ekj s GLU 315 N 0.79 3.12 -0.05 10.12 2.02 0.05 -4.96 118.70 129.80 1ekj s GLU 315 Ca -0.08 -0.72 0.04 0.00 0.02 0.00 0.00 54.97 54.23 1ekj s GLU 315 Cb -0.11 -2.51 -0.00 0.00 0.10 0.00 0.00 34.13 31.60 1ekj s GLU 315 CO -0.01 0.30 -0.17 -1.17 0.02 0.00 0.00 175.26 174.23 1ekj s LEU 316 N 0.10 1.90 0.20 1.80 2.96 -1.26 -0.39 118.68 123.99 1ekj s LEU 316 Ca -0.07 -0.36 -0.07 0.00 -0.22 0.00 0.00 54.13 53.41 1ekj s LEU 316 Cb -0.15 -0.98 -0.02 0.00 0.50 0.00 0.00 46.19 45.54 1ekj s LEU 316 CO 0.05 0.14 0.28 -1.66 -1.32 0.00 0.00 176.35 173.84 1ekj s TRP 317 N 0.12 0.70 0.19 5.38 -2.14 0.04 -5.00 118.94 118.23 1ekj s TRP 317 Ca -0.06 -1.01 -0.07 0.00 2.66 0.00 0.00 56.10 57.62 1ekj s TRP 317 Cb -0.12 -0.19 -0.02 0.00 -3.10 0.00 0.00 33.47 30.04 1ekj s TRP 317 CO 0.03 -0.77 0.27 0.20 -2.66 0.00 0.00 176.95 174.01 1ekj s GLY 318 N -3.06 0.82 -0.39 3.67 0.00 -1.26 -0.42 107.32 106.68 1ekj s GLY 318 Ca 0.28 -1.18 -0.22 0.00 0.00 0.00 0.00 44.72 43.60 1ekj s GLY 318 CO 0.08 -0.99 0.71 -2.27 0.00 0.00 0.00 173.10 170.63 1ekj s LEU 319 N -3.04 4.24 -0.13 0.66 2.96 -0.10 -4.96 118.68 118.30 1ekj s LEU 319 Ca 0.25 0.10 -0.29 0.00 -0.22 0.00 0.00 54.13 53.97 1ekj s LEU 319 Cb 0.04 -2.89 -0.01 0.00 0.50 0.00 0.00 46.19 43.82 1ekj s LEU 319 CO 0.06 -0.72 1.14 -1.61 -1.32 0.00 0.00 176.35 173.90 1ekj s GLU 320 N 2.96 4.31 -0.11 1.98 0.41 -1.26 -4.67 118.70 122.33 1ekj s GLU 320 Ca 0.27 1.54 -0.05 0.00 -0.41 0.00 0.00 54.97 56.33 1ekj s GLU 320 Cb -0.14 -3.63 0.06 0.00 -1.78 0.00 0.00 34.13 28.64 1ekj s GLU 320 CO 0.18 -0.53 0.24 0.12 -0.49 0.00 0.00 175.26 174.77 1ekj s PHE 321 N 2.74 -0.34 0.00 1.61 5.36 -1.26 -5.14 117.98 120.95 1ekj s PHE 321 Ca 0.51 0.84 0.00 0.00 -0.96 0.00 0.00 56.93 57.32 1ekj s PHE 321 Cb -0.20 -0.05 0.00 0.00 -0.34 0.00 0.00 43.02 42.42 1ekj s PHE 321 CO 0.16 -0.30 0.00 0.41 -1.46 0.00 0.00 175.22 174.03 1ekj n GLY 322 N 4.97 2.74 3.75 13.12 0.00 -1.26 -5.01 105.19 123.49 1ekj n GLY 322 Ca -0.12 -0.72 -0.40 0.00 0.00 0.00 0.00 46.02 44.78 1ekj n GLY 322 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ekj s LEU 323 N 0.00 4.47 -0.05 0.99 1.02 -1.26 -5.06 118.68 118.78 1ekj s LEU 323 Ca 0.00 1.41 0.03 0.00 0.02 0.00 0.00 54.13 55.59 1ekj s LEU 323 Cb 0.00 -3.17 0.01 0.00 0.02 0.00 0.00 46.19 43.05 1ekj s LEU 323 CO 0.00 0.07 -0.12 -0.55 0.02 0.00 0.00 176.35 175.76 1ekj s SER 324 N -0.26 1.72 -0.03 2.29 0.15 -1.26 -5.11 113.70 111.19 1ekj s SER 324 Ca 0.36 -0.28 -0.30 0.00 0.70 0.00 0.00 55.95 56.43 1ekj s SER 324 Cb -0.20 -0.66 -0.05 0.00 -1.71 0.00 0.00 66.02 63.40 1ekj s SER 324 CO 0.22 0.06 1.36 -0.55 1.20 0.00 0.00 173.24 175.53 1ekj s SER 325 N 0.43 6.89 -0.17 5.45 0.15 -1.26 -4.94 113.70 120.26 1ekj s SER 325 Ca -0.10 2.02 -0.24 0.00 0.70 0.00 0.00 55.95 58.33 1ekj s SER 325 Cb -0.13 -2.56 -0.21 0.00 -1.71 0.00 0.00 66.02 61.41 1ekj s SER 325 CO 0.03 -0.70 0.47 0.74 1.20 0.00 0.00 173.24 174.97 1ekj h THR 326 N 5.02 1.30 -2.69 6.45 2.02 -2.05 -3.49 112.91 119.47 1ekj h THR 326 Ca -0.36 -2.19 0.03 0.00 0.77 0.00 0.00 66.41 64.66 1ekj h THR 326 Cb 1.17 2.67 -0.13 0.00 -1.74 0.00 0.00 68.15 70.12 1ekj h THR 326 CO 0.91 0.44 0.33 0.72 0.37 0.00 0.00 175.52 178.29 1ekj s PHE 327 N -2.26 -0.46 -0.37 3.16 -0.12 -1.26 -5.12 117.98 111.55 1ekj s PHE 327 Ca -0.23 0.29 0.01 0.00 -0.05 0.00 0.00 56.93 56.95 1ekj s PHE 327 Cb 0.01 0.55 0.15 0.00 -0.63 0.00 0.00 43.02 43.10 1ekj s PHE 327 CO 0.61 -0.72 0.27 0.45 -0.05 0.00 0.00 175.22 175.78 1ekj s SER 328 N -2.62 2.33 0.00 1.98 0.15 -1.26 -5.28 113.70 109.00 1ekj s SER 328 Ca 0.03 -2.23 0.23 0.00 0.70 0.00 0.00 55.95 54.67 1ekj s SER 328 Cb -0.01 -0.21 0.18 0.00 -1.71 0.00 0.00 66.02 64.27 1ekj s SER 328 CO -0.11 -0.27 1.22 1.33 1.20 0.00 0.00 173.24 176.60