NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 112 E 4.3244 8.4449 120.2282 55.7409 30.9083 175.3472 113 L 4.0552 8.1289 121.2050 53.6147 42.2228 175.6052 114 H 4.0893 8.8252 120.5438 56.4959 31.3071 174.0460 115 N 4.6991 8.1096 124.3357 51.7606 39.0549 175.0275 116 D 4.4327 8.5342 126.3804 56.6861 41.0658 177.4300 117 D 4.4890 8.3756 118.4691 55.6799 41.1849 176.8342 118 T 4.3905 7.6580 110.2683 61.7546 69.7115 174.0661 119 R 4.7078 8.9477 121.4361 54.5007 35.0702 174.2825 120 V 4.9672 8.3741 120.6833 61.5765 33.4966 174.6080 121 V 4.6893 8.9869 128.7798 60.4054 33.8082 174.8702 122 R 4.6639 9.3147 126.1889 55.1144 31.6341 174.9292 123 V 4.6009 9.0825 127.8730 61.3260 33.6890 174.5065 124 K 4.8592 9.3709 129.2155 55.2707 33.7730 176.4122 125 V 3.9901 9.0900 127.4748 62.2955 31.4455 176.4583 126 I 4.1530 8.9231 128.9554 62.8482 37.7450 175.6717 127 A 4.8100 7.9126 121.3270 50.9989 22.7967 174.3299 128 G 4.4358 8.4101 107.3538 44.8170 0.0000 172.9364 129 I 4.7291 8.7533 124.3609 59.1512 39.9418 176.2369 130 G 3.9907 9.1966 117.9322 46.5288 0.0000 173.3226 131 L 4.1896 8.0860 117.3635 54.2763 42.6687 177.3012 132 A 4.2252 8.1115 124.0164 51.5101 17.8316 177.2141 *136 I 4.1543 7.5992 123.5019 61.4299 39.5929 177.9843 137 L 4.0883 7.8007 123.3292 56.0699 41.9791 177.9858 138 G 3.7959 7.4600 103.3636 46.6399 0.0000 174.7767 139 A 4.3402 7.9113 121.9428 50.8322 17.0931 177.6997 140 S 5.0684 7.5127 118.3955 56.0749 66.1119 174.2748 141 D 5.8500 9.2198 123.8279 51.3822 40.9927 173.1678 142 P 5.3499 0.0000 0.0000 62.4387 33.4127 174.4819 143 Y 5.5212 8.9871 120.6564 55.6770 42.5419 173.6084 144 V 4.5965 8.1628 119.1373 60.9643 34.3683 174.0471 145 R 4.9138 9.2442 129.1248 55.3177 31.6164 174.8897 146 V 4.4536 9.4240 128.4867 61.5614 33.6711 174.5444 147 T 4.8155 8.7407 125.8605 61.4805 71.1945 173.1403 148 L 4.4109 8.3464 130.5572 54.6589 43.1723 175.3407 149 Y 5.1439 8.5728 123.2863 55.7040 42.3540 173.0899 150 D 4.9115 8.9476 120.4779 51.9400 42.4938 175.1279 151 P 4.2719 0.0000 0.0000 65.8783 31.4991 177.2229 152 M 4.3938 8.5430 116.1137 56.0536 32.3685 176.8545 153 S 4.5005 8.0339 109.8717 56.4028 64.9698 172.3357 154 G 3.7592 8.6927 106.7487 43.8864 0.0000 172.6072 155 I 4.0430 8.1893 119.4556 61.8974 37.6608 175.3954 156 L 4.5644 8.9089 124.9981 56.4030 43.2047 177.3152 157 T 4.7429 7.5321 114.1073 61.9686 73.0390 172.6400 158 S 5.1821 8.8053 120.0770 56.4887 65.2087 173.0870 159 V 4.5790 9.0619 126.1904 61.1244 35.0887 173.5297 160 Q 5.3192 8.5902 127.7200 54.4002 30.8623 175.2670 161 T 4.5245 8.6614 117.2465 60.2575 70.0578 174.3501 162 K 4.2080 10.0168 122.7514 56.9665 32.6137 176.8912 163 T 5.0123 8.2889 117.3476 63.0325 70.1371 174.2619 164 I 4.5326 8.8325 126.3213 59.4676 39.5791 175.1027 165 K 4.2963 8.7715 126.8421 56.2162 32.7122 177.1593 166 K 3.8286 8.7035 125.5611 57.0851 30.7835 174.5177 167 S 4.6022 8.4245 111.8801 57.0061 66.1185 173.1205 168 L 4.5457 8.4315 124.2686 54.1450 43.0368 175.5989 169 N 5.7515 7.8694 115.4393 50.0901 38.0222 172.9789 170 P 3.9713 0.0000 0.0000 62.5699 33.3771 177.5166 171 K 4.4184 8.0327 122.5900 54.6734 32.3324 175.7995 172 W 4.2727 8.6501 125.6930 57.4939 29.9063 176.9149 173 N 4.2192 8.0117 115.6154 54.4454 36.1178 173.6412 174 E 4.8550 8.3746 116.2270 54.6746 32.8176 176.0972 175 E 5.0844 8.7165 122.9287 54.5625 32.6455 175.0703 176 I 4.5297 9.0015 126.4805 59.5198 41.4081 173.9786 177 L 5.0893 8.2827 126.1449 53.0749 43.6555 175.8583 178 F 5.0588 8.9128 121.3094 55.6180 42.9629 174.0139 179 R 4.8236 8.8397 123.4936 56.0276 30.7257 175.7240 180 V 4.7038 9.1724 118.8887 59.8182 37.0773 174.7166 181 L 4.4836 8.1199 122.2045 52.8527 41.7342 175.6373 182 P 4.3113 0.0000 0.0000 65.5805 31.4203 178.0097 183 Q 4.1106 7.7672 114.4044 56.6635 29.3123 176.1364 184 R 4.3193 7.7037 116.3069 