#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j8t s PRO 119 N 0.00 3.57 0.43 5.55 0.02 -1.26 -4.94 135.00 138.37 1j8t s PRO 119 Ca 0.00 2.42 -0.26 0.00 0.02 0.00 0.00 61.00 63.18 1j8t s PRO 119 Cb 0.00 -2.58 -0.08 0.00 0.02 0.00 0.00 34.50 31.85 1j8t s PRO 119 CO 0.00 -0.91 1.36 -0.46 -0.33 0.00 0.00 177.00 176.66 1j8t s TRP 120 N -1.21 2.64 0.03 6.54 -0.00 -1.26 -4.43 118.94 121.25 1j8t s TRP 120 Ca 0.63 1.34 -0.03 0.00 -0.00 0.00 0.00 56.10 58.04 1j8t s TRP 120 Cb -0.44 -3.79 -0.02 0.00 -0.00 0.00 0.00 33.47 29.22 1j8t s TRP 120 CO 0.56 -2.51 0.03 -0.59 -0.00 0.00 0.00 176.95 174.44 1j8t s PHE 121 N -1.23 0.28 0.42 5.86 -0.71 -1.26 -4.77 117.98 116.56 1j8t s PHE 121 Ca 0.59 -0.61 -0.25 0.00 -1.04 0.00 0.00 56.93 55.62 1j8t s PHE 121 Cb -0.41 -0.21 -0.08 0.00 -1.21 0.00 0.00 43.02 41.11 1j8t s PHE 121 CO 0.53 -0.30 1.23 -1.25 -1.34 0.00 0.00 175.22 174.08 1j8t s PRO 122 N -2.42 3.95 0.00 1.99 0.04 -1.26 -4.92 135.00 132.38 1j8t s PRO 122 Ca -0.07 1.96 0.04 0.00 0.04 0.00 0.00 61.00 62.98 1j8t s PRO 122 Cb -0.03 -2.66 -0.04 0.00 0.04 0.00 0.00 34.50 31.81 1j8t s PRO 122 CO -0.04 -0.45 0.20 0.54 0.04 0.00 0.00 177.00 177.29 1j8t n ARG 123 N -0.02 5.38 -4.25 4.56 1.74 -1.26 -4.86 116.66 117.95 1j8t n ARG 123 Ca 0.05 -0.03 -0.15 0.00 -0.77 0.00 0.00 57.85 56.95 1j8t n ARG 123 Cb 0.45 -0.71 -0.10 0.00 -1.02 0.00 0.00 32.46 31.08 1j8t n ARG 123 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1j8t s THR 124 N -1.36 1.24 0.38 0.55 -4.23 -1.26 -0.30 115.64 110.65 1j8t s THR 124 Ca 0.02 -1.99 0.19 0.00 -1.18 0.00 0.00 61.69 58.73 1j8t s THR 124 Cb 0.03 -1.78 0.19 0.00 1.34 0.00 0.00 72.50 72.29 1j8t s THR 124 CO 0.17 -0.66 1.94 -0.29 -0.54 0.00 0.00 174.62 175.24 1j8t h ILE 125 N 2.94 0.93 0.00 2.99 2.10 -1.70 -2.38 117.51 122.40 1j8t h ILE 125 Ca -0.37 -0.90 -0.08 0.00 1.08 0.00 0.00 64.86 64.58 1j8t h ILE 125 Cb 1.19 1.52 -0.01 0.00 -1.09 0.00 0.00 36.82 38.43 1j8t h ILE 125 CO 0.60 0.24 -0.40 -0.61 -1.08 0.00 0.00 178.15 176.90 1j8t h GLN 126 N 0.00 0.00 0.00 2.19 4.15 -1.96 -2.80 115.11 116.69 1j8t h GLN 126 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1j8t h GLN 126 Cb 0.50 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.19 1j8t h GLN 126 CO 0.03 0.40 0.00 0.39 -1.93 0.00 0.00 178.83 177.72 1j8t n GLU 127 N -3.99 0.10 0.30 1.69 1.02 -0.89 -1.20 120.64 117.65 1j8t n GLU 127 Ca -0.02 0.51 0.20 0.00 -0.02 0.00 0.00 57.16 57.83 1j8t n GLU 127 Cb 0.44 -1.76 0.98 0.00 -0.02 0.00 0.00 31.44 31.07 1j8t n GLU 127 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1j8t h LEU 128 N 0.00 0.00 -1.82 -4.62 3.38 -1.63 -2.71 115.31 107.92 1j8t h LEU 128 Ca 0.00 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.10 1j8t h LEU 128 Cb 0.10 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1j8t h LEU 128 CO 0.00 0.00 0.40 0.44 0.09 0.00 0.00 178.44 179.37 1j8t h ASP 129 N 0.00 0.18 -0.36 -0.43 3.32 -1.40 -0.94 116.42 116.78 1j8t h ASP 129 Ca 0.00 0.01 0.11 0.00 0.02 0.00 0.00 57.03 57.16 1j8t h ASP 129 Cb 0.17 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1j8t h ASP 129 CO 0.00 0.10 0.29 0.03 -1.72 0.00 0.00 179.24 177.94 1j8t h ARG 130 N 0.19 0.00 -0.60 3.56 3.08 -1.72 -3.01 114.38 115.88 1j8t h ARG 130 Ca 0.28 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.35 1j8t h ARG 130 Cb 0.82 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.84 1j8t h ARG 130 CO -0.05 0.00 0.40 0.74 -1.07 0.00 0.00 179.97 179.99 1j8t h PHE 131 N 0.00 0.71 0.00 3.04 0.05 -1.40 -2.64 116.94 116.69 1j8t h PHE 131 Ca 0.17 0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.98 1j8t h PHE 131 Cb 0.75 -0.24 0.00 0.00 2.00 0.00 0.00 35.95 38.46 1j8t h PHE 131 CO 0.00 0.43 0.00 0.00 -0.18 0.00 0.00 178.31 178.56 1j8t h ALA 132 N 1.64 1.00 -0.48 2.45 0.00 -1.72 -0.03 119.26 122.13 1j8t h ALA 132 Ca 0.23 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.96 1j8t h ALA 132 Cb 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.69 1j8t h ALA 132 CO -0.06 0.00 0.10 0.09 0.00 0.00 0.00 179.25 179.38 1j8t n ASN 133 N -2.42 3.38 -1.72 0.00 3.02 -1.00 -4.41 115.26 112.11 1j8t n ASN 133 Ca -0.01 -3.47 0.02 0.00 -0.03 0.00 0.00 54.58 51.09 1j8t n ASN 133 Cb 0.08 -0.66 0.02 0.00 -0.61 0.00 0.00 39.78 38.61 1j8t n ASN 133 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1j8t n GLN 134 N -0.82 0.32 -3.23 3.52 6.02 -0.03 -5.12 117.38 118.05 1j8t n GLN 134 Ca 0.35 -2.17 -0.23 0.00 -0.01 0.00 0.00 57.00 54.94 1j8t n GLN 134 Cb 1.14 -0.23 -0.00 0.00 1.02 0.00 0.00 30.24 32.17 1j8t n GLN 134 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 1j8t s ILE 135 N -0.66 4.47 -0.09 5.09 -4.36 -1.24 -4.56 121.20 119.85 1j8t s ILE 135 Ca 0.30 -0.56 -0.29 0.00 -0.26 0.00 0.00 60.65 59.83 1j8t s ILE 135 Cb 0.35 -3.63 -0.05 0.00 1.25 0.00 0.00 42.46 40.38 1j8t s ILE 135 CO -0.13 -0.40 1.63 -0.22 0.24 0.00 0.00 174.94 176.05 1j8t s LEU 136 N -4.40 4.23 0.32 0.37 2.96 -0.72 -4.90 118.68 116.54 1j8t s LEU 136 Ca 0.44 2.08 0.20 0.00 -0.22 0.00 0.00 54.13 56.64 1j8t s LEU 136 Cb -0.10 -3.53 0.16 0.00 0.50 0.00 0.00 46.19 43.22 1j8t s LEU 136 CO 0.36 -0.98 1.39 0.28 -1.32 0.00 0.00 176.35 176.08 1j8t h SER 137 N 9.72 0.00 -3.93 3.68 0.02 -1.96 -3.39 113.55 117.68 1j8t h SER 137 Ca -0.37 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 59.89 1j8t h SER 137 Cb 1.17 0.00 -0.37 0.00 0.14 0.00 0.00 62.40 63.34 1j8t h SER 137 CO 0.96 0.18 -0.36 -0.31 -1.14 0.00 0.00 176.83 176.17 1j8t s TYR 138 N -3.15 3.49 0.90 3.45 1.51 -1.26 -5.07 117.35 117.22 1j8t s TYR 138 Ca 0.04 -2.90 -0.14 0.00 -1.01 0.00 0.00 57.07 53.06 1j8t s TYR 138 Cb 0.07 -3.12 0.15 0.00 -0.11 0.00 0.00 41.96 38.95 1j8t s TYR 138 CO 0.72 -0.78 1.26 0.20 -1.11 0.00 0.00 175.55 175.85 1j8t s GLY 139 N 0.17 1.71 0.52 0.71 0.00 -1.26 -4.96 107.32 104.21 1j8t s GLY 139 Ca 0.20 -1.00 0.22 0.00 0.00 0.00 0.00 44.72 44.14 1j8t s GLY 139 CO -0.06 -0.34 2.12 0.00 0.00 0.00 0.00 173.10 174.82 1j8t h ALA 140 N -1.39 1.63 0.00 3.20 0.00 -1.97 -1.94 119.26 118.78 1j8t h ALA 140 Ca -0.45 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1j8t h ALA 140 Cb 1.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1j8t h ALA 140 CO 0.49 0.09 0.00 -0.85 0.00 0.00 0.00 179.25 178.98 1j8t n GLU 141 N -4.09 0.00 0.00 0.00 0.00 -1.26 -2.04 120.64 113.25 1j8t n GLU 141 Ca -0.03 0.17 0.14 0.00 0.00 0.00 0.00 57.16 57.44 1j8t n GLU 141 Cb 0.16 -1.50 0.56 0.00 0.00 0.00 0.00 31.44 30.66 1j8t n GLU 141 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1j8t n LEU 142 N -1.50 0.56 -4.79 -1.84 4.77 -0.73 -4.48 117.00 108.98 1j8t n LEU 142 Ca 0.05 -0.03 -0.39 0.00 -0.03 0.00 0.00 56.01 55.61 1j8t n LEU 142 Cb 0.22 -0.18 -0.06 0.00 -2.33 0.00 0.00 43.42 41.07 1j8t n LEU 142 CO 0.18 0.10 0.37 -1.81 -1.33 0.00 0.00 177.39 174.90 1j8t s ASP 143 N -2.50 7.21 0.51 -1.43 1.01 -0.87 -4.97 116.67 115.64 1j8t s ASP 143 Ca 0.27 1.43 0.25 0.00 0.71 0.00 0.00 52.55 55.22 1j8t s ASP 143 Cb 0.20 -2.42 1.36 0.00 1.01 0.00 0.00 42.92 43.06 1j8t s ASP 143 CO 0.49 0.24 1.95 0.00 0.21 0.00 0.00 175.17 178.06 1j8t h ALA 144 N 4.47 2.54 -0.38 5.23 0.00 -1.90 0.13 119.26 129.35 1j8t h ALA 144 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1j8t h ALA 144 Cb 1.21 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1j8t h ALA 144 CO 0.65 -0.73 0.00 -0.40 0.00 0.00 0.00 179.25 178.76 1j8t n ASP 145 N -4.37 2.59 -4.75 0.00 5.75 -1.26 -4.85 116.55 109.66 1j8t n ASP 145 Ca 0.13 -1.91 -0.41 0.00 -0.01 0.00 0.00 54.79 52.59 1j8t n ASP 145 Cb 0.71 -0.25 -0.03 0.00 -1.03 0.00 0.00 41.12 40.52 1j8t n ASP 145 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 1j8t s HIS 146 N -1.51 3.20 0.56 2.11 2.46 0.47 -4.86 115.29 117.72 1j8t s HIS 146 Ca 0.35 1.35 0.30 0.00 0.47 0.00 0.00 55.06 57.53 1j8t s HIS 146 Cb 0.19 -3.61 1.46 0.00 -0.13 0.00 0.00 32.58 30.49 1j8t s HIS 146 CO 0.26 -1.76 1.86 -1.35 -2.47 0.00 0.00 174.74 171.29 1j8t h PRO 147 N 4.33 0.00 -0.55 2.88 0.11 -1.90 -0.85 132.00 136.02 1j8t h PRO 147 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1j8t h PRO 147 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1j8t h PRO 147 CO 0.71 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.91 1j8t n GLY 148 N -1.63 2.43 0.28 -0.55 0.00 -1.26 -4.70 105.19 99.75 1j8t n GLY 148 Ca 0.15 -0.64 0.05 0.00 0.00 0.00 0.00 46.02 45.58 1j8t n GLY 148 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1j8t h PHE 149 N 3.51 0.54 -0.33 1.61 3.57 -1.37 0.08 116.94 124.55 1j8t h PHE 149 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1j8t h PHE 149 Cb 0.89 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.51 1j8t h PHE 149 CO 0.37 0.08 0.00 1.63 -2.23 0.00 0.00 178.31 178.16 1j8t n LYS 150 N -4.98 1.95 -3.62 1.11 5.02 -1.26 -4.71 118.16 111.66 1j8t n LYS 150 Ca 0.14 -1.25 -0.40 0.00 -2.02 0.00 0.00 58.31 54.78 1j8t n LYS 150 Cb 0.40 -1.36 -0.10 0.00 -0.02 0.00 0.00 35.03 33.95 1j8t n LYS 150 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1j8t s ASP 151 N -0.89 5.59 0.41 4.39 -1.08 0.01 -4.94 116.67 120.15 1j8t s ASP 151 Ca 0.23 -1.56 0.19 0.00 -0.52 0.00 0.00 52.55 50.88 1j8t s ASP 151 Cb 0.13 -1.97 0.86 0.00 -1.46 0.00 0.00 42.92 40.48 1j8t s ASP 151 CO 0.14 -0.54 1.84 1.55 0.52 0.00 0.00 175.17 178.68 1j8t h PRO 152 N 8.37 0.00 -0.39 4.34 0.13 -1.84 -1.02 132.00 141.59 1j8t h PRO 152 Ca -0.22 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.81 1j8t h PRO 152 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1j8t h PRO 152 CO 0.75 0.32 -0.15 0.28 -0.23 0.00 0.00 178.00 178.97 1j8t h VAL 153 N 0.00 1.28 -0.41 1.56 2.07 -1.95 -1.90 116.25 116.90 1j8t h VAL 153 Ca -0.00 -1.27 -0.11 0.00 0.82 0.00 0.00 66.70 66.14 1j8t h VAL 153 Cb 0.70 1.