NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 49 S 4.4094 8.4345 116.7952 58.4552 64.4595 173.2139 50 Q 4.5565 8.8441 121.3531 52.5280 30.3128 173.1113 51 V 3.6305 8.7061 116.6115 63.8907 32.7493 178.5039 52 E 4.1386 8.0213 114.7809 58.2750 29.8422 183.4916 53 Q 4.2194 8.5135 115.7364 58.3362 29.0790 176.4796 54 I 4.1682 7.2277 119.9108 60.8972 37.7876 174.6147 55 E 4.4091 9.2142 127.3943 54.8345 31.4215 174.9243 56 L 4.5744 8.4553 129.6099 54.3064 41.2169 176.8510 57 R 4.0674 8.3171 123.2365 57.9916 30.7959 176.9394 58 T 4.4929 7.7538 113.1189 60.5093 72.1170 173.3567 59 Y 4.8719 8.6270 125.9530 56.0052 41.6365 174.5058 60 V 4.7090 8.7116 126.3273 59.9598 35.0054 173.9726 61 F 5.1724 9.1534 126.7484 56.4040 41.4370 174.2444 62 L 4.4086 8.2577 127.2757 52.9007 42.8279 177.0869 63 D 3.9285 8.5389 124.5134 55.7666 39.7584 176.3592 64 S 4.7122 7.5679 116.8003 55.8252 65.6809 172.6885 65 L 4.5050 8.9401 129.2279 54.8547 42.2977 177.4429 66 Q 4.3465 9.2482 123.4296 55.3122 29.8665 176.0595 67 P 4.1856 0.0000 0.0000 65.9778 31.3742 179.0836 68 Q 3.9893 8.7776 117.1197 58.9972 28.4478 178.6709 69 L 3.9580 8.0904 119.6984 58.1721 42.1340 178.6038 70 A 4.0766 8.0861 119.7799 55.0329 18.6539 179.1722 71 A 4.1442 8.3302 119.6413 55.2109 18.5058 179.3795 72 Y 4.0054 8.3842 116.2854 58.3193 38.5219 177.7551 *74 G 3.9392 8.0186 108.8336 45.4201 0.0000 175.1777 75 T 3.9034 7.7308 115.8308 65.7987 68.5503 175.5144 76 V 3.8535 7.2768 119.0176 63.9516 32.3104 176.1934 77 S 4.5870 7.8116 114.6878 58.1846 63.6526 173.7752 78 R 4.5118 8.8310 118.6103 56.1472 31.0604 177.5695 79 G 4.2126 7.4330 106.9056 45.7608 0.0000 173.6921 80 F 4.6990 9.2072 123.1440 56.5488 40.0125 175.7556 81 L 4.4407 8.8109 125.0428 55.4103 40.9080 175.2114 82 P 4.3324 0.0000 0.0000 61.6972 32.9847 175.0656 83 I 4.2610 8.4870 120.4824 58.9719 38.4861 174.0779 84 P 4.3036 0.0000 0.0000 64.5222 31.5424 176.9071 85 G 4.2261 9.1033 111.3855 44.7598 0.0000 173.6479 86 D 4.5683 7.8353 119.7160 54.8442 42.0625 176.2437 87 S 5.0050 9.0433 117.2445 57.6396 64.9979 172.9716 88 C 5.7074 8.5937 121.9321 56.8984 35.2221 172.1853 89 L 5.0441 8.6715 127.8625 53.3321 43.8823 175.1336 90 W 5.4167 8.7832 135.0000 54.7437 34.3009 173.7112 *92 E 4.4785 8.3717 121.3642 56.1828 30.5352 174.6987 93 V 5.0815 9.0234 118.5574 59.7592 36.8792 174.1226 94 S 5.3035 8.6280 116.0092 55.7728 65.6182 171.7592 95 P 4.6795 0.0000 0.0000 61.7434 32.5959 176.2699 96 G 3.6922 8.2178 108.5319 46.9458 0.0000 175.1770 *98 A 4.3550 8.0316 123.4650 51.3364 20.5895 180.0285 99 V 3.6461 7.5387 115.7791 64.9512 31.0741 178.3175 100 H 4.1590 8.0658 116.8377 58.5859 28.6103 177.5038 101 R 3.8364 7.8699 120.1918 59.4800 29.9867 178.4636 102 V 3.5742 7.8555 117.5604 66.4736 31.2942 178.0404 103 T 3.7713 7.7682 115.1357 66.6101 68.4444 176.0628 104 D 4.3401 8.1601 119.9853 57.5463 40.9600 178.4946 105 I 3.6471 7.5978 118.3656 64.4161 37.1113 177.8861 106 A 4.1038 8.0542 121.5352 55.3060 17.9788 179.6202 107 L 4.0210 7.8899 116.0912 57.0772 41.8728 