57.6246 32.0448 175.5574 185 H 4.7904 7.9514 113.3099 55.5917 29.9414 175.0225 186 R 4.6781 8.2527 117.8664 54.6758 35.1430 174.1790 187 I 4.7708 8.3931 120.8868 59.4543 40.6381 174.3086 188 L 4.9663 8.8894 129.5211 53.5695 44.0684 174.8106 189 F 5.2423 9.6311 125.3142 55.7638 41.7209 174.3000 190 E 4.8763 9.0863 123.0662 54.4338 32.8436 174.9765 191 V 4.3252 8.2603 125.3455 61.6009 33.1566 174.7129 192 F 5.1643 8.6107 126.1296 55.5311 43.1113 173.8762 193 D 5.0836 8.9897 122.1548 53.1351 41.3710 176.7107 194 E 4.6422 9.4239 128.8534 58.2805 30.0000 177.6662 195 N 4.4799 8.0537 113.7427 55.0056 38.4571 174.3940 *200 D 4.4843 7.7237 118.3851 53.7736 42.2628 174.0963 201 D 4.7023 8.4189 120.9464 54.3802 42.6552 174.6833 202 F 4.6952 8.9385 127.7208 57.6812 40.1068 174.9128 203 L 4.3221 7.8896 124.7430 53.8110 42.8156 175.7659 204 G 3.7175 5.3800 105.7958 43.3160 0.0000 172.8605 205 Q 5.1389 8.7903 117.3354 54.4602 32.8419 174.1494 206 V 4.7178 8.9905 119.7386 61.3198 35.0602 173.4972 207 D 5.3707 8.9746 126.7356 52.7477 43.5396 174.8741 208 V 4.7228 8.7850 119.3827 58.7458 35.4872 173.9088 209 P 4.7544 0.0000 0.0000 62.2272 32.8117 175.6565 210 L 4.7639 8.1699 116.7980 54.1277 42.0839 175.8849 211 Y 4.8420 7.6648 117.8449 55.9598 41.6085 172.1413 212 P 4.1107 0.0000 0.0000 61.6793 32.7374 175.1962 213 L 4.7652 8.0786 119.1935 52.0661 45.5916 174.6314 214 P 4.4010 0.0000 0.0000 63.0980 32.7693 174.9872 215 T 5.0609 8.2790 117.9454 62.4470 69.8973 174.3040 216 E 4.6574 9.0411 124.3084 54.9248 31.4903 173.8221 *223 P 4.0620 0.0000 0.0000 62.5558 32.5426 175.9107 224 Y 4.3775 8.1696 117.4649 57.6784 38.9264 174.5260 225 T 4.6429 8.0012 114.8150 59.6441 70.3507 172.8828 226 F 4.8110 8.1332 119.8734 56.7558 39.2043 174.3907 227 K 4.5268 9.3722 118.0741 54.7653 36.0297 175.9250 228 D 5.0136 8.5638 123.8517 53.0209 41.0082 175.7483 229 F 4.3889 9.2033 123.6387 56.7425 40.3539 175.4646 230 V 3.7445 8.5610 123.6446 62.9695 32.0373 175.2182 231 L 4.4866 7.9881 128.0023 54.6296 42.5501 175.9745 232 H 5.1408 8.9537 120.5895 53.1790 31.8054 172.7660 233 P 5.0293 0.0000 0.0000 62.8152 32.0357 176.2004 234 R 4.4946 8.2117 113.4950 55.8331 30.6167 175.5907 235 S 4.5324 7.4020 112.0212 57.3578 65.4765 174.9858 236 H 4.2859 8.6641 118.8074 58.3988 28.4954 176.7121 237 K 4.3012 7.4259 115.7752 57.2704 33.1477 177.3338 238 S 4.2532 8.1847 117.9466 58.7159 63.0702 173.7799 239 R 4.5658 8.6156 123.8148 54.5587 31.7022 175.3130 240 V 4.4899 8.1790 115.7293 59.3714 35.0327 174.9228 241 K 4.3303 8.1033 120.1727 56.3643 35.8958 175.8171 242 G 3.8387 8.5471 105.3045 45.7616 0.0000 171.4477 243 Y 5.1812 8.6012 114.4212 56.0832 42.8093 174.5968 244 L 5.1421 9.1822 123.8016 53.4532 44.6419 175.1703 245 R 4.8978 9.1849 128.5570 55.6861 31.2384 175.1010 246 L 5.4374 9.3336 125.9340 52.8800 46.5412 175.3935 247 K 5.0423 8.9419 122.5844 55.0185 35.5282 174.8370 248 M 5.4485 8.7008 125.7341 54.0187 35.5545 174.5020 249 T 4.6706 8.5941 112.6406 60.2486 73.1695 172.4420 250 Y 5.0907 8.5959 120.7114 57.1023 39.5374 175.4916 251 L 4.2680 8.9159 123.8318 54.3251 42.1069 175.1741 252 P 4.1501 0.0000 0.0000 66.5151 31.7247 177.7606 *281 T 4.4058 7.6205 114.5965 63.6542 70.4939 173.7776 282 H 4.8482 7.3687 113.3091 53.6493 31.2999 172.5863 283 L 4.0976 8.3287 122.9887 54.0096 42.4453 175.0758 284 P 4.4686 0.0000 0.0000 62.7689 32.0403 175.9306 285 H 4.5147 8.4182 117.4088 54.8769 29.4193 173.4989 286 P 4.4783 0.0000 0.0000 61.8384 32.0909 174.6911 287 P 4.4185 0.0000 0.0000 62.8840 31.2223 176.1805 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 112 E 8.44 4.32 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 113 L 8.13 4.06 0.00 1.62 1.62 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 114 H 8.83 4.09 0.00 3.07 3.23 0.00 5.89 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.11 4.70 0.00 2.68 2.58 0.00 0.00 7.18 8.