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.73 1j8t h VAL 153 CO 0.04 0.42 -0.19 0.22 0.02 0.00 0.00 177.57 178.09 1j8t h TYR 154 N 0.60 0.89 -0.34 1.57 3.20 -1.76 -0.95 116.97 120.19 1j8t h TYR 154 Ca 0.09 -0.19 0.05 0.00 3.14 0.00 0.00 58.73 61.81 1j8t h TYR 154 Cb 0.70 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.71 1j8t h TYR 154 CO 0.05 0.92 0.08 -0.09 -1.64 0.00 0.00 178.16 177.49 1j8t h ARG 155 N 0.70 0.20 -0.23 1.82 9.65 -1.04 -0.77 114.38 124.71 1j8t h ARG 155 Ca 0.10 -0.01 -0.09 0.00 -1.10 0.00 0.00 59.98 58.88 1j8t h ARG 155 Cb 0.70 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.22 1j8t h ARG 155 CO 0.05 0.14 -0.23 0.00 2.80 0.00 0.00 179.97 182.73 1j8t h ALA 156 N 1.24 1.18 -0.65 2.80 0.00 -1.08 -2.09 119.26 120.67 1j8t h ALA 156 Ca 0.16 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1j8t h ALA 156 Cb 0.16 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1j8t h ALA 156 CO -0.19 0.52 0.17 -0.09 0.00 0.00 0.00 179.25 179.66 1j8t h ARG 157 N 0.38 1.03 -0.74 0.00 9.65 -0.62 0.17 114.38 124.25 1j8t h ARG 157 Ca 0.06 -0.24 -0.06 0.00 -1.10 0.00 0.00 59.98 58.64 1j8t h ARG 157 Cb 0.62 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 29.03 1j8t h ARG 157 CO 0.04 0.92 0.24 0.00 2.80 0.00 0.00 179.97 183.98 1j8t h ARG 158 N 0.95 1.13 -0.37 0.20 2.47 -0.87 -1.64 114.38 116.26 1j8t h ARG 158 Ca 0.20 -0.23 -0.10 0.00 -1.26 0.00 0.00 59.98 58.59 1j8t h ARG 158 Cb 0.35 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.48 1j8t h ARG 158 CO 0.00 0.95 -0.18 -0.22 0.56 0.00 0.00 179.97 181.08 1j8t h LYS 159 N 1.09 0.68 -0.60 0.04 3.64 -1.09 -0.09 116.57 120.25 1j8t h LYS 159 Ca 0.24 -0.25 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 1j8t h LYS 159 Cb 0.28 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1j8t h LYS 159 CO -0.01 0.82 0.19 0.37 -2.27 0.00 0.00 179.45 178.55 1j8t h GLN 160 N 0.61 0.93 -0.56 1.90 4.15 -0.42 -0.80 115.11 120.91 1j8t h GLN 160 Ca 0.10 -0.20 -0.07 0.00 0.77 0.00 0.00 58.65 59.25 1j8t h GLN 160 Cb 0.65 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 28.18 1j8t h GLN 160 CO 0.05 0.83 0.07 0.74 -1.93 0.00 0.00 178.83 178.58 1j8t h PHE 161 N 0.85 0.97 -0.74 3.99 -1.00 -0.95 -2.22 116.94 117.84 1j8t h PHE 161 Ca 0.19 -0.13 -0.04 0.00 2.81 0.00 0.00 57.97 60.81 1j8t h PHE 161 Cb 0.29 -0.27 -0.03 0.00 3.61 0.00 0.00 35.95 39.54 1j8t h PHE 161 CO 0.02 0.84 0.30 0.00 -1.61 0.00 0.00 178.31 177.86 1j8t h ALA 162 N 1.20 1.14 -0.61 2.45 0.00 -0.71 -1.94 119.26 120.79 1j8t h ALA 162 Ca 0.17 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1j8t h ALA 162 Cb 0.42 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1j8t h ALA 162 CO 0.01 0.62 0.06 -0.44 0.00 0.00 0.00 179.25 179.51 1j8t h ASP 163 N 1.06 0.98 -0.60 0.00 3.32 -0.90 0.15 116.42 120.44 1j8t h ASP 163 Ca 0.25 -0.24 0.03 0.00 0.02 0.00 0.00 57.03 57.08 1j8t h ASP 163 Cb 0.20 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.45 1j8t h ASP 163 CO -0.02 1.00 0.36 0.40 -1.72 0.00 0.00 179.24 179.26 1j8t h ILE 164 N 0.95 1.07 -0.45 0.35 2.04 -1.01 -1.79 117.51 118.67 1j8t h ILE 164 Ca 0.18 -0.25 -0.12 0.00 1.00 0.00 0.00 64.86 65.68 1j8t h ILE 164 Cb 0.46 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 1j8t h ILE 164 CO 0.02 0.13 -0.22 0.00 0.00 0.00 0.00 178.15 178.08 1j8t h ALA 165 N 1.26 0.77 -0.82 1.87 0.00 -0.58 -2.47 119.26 119.30 1j8t h ALA 165 Ca 0.24 -0.38 0.11 0.00 0.00 0.00 0.00 54.91 54.88 1j8t h ALA 165 Cb 0.03 -0.16 -0.08 0.00 0.00 0.00 0.00 17.79 17.57 1j8t h ALA 165 CO -0.10 0.66 0.44 -0.92 0.00 0.00 0.00 179.25 179.33 1j8t h TYR 166 N 0.78 0.79 -0.01 0.00 3.20 -0.47 -2.36 116.97 118.90 1j8t h TYR 166 Ca 0.10 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.01 1j8t h TYR 166 Cb 0.77 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.81 1j8t h TYR 166 CO 0.05 0.27 -0.14 0.09 -1.64 0.00 0.00 178.16 176.78 1j8t n ASN 167 N -4.81 1.09 -4.78 -2.11 3.02 -0.70 -4.91 115.26 102.07 1j8t n ASN 167 Ca 0.15 -1.07 -0.37 0.00 -0.03 0.00 0.00 54.58 53.26 1j8t n ASN 167 Cb 0.34 0.06 -0.03 0.00 -0.61 0.00 0.00 39.78 39.53 1j8t n ASN 167 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1j8t s TYR 168 N -2.31 3.20 0.00 3.10 5.04 -0.89 -5.05 117.35 120.45 1j8t s TYR 168 Ca 0.30 1.62 0.02 0.00 -2.44 0.00 0.00 57.07 56.58 1j8t s TYR 168 Cb 0.20 -3.18 -0.01 0.00 0.35 0.00 0.00 41.96 39.32 1j8t s TYR 168 CO 0.45 -0.80 -0.07 1.03 -1.34 0.00 0.00 175.55 174.81 1j8t s ARG 169 N -2.50 0.56 0.46 4.97 1.81 -1.26 -5.04 118.95 117.95 1j8t s ARG 169 Ca 0.58 -0.34 -0.23 0.00 -1.72 0.00 0.00 55.73 54.02 1j8t s ARG 169 Cb -0.24 -0.51 -0.10 0.00 -0.45 0.00 0.00 34.95 33.66 1j8t s ARG 169 CO 0.29 0.13 0.91 1.58 -0.68 0.00 0.00 175.30 177.54 1j8t n HIS 170 N 2.64 0.77 0.00 -0.53 -0.00 -1.26 -1.77 115.22 115.07 1j8t n HIS 170 Ca -0.15 0.53 0.00 0.00 -0.00 0.00 0.00 57.72 58.11 1j8t n HIS 170 Cb 0.57 -2.16 0.00 0.00 -0.00 0.00 0.00 29.99 28.40 1j8t n HIS 170 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1j8t n GLY 171 N 1.32 2.86 3.82 1.57 0.00 -1.26 -5.05 105.19 108.45 1j8t n GLY 171 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 1j8t n GLY 171 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1j8t s GLN 172 N -0.05 3.18 0.47 1.61 -0.21 -0.73 -5.03 119.66 118.91 1j8t s GLN 172 Ca 0.00 1.02 -0.22 0.00 0.02 0.00 0.00 55.36 56.18 1j8t s GLN 172 Cb 0.00 -2.02 -0.08 0.00 1.00 0.00 0.00 33.01 31.91 1j8t s GLN 172 CO 0.00 -0.91 1.10 -1.25 -2.12 0.00 0.00 175.29 172.11 1j8t s PRO 173 N -4.67 3.77 -0.15 2.91 0.04 -1.26 -4.97 135.00 130.68 1j8t s PRO 173 Ca 0.60 1.58 -0.29 0.00 0.04 0.00 0.00 61.00 62.92 1j8t s PRO 173 Cb -0.14 -2.27 -0.01 0.00 0.04 0.00 0.00 34.50 32.12 1j8t s PRO 173 CO 0.47 -0.49 1.08 0.42 0.04 0.00 0.00 177.00 178.52 1j8t s ILE 174 N -1.73 4.60 0.22 0.56 1.01 -1.26 -4.96 121.20 119.64 1j8t s ILE 174 Ca 0.65 1.90 -0.31 0.00 0.00 0.00 0.00 60.65 62.89 1j8t s ILE 174 Cb -0.23 -4.23 -0.15 0.00 0.01 0.00 0.00 42.46 37.87 1j8t s ILE 174 CO 0.28 -0.07 1.22 -2.65 0.00 0.00 0.00 174.94 173.71 1j8t n PRO 175 N 5.66 1.51 -2.86 2.79 -0.02 -1.26 -4.36 135.00 136.46 1j8t n PRO 175 Ca 0.11 0.53 -0.33 0.00 -2.02 0.00 0.00 63.50 61.79 1j8t n PRO 175 Cb 0.47 -2.06 -0.07 0.00 -0.02 0.00 0.00 33.50 31.82 1j8t n PRO 175 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1j8t s ARG 176 N -0.64 4.16 0.02 -0.52 0.52 -1.26 -4.85 118.95 116.38 1j8t s ARG 176 Ca 0.68 1.00 0.06 0.00 -0.52 0.00 0.00 55.73 56.95 1j8t s ARG 176 Cb -0.75 -2.23 -0.02 0.00 0.52 0.00 0.00 34.95 32.47 1j8t s ARG 176 CO 0.53 -0.01 -0.17 0.08 0.02 0.00 0.00 175.30 175.75 1j8t s VAL 177 N -2.17 1.35 -0.36 3.52 1.01 -1.26 -5.10 120.40 117.39 1j8t s VAL 177 Ca 0.60 -0.91 -0.25 0.00 0.00 0.00 0.00 61.98 61.42 1j8t s VAL 177 Cb -0.09 -1.16 0.01 0.00 0.00 0.00 0.00 36.38 35.14 1j8t s VAL 177 CO 0.15 0.23 0.86 -0.70 0.00 0.00 0.00 175.10 175.65 1j8t s GLU 178 N -0.79 3.82 0.30 2.72 2.12 -1.26 -5.02 118.70 120.59 1j8t s GLU 178 Ca 0.05 0.48 -0.23 0.00 0.36 0.00 0.00 54.97 55.64 1j8t s GLU 178 Cb -0.07 -3.80 -0.09 0.00 0.26 0.00 0.00 34.13 30.42 1j8t s GLU 178 CO 0.00 -0.89 0.86 0.71 -0.54 0.00 0.00 175.26 175.40 1j8t s TYR 179 N 3.30 3.63 0.79 5.30 2.02 -1.26 -5.05 117.35 126.07 1j8t s TYR 179 Ca 0.35 1.60 -0.11 0.00 -0.37 0.00 0.00 57.07 58.54 1j8t s TYR 179 Cb -0.13 -2.79 0.06 0.00 -0.40 0.00 0.00 41.96 38.71 1j8t s TYR 179 CO 0.17 0.22 1.09 -1.64 -1.57 0.00 0.00 175.55 173.82 1j8t s MET 180 N -2.18 2.16 0.33 -0.62 -1.94 -1.26 -4.86 119.30 110.93 1j8t s MET 180 Ca 0.49 0.80 0.01 0.00 -1.71 0.00 0.00 55.69 55.27 1j8t s MET 180 Cb -0.17 -1.91 0.55 0.00 2.01 0.00 0.00 34.83 35.31 1j8t s MET 180 CO 0.21 -1.61 1.96 0.93 -0.01 0.00 0.00 175.02 176.51 1j8t h GLU 181 N -1.09 0.89 -0.45 2.03 4.39 -1.99 -1.52 114.58 116.84 1j8t h GLU 181 Ca -0.46 -0.08 -0.07 0.00 0.34 0.00 0.00 59.36 59.09 1j8t h GLU 181 Cb 1.25 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.70 1j8t h GLU 181 CO 0.57 0.63 -0.01 1.49 -1.16 0.00 0.00 179.01 180.53 1j8t h GLU 182 N 0.90 0.73 -0.42 2.33 4.22 -1.99 -1.04 114.58 119.31 1j8t h GLU 182 Ca 0.24 -0.19 -0.11 0.00 0.08 0.00 0.00 59.36 59.37 1j8t h GLU 182 Cb -0.03 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 1j8t h GLU 182 CO -0.04 0.75 -0.17 0.93 -2.18 0.00 0.00 179.01 178.30 1j8t h GLU 183 N 0.69 0.86 -0.08 1.92 5.08 -1.76 -2.58 114.58 118.71 1j8t h GLU 183 Ca 0.14 -0.36 -0.11 0.00 -1.00 0.00 0.00 59.36 58.02 1j8t h GLU 183 Cb 0.44 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1j8t h GLU 183 CO 0.02 1.00 -0.47 0.87 -1.00 0.00 0.00 179.01 179.43 1j8t h LYS 184 N 0.68 0.20 -0.54 2.33 1.57 -0.94 -1.43 116.57 118.43 1j8t h LYS 184 Ca 0.10 -0.11 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1j8t h LYS 184 Cb 0.72 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 1j8t h LYS 184 CO 0.05 0.63 0.12 -0.22 -0.57 0.00 0.00 179.45 179.47 1j8t h LYS 185 N 0.16 0.87 -0.24 3.15 3.64 -1.09 0.47 116.57 123.53 1j8t h LYS 185 Ca 0.01 -0.22 -0.01 0.00 -1.27 0.00 0.00 60.65 59.16 1j8t h LYS 185 Cb 0.89 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 1j8t h LYS 185 CO 0.07 0.83 0.11 1.15 -2.27 0.00 0.00 179.45 179.34 1j8t h THR 186 N 0.77 1.16 -0.38 1.00 2.02 -1.15 -1.88 112.91 114.46 1j8t h THR 186 Ca 0.17 -0.48 0.04 0.00 0.77 0.00 0.00 66.41 66.91 1j8t h THR 186 Cb 0.36 1.02 -0.04 0.00 -1.74 0.00 0.00 68.15 67.75 1j8t h THR 186 CO 0.00 0.16 0.14 -0.25 0.37 0.00 0.00 175.52 175.95 1j8t h TRP 187 N 0.25 0.26 -0.38 3.16 2.91 -1.13 -2.54 115.95 118.49 1j8t h TRP 187 Ca 0.08 0.02 -0.07 0.00 1.13 0.00 0.00 58.89 60.05 1j8t h TRP 187 Cb 0.16 -0.06 -0.02 0.00 -0.51 0.00 0.00 29.16 28.73 1j8t h TRP 187 CO -0.01 0.11 -0.05 0.78 -1.03 0.00 0.00 178.44 178.24 1j8t h GLY 188 N 0.31 0.68 0.96 2.65 0.00 -0.52 -0.59 103.07 106.54 1j8t h GLY 188 Ca 0.17 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 1j8t h GLY 188 CO -0.16 0.42 0.19 -0.84 0.00 0.00 0.00 176.54 176.15 1j8t h THR 189 N 0.59 1.18 -0.50 4.70 2.02 -1.15 -0.84 112.91 118.91 1j8t h THR 189 Ca 0.11 -0.53 -0.10 0.00 0.77 0.00 0.00 66.41 66.67 1j8t h THR 189 Cb 0.45 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 1j8t h THR 189 CO 0.02 0.20 -0.06 0.58 0.37 0.00 0.00 175.52 176.63 1j8t h VAL 190 N 0.53 1.27 -0.06 3.16 2.07 -1.03 -2.37 116.25 119.82 1j8t h VAL 190 Ca 0.14 -1.18 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 1j8t h VAL 190 Cb 0.14 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1j8t h VAL 190 CO -0.02 0.41 0.01 0.15 0.02 0.00 0.00 177.57 178.15 1j8t h PHE 191 N 0.79 0.11 -0.05 1.57 3.57 -1.05 -1.36 116.94 120.52 1j8t h PHE 191 Ca 0.13 -0.02 -0.20 0.00 3.53 0.00 0.00 57.97 61.42 1j8t h PHE 191 Cb 0.61 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.31 1j8t h PHE 191 CO 0.04 0.33 -0.79 0.87 -2.23 0.00 0.00 178.31 176.53 1j8t h LYS 192 N -0.14 0.39 -0.21 1.11 1.57 -1.18 -1.68 116.57 116.43 1j8t h LYS 192 Ca 0.02 -0.35 -0.14 0.00 -1.87 0.00 0.00 60.65 58.30 1j8t h LYS 192 Cb 0.28 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1j8t h LYS 192 CO 0.00 1.01 -0.43 1.79 -0.57 0.00 0.00 179.45 181.25 1j8t h THR 193 N 0.25 1.32 -0.48 -0.16 1.35 -1.43 -3.26 112.91 110.50 1j8t h THR 193 Ca -0.04 -1.65 -0.10 0.00 -0.55 0.00 0.00 66.41 64.06 1j8t h THR 193 