178.9526 108 K 4.2218 7.7616 115.9237 57.4227 32.4136 177.9293 109 A 4.4280 7.4607 119.8824 53.0829 19.3378 176.2471 110 S 4.4595 7.5221 109.3376 58.4040 65.2535 174.5627 111 N 4.7689 8.5899 116.5513 53.2762 38.2576 176.0117 112 V 3.9189 7.2411 111.7501 62.3211 32.4289 175.7723 113 R 4.4770 8.5840 121.1112 54.4931 33.1298 175.6767 114 L 4.5511 8.3688 124.0299 54.4153 42.2407 177.1194 115 G 3.5882 8.8478 116.1870 48.6115 0.0000 171.5389 116 Q 4.7813 7.3602 119.6380 54.9826 33.1921 172.6408 *118 I 4.0873 8.1401 119.3662 60.7512 39.5165 174.3940 119 V 4.5838 8.3425 128.0841 61.2140 32.9674 174.5794 120 E 4.5394 8.8065 130.3956 54.5925 31.9351 175.5194 121 R 3.7910 8.7642 117.6569 59.3375 29.6641 177.4072 122 A 4.3775 8.2364 117.8928 51.6976 21.8209 175.9278 123 F 5.2766 8.0191 112.4629 55.7027 43.2149 174.7369 124 G 4.4806 8.9460 108.1309 44.6916 0.0000 172.5021 125 S 4.9733 9.0255 120.2575 56.4639 66.9778 173.3709 126 L 4.5017 7.2225 120.0876 54.0253 44.1062 174.4492 127 A 4.9100 8.4232 122.0858 50.0509 22.2729 174.9806 128 L 4.9835 8.5534 121.3655 53.0068 44.9395 175.2164 129 Y 5.6376 8.4045 120.3245 56.8961 41.4013 174.2038 130 H 5.0113 8.9131 120.9389 55.0715 33.3681 174.8668 131 K 4.0691 8.6432 123.1708 59.1800 32.6838 177.2354 132 D 4.7424 8.3241 120.5874 52.9903 41.9936 176.3640 133 Q 4.3744 9.2374 127.8052 58.8510 28.8707 178.9074 134 S 4.2466 8.0682 114.3484 61.3748 63.2715 176.2389 135 T 3.8229 7.9458 118.9295 66.5033 68.2082 176.4466 136 V 3.6531 7.6035 119.3694 66.1782 31.6533 178.1578 137 L 3.9994 7.8607 118.2374 57.9283 41.3606 179.0404 138 H 4.2301 8.5631 118.6309 59.3240 29.7935 177.5321 139 S 4.1711 8.0335 117.2146 61.2796 62.5221 176.8367 140 G 3.6782 8.0619 108.3508 47.9711 0.0000 175.1589 141 D 4.4029 8.4216 122.5207 57.1963 41.0027 179.3464 142 V 3.5305 7.7638 118.3403 65.8623 31.3888 178.2971 143 V 3.5345 7.7390 117.9322 66.0196 31.4972 177.9588 144 L 3.9928 8.1585 118.9960 57.9205 41.3347 179.0699 145 D 4.3322 8.3665 117.7896 57.3731 40.9510 178.2283 146 A 4.0717 7.8237 120.2900 54.0301 18.4330 178.5425 147 I 4.2851 7.5694 109.2271 59.9784 38.3288 175.6332 148 G 3.7579 7.8916 108.1794 47.1558 0.0000 173.0295 149 S 4.6867 8.3072 114.0965 56.9361 66.0353 171.7144 150 E 4.6350 8.2585 115.9404 55.1676 31.8363 176.0748 151 V 3.0043 8.4867 122.1177 66.8325 31.2607 179.0508 152 R 4.1770 7.8027 115.0775 58.2943 29.4359 178.8481 153 K 4.3693 7.8723 114.2889 57.5455 32.2357 177.3061 154 R 4.4200 7.6458 117.0583 55.9531 30.2709 176.8879 155 T 4.0052 8.7977 119.1434 64.2248 69.5029 173.5934 156 K 4.2942 8.5739 125.6012 55.0059 33.3654 174.8779 157 P 4.5602 0.0000 0.0000 62.7779 32.3939 175.2725 158 S 4.7022 9.2387 118.5947 57.0970 64.6576 173.0001 159 T 4.9702 8.4844 123.9979 62.5272 68.1467 174.5583 160 S 4.5762 8.7295 122.7669 60.2552 64.3932 174.6132 161 W 4.9185 7.9965 128.7261 56.6542 33.8825 173.0343 162 T 5.0774 7.1546 119.2204 61.9703 69.9311 171.8990 163 E 4.6849 8.3589 125.9502 55.3846 33.1327 173.6353 164 V 4.8780 8.5097 124.6832 61.2183 33.6773 