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.53 4.43 0.00 2.69 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 D 8.38 4.49 0.00 2.73 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 T 7.66 4.39 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 119 R 8.95 4.71 0.00 1.27 1.47 0.00 3.14 0.00 0.00 2.93 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.10 0.00 120 V 8.37 4.97 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.00 0.00 0.00 121 V 8.99 4.69 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.87 0.00 0.00 122 R 9.31 4.66 0.00 1.91 1.88 0.00 3.10 0.00 0.00 3.44 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 123 V 9.08 4.60 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 1.19 0.00 0.00 124 K 9.37 4.86 0.00 1.78 1.80 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.43 7.81 125 V 9.09 3.99 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.08 0.00 0.00 126 I 8.92 4.15 2.02 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.60 0.86 0.00 0.00 127 A 7.91 4.81 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.41 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 I 8.75 4.73 2.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.77 0.91 0.00 0.00 130 G 9.20 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 L 8.09 4.19 0.00 1.61 1.58 0.96 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 132 A 8.11 4.23 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *136 I 7.60 4.15 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.84 0.91 0.00 0.00 137 L 7.80 4.09 0.00 1.62 1.74 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 138 G 7.46 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 A 7.91 4.34 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 S 7.51 5.07 0.00 3.80 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 9.22 5.85 0.00 2.78 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 5.35 0.00 2.45 2.15 0.00 3.77 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 143 Y 8.99 5.52 0.00 3.17 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 V 8.16 4.60 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 -0.39 0.00 0.00 145 R 9.24 4.91 0.00 2.30 2.09 0.00 3.22 0.00 0.00 3.39 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 146 V 9.42 4.45 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.03 0.00 0.00 147 T 8.74 4.82 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 148 L 8.35 4.41 0.00 0.58 1.19 0.65 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 149 Y 8.57 5.14 0.00 2.98 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 D 8.95 4.91 0.00 2.70 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 P 0.00 4.27 0.00 2.12 2.23 0.00 3.71 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 152 M 8.54 4.39 0.00 2.00 2.21 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.47 0.00 153 S 8.03 4.50 0.00 3.91 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 G 8.69 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.19 4.04 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.51 0.90 0.00 0.00 156 L 8.91 4.56 0.00 1.45 1.64 0.58 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 157 T 7.53 4.74 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 158 S 8.81 5.18 0.00 3.83 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 V 9.06 4.58 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.10 0.00 0.00 160 Q 8.59 5.32 0.00 2.