Cb 1.39 1.82 -0.02 0.00 -1.73 0.00 0.00 68.15 69.61 1j8t h THR 193 CO 0.14 0.52 -0.10 -0.07 -0.25 0.00 0.00 175.52 175.75 1j8t h LEU 194 N 0.37 0.87 -2.17 3.87 3.38 -1.26 -3.22 115.31 117.17 1j8t h LEU 194 Ca 0.01 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.72 1j8t h LEU 194 Cb 1.03 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1j8t h LEU 194 CO 0.10 0.99 0.04 0.50 0.09 0.00 0.00 178.44 180.15 1j8t h LYS 195 N 0.79 0.00 0.00 1.13 3.64 -1.34 0.55 116.57 121.34 1j8t h LYS 195 Ca 0.13 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1j8t h LYS 195 Cb 0.61 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1j8t h LYS 195 CO 0.04 0.00 0.00 -1.13 -2.27 0.00 0.00 179.45 176.09 1j8t n SER 196 N -4.26 0.59 -0.00 4.20 3.41 -1.22 -2.70 113.62 113.64 1j8t n SER 196 Ca -0.02 0.71 0.08 0.00 -0.26 0.00 0.00 58.87 59.39 1j8t n SER 196 Cb 0.13 -0.81 -0.11 0.00 -0.26 0.00 0.00 64.21 63.16 1j8t n SER 196 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1j8t n LEU 197 N -2.22 0.47 -0.14 1.04 4.77 0.18 -4.72 117.00 116.38 1j8t n LEU 197 Ca 0.00 -0.29 -0.11 0.00 -0.03 0.00 0.00 56.01 55.58 1j8t n LEU 197 Cb 0.12 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.21 1j8t n LEU 197 CO 0.14 0.12 0.64 1.88 -1.33 0.00 0.00 177.39 178.84 1j8t h TYR 198 N 0.00 1.10 -0.63 -1.77 0.05 -1.53 0.20 116.97 114.40 1j8t h TYR 198 Ca 0.00 -0.28 0.05 0.00 0.05 0.00 0.00 58.73 58.55 1j8t h TYR 198 Cb 0.57 -0.25 -0.04 0.00 1.01 0.00 0.00 36.73 38.02 1j8t h TYR 198 CO 0.00 1.10 0.41 -0.22 -1.05 0.00 0.00 178.16 178.40 1j8t h LYS 199 N 0.81 0.64 0.00 4.88 3.64 -1.85 -0.77 116.57 123.92 1j8t h LYS 199 Ca 0.10 -0.04 -0.27 0.00 -1.27 0.00 0.00 60.65 59.16 1j8t h LYS 199 Cb 0.84 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.46 1j8t h LYS 199 CO 0.07 0.42 -1.87 0.25 -2.27 0.00 0.00 179.45 176.06 1j8t n THR 200 N -4.47 1.37 -0.04 1.00 -2.24 -1.11 -4.65 114.28 104.15 1j8t n THR 200 Ca 0.08 -0.78 -0.01 0.00 -2.27 0.00 0.00 64.05 61.07 1j8t n THR 200 Cb 0.20 -0.74 -0.09 0.00 -2.10 0.00 0.00 70.33 67.60 1j8t n THR 200 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1j8t n HIS 201 N -2.88 0.00 -3.07 4.78 8.25 0.04 -5.02 115.22 117.32 1j8t n HIS 201 Ca -0.20 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 56.95 1j8t n HIS 201 Cb 1.02 -0.44 -0.05 0.00 1.12 0.00 0.00 29.99 31.63 1j8t n HIS 201 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1j8t s ALA 202 N -2.47 3.35 0.88 -1.41 0.00 -0.31 -1.46 121.76 120.34 1j8t s ALA 202 Ca -0.05 -0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.74 1j8t s ALA 202 Cb 0.05 -2.72 0.12 0.00 0.00 0.00 0.00 23.12 20.57 1j8t s ALA 202 CO 0.46 0.24 1.11 0.00 0.00 0.00 0.00 175.76 177.57 1j8t h TYR 204 N -1.64 0.49 -0.61 0.00 3.20 -1.96 -1.04 116.97 115.40 1j8t h TYR 204 Ca -0.45 0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.48 1j8t h TYR 204 Cb 1.26 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 39.39 1j8t h TYR 204 CO 0.50 0.11 0.40 0.93 -1.64 0.00 0.00 178.16 178.46 1j8t h GLU 205 N 0.46 0.69 0.45 1.82 3.07 -1.98 0.25 114.58 119.34 1j8t h GLU 205 Ca 0.36 -0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 59.16 1j8t h GLU 205 Cb 0.49 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.25 1j8t h GLU 205 CO -0.35 0.46 -0.22 -0.92 -1.40 0.00 0.00 179.01 176.58 1j8t h TYR 206 N 0.71 -0.56 0.00 4.33 3.20 -1.50 -2.89 116.97 120.25 1j8t h TYR 206 Ca 0.25 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 62.06 1j8t h TYR 206 Cb 0.10 0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 1j8t h TYR 206 CO -0.00 -0.25 -0.22 -0.91 -1.64 0.00 0.00 178.16 175.14 1j8t h ASN 207 N -0.86 0.00 -0.42 -2.11 2.35 -1.12 -1.73 115.58 111.69 1j8t h ASN 207 Ca -0.06 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.65 1j8t h ASN 207 Cb 0.57 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.92 1j8t h ASN 207 CO 0.10 0.22 0.13 -0.74 -1.65 0.00 0.00 177.43 175.49 1j8t h HIS 208 N 0.00 0.68 0.00 1.19 2.76 -0.53 -3.24 115.15 116.01 1j8t h HIS 208 Ca -0.00 -0.07 -0.16 0.00 -2.20 0.00 0.00 60.37 57.94 1j8t h HIS 208 Cb 0.40 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 29.14 1j8t h HIS 208 CO 0.00 0.63 -1.14 0.97 -1.30 0.00 0.00 177.93 177.09 1j8t h ILE 209 N 0.54 0.70 -0.66 6.26 6.09 -1.27 -3.40 117.51 125.77 1j8t h ILE 209 Ca 0.13 -2.18 0.09 0.00 -1.37 0.00 0.00 64.86 61.53 1j8t h ILE 209 Cb 0.27 2.21 -0.07 0.00 0.47 0.00 0.00 36.82 39.71 1j8t h ILE 209 CO -0.00 0.40 0.31 0.15 -3.07 0.00 0.00 178.15 175.93 1j8t h PHE 210 N 0.00 0.55 -0.09 2.19 3.04 -1.35 0.38 116.94 121.66 1j8t h PHE 210 Ca -0.11 0.03 0.03 0.00 3.98 0.00 0.00 57.97 61.89 1j8t h PHE 210 Cb 1.56 -0.15 -0.00 0.00 2.56 0.00 0.00 35.95 39.92 1j8t h PHE 210 CO 0.00 0.19 0.07 -1.35 -2.02 0.00 0.00 178.31 175.20 1j8t h PRO 211 N 0.54 0.00 0.00 6.41 0.11 -1.77 -1.34 132.00 135.95 1j8t h PRO 211 Ca 0.32 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 66.23 1j8t h PRO 211 Cb 0.34 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.44 1j8t h PRO 211 CO -0.27 0.00 -0.89 -0.07 -0.21 0.00 0.00 178.00 176.56 1j8t h LEU 212 N 0.00 0.29 -1.06 2.35 3.38 -1.19 -0.79 115.31 118.29 1j8t h LEU 212 Ca 0.04 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 1j8t h LEU 212 Cb 0.18 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1j8t h LEU 212 CO -0.00 1.04 0.21 -0.07 0.09 0.00 0.00 178.44 179.71 1j8t h LEU 213 N 0.12 0.81 -0.55 1.67 3.38 -0.68 0.52 115.31 120.58 1j8t h LEU 213 Ca -0.05 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.67 1j8t h LEU 213 Cb 1.52 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 42.05 1j8t h LEU 213 CO 0.14 0.75 -0.29 -0.33 0.09 0.00 0.00 178.44 178.80 1j8t h GLU 214 N 0.86 0.85 0.02 1.13 5.08 -1.05 0.13 114.58 121.60 1j8t h GLU 214 Ca 0.20 -0.39 -0.13 0.00 -1.00 0.00 0.00 59.36 58.04 1j8t h GLU 214 Cb 0.21 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.46 1j8t h GLU 214 CO -0.01 1.03 -0.53 -0.22 -1.00 0.00 0.00 179.01 178.28 1j8t h LYS 215 N 0.72 0.33 -0.00 2.33 3.64 -0.78 -3.29 116.57 119.51 1j8t h LYS 215 Ca 0.08 -0.38 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 1j8t h LYS 215 Cb 0.84 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1j8t h LYS 215 CO 0.07 1.07 -0.44 0.66 -2.27 0.00 0.00 179.45 178.55 1j8t n TYR 216 N -4.29 0.00 0.09 1.91 4.02 0.18 -4.46 117.16 114.62 1j8t n TYR 216 Ca -0.11 0.00 0.02 0.00 -0.01 0.00 0.00 57.90 57.81 1j8t n TYR 216 Cb 0.65 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 40.01 1j8t n TYR 216 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1j8t n GLY 218 N 0.15 0.19 3.55 0.00 0.00 -1.08 -4.60 105.19 103.39 1j8t n GLY 218 Ca 0.04 -0.56 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 1j8t n GLY 218 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j8t s PHE 219 N -2.40 2.16 0.10 1.61 0.40 -1.09 -4.29 117.98 114.49 1j8t s PHE 219 Ca 0.00 0.16 -0.18 0.00 -0.60 0.00 0.00 56.93 56.32 1j8t s PHE 219 Cb 0.00 -4.50 0.04 0.00 0.51 0.00 0.00 43.02 39.07 1j8t s PHE 219 CO 0.00 -2.11 0.43 -1.58 0.70 0.00 0.00 175.22 172.66 1j8t s HIS 220 N 6.43 -0.27 -0.12 0.36 2.46 -1.26 -4.36 115.29 118.53 1j8t s HIS 220 Ca 0.43 0.05 0.28 0.00 0.47 0.00 0.00 55.06 56.29 1j8t s HIS 220 Cb -0.09 0.29 1.33 0.00 -0.13 0.00 0.00 32.58 33.97 1j8t s HIS 220 CO 0.17 -0.68 1.84 1.05 -2.47 0.00 0.00 174.74 174.64 1j8t h GLU 221 N 2.50 0.00 -0.34 2.88 9.09 -1.91 -2.31 114.58 124.49 1j8t h GLU 221 Ca -0.33 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.01 1j8t h GLU 221 Cb 1.25 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 28.31 1j8t h GLU 221 CO 0.45 0.00 0.02 -0.40 0.05 0.00 0.00 179.01 179.13 1j8t n ASP 222 N -2.51 3.74 -3.68 3.06 3.85 -1.26 -3.45 116.55 116.30 1j8t n ASP 222 Ca -0.00 -3.20 -0.10 0.00 -0.71 0.00 0.00 54.79 50.78 1j8t n ASP 222 Cb 0.15 -0.59 -0.11 0.00 -1.35 0.00 0.00 41.12 39.22 1j8t n ASP 222 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.20 176.40 1j8t s ASN 223 N -1.94 -0.35 -0.26 -1.12 2.47 -0.87 -5.03 114.94 107.84 1j8t s ASN 223 Ca 0.44 0.90 -0.21 0.00 0.42 0.00 0.00 52.86 54.42 1j8t s ASN 223 Cb 0.37 0.98 -0.01 0.00 -1.45 0.00 0.00 41.25 41.13 1j8t s ASN 223 CO 0.08 -0.21 0.67 -0.63 -3.72 0.00 0.00 177.10 173.29 1j8t s ILE 224 N 1.93 4.95 0.63 -5.21 1.01 -1.26 -4.04 121.20 119.20 1j8t s ILE 224 Ca -0.06 1.18 -0.19 0.00 0.00 0.00 0.00 60.65 61.59 1j8t s ILE 224 Cb -0.10 -3.98 -0.02 0.00 0.01 0.00 0.00 42.46 38.37 1j8t s ILE 224 CO -0.12 -0.02 1.30 -2.84 0.00 0.00 0.00 174.94 173.26 1j8t s PRO 225 N 2.59 2.66 0.07 2.79 0.02 -1.26 -4.99 135.00 136.89 1j8t s PRO 225 Ca 0.28 2.08 -0.16 0.00 0.02 0.00 0.00 61.00 63.21 1j8t s PRO 225 Cb -0.15 -1.91 -0.06 0.00 0.02 0.00 0.00 34.50 32.40 1j8t s PRO 225 CO 0.09 -1.52 0.50 -0.65 -0.33 0.00 0.00 177.00 175.09 1j8t s GLN 226 N -3.31 4.03 0.47 5.54 -1.52 -1.26 -4.96 119.66 118.64 1j8t s GLN 226 Ca 0.81 0.54 0.22 0.00 -1.95 0.00 0.00 55.36 54.98 1j8t s GLN 226 Cb -0.38 -3.14 1.17 0.00 -0.22 0.00 0.00 33.01 30.44 1j8t s GLN 226 CO 0.40 0.61 1.98 -0.07 -0.25 0.00 0.00 175.29 177.96 1j8t h LEU 227 N 4.29 0.00 -0.58 2.90 3.38 -1.89 -2.10 115.31 121.30 1j8t h LEU 227 Ca -0.50 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.39 1j8t h LEU 227 Cb 1.21 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 1j8t h LEU 227 CO 0.64 0.20 0.04 -0.08 0.09 0.00 0.00 178.44 179.33 1j8t h GLU 228 N 0.00 1.00 -0.51 1.13 4.57 -1.90 0.20 114.58 119.08 1j8t h GLU 228 Ca -0.00 -0.30 -0.05 0.00 -1.18 0.00 0.00 59.36 57.83 1j8t h GLU 228 Cb 0.46 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.93 1j8t h GLU 228 CO 0.03 0.97 0.10 -0.44 -1.18 0.00 0.00 179.01 178.49 1j8t h ASP 229 N 0.90 0.79 -0.75 1.04 3.32 -1.77 -1.52 116.42 118.43 1j8t h ASP 229 Ca 0.17 -0.25 -0.05 0.00 0.02 0.00 0.00 57.03 56.92 1j8t h ASP 229 Cb 0.49 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 1j8t h ASP 229 CO 0.02 0.83 0.27 0.58 -1.72 0.00 0.00 179.24 179.22 1j8t h VAL 230 N 0.71 1.26 -0.55 -1.35 2.07 -1.18 -1.53 116.25 115.69 1j8t h VAL 230 Ca 0.16 -0.85 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 1j8t h VAL 230 Cb 0.36 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 1j8t h VAL 230 CO 0.01 0.34 0.25 -1.28 0.02 0.00 0.00 177.57 176.90 1j8t h SER 231 N 1.11 0.73 -0.05 0.57 0.87 -0.40 -0.07 113.55 116.31 1j8t h SER 231 Ca 0.25 -0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.59 1j8t h SER 231 Cb 0.25 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 