174.6908 165 I 4.6409 8.2714 127.0248 59.8144 40.2578 174.4190 166 C 4.4214 9.1794 124.1191 57.8987 29.6305 173.2345 167 A 3.9386 8.2493 121.3007 51.6888 15.5752 178.1962 168 I 3.7283 7.4544 122.2220 62.0836 38.3566 176.9637 169 T 4.4481 8.3309 114.6928 60.6342 71.0125 173.9267 170 P 4.2271 0.0000 0.0000 66.0195 31.3306 178.6136 171 D 4.3575 8.0825 116.9437 57.7558 40.9185 178.2350 172 H 4.1867 8.1872 118.0619 59.1904 29.7504 177.1795 173 A 3.9848 8.3094 123.0021 55.1872 18.0487 180.0754 174 V 3.5881 7.6656 116.4852 64.7393 31.8918 178.3155 175 L 4.1358 7.8202 119.5219 57.6391 41.5518 179.4190 176 I 3.7269 7.6589 119.2469 64.5971 36.8896 178.3221 177 N 4.4542 8.3211 115.8488 55.6582 38.3623 176.7423 178 R 4.5549 7.6119 117.3970 55.9440 31.7924 176.8265 179 Q 4.2889 7.4327 117.5185 55.3325 27.6026 175.0064 180 N 4.1403 8.2369 124.4631 53.8032 36.5166 174.7858 181 R 5.1480 7.7866 115.8346 55.2518 31.2858 175.6255 182 S 4.6614 9.4215 120.5793 58.7638 65.0614 175.2826 183 G 4.8290 8.0212 110.6906 45.1928 0.0000 172.0854 184 S 4.8844 8.9696 124.0559 58.6236 63.5942 177.5231 *186 I 3.9826 8.6299 125.8899 61.8382 38.5628 173.0105 187 Q 4.7264 8.4312 126.2316 53.4952 31.2677 175.9011 188 S 4.2451 8.4341 116.5644 59.9399 63.2951 174.3243 189 G 3.8882 8.8587 110.2964 46.0782 0.0000 172.9952 *191 S 4.9844 7.6928 115.5485 57.9867 65.3550 172.6201 *193 F 4.9553 8.3669 121.1102 59.1411 41.0055 175.1001 194 I 4.7326 7.5229 125.1153 59.2885 41.0906 174.2959 195 L 4.8963 8.4907 127.8289 53.4858 45.6334 174.1254 196 E 5.9516 9.8675 127.4398 53.7835 32.8039 174.5744 197 T 5.4391 8.5769 115.1810 60.2177 73.4020 172.1035 198 E 4.9882 9.0627 119.1061 54.0581 33.0999 173.7462 199 P 4.5858 0.0000 0.0000 62.0575 32.2743 176.8497 200 A 4.4085 8.4848 120.5743 55.1735 18.3096 179.9657 201 G 3.3961 8.0659 104.0946 48.0639 0.0000 175.4093 202 Y 4.2060 7.7671 117.9769 60.5992 37.8571 178.3963 203 V 3.7082 7.7942 113.0121 63.6146 31.5737 178.0060 204 L 3.7204 7.4974 120.4619 57.9312 41.9211 178.8473 205 K 3.9147 7.9494 118.8146 59.4541 32.1981 178.3703 206 A 4.0275 7.9696 120.3848 55.0551 18.2953 179.4840 207 A 3.9064 8.2764 119.6949 55.2369 18.4413 179.4175 208 N 4.1987 8.1727 115.4927 56.8279 39.0660 176.8499 209 E 3.9190 8.2020 119.7155 59.4947 29.0993 179.1565 210 A 3.9457 8.1142 120.7187 55.2887 18.1702 179.3473 211 E 3.9050 8.0441 116.7729 59.0886 29.7488 178.6668 212 K 4.0389 7.9575 117.9753 59.6453 32.3136 178.8482 213 S 4.4483 7.8867 112.1188 58.8637 63.2780 173.7665 214 A 4.4822 6.8654 121.9769 50.9551 22.0577 176.0848 215 N 4.6484 8.4866 118.0565 52.2888 37.6485 174.4830 216 I 4.7902 7.7845 115.5634 59.6273 41.7785 174.1354 217 T 4.7696 9.0638 118.7598 61.7951 70.9037 174.0845 218 I 4.1361 8.8819 127.9894 61.3972 38.0354 176.3214 219 I 4.2093 8.3920 127.8679 62.4202 38.8561 175.5462 220 D 4.7670 7.5013 118.8895 53.4706 45.5095 174.9420 221 V 4.6384 8.2923 120.8553 61.3625 32.8382 173.5592 222 K 4.4733 9.3392 125.7518 54.6295 32.6793 176.3409 223 A 4.6106 8.5234 126.3242 51.3695 19.6256 