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.81 0.00 0.00 0.00 0.00 0.00 2.06 2.50 0.00 161 T 8.66 4.52 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 162 K 10.02 4.21 0.00 1.91 1.90 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.69 7.81 163 T 8.29 5.01 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 164 I 8.83 4.53 1.74 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.05 0.80 0.00 0.00 165 K 8.77 4.30 0.00 1.66 1.76 0.00 1.92 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.62 1.47 7.81 166 K 8.70 3.83 0.00 1.85 1.79 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.36 7.81 167 S 8.42 4.60 0.00 3.72 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 L 8.43 4.55 0.00 1.59 1.62 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 169 N 7.87 5.75 0.00 2.47 2.60 0.00 0.00 6.98 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 P 0.00 3.97 0.00 0.54 1.70 0.00 3.56 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.65 0.00 171 K 8.03 4.42 0.00 1.50 1.70 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.19 1.26 7.81 172 W 8.65 4.27 0.00 3.57 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 N 8.01 4.22 0.00 2.84 2.88 0.00 0.00 6.96 8.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 E 8.37 4.86 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.57 0.00 175 E 8.72 5.08 0.00 1.96 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.31 0.00 176 I 9.00 4.53 1.66 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.55 0.10 0.00 0.00 177 L 8.28 5.09 0.00 1.40 1.54 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 178 F 8.91 5.06 0.00 2.98 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 R 8.84 4.82 0.00 1.90 1.92 0.00 3.23 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 180 V 9.17 4.70 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.15 0.00 0.00 181 L 8.12 4.48 0.00 1.08 1.41 0.82 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 182 P 0.00 4.31 0.00 1.94 2.26 0.00 3.54 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.87 0.00 183 Q 7.77 4.11 0.00 1.87 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 1.92 2.00 0.00 184 R 7.70 4.32 0.00 1.62 1.74 0.00 3.18 0.00 0.00 3.18 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 185 H 7.95 4.79 0.00 3.05 3.01 0.00 5.67 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 R 8.25 4.68 0.00 0.67 1.50 0.00 3.01 0.00 0.00 3.04 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.33 0.00 187 I 8.39 4.77 1.70 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.53 0.03 0.00 0.00 188 L 8.89 4.97 0.00 1.93 1.48 1.13 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 189 F 9.63 5.24 0.00 2.90 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 E 9.09 4.88 0.00 1.94 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 191 V 8.26 4.33 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.84 0.00 0.00 192 F 8.61 5.16 0.00 1.79 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 D 8.99 5.08 0.00 2.76 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 E 9.42 4.64 0.00 2.45 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.18 0.00 195 N 8.05 4.48 0.00 3.13 2.89 0.00 0.00 6.96 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *200 D 7.72 4.48 0.00 2.59 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 D 8.42 4.70 0.00 2.90 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 F 8.94 4.70 0.00 3.06 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 L 7.89 4.32 0.00 1.38 1.42 0.90 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 204 G 5.38 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 Q 8.79 5.14 0.00 2.29 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.71 0.00 0.00 0.00 0.00 0.00 2.71 2.42 0.00 206 V 8.99 4.72 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.95 0.00 0.00 207 D 8.97 5.37 0.00 2.76 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 V 8.79 4.72 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 1.07 0.00 0.00 209 P 0.00 4.75 0.00 2.28 2.10 0.00 3.77 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 210 L 8.17 4.76 0.00 1.86 1.86 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 