1j8t h SER 231 CO -0.02 0.68 -0.17 1.56 -0.53 0.00 0.00 176.83 178.35 1j8t h GLN 232 N 0.74 0.41 -0.12 2.24 1.08 -1.03 -0.33 115.11 118.09 1j8t h GLN 232 Ca 0.19 -0.12 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 1j8t h GLN 232 Cb 0.15 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.54 1j8t h GLN 232 CO -0.02 0.57 0.03 0.35 -0.95 0.00 0.00 178.83 178.81 1j8t h PHE 233 N 0.37 0.20 -0.61 2.96 3.57 -0.85 -2.21 116.94 120.37 1j8t h PHE 233 Ca 0.07 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 1j8t h PHE 233 Cb 0.52 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.18 1j8t h PHE 233 CO 0.01 0.34 0.29 -0.07 -2.23 0.00 0.00 178.31 176.65 1j8t h LEU 234 N -0.01 0.78 -0.79 0.59 3.38 -0.75 -2.16 115.31 116.35 1j8t h LEU 234 Ca 0.04 -0.08 0.05 0.00 0.09 0.00 0.00 57.88 57.98 1j8t h LEU 234 Cb 0.24 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 1j8t h LEU 234 CO -0.00 0.67 0.49 1.56 0.09 0.00 0.00 178.44 181.24 1j8t h GLN 235 N 0.86 0.88 0.00 1.13 4.20 0.04 0.08 115.11 122.31 1j8t h GLN 235 Ca 0.21 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.81 1j8t h GLN 235 Cb 0.10 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1j8t h GLN 235 CO -0.03 0.58 -0.26 1.79 -0.67 0.00 0.00 178.83 180.25 1j8t h THR 236 N 0.91 0.90 0.09 -0.54 1.35 -0.84 -0.55 112.91 114.24 1j8t h THR 236 Ca 0.34 -1.01 -0.17 0.00 -0.55 0.00 0.00 66.41 65.02 1j8t h THR 236 Cb 0.12 1.59 0.01 0.00 -1.73 0.00 0.00 68.15 68.14 1j8t h THR 236 CO -0.15 0.26 -0.80 0.00 -0.25 0.00 0.00 175.52 174.57 1j8t n THR 238 N -4.21 0.00 0.00 0.00 -2.24 -0.13 -4.77 114.28 102.93 1j8t n THR 238 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1j8t n THR 238 Cb 0.75 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.94 1j8t n THR 238 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1j8t n GLY 239 N 0.00 2.60 3.76 3.38 0.00 -0.22 -4.98 105.19 109.74 1j8t n GLY 239 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1j8t n GLY 239 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1j8t s PHE 240 N -2.14 2.50 0.16 1.61 0.40 -1.23 -4.72 117.98 114.55 1j8t s PHE 240 Ca 0.00 1.46 0.02 0.00 -0.60 0.00 0.00 56.93 57.81 1j8t s PHE 240 Cb 0.00 -3.59 -0.05 0.00 0.51 0.00 0.00 43.02 39.89 1j8t s PHE 240 CO 0.00 -2.30 -0.02 -0.98 0.70 0.00 0.00 175.22 172.62 1j8t s ARG 241 N -2.93 1.06 0.10 0.44 1.70 -0.46 -1.51 118.95 117.35 1j8t s ARG 241 Ca 0.70 -1.49 0.03 0.00 -0.47 0.00 0.00 55.73 54.49 1j8t s ARG 241 Cb -0.34 -0.30 -0.04 0.00 -0.57 0.00 0.00 34.95 33.70 1j8t s ARG 241 CO 0.40 -0.09 0.15 -0.51 -1.08 0.00 0.00 175.30 174.17 1j8t s LEU 242 N -3.15 4.00 -0.04 -1.89 1.43 -1.26 -1.05 118.68 116.71 1j8t s LEU 242 Ca 0.21 0.05 0.04 0.00 -1.03 0.00 0.00 54.13 53.41 1j8t s LEU 242 Cb 0.06 -2.63 -0.01 0.00 0.03 0.00 0.00 46.19 43.64 1j8t s LEU 242 CO 0.02 0.14 -0.17 -0.13 0.23 0.00 0.00 176.35 176.44 1j8t s ARG 243 N -2.67 1.66 0.39 1.70 0.52 -0.74 -4.90 118.95 114.92 1j8t s ARG 243 Ca 0.32 -0.60 -0.26 0.00 -0.52 0.00 0.00 55.73 54.67 1j8t s ARG 243 Cb -0.12 -1.48 -0.09 0.00 0.52 0.00 0.00 34.95 33.78 1j8t s ARG 243 CO 0.24 0.27 1.18 -1.25 0.02 0.00 0.00 175.30 175.76 1j8t s PRO 244 N -0.06 4.08 0.01 3.54 0.04 -1.26 -0.84 135.00 140.51 1j8t s PRO 244 Ca -0.01 1.87 0.01 0.00 0.04 0.00 0.00 61.00 62.90 1j8t s PRO 244 Cb -0.10 -2.71 -0.01 0.00 0.04 0.00 0.00 34.50 31.72 1j8t s PRO 244 CO 0.01 -0.30 -0.04 0.54 0.04 0.00 0.00 177.00 177.25 1j8t s VAL 245 N -1.39 0.28 -0.20 -0.36 0.11 -0.44 -4.73 120.40 113.68 1j8t s VAL 245 Ca 0.56 -0.41 -0.17 0.00 -2.93 0.00 0.00 61.98 59.03 1j8t s VAL 245 Cb -0.31 -0.29 -0.14 0.00 -1.53 0.00 0.00 36.38 34.11 1j8t s VAL 245 CO 0.40 -0.09 0.05 0.00 -3.33 0.00 0.00 175.10 172.12 1j8t n ALA 246 N 2.53 0.73 -3.00 1.54 0.00 -1.26 -4.11 120.51 116.94 1j8t n ALA 246 Ca -0.16 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1j8t n ALA 246 Cb 0.58 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 19.69 1j8t n ALA 246 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j8t n GLY 247 N 1.47 5.92 3.63 0.00 0.00 -1.26 -4.90 105.19 110.04 1j8t n GLY 247 Ca -0.27 -1.57 -0.43 0.00 0.00 0.00 0.00 46.02 43.75 1j8t n GLY 247 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1j8t s LEU 248 N 0.00 3.86 0.54 0.99 2.96 -1.26 -4.90 118.68 120.86 1j8t s LEU 248 Ca 0.00 0.92 -0.18 0.00 -0.22 0.00 0.00 54.13 54.66 1j8t s LEU 248 Cb 0.00 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 43.08 1j8t s LEU 248 CO 0.00 -0.98 1.04 -0.76 -1.32 0.00 0.00 176.35 174.32 1j8t s LEU 249 N 3.90 3.66 0.78 -0.68 1.43 -1.26 -1.76 118.68 124.75 1j8t s LEU 249 Ca 0.47 1.83 -0.13 0.00 -1.03 0.00 0.00 54.13 55.26 1j8t s LEU 249 Cb -0.11 -4.54 0.07 0.00 0.03 0.00 0.00 46.19 41.64 1j8t s LEU 249 CO 0.20 -0.93 1.18 -0.94 0.23 0.00 0.00 176.35 176.09 1j8t s SER 250 N -2.50 3.88 0.24 2.29 1.04 -1.26 -4.80 113.70 112.59 1j8t s SER 250 Ca 0.64 2.26 -0.07 0.00 0.48 0.00 0.00 55.95 59.26 1j8t s SER 250 Cb -0.15 -2.58 0.23 0.00 0.10 0.00 0.00 66.02 63.62 1j8t s SER 250 CO 0.29 -2.47 1.90 0.28 0.98 0.00 0.00 173.24 174.22 1j8t h SER 251 N -0.81 1.13 -0.68 7.02 0.02 -1.97 -0.94 113.55 117.31 1j8t h SER 251 Ca -0.46 -0.06 0.06 0.00 -0.84 0.00 0.00 61.79 60.50 1j8t h SER 251 Cb 1.28 -0.28 -0.06 0.00 0.14 0.00 0.00 62.40 63.48 1j8t h SER 251 CO 0.48 0.85 0.38 -0.09 -1.14 0.00 0.00 176.83 177.30 1j8t h ARG 252 N 1.30 0.67 0.08 3.45 2.43 -1.92 -0.87 114.38 119.52 1j8t h ARG 252 Ca 0.34 -0.04 -0.23 0.00 -0.81 0.00 0.00 59.98 59.24 1j8t h ARG 252 Cb -0.09 -0.15 0.02 0.00 -0.42 0.00 0.00 29.97 29.33 1j8t h ARG 252 CO -0.07 0.44 -0.95 -0.44 -1.51 0.00 0.00 179.97 177.44 1j8t h ASP 253 N 0.69 0.71 0.07 -3.80 3.32 -1.79 -1.45 116.42 114.18 1j8t h ASP 253 Ca 0.31 -0.82 0.01 0.00 0.02 0.00 0.00 57.03 56.55 1j8t h ASP 253 Cb 0.20 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1j8t h ASP 253 CO -0.19 1.45 -0.14 0.15 -1.72 0.00 0.00 179.24 178.79 1j8t h PHE 254 N 0.06 -0.36 -0.91 4.55 3.57 -1.10 -2.28 116.94 120.47 1j8t h PHE 254 Ca -0.14 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.35 1j8t h PHE 254 Cb 1.66 0.15 -0.04 0.00 2.79 0.00 0.00 35.95 40.51 1j8t h PHE 254 CO 0.14 -0.21 0.51 -0.07 -2.23 0.00 0.00 178.31 176.44 1j8t h LEU 255 N -0.27 1.13 -1.45 0.59 4.07 -1.22 -2.65 115.31 115.51 1j8t h LEU 255 Ca 0.03 -0.09 -0.01 0.00 0.08 0.00 0.00 57.88 57.88 1j8t h LEU 255 Cb 0.30 -0.29 -0.02 0.00 1.08 0.00 0.00 40.66 41.73 1j8t h LEU 255 CO -0.09 0.90 0.24 1.23 -1.08 0.00 0.00 178.44 179.64 1j8t h GLY 256 N 1.27 0.65 1.16 0.83 0.00 -0.94 -0.51 103.07 105.53 1j8t h GLY 256 Ca 0.32 -0.28 0.03 0.00 0.00 0.00 0.00 47.33 47.40 1j8t h GLY 256 CO -0.05 0.27 0.50 -1.33 0.00 0.00 0.00 176.54 175.92 1j8t h GLY 257 N 0.70 1.05 2.00 4.60 0.00 -1.04 -1.00 103.07 109.39 1j8t h GLY 257 Ca 0.16 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.12 1j8t h GLY 257 CO -0.03 0.33 -0.01 1.41 0.00 0.00 0.00 176.54 178.24 1j8t h LEU 258 N 0.94 0.00 -1.78 3.11 3.38 -1.00 -0.62 115.31 119.34 1j8t h LEU 258 Ca 0.30 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.24 1j8t h LEU 258 Cb 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1j8t h LEU 258 CO -0.08 0.01 -0.14 0.00 0.09 0.00 0.00 178.44 178.32 1j8t h ALA 259 N 1.99 1.69 -0.62 1.53 0.00 -1.16 -1.27 119.26 121.41 1j8t h ALA 259 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1j8t h ALA 259 Cb 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1j8t h ALA 259 CO 0.00 0.17 0.00 1.19 0.00 0.00 0.00 179.25 180.61 1j8t n PHE 260 N -4.25 0.85 -3.87 0.00 3.01 -0.31 -4.84 117.46 108.04 1j8t n PHE 260 Ca -0.03 -0.42 -0.25 0.00 1.01 0.00 0.00 57.45 57.76 1j8t n PHE 260 Cb 0.21 -0.01 0.01 0.00 -0.01 0.00 0.00 39.48 39.67 1j8t n PHE 260 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1j8t n ARG 261 N 1.30 -4.22 -4.61 -1.08 1.74 -0.48 -4.89 116.66 104.42 1j8t n ARG 261 Ca 0.21 0.51 -0.33 0.00 -0.77 0.00 0.00 57.85 57.47 1j8t n ARG 261 Cb 0.54 -4.95 -0.16 0.00 -1.02 0.00 0.00 32.46 26.86 1j8t n ARG 261 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1j8t s VAL 262 N -3.71 2.50 -0.27 1.55 1.01 -0.76 -1.35 120.40 119.37 1j8t s VAL 262 Ca 0.15 -0.83 -0.06 0.00 0.00 0.00 0.00 61.98 61.24 1j8t s VAL 262 Cb -0.08 -2.04 -0.00 0.00 0.00 0.00 0.00 36.38 34.26 1j8t s VAL 262 CO 0.85 0.53 0.05 0.12 0.00 0.00 0.00 175.10 176.65 1j8t s PHE 263 N 0.77 3.09 -0.16 5.22 5.36 -0.22 -3.05 117.98 129.00 1j8t s PHE 263 Ca -0.07 -0.85 -0.29 0.00 -0.96 0.00 0.00 56.93 54.76 1j8t s PHE 263 Cb -0.16 -2.22 -0.01 0.00 -0.34 0.00 0.00 43.02 40.30 1j8t s PHE 263 CO 0.00 -0.52 1.15 -1.01 -1.46 0.00 0.00 175.22 173.38 1j8t s HIS 264 N 1.52 3.15 -0.10 10.12 3.76 -1.26 -1.79 115.29 130.69 1j8t s HIS 264 Ca 0.04 1.26 0.02 0.00 -0.15 0.00 0.00 55.06 56.23 1j8t s HIS 264 Cb -0.16 -3.38 0.01 0.00 1.11 0.00 0.00 32.58 30.17 1j8t s HIS 264 CO 0.01 -1.06 -0.15 0.00 -0.85 0.00 0.00 174.74 172.70 1j8t s THR 266 N 0.87 3.86 -0.03 0.00 -4.23 -1.26 -1.32 115.64 113.53 1j8t s THR 266 Ca -0.09 0.84 0.04 0.00 -1.18 0.00 0.00 61.69 61.29 1j8t s THR 266 Cb -0.15 -3.39 -0.05 0.00 1.34 0.00 0.00 72.50 70.24 1j8t s THR 266 CO 0.01 -0.56 0.09 1.67 -0.54 0.00 0.00 174.62 175.28 1j8t n GLN 267 N -2.19 1.12 -1.72 3.99 7.27 -1.26 -4.41 117.38 120.18 1j8t n GLN 267 Ca 0.08 -0.03 -0.30 0.00 0.07 0.00 0.00 57.00 56.83 1j8t n GLN 267 Cb 0.53 -1.01 0.06 0.00 2.41 0.00 0.00 30.24 32.23 1j8t n GLN 267 CO 0.00 0.00 0.00 1.52 0.07 0.00 0.00 177.06 178.65 1j8t s TYR 268 N -2.08 3.11 0.16 3.69 -0.85 -1.26 -4.75 117.35 115.38 1j8t s TYR 268 Ca -0.01 1.13 0.11 0.00 -0.52 0.00 0.00 57.07 57.78 1j8t s TYR 268 Cb 0.02 -3.06 -0.04 0.00 0.38 0.00 0.00 41.96 39.26 1j8t s TYR 268 CO 0.15 -1.41 -0.25 -1.50 -1.52 0.00 0.00 175.55 171.01 1j8t s ILE 269 N -3.24 2.33 0.85 -3.49 2.07 -1.26 -0.39 121.20 118.07 1j8t s ILE 269 Ca 0.59 -1.90 -0.13 0.00 -1.41 0.00 0.00 60.65 57.81 1j8t s ILE 269 Cb -0.13 -2.08 0.08 0.00 0.13 0.00 0.00 42.46 40.47 1j8t s ILE 269 CO 0.53 -0.02 1.03 -2.11 -1.91 0.00 0.00 174.94 172.46 1j8t n ARG 270 N 0.56 -0.03 -1.86 3.50 1.85 -1.26 -4.95 116.66 114.47 1j8t n ARG 270 Ca -0.15 0.06 -0.41 0.00 -1.00 0.00 0.00 57.85 56.35 1j8t n ARG 270 Cb 0.55 -2.30 -0.01 0.00 -1.05 0.00 0.00 32.46 29.65 1j8t n ARG 270 CO 0.00 0.00 0.00 -1.58 -0.01 0.00 0.00 177.63 176.04 1j8t s HIS 271 N -2.27 2.71 -0.97 2.89 5.65 -1.26 -4.90 115.29 117.14 1j8t s HIS 271 Ca 0.69 1.12 0.23 0.00 0.25 0.00 0.00 55.06 57.34 1j8t s HIS 271 Cb -0.27 -3.97 0.96 0.00 -1.18 0.00 0.00 32.58 28.12 1j8t s