176.1352 224 V 4.4900 8.3716 116.3051 60.9893 34.0487 175.2279 225 G 4.5647 8.9448 112.1265 42.9574 0.0000 172.7473 226 A 4.2846 8.5703 122.3824 54.4249 18.5522 178.0673 227 F 5.0779 8.0370 112.2425 55.6551 42.8609 175.2489 228 G 4.1821 9.1795 109.9892 44.7998 0.0000 173.0376 229 R 5.1409 9.1249 122.2162 54.2670 34.1202 173.7793 230 L 4.9612 9.0327 127.2914 53.5952 44.5526 175.2391 231 T 5.1758 8.7285 122.3091 61.7055 72.0581 172.9284 232 L 5.2410 8.9442 125.6300 54.2730 44.0254 175.2084 233 A 4.8784 9.7311 121.3848 49.9879 23.0888 176.4430 234 G 3.8781 7.6528 104.3418 45.4970 0.0000 173.1603 235 K 4.1748 7.8896 120.1767 55.8953 34.0903 177.0775 236 E 4.0196 8.9851 123.6405 59.6411 29.4473 179.6965 237 G 3.5798 8.0064 104.8230 47.9500 0.0000 175.2066 238 D 4.3159 7.9949 121.3461 56.8968 40.8711 178.8615 239 V 3.5597 8.1216 119.0588 66.1260 31.5547 177.8007 240 E 3.8703 8.3104 118.3794 59.3143 29.2827 179.0037 241 E 3.7886 8.0932 118.9247 59.2857 29.6681 178.6608 242 A 3.8674 8.2827 120.9412 54.9724 18.3364 179.4530 243 A 2.5800 7.8252 119.2809 54.6692 18.3028 179.7369 244 A 3.7891 7.6487 118.9697 55.0906 18.4205 179.5649 245 A 3.8567 7.9393 119.0403 55.3436 18.5211 179.7438 246 A 3.9540 7.9924 119.3032 55.4035 18.4293 179.9944 247 I 3.7146 7.8463 118.3482 64.3874 37.0751 178.6440 248 R 3.8848 8.2600 119.1113 59.3975 29.8354 178.7584 249 A 4.0221 8.0942 120.2052 55.3995 18.0620 179.8075 250 I 3.6628 7.7360 118.0003 64.6305 37.1917 178.4157 251 D 4.3665 8.5200 120.1800 57.5343 40.3985 178.9306 252 Q 4.0863 8.2826 118.0280 58.9687 28.7440 178.4897 253 I 3.8274 7.3813 120.2937 64.6121 37.1063 178.2327 254 S 4.2324 7.4720 115.2017 60.9815 64.1306 175.9375 255 N 4.7789 8.1666 120.8502 52.5523 35.1186 174.8530 256 Y 4.2509 7.6317 124.1241 57.5628 39.3012 174.8476 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 49 S 8.43 4.41 0.00 3.88 3.87 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 50 Q 8.84 4.56 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.74 0.00 0.00 0.00 0.00 0.00 2.19 2.27 0.00 51 V 8.71 3.63 2.20 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 0.92 0.00 0.00 0.93 0.00 0.00 52 E 8.02 4.14 0.00 1.99 1.87 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 2.23 1.90 0.00 53 Q 8.51 4.22 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 54 I 7.23 4.17 2.03 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 1.19 0.47 0.92 0.00 0.00 55 E 9.21 4.41 0.00 2.01 1.81 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 2.21 2.24 0.00 56 L 8.46 4.57 0.00 1.84 1.58 1.00 1.06 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 57 R 8.32 4.07 0.00 1.70 1.77 0.00 2.54 0.00 0.00 2.25 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.35 0.00 58 T 7.75 4.49 4.20 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 0.58 0.00 0.00 59 Y 8.63 4.87 0.00 2.93 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.71 4.71 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 0.76 0.00 0.00 1.02 0.00 0.00 61 F 9.15 5.17 0.00 3.10 3.13 