211 Y 7.66 4.84 0.00 3.02 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 P 0.00 4.11 0.00 1.88 1.13 0.00 3.61 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 213 L 8.08 4.77 0.00 1.33 1.29 0.62 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 214 P 0.00 4.40 0.00 0.75 1.49 0.00 3.48 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.45 0.00 215 T 8.28 5.06 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 216 E 9.04 4.66 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.36 0.00 *223 P 0.00 4.06 0.00 2.09 2.09 0.00 3.62 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.10 0.00 224 Y 8.17 4.38 0.00 2.99 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 T 8.00 4.64 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 226 F 8.13 4.81 0.00 3.19 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 K 9.37 4.53 0.00 1.27 1.00 0.00 1.52 0.00 0.00 1.37 0.00 0.00 2.78 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.14 1.28 7.81 228 D 8.56 5.01 0.00 2.42 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 F 9.20 4.39 0.00 3.17 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 V 8.56 3.74 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.99 0.00 0.00 231 L 7.99 4.49 0.00 1.55 1.43 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 232 H 8.95 5.14 0.00 3.11 3.21 0.00 5.61 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 P 0.00 5.03 0.00 2.24 2.14 0.00 3.81 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.00 0.00 234 R 8.21 4.49 0.00 1.67 1.67 0.00 2.54 0.00 0.00 2.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.06 0.00 235 S 7.40 4.53 0.00 3.92 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 H 8.66 4.29 0.00 3.17 3.40 0.00 5.71 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 K 7.43 4.30 0.00 2.01 1.94 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.41 7.81 238 S 8.18 4.25 0.00 4.11 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 R 8.62 4.57 0.00 1.77 1.84 0.00 3.32 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 240 V 8.18 4.49 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.98 0.00 0.00 241 K 8.10 4.33 0.00 1.73 1.69 0.00 1.57 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.66 7.81 242 G 8.55 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 Y 8.60 5.18 0.00 2.88 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 L 9.18 5.14 0.00 1.73 1.56 1.10 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 245 R 9.18 4.90 0.00 1.95 1.89 0.00 2.66 0.00 0.00 2.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.55 0.00 246 L 9.33 5.44 0.00 1.77 1.44 -0.56 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 247 K 8.94 5.04 0.00 1.97 1.71 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.48 7.81 248 M 8.70 5.45 0.00 1.84 1.92 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.63 0.00 249 T 8.59 4.67 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 250 Y 8.60 5.09 0.00 2.98 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 251 L 8.92 4.27 0.00 1.59 1.67 1.06 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 252 P 0.00 4.15 0.00 2.07 2.11 0.00 3.76 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 *281 T 7.62 4.41 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 282 H 7.37 4.85 0.00 3.14 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 283 L 8.33 4.10 0.00 1.61 1.61 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 284 P 0.00 4.47 0.00 2.22 2.03 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 285 H 8.42 4.51 0.00 3.20 3.25 0.00 5.70 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 286 P 0.00 4.48 0.00 2.17 2.07 0.00 3.55 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.13 0.00 287 P 0.00 4.42 0.00 2.07 2.01 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.