HIS 271 CO 0.55 -2.93 1.73 0.41 -0.65 0.00 0.00 174.74 173.85 1j8t n GLY 272 N 0.97 -1.30 0.25 1.59 0.00 -1.26 -2.66 105.19 102.78 1j8t n GLY 272 Ca 0.03 -0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.11 1j8t n GLY 272 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1j8t h SER 273 N 0.00 0.00 -2.01 1.61 4.64 -1.91 -3.34 113.55 112.54 1j8t h SER 273 Ca 0.00 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.76 1j8t h SER 273 Cb 0.40 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.10 1j8t h SER 273 CO 0.00 0.13 -1.10 0.29 -0.87 0.00 0.00 176.83 175.28 1j8t n LYS 274 N -3.42 0.79 0.27 4.77 5.02 -1.09 -4.97 118.16 119.53 1j8t n LYS 274 Ca -0.01 -3.28 0.13 0.00 -2.02 0.00 0.00 58.31 53.13 1j8t n LYS 274 Cb 0.31 -1.28 0.76 0.00 -0.02 0.00 0.00 35.03 34.80 1j8t n LYS 274 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1j8t h PRO 275 N 3.93 0.00 -0.47 1.97 0.13 -1.73 -0.31 132.00 135.51 1j8t h PRO 275 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1j8t h PRO 275 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1j8t h PRO 275 CO 0.48 0.08 0.00 -1.33 -0.23 0.00 0.00 178.00 177.00 1j8t n MET 276 N -3.81 2.10 -4.23 0.86 2.81 -1.26 -4.74 117.12 108.84 1j8t n MET 276 Ca -0.02 -1.70 -0.19 0.00 -1.81 0.00 0.00 57.70 53.97 1j8t n MET 276 Cb 0.18 -1.37 -0.16 0.00 -0.71 0.00 0.00 33.22 31.17 1j8t n MET 276 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 1j8t s TYR 277 N -1.37 0.76 -0.05 2.03 5.04 -0.13 -4.98 117.35 118.66 1j8t s TYR 277 Ca 0.32 -0.20 -0.02 0.00 -2.44 0.00 0.00 57.07 54.73 1j8t s TYR 277 Cb 0.16 -0.61 0.03 0.00 0.35 0.00 0.00 41.96 41.89 1j8t s TYR 277 CO 0.21 -0.14 0.10 -0.08 -1.34 0.00 0.00 175.55 174.31 1j8t s THR 278 N 0.55 -0.03 -2.02 4.34 -1.32 -1.26 -4.85 115.64 111.05 1j8t s THR 278 Ca -0.08 0.12 0.07 0.00 -1.21 0.00 0.00 61.69 60.60 1j8t s THR 278 Cb -0.11 -0.17 0.19 0.00 -1.51 0.00 0.00 72.50 70.90 1j8t s THR 278 CO 0.00 0.05 1.20 -0.81 -2.21 0.00 0.00 174.62 172.86 1j8t n PRO 279 N 3.78 1.31 -3.55 7.08 -0.04 -1.26 -4.90 135.00 137.42 1j8t n PRO 279 Ca -0.22 -0.48 -0.11 0.00 -0.04 0.00 0.00 63.50 62.66 1j8t n PRO 279 Cb 0.54 -1.15 -0.02 0.00 -0.04 0.00 0.00 33.50 32.83 1j8t n PRO 279 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1j8t s GLU 280 N -1.84 1.42 0.13 0.54 -1.05 -1.26 -5.11 118.70 111.54 1j8t s GLU 280 Ca 0.13 -0.62 -0.31 0.00 -0.15 0.00 0.00 54.97 54.02 1j8t s GLU 280 Cb 0.07 0.59 -0.08 0.00 -0.44 0.00 0.00 34.13 34.27 1j8t s GLU 280 CO 0.09 -0.63 1.36 -1.25 0.95 0.00 0.00 175.26 175.78 1j8t s PRO 281 N -3.80 4.34 0.28 -4.83 0.04 -1.26 -4.97 135.00 124.81 1j8t s PRO 281 Ca 0.04 2.05 0.01 0.00 0.04 0.00 0.00 61.00 63.14 1j8t s PRO 281 Cb -0.02 -3.24 -0.00 0.00 0.04 0.00 0.00 34.50 31.27 1j8t s PRO 281 CO -0.07 -0.38 0.04 -0.40 0.04 0.00 0.00 177.00 176.23 1j8t n ASP 282 N 3.63 2.06 0.05 6.66 3.85 -1.26 -4.93 116.55 126.60 1j8t n ASP 282 Ca 0.10 -2.36 0.00 0.00 -0.71 0.00 0.00 54.79 51.83 1j8t n ASP 282 Cb 0.43 0.41 0.31 0.00 -1.35 0.00 0.00 41.12 40.92 1j8t n ASP 282 CO 0.00 0.00 0.00 -0.29 -1.01 0.00 0.00 177.20 175.90 1j8t h ILE 283 N 1.28 1.20 -0.72 2.12 2.10 -0.93 -1.00 117.51 121.57 1j8t h ILE 283 Ca -0.23 -0.88 -0.00 0.00 1.08 0.00 0.00 64.86 64.83 1j8t h ILE 283 Cb 0.77 1.12 -0.03 0.00 -1.09 0.00 0.00 36.82 37.58 1j8t h ILE 283 CO 0.37 0.29 0.43 0.00 -1.08 0.00 0.00 178.15 178.16 1j8t h HIS 285 N 0.98 0.40 -0.29 0.00 -0.00 -1.58 -1.36 115.15 113.29 1j8t h HIS 285 Ca 0.26 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.61 1j8t h HIS 285 Cb -0.03 -0.13 -0.01 0.00 -0.00 0.00 0.00 27.41 27.24 1j8t h HIS 285 CO -0.01 0.28 0.12 0.93 -0.00 0.00 0.00 177.93 179.25 1j8t h GLU 286 N 0.40 0.43 0.13 5.26 4.39 -1.08 0.36 114.58 124.47 1j8t h GLU 286 Ca 0.11 -0.07 -0.29 0.00 0.34 0.00 0.00 59.36 59.45 1j8t h GLU 286 Cb -0.00 -0.07 0.02 0.00 -0.10 0.00 0.00 28.75 28.59 1j8t h GLU 286 CO -0.02 0.43 -1.24 -0.07 -1.16 0.00 0.00 179.01 176.95 1j8t h LEU 287 N 0.33 0.70 0.00 1.33 3.38 -1.00 -0.30 115.31 119.75 1j8t h LEU 287 Ca 0.10 -0.67 -0.04 0.00 0.09 0.00 0.00 57.88 57.36 1j8t h LEU 287 Cb 0.16 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1j8t h LEU 287 CO -0.01 1.50 -1.09 -0.07 0.09 0.00 0.00 178.44 178.86 1j8t h LEU 288 N 0.19 0.00 0.00 1.67 3.38 -1.34 -3.36 115.31 115.85 1j8t h LEU 288 Ca -0.17 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.57 1j8t h LEU 288 Cb 1.92 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.64 1j8t h LEU 288 CO 0.22 0.13 -1.61 0.61 0.09 0.00 0.00 178.44 177.89 1j8t n GLY 289 N 1.23 -0.61 0.10 0.83 0.00 0.09 -4.68 105.19 102.16 1j8t n GLY 289 Ca -0.02 -0.16 -0.20 0.00 0.00 0.00 0.00 46.02 45.63 1j8t n GLY 289 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1j8t h HIS 290 N -1.00 0.03 -0.29 1.61 3.86 -1.10 -3.37 115.15 114.89 1j8t h HIS 290 Ca -0.34 -0.02 0.05 0.00 -1.16 0.00 0.00 60.37 58.90 1j8t h HIS 290 Cb 1.23 -0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.66 1j8t h HIS 290 CO -0.18 1.40 0.01 0.28 0.86 0.00 0.00 177.93 180.30 1j8t h VAL 291 N -0.95 0.80 -0.42 2.45 2.07 -1.22 -2.31 116.25 116.66 1j8t h VAL 291 Ca -0.28 -0.04 0.08 0.00 0.82 0.00 0.00 66.70 67.28 1j8t h VAL 291 Cb 1.27 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 1j8t h VAL 291 CO -0.15 0.02 0.29 -0.65 0.02 0.00 0.00 177.57 177.09 1j8t h PRO 292 N 0.10 0.22 0.00 1.57 0.11 -1.82 -0.52 132.00 131.66 1j8t h PRO 292 Ca 0.14 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 66.11 1j8t h PRO 292 Cb 0.18 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.22 1j8t h PRO 292 CO -0.22 0.15 -0.60 -0.07 -0.21 0.00 0.00 178.00 177.04 1j8t h LEU 293 N 0.23 0.00 0.00 2.35 -0.00 -1.68 -2.72 115.31 113.49 1j8t h LEU 293 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.07 1j8t h LEU 293 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.12 1j8t h LEU 293 CO -0.04 0.60 0.00 0.49 -0.00 0.00 0.00 178.44 179.50 1j8t n PHE 294 N -3.48 0.00 1.17 1.13 3.72 -0.21 -1.49 117.46 118.30 1j8t n PHE 294 Ca 0.00 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.54 1j8t n PHE 294 Cb 0.68 -0.46 0.62 0.00 -0.94 0.00 0.00 39.48 39.39 1j8t n PHE 294 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1j8t n SER 295 N -1.46 0.11 -4.71 4.37 3.41 -1.03 -4.59 113.62 109.73 1j8t n SER 295 Ca 0.05 0.11 -0.36 0.00 -0.26 0.00 0.00 58.87 58.41 1j8t n SER 295 Cb 0.17 -0.31 -0.08 0.00 -0.26 0.00 0.00 64.21 63.73 1j8t n SER 295 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1j8t s ASP 296 N -2.81 6.25 0.12 4.04 2.15 -0.56 -4.65 116.67 121.21 1j8t s ASP 296 Ca 0.20 0.28 -0.21 0.00 0.43 0.00 0.00 52.55 53.25 1j8t s ASP 296 Cb 0.19 -2.12 -0.04 0.00 -0.30 0.00 0.00 42.92 40.66 1j8t s ASP 296 CO 0.52 0.13 1.69 -0.09 -0.17 0.00 0.00 175.17 177.25 1j8t h ARG 297 N 6.86 -0.08 -0.95 4.34 2.43 -1.86 0.17 114.38 125.30 1j8t h ARG 297 Ca -0.40 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 58.78 1j8t h ARG 297 Cb 1.16 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.68 1j8t h ARG 297 CO 0.74 -0.05 0.62 0.77 -1.51 0.00 0.00 179.97 180.53 1j8t h SER 298 N -0.08 1.11 -0.44 -3.80 0.02 -1.94 0.52 113.55 108.94 1j8t h SER 298 Ca 0.08 -0.04 -0.11 0.00 -0.84 0.00 0.00 61.79 60.88 1j8t h SER 298 Cb 0.20 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 1j8t h SER 298 CO -0.19 0.82 -0.16 0.15 -1.14 0.00 0.00 176.83 176.31 1j8t h PHE 299 N 1.30 1.00 -0.78 3.45 3.57 -1.74 -1.10 116.94 122.63 1j8t h PHE 299 Ca 0.35 -0.23 0.03 0.00 3.53 0.00 0.00 57.97 61.65 1j8t h PHE 299 Cb -0.12 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.33 1j8t h PHE 299 CO -0.00 1.00 0.49 0.00 -2.23 0.00 0.00 178.31 177.57 1j8t h ALA 300 N 0.85 1.02 -0.61 2.41 0.00 0.01 0.57 119.26 123.50 1j8t h ALA 300 Ca 0.10 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1j8t h ALA 300 Cb 0.71 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1j8t h ALA 300 CO 0.05 0.30 0.15 1.96 0.00 0.00 0.00 179.25 181.72 1j8t h GLN 301 N 0.96 0.97 0.17 0.00 4.20 -0.75 -1.05 115.11 119.61 1j8t h GLN 301 Ca 0.31 -0.23 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 1j8t h GLN 301 Cb 0.01 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 1j8t h GLN 301 CO -0.11 0.88 -0.11 0.35 -0.67 0.00 0.00 178.83 179.17 1j8t h PHE 302 N 0.88 -0.29 -0.34 2.96 3.57 -0.95 -1.86 116.94 120.92 1j8t h PHE 302 Ca 0.19 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.57 1j8t h PHE 302 Cb 0.35 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 1j8t h PHE 302 CO 0.02 -0.18 -0.28 0.66 -2.23 0.00 0.00 178.31 176.30 1j8t h SER 303 N -0.28 0.73 -0.51 0.41 4.64 -0.75 -1.96 113.55 115.83 1j8t h SER 303 Ca -0.01 -0.28 0.08 0.00 -0.47 0.00 0.00 61.79 61.10 1j8t h SER 303 Cb 0.24 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.10 1j8t h SER 303 CO 0.01 0.98 0.34 -0.61 -0.87 0.00 0.00 176.83 176.68 1j8t h GLN 304 N 0.61 0.34 -0.37 4.77 4.15 -1.13 -1.73 115.11 121.75 1j8t h GLN 304 Ca 0.08 -0.02 -0.07 0.00 0.77 0.00 0.00 58.65 59.41 1j8t h GLN 304 Cb 0.79 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.39 1j8t h GLN 304 CO 0.07 0.23 -0.05 1.49 -1.93 0.00 0.00 178.83 178.63 1j8t h GLU 305 N 0.35 0.61 -0.38 1.69 4.57 -0.54 0.34 114.58 121.22 1j8t h GLU 305 Ca 0.23 -0.16 -0.08 0.00 -1.18 0.00 0.00 59.36 58.17 1j8t h GLU 305 Cb 0.45 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.95 1j8t h GLU 305 CO -0.06 0.67 -0.07 0.82 -1.18 0.00 0.00 179.01 179.20 1j8t h ILE 306 N 0.57 1.27 -0.19 2.32 2.04 -1.15 -1.19 117.51 121.19 1j8t h ILE 306 Ca 0.11 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.85 1j8t h ILE 306 Cb 0.45 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 1j8t h ILE 306 CO 0.02 0.37 0.12 1.23 0.00 0.00 0.00 178.15 179.90 1j8t h GLY 307 N 0.51 0.27 1.01 5.37 0.00 -0.80 -2.51 103.07 106.92 1j8t h GLY 307 Ca 0.10 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.34 1j8t h GLY 307 CO 0.03 0.10 0.64 1.41 0.00 0.00 0.00 176.54 178.72 1j8t h LEU 308 N 0.25 1.12 -2.01 3.11 3.38 -0.24 -1.73 115.31 119.20 1j8t h LEU 308 Ca 0.07 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.05 1j8t h LEU 308 Cb -0.02 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 1j8t h LEU 308 CO -0.01 0.82 0.11 0.00 0.09 0.00 0.00 178.44 179.44 1j8t h ALA 309 N 1.35 2.14 0.00 1.53 0.00 -0.91 -2.69 119.26 120.68 1j8t h ALA 309 Ca 0.36 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.16 1j8t h ALA 309 Cb -0.15 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1j8t h ALA 309 