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 0.00 0.00 0.00 62 L 8.26 4.41 0.00 1.59 1.41 0.88 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.54 3.93 0.00 3.05 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 S 7.57 4.71 0.00 3.86 3.69 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 65 L 8.94 4.50 0.00 1.55 1.54 0.74 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 9.25 4.35 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.81 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 67 P 0.00 4.19 0.00 2.15 2.08 0.00 3.74 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 2.10 2.16 0.00 68 Q 8.78 3.99 0.00 2.44 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 69 L 8.09 3.96 0.00 1.71 1.69 0.85 0.98 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 70 A 8.09 4.08 1.30 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 0.00 0.00 0.00 71 A 8.33 4.14 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 8.38 4.01 0.00 3.17 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *74 G 8.02 3.94 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 0.00 0.00 0.00 75 T 7.73 3.90 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 76 V 7.28 3.85 1.87 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 0.78 0.00 0.00 0.34 0.00 0.00 77 S 7.81 4.59 0.00 4.04 4.10 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 78 R 8.83 4.51 0.00 1.76 1.89 0.00 3.13 0.00 0.00 3.21 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 79 G 7.43 4.21 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 0.00 0.00 0.00 80 F 9.21 4.70 0.00 3.06 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.81 4.44 0.00 1.64 1.72 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 82 P 0.00 4.33 0.00 1.60 0.49 0.00 3.65 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.31 0.00 83 I 8.49 4.26 2.10 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 161 W 8.00 4.92 0.00 3.40 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 0.00 162 T 7.15 5.08 4.21 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 1.13 0.00 0.00 163 E 8.36 4.68 0.00 1.91 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 0.00 2.27 2.14 0.00 164 V 8.51 4.88 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 0.92 0.00 0.00 1.05 0.00 0.00 165 I 8.27 4.64 1.92 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.02 0.97 0.00 0.00 166 C 9.18 4.42 0.00 2.87 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 A 8.25 3.94 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 0.00 0.00 0.00 0.00 0.00 168 I 7.45 3.73 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.83 0.83 0.00 0.00 169 T 8.33 4.45 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 1.24 0.00 0.00 170 P 0.00 4.23 0.00 2.18 2.16 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 171 D 8.08 4.36 0.00 2.73 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 0.00 172 H 8.19 4.19 0.00 3.23 3.42 0.00 5.61 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 A 8.31 3.98 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.67 