CO -0.08 -0.19 -0.50 0.66 0.00 0.00 0.00 179.25 179.14 1j8t h SER 310 N 0.00 0.00 -2.49 0.00 4.64 -0.89 -3.41 113.55 111.40 1j8t h SER 310 Ca 0.07 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.85 1j8t h SER 310 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1j8t h SER 310 CO -0.00 0.50 1.17 -0.76 -0.87 0.00 0.00 176.83 176.87 1j8t s LEU 311 N -6.61 4.28 -0.16 5.97 1.43 -1.02 -0.95 118.68 121.63 1j8t s LEU 311 Ca 0.03 2.34 0.00 0.00 -1.03 0.00 0.00 54.13 55.46 1j8t s LEU 311 Cb 0.09 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.77 1j8t s LEU 311 CO 0.73 -1.06 0.00 0.61 0.23 0.00 0.00 176.35 176.86 1j8t n GLY 312 N 4.43 0.38 3.79 -3.19 0.00 -1.26 -5.00 105.19 104.34 1j8t n GLY 312 Ca 0.19 -0.07 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1j8t n GLY 312 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j8t s ALA 313 N -1.61 2.84 0.58 4.61 0.00 -0.12 -4.51 121.76 123.55 1j8t s ALA 313 Ca 0.00 0.72 -0.19 0.00 0.00 0.00 0.00 51.96 52.49 1j8t s ALA 313 Cb 0.00 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 1j8t s ALA 313 CO 0.00 -0.49 1.18 -2.14 0.00 0.00 0.00 175.76 174.31 1j8t s PRO 314 N -3.13 3.07 0.39 0.00 0.02 -1.26 -4.73 135.00 129.36 1j8t s PRO 314 Ca 0.68 1.73 0.17 0.00 0.02 0.00 0.00 61.00 63.60 1j8t s PRO 314 Cb -0.21 -1.95 1.06 0.00 0.02 0.00 0.00 34.50 33.42 1j8t s PRO 314 CO 0.24 -1.11 1.78 -0.44 -0.33 0.00 0.00 177.00 177.14 1j8t h ASP 315 N 0.91 0.49 -0.10 2.53 3.45 -1.99 0.58 116.42 122.30 1j8t h ASP 315 Ca -0.50 0.08 -0.03 0.00 0.43 0.00 0.00 57.03 57.01 1j8t h ASP 315 Cb 1.28 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 40.04 1j8t h ASP 315 CO 0.55 0.11 -0.02 -0.08 -1.57 0.00 0.00 179.24 178.24 1j8t h GLU 316 N 0.44 0.30 0.00 3.56 4.81 -2.01 -1.56 114.58 120.11 1j8t h GLU 316 Ca 0.58 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.63 1j8t h GLU 316 Cb 1.40 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.71 1j8t h GLU 316 CO -0.30 0.34 -1.10 1.88 -0.73 0.00 0.00 179.01 179.10 1j8t h TYR 317 N 0.29 0.00 -0.72 0.92 -1.99 -0.21 -3.17 116.97 112.09 1j8t h TYR 317 Ca 0.07 0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.82 1j8t h TYR 317 Cb 0.23 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.92 1j8t h TYR 317 CO 0.00 0.49 0.46 0.82 -0.00 0.00 0.00 178.16 179.93 1j8t h ILE 318 N 0.00 1.12 -0.73 -2.88 1.08 -0.53 0.75 117.51 116.32 1j8t h ILE 318 Ca -0.10 -0.31 -0.06 0.00 -0.39 0.00 0.00 64.86 64.00 1j8t h ILE 318 Cb 1.46 0.14 -0.03 0.00 -3.07 0.00 0.00 36.82 35.32 1j8t h ILE 318 CO 0.05 0.17 0.24 -0.08 -0.69 0.00 0.00 178.15 177.83 1j8t h GLU 319 N 0.90 1.12 -0.65 2.37 4.22 -1.34 0.17 114.58 121.38 1j8t h GLU 319 Ca 0.28 -0.24 -0.01 0.00 0.08 0.00 0.00 59.36 59.48 1j8t h GLU 319 Cb -0.02 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 1j8t h GLU 319 CO -0.10 0.95 0.37 0.87 -2.18 0.00 0.00 179.01 178.93 1j8t h LYS 320 N 1.07 0.90 -0.32 1.92 1.57 -1.43 -1.09 116.57 119.18 1j8t h LYS 320 Ca 0.24 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.82 1j8t h LYS 320 Cb 0.29 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1j8t h LYS 320 CO -0.01 0.66 -0.21 -0.07 -0.57 0.00 0.00 179.45 179.25 1j8t h LEU 321 N 0.89 0.61 -1.32 2.94 3.38 -0.26 -0.24 115.31 121.31 1j8t h LEU 321 Ca 0.23 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1j8t h LEU 321 Cb 0.01 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1j8t h LEU 321 CO -0.04 0.82 0.25 0.00 0.09 0.00 0.00 178.44 179.56 1j8t h ALA 322 N 1.23 1.48 -0.12 1.53 0.00 -0.44 0.10 119.26 123.03 1j8t h ALA 322 Ca 0.08 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.71 1j8t h ALA 322 Cb 0.66 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.25 1j8t h ALA 322 CO 0.05 0.42 -0.63 1.15 0.00 0.00 0.00 179.25 180.24 1j8t h THR 323 N 0.71 1.33 -0.79 0.00 2.02 -0.67 -0.52 112.91 114.99 1j8t h THR 323 Ca 0.18 -1.90 0.05 0.00 0.77 0.00 0.00 66.41 65.51 1j8t h THR 323 Cb 0.07 2.12 -0.06 0.00 -1.74 0.00 0.00 68.15 68.55 1j8t h THR 323 CO -0.02 0.58 0.49 0.40 0.37 0.00 0.00 175.52 177.34 1j8t h ILE 324 N 0.29 1.04 -0.56 3.11 2.04 -0.77 -2.21 117.51 120.46 1j8t h ILE 324 Ca -0.04 -0.31 0.02 0.00 1.00 0.00 0.00 64.86 65.53 1j8t h ILE 324 Cb 1.27 0.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.37 1j8t h ILE 324 CO 0.13 0.17 0.34 0.22 0.00 0.00 0.00 178.15 179.01 1j8t h TYR 325 N 0.91 0.64 -0.55 1.37 3.20 -0.60 -1.79 116.97 120.14 1j8t h TYR 325 Ca 0.34 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.29 1j8t h TYR 325 Cb 0.13 -0.21 -0.05 0.00 1.54 0.00 0.00 36.73 38.14 1j8t h TYR 325 CO -0.04 0.37 0.25 2.35 -1.64 0.00 0.00 178.16 179.45 1j8t h TRP 326 N 0.68 0.46 -0.07 -3.82 2.91 -0.63 -0.96 115.95 114.52 1j8t h TRP 326 Ca 0.22 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.27 1j8t h TRP 326 Cb 0.00 -0.12 0.00 0.00 -0.51 0.00 0.00 29.16 28.53 1j8t h TRP 326 CO -0.06 0.19 0.00 1.19 -1.03 0.00 0.00 178.44 178.73 1j8t n PHE 327 N -4.92 0.09 0.00 2.65 3.72 -0.86 0.12 117.46 118.26 1j8t n PHE 327 Ca 0.06 -0.04 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1j8t n PHE 327 Cb 0.19 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 1j8t n PHE 327 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1j8t n THR 328 N -0.24 0.00 -0.07 4.37 -2.24 -0.73 -3.63 114.28 111.74 1j8t n THR 328 Ca 0.16 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.05 1j8t n THR 328 Cb 0.21 -0.26 0.49 0.00 -2.10 0.00 0.00 70.33 68.66 1j8t n THR 328 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1j8t h VAL 329 N 0.00 0.93 0.03 2.28 2.07 -1.44 0.63 116.25 120.75 1j8t h VAL 329 Ca 0.00 -0.15 -0.37 0.00 0.82 0.00 0.00 66.70 67.00 1j8t h VAL 329 Cb 0.00 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.17 1j8t h VAL 329 CO 0.00 0.08 -2.10 -0.62 0.02 0.00 0.00 177.57 174.95 1j8t n GLU 330 N -4.47 0.65 -0.93 1.57 -0.58 -0.54 -0.62 120.64 115.72 1j8t n GLU 330 Ca 0.09 0.30 0.05 0.00 -0.42 0.00 0.00 57.16 57.18 1j8t n GLU 330 Cb 0.32 -1.62 0.14 0.00 -0.57 0.00 0.00 31.44 29.71 1j8t n GLU 330 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1j8t n PHE 331 N -3.82 0.00 -2.81 -0.32 3.01 0.12 -0.07 117.46 113.57 1j8t n PHE 331 Ca -0.41 -1.11 -0.31 0.00 1.01 0.00 0.00 57.45 56.63 1j8t n PHE 331 Cb 0.91 -0.21 -0.04 0.00 -0.01 0.00 0.00 39.48 40.14 1j8t n PHE 331 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1j8t s GLY 332 N -2.75 2.04 0.17 1.37 0.00 0.21 -4.66 107.32 103.70 1j8t s GLY 332 Ca 0.36 -0.08 0.09 0.00 0.00 0.00 0.00 44.72 45.09 1j8t s GLY 332 CO -0.11 0.13 -0.10 1.08 0.00 0.00 0.00 173.10 174.11 1j8t s LEU 333 N -3.74 2.97 0.04 0.66 1.43 -1.15 -1.72 118.68 117.17 1j8t s LEU 333 Ca 0.53 -0.57 0.02 0.00 -1.03 0.00 0.00 54.13 53.09 1j8t s LEU 333 Cb -0.10 -1.66 -0.02 0.00 0.03 0.00 0.00 46.19 44.43 1j8t s LEU 333 CO 0.29 0.11 -0.08 0.00 0.23 0.00 0.00 176.35 176.90 1j8t s LYS 335 N -1.56 3.82 -0.26 0.00 1.02 -0.09 -1.60 119.74 121.07 1j8t s LYS 335 Ca -0.10 1.73 -0.02 0.00 0.02 0.00 0.00 55.97 57.60 1j8t s LYS 335 Cb -0.10 -2.42 0.13 0.00 -0.52 0.00 0.00 37.83 34.91 1j8t s LYS 335 CO 0.00 -0.48 0.30 -1.14 -0.92 0.00 0.00 175.35 173.11 1j8t s GLN 336 N -2.67 0.30 5.66 1.68 0.74 -0.53 -4.75 119.66 120.09 1j8t s GLN 336 Ca 0.63 0.08 0.00 0.00 0.05 0.00 0.00 55.36 56.12 1j8t s GLN 336 Cb -0.27 -0.74 0.00 0.00 1.10 0.00 0.00 33.01 33.09 1j8t s GLN 336 CO 0.33 -0.87 0.00 0.41 -0.55 0.00 0.00 175.29 174.61 1j8t n GLY 337 N 5.32 3.59 1.55 2.59 0.00 -1.26 -0.29 105.19 116.70 1j8t n GLY 337 Ca -0.03 0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.20 1j8t n GLY 337 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1j8t n ASP 338 N 5.87 4.60 -2.46 1.61 8.00 -1.26 -4.96 116.55 127.95 1j8t n ASP 338 Ca 0.00 -2.40 -0.05 0.00 0.71 0.00 0.00 54.79 53.05 1j8t n ASP 338 Cb 0.00 -0.57 -0.00 0.00 -0.02 0.00 0.00 41.12 40.53 1j8t n ASP 338 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1j8t n SER 339 N 1.14 1.47 -3.91 -2.24 2.88 0.60 -5.14 113.62 108.42 1j8t n SER 339 Ca 0.25 -1.32 -0.17 0.00 -1.33 0.00 0.00 58.87 56.30 1j8t n SER 339 Cb 0.85 0.01 -0.15 0.00 -0.75 0.00 0.00 64.21 64.17 1j8t n SER 339 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1j8t s ILE 340 N -0.61 0.39 0.09 2.46 1.01 -1.26 -1.45 121.20 121.83 1j8t s ILE 340 Ca 0.04 -0.13 0.02 0.00 0.00 0.00 0.00 60.65 60.58 1j8t s ILE 340 Cb -0.00 -0.38 -0.04 0.00 0.01 0.00 0.00 42.46 42.04 1j8t s ILE 340 CO 0.03 0.15 -0.07 -0.54 0.00 0.00 0.00 174.94 174.51 1j8t s LYS 341 N 0.37 0.81 0.16 2.79 -0.14 -0.63 -4.95 119.74 118.15 1j8t s LYS 341 Ca -0.04 -1.31 -0.22 0.00 -1.36 0.00 0.00 55.97 53.04 1j8t s LYS 341 Cb -0.08 -0.20 -0.08 0.00 -1.68 0.00 0.00 37.83 35.80 1j8t s LYS 341 CO -0.00 -0.02 0.71 0.00 -0.76 0.00 0.00 175.35 175.27 1j8t s ALA 342 N -3.53 3.48 0.00 5.17 0.00 -0.53 -0.94 121.76 125.41 1j8t s ALA 342 Ca 0.11 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.29 1j8t s ALA 342 Cb 0.05 -2.83 0.00 0.00 0.00 0.00 0.00 23.12 20.34 1j8t s ALA 342 CO -0.05 0.33 0.00 2.48 0.00 0.00 0.00 175.76 178.53 1j8t n TYR 343 N 1.40 0.00 -2.11 0.00 0.18 -0.80 -1.46 117.16 114.37 1j8t n TYR 343 Ca -0.06 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.31 1j8t n TYR 343 Cb 0.50 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.43 1j8t n TYR 343 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 1j8t s GLY 344 N -0.64 2.52 0.29 -7.48 0.00 -0.70 -4.84 107.32 96.47 1j8t s GLY 344 Ca 0.00 1.23 0.00 0.00 0.00 0.00 0.00 44.72 45.96 1j8t s GLY 344 CO 0.00 2.12 1.89 0.00 0.00 0.00 0.00 173.10 177.11 1j8t h ALA 345 N 4.80 1.50 0.00 3.20 0.00 -0.24 -0.61 119.26 127.91 1j8t h ALA 345 Ca -0.46 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 1j8t h ALA 345 Cb 1.22 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1j8t h ALA 345 CO 0.75 0.33 -0.21 0.78 0.00 0.00 0.00 179.25 180.90 1j8t h GLY 346 N 1.04 0.00 0.41 0.00 0.00 -0.72 -1.85 103.07 101.96 1j8t h GLY 346 Ca 0.42 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.64 1j8t h GLY 346 CO -0.18 0.00 -0.50 1.41 0.00 0.00 0.00 176.54 177.27 1j8t h LEU 347 N 0.00 0.28 -1.16 3.11 3.38 -1.35 -3.26 115.31 116.31 1j8t h LEU 347 Ca -0.00 -0.97 0.00 0.00 0.09 0.00 0.00 57.88 57.00 1j8t h LEU 347 Cb 0.81 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1j8t h LEU 347 CO 0.03 1.24 0.00 -0.07 0.09 0.00 0.00 178.44 179.73 1j8t h LEU 348 N -0.62 0.00 -3.08 1.67 3.38 -0.96 -1.44 115.31 114.26 1j8t h LEU 348 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1j8t h LEU 348 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1j8t h LEU 348 CO 0.09 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.08 1j8t n SER 349 N -2.44 3.44 -3.98 -0.43 3.41 -0.71 -4.64 113.62 108.27 1j8t n SER 349 Ca 0.01 -2.53 -0.31 0.00 -0.26 0.00 0.00 58.87 55.78 1j8t n SER 349 Cb 0.18 -0.39 -0.15 0.00 -0.26 0.00 0.00 64.21 63.59 1j8t n SER 349 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1j8t s SER 350 N -1.48 4.08 0.16 4.04 0.15 -0.54 -4.93 113.70 115.19 1j8t s SER 350 Ca 0.33 -1.31 -0.15 0.00 0.70 0.00 0.00 55.95 55.53 1j8t s SER 350 Cb 0.24 -1.30 0.06 0.00 -1.71 0.00 0.00 66.02 63.30 1j8t s SER 350 CO 0.12 -0.23 1.81 0.15 1.20 0.00 0.00 173.24 176.29 1j8t h PHE 351 N 7.89 0.54 -0.16 3.44 3.57 -1.89 -0.41 116.94 129.91 1j8t h PHE 351 Ca -0.17 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.27 1j8t h PHE 351 Cb 1.06 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.62 1j8t h PHE 351 CO 0.54 0.32 -0.16 0.78 -2.23 0.00 0.00 178.31 177.56 1j8t h GLY 352 N 0.58 0.43 2.00 2.40 0.00 -1.95 -3.19 103.07 103.35 1j8t h GLY 352 Ca 0.18 -0.44 -0.11 0.00 0.00 0.00 0.00 47.33 46.95 1j8t h GLY 352 CO -0.06 0.40 -0.54 -2.09 0.00 0.00 0.00 176.54 174.24 1j8t h GLU 353 N 0.04 0.00 -0.60 4.80 4.81 -1.86 -2.01 114.58 119.76 1j8t h GLU 353 Ca 0.03 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.20 1j8t h GLU 353 Cb 0.69 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.04 1j8t h GLU 353 CO 0.04 0.54 0.15 1.25 -0.73 0.00 0.00 179.01 180.27 1j8t h LEU 354 N 0.00 0.87 -0.18 1.64 5.85 -1.12 0.54 115.31 122.92 1j8t h LEU 354 Ca -0.01 -0.16 -0.23 0.00 0.84 0.00 0.00 57.88 58.33 1j8t h LEU 354 Cb 1.19 -0.23 0.01 0.00 0.37 0.00 0.00 40.66 42.00 1j8t h LEU 354 CO 0.07 0.84 -0.86 1.56 -0.34 0.00 0.00 178.44 179.71 1j8t h GLN 355 N 0.90 0.62 -0.56 1.25 4.20 -1.51 -3.29 115.11 116.71 1j8t h GLN 355 Ca 0.20 -0.57 -0.06 0.00 0.06 0.00 0.00 58.65 58.28 1j8t h GLN 355 Cb 0.31 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 1j8t h GLN 355 CO -0.00 1.18 0.10 -0.92 -0.67 0.00 0.00 178.83 178.52 1j8t h TYR 356 N 0.39 0.97 0.00 2.96 3.20 -0.98 -3.05 116.97 120.47 1j8t h TYR 356 Ca -0.07 -0.13 0.00 0.00 3.14 0.00 0.00 58.73 61.67 1j8t h TYR 356 Cb 1.48 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 39.49 1j8t h TYR 356 CO 0.08 0.85 0.00 0.00 -1.64 0.00 0.00 178.16 177.45 1j8t n LEU 358 N -2.80 3.43 -4.99 0.00 4.77 -1.15 -4.88 117.00 111.37 1j8t n LEU 358 Ca -0.01 -2.48 -0.22 0.00 -0.03 0.00 0.00 56.01 53.26 1j8t n LEU 358 Cb 0.12 -0.39 0.08 0.00 -2.33 0.00 0.00 43.42 40.91 1j8t n LEU 358 CO 0.19 0.71 0.47 -0.94 -1.33 0.00 0.00 177.39 176.49 1j8t s SER 359 N -1.42 4.70 0.00 -1.43 1.04 -0.44 -5.00 113.70 111.15 1j8t s SER 359 Ca 0.33 -0.33 0.16 0.00 0.48 0.00 0.00 55.95 56.60 1j8t s SER 359 Cb 0.23 -0.22 0.73 0.00 0.10 0.00 0.00 66.02 66.86 1j8t s SER 359 CO 0.13 -1.60 1.52 -1.84 0.98 0.00 0.00 173.24 172.43 1j8t n GLU 360 N -2.62 0.04 -0.02 4.02 0.28 -1.26 -4.24 120.64 116.84 1j8t n GLU 360 Ca 0.13 0.20 -0.16 0.00 -0.16 0.00 0.00 57.16 57.17 1j8t n GLU 360 Cb 0.60 -1.50 -0.11 0.00 1.43 0.00 0.00 31.44 31.87 1j8t n GLU 360 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 1j8t h LYS 361 N 0.00 0.28 -7.37 3.44 1.57 -1.95 -3.46 116.57 109.09 1j8t h LYS 361 Ca 0.00 -0.29 -0.50 0.00 -1.87 0.00 0.00 60.65 57.99 1j8t h LYS 361 Cb 0.26 0.08 0.11 0.00 0.08 0.00 0.00 32.23 32.75 1j8t h LYS 361 CO 0.00 0.98 0.35 -1.25 -0.57 0.00 0.00 179.45 178.96 1j8t s PRO 362 N -3.26 2.51 0.09 3.15 0.04 -1.26 -5.03 135.00 131.23 1j8t s PRO 362 Ca -0.15 0.83 -0.21 0.00 0.04 0.00 0.00 61.00 61.51 1j8t s PRO 362 Cb 0.02 -1.95 -0.07 0.00 0.04 0.00 0.00 34.50 32.54 1j8t s PRO 362 CO 0.77 -1.37 0.63 0.21 0.04 0.00 0.00 177.00 177.28 1j8t s LYS 363 N -5.08 4.31 -0.06 4.56 2.20 -0.24 -5.00 119.74 120.44 1j8t s LYS 363 Ca 0.59 0.85 0.03 0.00 -0.36 0.00 0.00 55.97 57.09 1j8t s LYS 363 Cb -0.14 -3.26 -0.02 0.00 -1.51 0.00 0.00 37.83 32.89 1j8t s LYS 363 CO 0.55 0.58 -0.15 -0.51 -0.36 0.00 0.00 175.35 175.46 1j8t s LEU 364 N -0.98 2.68 0.09 5.43 1.02 -1.26 -1.34 118.68 124.32 1j8t s LEU 364 Ca 0.31 -0.24 0.04 0.00 0.02 0.00 0.00 54.13 54.26 1j8t s LEU 364 Cb -0.20 -1.55 -0.03 0.00 0.02 0.00 0.00 46.19 44.43 1j8t s LEU 364 CO 0.21 0.31 -0.10 -0.76 0.02 0.00 0.00 176.35 176.03 1j8t s LEU 365 N -0.53 2.39 0.45 1.79 1.43 -0.44 -4.97 118.68 118.80 1j8t s LEU 365 Ca 0.07 -0.79 -0.24 0.00 -1.03 0.00 0.00 54.13 52.14 1j8t s LEU 365 Cb -0.12 -0.29 -0.08 0.00 0.03 0.00 0.00 46.19 45.74 1j8t s LEU 365 CO 0.01 -0.26 1.22 -2.84 0.23 0.00 0.00 176.35 174.71 1j8t s PRO 366 N -2.70 3.79 0.06 1.29 0.02 -1.26 0.04 135.00 136.23 1j8t s PRO 366 Ca 0.04 1.92 -0.32 0.00 0.02 0.00 0.00 61.00 62.67 1j8t s PRO 366 Cb -0.03 -2.52 -0.11 0.00 0.02 0.00 0.00 34.50 31.86 1j8t s PRO 366 CO -0.00 -0.57 1.87 -0.11 -0.33 0.00 0.00 177.00 177.86 1j8t n LEU 367 N -0.31 3.88 -3.39 -5.54 7.94 -0.19 -4.63 117.00 114.76 1j8t n LEU 367 Ca 0.06 0.97 -0.16 0.00 -1.11 0.00 0.00 56.01 55.77 1j8t n LEU 367 Cb 0.46 -1.49 -0.09 0.00 0.53 0.00 0.00 43.42 42.83 1j8t n LEU 367 CO 0.51 0.10 -0.16 -0.70 -1.11 0.00 0.00 177.39 176.03 1j8t s GLU 368 N 3.37 0.32 0.50 1.96 2.12 -1.26 -4.99 118.70 120.72 1j8t s GLU 368 Ca 0.86 -0.04 0.29 0.00 0.36 0.00 0.00 54.97 56.44 1j8t s GLU 368 Cb -0.53 -0.65 0.98 0.00 0.26 0.00 0.00 34.13 34.19 1j8t s GLU 368 CO 0.42 -0.98 1.84 -0.07 -0.54 0.00 0.00 175.26 175.93 1j8t h LEU 369 N 8.25 0.00 -1.41 2.70 3.38 -1.93 0.13 115.31 126.43 1j8t h LEU 369 Ca -0.13 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1j8t h LEU 369 Cb 1.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 1j8t h LEU 369 CO 0.32 0.03 -0.26 -0.33 0.09 0.00 0.00 178.44 178.29 1j8t h GLU 370 N 0.00 0.00 0.00 1.13 4.39 -1.98 -0.96 114.58 117.16 1j8t h GLU 370 Ca -0.00 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 1j8t h GLU 370 Cb 0.70 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.34 1j8t h GLU 370 CO 0.00 0.26 -0.84 0.87 -1.16 0.00 0.00 179.01 178.14 1j8t h LYS 371 N 0.00 0.00 -0.93 2.33 1.57 -1.71 -3.39 116.57 114.44 1j8t h LYS 371 Ca -0.00 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.86 1j8t h LYS 371 Cb 0.60 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.84 1j8t h LYS 371 CO 0.03 0.63 0.58 1.15 -0.57 0.00 0.00 179.45 181.27 1j8t h THR 372 N -1.00 1.01 0.00 -0.16 2.02 -0.80 -2.32 112.91 111.66 1j8t h THR 372 Ca -0.19 -0.35 -0.00 0.00 0.77 0.00 0.00 66.41 66.64 1j8t h THR 372 Cb 0.95 -0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1j8t h THR 372 CO -0.11 0.19 -0.02 0.00 0.37 0.00 0.00 175.52 175.95 1j8t h ALA 373 N 1.45 1.63 -0.37 6.16 0.00 -1.37 -1.94 119.26 124.83 1j8t h ALA 373 Ca 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1j8t h ALA 373 Cb 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1j8t h ALA 373 CO -0.20 0.02 0.00 0.44 0.00 0.00 0.00 179.25 179.51 1j8t n ILE 374 N -4.02 1.19 -2.61 0.00 -5.35 -0.90 -4.62 119.36 103.06 1j8t n ILE 374 Ca -0.03 -1.12 -0.41 0.00 -0.27 0.00 0.00 62.75 60.92 1j8t n ILE 374 Cb 0.10 0.39 -0.04 0.00 -1.74 0.00 0.00 39.64 38.35 1j8t n ILE 374 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 1j8t s GLN 375 N -1.26 4.62 0.63 6.28 2.00 -0.73 -5.02 119.66 126.18 1j8t s GLN 375 Ca 0.28 1.59 -0.10 0.00 -2.00 0.00 0.00 55.36 55.13 1j8t s GLN 375 Cb 0.16 -3.34 -0.02 0.00 0.80 0.00 0.00 33.01 30.61 1j8t s GLN 375 CO 0.16 0.08 1.02 -0.80 -0.50 0.00 0.00 175.29 175.26 1j8t s ASN 376 N 0.16 5.94 0.23 6.67 0.01 -1.26 -5.05 114.94 121.65 1j8t s ASN 376 Ca 0.50 1.25 -0.16 0.00 -0.71 0.00 0.00 52.86 53.73 1j8t s ASN 376 Cb -0.26 -2.23 0.01 0.00 0.41 0.00 0.00 41.25 39.18 1j8t s ASN 376 CO 0.32 -1.01 0.55 -0.72 -1.51 0.00 0.00 177.10 174.72 1j8t s TYR 377 N -3.19 0.06 0.26 2.20 -0.85 -1.26 -5.09 117.35 109.49 1j8t s TYR 377 Ca 0.55 -0.44 0.09 0.00 -0.52 0.00 0.00 57.07 56.75 1j8t s TYR 377 Cb -0.11 0.38 -0.05 0.00 0.38 0.00 0.00 41.96 42.55 1j8t s TYR 377 CO 0.52 -1.02 -0.13 0.95 -1.52 0.00 0.00 175.55 174.35 1j8t s THR 378 N -3.94 1.96 -1.91 -3.49 -4.23 -1.26 -5.05 115.64 97.71 1j8t s THR 378 Ca 0.15 -2.24 0.22 0.00 -1.18 0.00 0.00 61.69 58.64 1j8t s THR 378 Cb -0.02 -2.28 -0.04 0.00 1.34 0.00 0.00 72.50 71.50 1j8t s THR 378 CO 0.04 -0.43 1.06 0.55 -0.54 0.00 0.00 174.62 175.31 1j8t n VAL 379 N -0.54 0.00 0.95 2.29 3.14 -1.26 -4.59 118.33 118.33 1j8t n VAL 379 Ca -0.06 -0.23 0.10 0.00 -2.96 0.00 0.00 64.34 61.19 1j8t n VAL 379 Cb 0.61 1.23 -0.04 0.00 -1.06 0.00 0.00 33.84 34.58 1j8t n VAL 379 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 1j8t n THR 380 N -0.19 0.00 -4.58 1.55 -2.24 -1.26 -4.96 114.28 102.60 1j8t n THR 380 Ca 0.09 -0.19 -0.27 0.00 -2.27 0.00 0.00 64.05 61.40 1j8t n THR 380 Cb 0.45 1.17 -0.08 0.00 -2.10 0.00 0.00 70.33 69.77 1j8t n THR 380 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1j8t s GLU 381 N -2.55 1.99 0.46 -0.78 2.56 -1.26 -5.13 118.70 113.99 1j8t s GLU 381 Ca 0.14 -2.22 -0.25 0.00 0.00 0.00 0.00 54.97 52.65 1j8t s GLU 381 Cb 0.17 -0.89 -0.08 0.00 2.00 0.00 0.00 34.13 35.33 1j8t s GLU 381 CO 0.64 -0.42 1.37 -0.06 -0.56 0.00 0.00 175.26 176.23 1j8t s PHE 382 N -3.11 2.52 0.21 5.30 0.08 -1.26 -4.96 117.98 116.75 1j8t s PHE 382 Ca 0.20 1.33 -0.30 0.00 0.12 0.00 0.00 56.93 58.27 1j8t s PHE 382 Cb 0.03 -3.82 -0.10 0.00 -0.57 0.00 0.00 43.02 38.56 1j8t s PHE 382 CO 0.12 -2.69 1.43 -0.65 -0.10 0.00 0.00 175.22 173.33 1j8t s GLN 383 N -2.51 4.29 0.35 0.44 -1.52 -1.26 -4.91 119.66 114.53 1j8t s GLN 383 Ca 0.62 2.23 0.26 0.00 -1.95 0.00 0.00 55.36 56.53 1j8t s GLN 383 Cb -0.41 -3.15 0.79 0.00 -0.22 0.00 0.00 33.01 30.02 1j8t s GLN 383 CO 0.52 -0.42 1.75 -1.00 -0.25 0.00 0.00 175.29 175.89 1j8t h PRO 384 N 5.59 0.00 -3.84 2.91 0.13 -1.95 -3.46 132.00 131.39 1j8t h PRO 384 Ca -0.45 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.39 1j8t h PRO 384 Cb 1.21 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.04 1j8t h PRO 384 CO 0.81 0.00 -0.74 -1.17 -0.23 0.00 0.00 178.00 176.67 1j8t s LEU 385 N -5.31 1.68 0.13 1.56 2.96 -1.26 -1.08 118.68 117.36 1j8t s LEU 385 Ca 0.07 -0.02 0.09 0.00 -0.22 0.00 0.00 54.13 54.04 1j8t s LEU 385 Cb 0.09 -0.13 -0.04 0.00 0.50 0.00 0.00 46.19 46.61 1j8t s LEU 385 CO 0.57 -0.03 -0.22 -0.31 -1.32 0.00 0.00 176.35 175.05 1j8t s TYR 386 N 0.36 1.94 -0.14 5.38 1.51 -0.45 -4.96 117.35 120.99 1j8t s TYR 386 Ca -0.03 -0.42 -0.06 0.00 -1.01 0.00 0.00 57.07 55.55 1j8t s TYR 386 Cb -0.06 -1.03 -0.04 0.00 -0.11 0.00 0.00 41.96 40.73 1j8t s TYR 386 CO -0.01 0.29 0.08 0.71 -1.11 0.00 0.00 175.55 175.51 1j8t s TYR 387 N -1.39 3.35 -0.29 2.71 1.51 -1.26 -1.33 117.35 120.65 1j8t s TYR 387 Ca 0.11 0.26 -0.12 0.00 -1.01 0.00 0.00 57.07 56.32 1j8t s TYR 387 Cb -0.09 -1.98 -0.04 0.00 -0.11 0.00 0.00 41.96 39.74 1j8t s TYR 387 CO 0.06 0.42 0.23 0.08 -1.11 0.00 0.00 175.55 175.22 1j8t s VAL 388 N -0.34 5.28 0.20 0.71 1.01 0.11 -2.93 120.40 124.44 1j8t s VAL 388 Ca 0.09 0.13 -0.27 0.00 0.00 0.00 0.00 61.98 61.94 1j8t s VAL 388 Cb -0.12 -3.60 -0.08 0.00 0.00 0.00 0.00 36.38 32.58 1j8t s VAL 388 CO 0.02 0.18 0.84 0.00 0.00 0.00 0.00 175.10 176.13 1j8t s ALA 389 N 1.80 3.40 0.29 5.51 0.00 -0.10 -1.02 121.76 131.63 1j8t s ALA 389 Ca 0.08 0.45 0.01 0.00 0.00 0.00 0.00 51.96 52.49 1j8t s ALA 389 Cb -0.16 -3.05 0.43 0.00 0.00 0.00 0.00 23.12 20.34 1j8t s ALA 389 CO 0.11 0.26 1.79 0.93 0.00 0.00 0.00 175.76 178.85 1j8t h GLU 390 N 4.16 0.67 -1.64 0.00 4.39 -1.92 -0.22 114.58 120.02 1j8t h GLU 390 Ca -0.46 -0.17 0.27 0.00 0.34 0.00 0.00 59.36 59.33 1j8t h GLU 390 Cb 1.20 -0.08 -0.14 0.00 -0.10 0.00 0.00 28.75 29.63 1j8t h GLU 390 CO 0.67 0.71 0.75 -1.54 -1.16 0.00 0.00 179.01 178.43 1j8t s SER 391 N -6.69 -0.12 0.27 1.42 1.04 -1.26 -4.31 113.70 104.05 1j8t s SER 391 Ca -0.09 -0.12 0.03 0.00 0.48 0.00 0.00 55.95 56.25 1j8t s SER 391 Cb 0.15 0.22 0.37 0.00 0.10 0.00 0.00 66.02 66.86 1j8t s SER 391 CO 0.79 -0.39 1.67 -0.26 0.98 0.00 0.00 173.24 176.04 1j8t h PHE 392 N 2.00 0.45 -0.45 5.02 0.05 -1.91 -1.27 116.94 120.84 1j8t h PHE 392 Ca -0.23 -0.12 -0.05 0.00 3.82 0.00 0.00 57.97 61.39 1j8t h PHE 392 Cb 1.20 -0.10 -0.02 0.00 2.00 0.00 0.00 35.95 39.03 1j8t h PHE 392 CO 0.31 0.72 0.09 -0.91 -0.18 0.00 0.00 178.31 178.34 1j8t h ASN 393 N 0.33 0.69 -0.50 2.17 2.35 -1.96 -0.24 115.58 118.42 1j8t h ASN 393 Ca 0.03 -0.25 -0.10 0.00 -0.55 0.00 0.00 56.30 55.43 1j8t h ASN 393 Cb 0.81 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.98 1j8t h ASN 393 CO 0.07 0.76 -0.09 -0.78 -1.65 0.00 0.00 177.43 175.74 1j8t h ASP 394 N 0.60 0.94 -0.79 5.81 3.58 -1.90 -0.95 116.42 123.70 1j8t h ASP 394 Ca 0.14 -0.35 0.03 0.00 0.42 0.00 0.00 57.03 57.27 1j8t h ASP 394 Cb 0.35 -0.25 -0.05 0.00 1.72 0.00 0.00 39.33 41.10 1j8t h ASP 394 CO 0.01 1.06 0.50 0.00 -2.88 0.00 0.00 179.24 177.93 1j8t h ALA 395 N 0.90 1.05 -0.64 -0.78 0.00 -1.09 -1.81 119.26 116.88 1j8t h ALA 395 Ca 0.13 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1j8t h ALA 395 Cb 0.64 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1j8t h ALA 395 CO 0.04 0.31 0.42 -0.22 0.00 0.00 0.00 179.25 179.81 1j8t h LYS 396 N 0.98 0.85 -0.93 0.00 3.64 -0.63 -0.10 116.57 120.38 1j8t h LYS 396 Ca 0.32 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.66 1j8t h LYS 396 Cb 0.02 -0.19 -0.05 0.00 -0.41 0.00 0.00 32.23 31.61 1j8t h LYS 396 CO -0.12 0.57 0.61 0.93 -2.27 0.00 0.00 179.45 179.17 1j8t h GLU 397 N 0.87 1.21 -0.58 1.90 4.39 -0.69 -1.20 114.58 120.48 1j8t h GLU 397 Ca 0.23 -0.07 -0.10 0.00 0.34 0.00 0.00 59.36 59.76 1j8t h GLU 397 Cb -0.09 -0.27 -0.02 0.00 -0.10 0.00 0.00 28.75 28.26 1j8t h GLU 397 CO -0.05 0.80 -0.04 0.87 -1.16 0.00 0.00 179.01 179.43 1j8t h LYS 398 N 1.24 1.03 -0.40 2.33 1.57 -0.74 -0.32 116.57 121.28 1j8t h LYS 398 Ca 0.34 -0.34 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1j8t h LYS 398 Cb -0.13 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 1j8t h LYS 398 CO -0.08 1.03 0.01 0.28 -0.57 0.00 0.00 179.45 180.12 1j8t h VAL 399 N 0.94 1.26 -0.31 0.50 2.07 -0.61 -0.25 116.25 119.84 1j8t h VAL 399 Ca 0.16 -0.99 0.03 0.00 0.82 0.00 0.00 66.70 66.72 1j8t h VAL 399 Cb 0.59 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1j8t h VAL 399 CO 0.04 0.34 0.11 -0.09 0.02 0.00 0.00 177.57 177.98 1j8t h ARG 400 N 0.53 0.24 -0.72 1.57 2.43 -1.02 0.25 114.38 117.66 1j8t h ARG 400 Ca 0.11 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.22 1j8t h ARG 400 Cb 0.46 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.93 1j8t h ARG 400 CO 0.02 0.16 0.26 -0.91 -1.51 0.00 0.00 179.97 177.99 1j8t h ASN 401 N 0.24 1.02 -0.54 -3.80 2.35 -0.92 -2.49 115.58 111.45 1j8t h ASN 401 Ca 0.14 -0.19 -0.05 0.00 -0.55 0.00 0.00 56.30 55.65 1j8t h ASN 401 Cb 0.11 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.19 1j8t h ASN 401 CO -0.14 0.93 0.14 0.15 -1.65 0.00 0.00 177.43 176.86 1j8t h PHE 402 N 1.04 0.93 -0.04 1.19 3.57 -0.50 -2.71 116.94 120.42 1j8t h PHE 402 Ca 0.24 -0.09 -0.07 0.00 3.53 0.00 0.00 57.97 61.57 1j8t h PHE 402 Cb 0.25 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 1j8t h PHE 402 CO 0.02 0.78 -0.31 0.00 -2.23 0.00 0.00 178.31 176.57 1j8t h ALA 403 N 1.29 1.41 0.00 2.41 0.00 -0.12 -1.05 119.26 123.21 1j8t h ALA 403 Ca 0.19 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1j8t h ALA 403 Cb 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1j8t h ALA 403 CO -0.00 0.43 0.00 0.00 0.00 0.00 0.00 179.25 179.68 1j8t h ALA 404 N 1.62 1.00 -0.01 0.00 0.00 -1.12 -0.78 119.26 119.98 1j8t h ALA 404 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1j8t h ALA 404 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1j8t h ALA 404 CO 0.04 0.00 -0.16 0.25 0.00 0.00 0.00 179.25 179.38 1j8t n THR 405 N -2.54 0.00 -2.99 0.00 -2.24 -0.40 -4.84 114.28 101.27 1j8t n THR 405 Ca 0.00 -0.10 -0.41 0.00 -2.27 0.00 0.00 64.05 61.27 1j8t n THR 405 Cb 0.17 0.16 -0.05 0.00 -2.10 0.00 0.00 70.33 68.51 1j8t n THR 405 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1j8t s ILE 406 N -2.44 4.96 -0.41 2.28 1.01 -0.30 -4.95 121.20 121.36 1j8t s ILE 406 Ca 0.28 1.47 -0.27 0.00 0.00 0.00 0.00 60.65 62.13 1j8t s ILE 406 Cb 0.20 -4.06 -0.05 0.00 0.01 0.00 0.00 42.46 38.55 1j8t s ILE 406 CO 0.48 0.11 2.23 -2.84 0.00 0.00 0.00 174.94 174.92 1j8t s PRO 407 N 1.71 2.59 -0.03 2.79 0.02 -1.26 -4.90 135.00 135.92 1j8t s PRO 407 Ca 0.36 1.50 -0.00 0.00 0.02 0.00 0.00 61.00 62.88 1j8t s PRO 407 Cb -0.17 -4.46 0.03 0.00 0.02 0.00 0.00 34.50 29.92 1j8t s PRO 407 CO 0.14 -2.72 0.02 1.03 -0.33 0.00 0.00 177.00 175.14 1j8t s ARG 408 N 7.28 0.07 -0.00 5.54 0.52 -1.26 -4.62 118.95 126.48 1j8t s ARG 408 Ca 0.93 0.17 0.00 0.00 -0.52 0.00 0.00 55.73 56.31 1j8t s ARG 408 Cb -0.22 -0.36 0.01 0.00 0.52 0.00 0.00 34.95 34.90 1j8t s ARG 408 CO 0.29 -0.18 0.99 -0.35 0.02 0.00 0.00 175.30 176.07 1j8t n PRO 409 N 4.30 1.01 -3.83 3.54 -0.04 -1.26 -4.78 135.00 133.94 1j8t n PRO 409 Ca -0.25 -0.03 -0.09 0.00 -0.04 0.00 0.00 63.50 63.10 1j8t n PRO 409 Cb 0.50 -1.03 0.01 0.00 -0.04 0.00 0.00 33.50 32.94 1j8t n PRO 409 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1j8t s PHE 410 N -0.07 0.12 0.20 0.54 -0.71 -1.26 -5.03 117.98 111.76 1j8t s PHE 410 Ca 0.00 -0.75 0.07 0.00 -1.04 0.00 0.00 56.93 55.21 1j8t s PHE 410 Cb 0.00 0.78 -0.05 0.00 -1.21 0.00 0.00 43.02 42.54 1j8t s PHE 410 CO 0.00 -1.50 -0.12 -1.54 -1.34 0.00 0.00 175.22 170.71 1j8t s SER 411 N -3.06 2.37 0.06 1.98 1.04 0.04 -4.97 113.70 111.17 1j8t s SER 411 Ca 0.16 -1.04 0.03 0.00 0.48 0.00 0.00 55.95 55.58 1j8t s SER 411 Cb -0.05 -0.10 -0.03 0.00 0.10 0.00 0.00 66.02 65.94 1j8t s SER 411 CO 0.11 -0.23 -0.10 0.68 0.98 0.00 0.00 173.24 174.68 1j8t s VAL 412 N -3.08 0.78 -0.07 5.02 -7.23 -1.26 -1.82 120.40 112.74 1j8t s VAL 412 Ca 0.22 -1.23 -0.09 0.00 -1.81 0.00 0.00 61.98 59.07 1j8t s VAL 412 Cb 0.01 -0.86 0.02 0.00 0.56 0.00 0.00 36.38 36.11 1j8t s VAL 412 CO 0.06 -0.35 0.25 -0.60 -0.31 0.00 0.00 175.10 174.14 1j8t s ARG 413 N -1.80 0.36 -0.03 4.82 3.52 -0.21 -4.98 118.95 120.64 1j8t s ARG 413 Ca -0.05 0.20 -0.20 0.00 -0.13 0.00 0.00 55.73 55.55 1j8t s ARG 413 Cb -0.09 0.17 -0.05 0.00 -1.56 0.00 0.00 34.95 33.42 1j8t s ARG 413 CO 0.01 -0.06 0.57 -0.47 -0.81 0.00 0.00 175.30 174.53 1j8t s TYR 414 N -0.23 3.65 -0.42 5.12 5.04 -1.26 0.86 117.35 130.12 1j8t s TYR 414 Ca -0.03 1.13 -0.10 0.00 -2.44 0.00 0.00 57.07 55.63 1j8t s TYR 414 Cb -0.03 -2.59 0.07 0.00 0.35 0.00 0.00 41.96 39.77 1j8t s TYR 414 CO 0.01 0.32 0.27 0.34 -1.34 0.00 0.00 175.55 175.15 1j8t s ASP 415 N -0.04 5.69 0.58 4.32 3.68 0.12 -4.92 116.67 126.11 1j8t s ASP 415 Ca 0.30 -1.44 0.36 0.00 2.13 0.00 0.00 52.55 53.89 1j8t s ASP 415 Cb -0.17 -2.01 1.71 0.00 -1.45 0.00 0.00 42.92 41.00 1j8t s ASP 415 CO 0.16 -0.53 2.12 1.55 0.13 0.00 0.00 175.17 178.59 1j8t h PRO 416 N 8.44 0.00 -0.10 4.34 0.13 -1.96 0.83 132.00 143.68 1j8t h PRO 416 Ca -0.24 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.80 1j8t h PRO 416 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1j8t h PRO 416 CO 0.76 0.03 -0.37 1.88 -0.23 0.00 0.00 178.00 180.07 1j8t h TYR 417 N 0.00 0.24 -0.00 1.56 -1.99 -1.95 -3.29 116.97 111.53 1j8t h TYR 417 Ca -0.00 -0.06 0.00 0.00 2.00 0.00 0.00 58.73 60.67 1j8t h TYR 417 Cb 0.32 -0.06 0.00 0.00 2.00 0.00 0.00 36.73 39.00 1j8t h TYR 417 CO 0.00 0.56 -0.11 0.25 -0.00 0.00 0.00 178.16 178.85 1j8t n THR 418 N -4.06 0.00 -3.52 -2.88 -2.24 -0.91 -5.00 114.28 95.67 1j8t n THR 418 Ca -0.01 -0.44 -0.20 0.00 -2.27 0.00 0.00 64.05 61.12 1j8t n THR 418 Cb 0.44 1.03 0.08 0.00 -2.10 0.00 0.00 70.33 69.79 1j8t n THR 418 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j8t n GLN 419 N -0.60 -7.09 -4.19 -0.78 6.02 0.28 -4.89 117.38 106.13 1j8t n GLN 419 Ca 0.01 0.83 -0.18 0.00 -0.01 0.00 0.00 57.00 57.65 1j8t n GLN 419 Cb 0.08 -5.85 -0.12 0.00 1.02 0.00 0.00 30.24 25.37 1j8t n GLN 419 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1j8t s ARG 420 N -5.78 0.79 -0.16 -1.09 0.52 -1.08 -1.81 118.95 110.33 1j8t s ARG 420 Ca 0.25 -0.88 -0.20 0.00 -0.52 0.00 0.00 55.73 54.38 1j8t s ARG 420 Cb -0.11 -0.77 -0.03 0.00 0.52 0.00 0.00 34.95 34.56 1j8t s ARG 420 CO 0.73 0.17 0.57 0.42 0.02 0.00 0.00 175.30 177.22 1j8t s ILE 421 N -1.19 5.09 -0.16 1.52 -1.09 0.60 0.15 121.20 126.11 1j8t s ILE 421 Ca -0.02 1.10 -0.17 0.00 -2.23 0.00 0.00 60.65 59.32 1j8t s ILE 421 Cb -0.09 -3.90 -0.04 0.00 -1.58 0.00 0.00 42.46 36.85 1j8t s ILE 421 CO 0.02 0.20 0.44 -1.61 -1.23 0.00 0.00 174.94 172.76 1j8t s GLU 422 N 1.41 4.25 -0.25 2.79 0.41 0.25 -4.91 118.70 122.65 1j8t s GLU 422 Ca 0.28 0.33 -0.06 0.00 -0.41 0.00 0.00 54.97 55.11 1j8t s GLU 422 Cb -0.16 -3.49 -0.01 0.00 -1.78 0.00 0.00 34.13 28.69 1j8t s GLU 422 CO 0.11 0.04 0.03 0.08 -0.49 0.00 0.00 175.26 175.03 1j8t s VAL 423 N 1.03 3.88 -0.74 2.63 1.01 -1.26 -1.05 120.40 125.90 1j8t s VAL 423 Ca 0.23 -0.40 0.06 0.00 0.00 0.00 0.00 61.98 61.86 1j8t s VAL 423 Cb -0.15 -2.84 0.05 0.00 0.00 0.00 0.00 36.38 33.44 1j8t s VAL 423 CO 0.09 0.32 0.69 0.18 0.00 0.00 0.00 175.10 176.37