3.59 2.09 0.00 0.00 0.00 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 0.94 0.00 0.00 175 L 7.82 4.14 0.00 1.83 1.77 0.92 1.24 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 0.00 176 I 7.66 3.73 2.04 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.02 0.91 0.00 0.00 177 N 8.32 4.45 0.00 2.81 2.90 0.00 0.00 7.05 8.51 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 0.00 178 R 7.61 4.55 0.00 2.03 1.98 0.00 3.15 0.00 0.00 3.31 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 179 Q 7.43 4.29 0.00 2.17 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.71 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 180 N 8.24 4.14 0.00 2.84 2.87 0.00 0.00 7.12 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 R 7.79 5.15 0.00 1.80 1.98 0.00 3.26 0.00 0.00 3.91 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 182 S 9.42 4.66 0.00 3.92 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 G 8.02 4.83 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 0.00 0.00 0.00 184 S 8.97 4.88 0.00 3.92 2.99 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 *186 I 8.63 3.98 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.75 0.98 0.00 0.00 187 Q 8.43 4.73 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 188 S 8.43 4.25 0.00 4.09 3.88 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 0.00 0.00 0.00 189 G 8.86 3.89 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 0.00 0.00 0.00 *191 S 7.69 4.98 0.00 3.84 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.37 4.96 0.00 3.13 2.99 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 0.00 194 I 7.52 4.73 1.81 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 1.09 1.23 1.00 0.00 0.00 195 L 8.49 4.90 0.00 1.33 1.20 0.98 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 196 E 9.87 5.95 0.00 2.07 1.87 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 2.36 2.27 0.00 197 T 8.58 5.44 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 198 E 9.06 4.99 0.00 1.80 1.83 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 2.27 2.27 0.00 199 P 0.00 4.59 0.00 2.06 1.85 0.00 3.94 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.01 0.00 200 A 8.48 4.41 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.07 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.77 4.21 0.00 3.13 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.79 3.71 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.92 0.00 0.00 204 L 7.50 3.72 0.00 1.45 1.38 0.33 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 205 K 7.95 3.91 0.00 1.96 2.03 0.00 1.69 0.00 0.00 1.85 0.00 0.00 3.39 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.62 7.81 206 A 7.97 4.03 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 A 8.28 3.91 1.32 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 0.00 0.00 0.00 208 N 8.17 4.20 0.00 2.93 2.79 0.00 0.00 7.27 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 E 8.20 3.92 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 210 A 8.11 3.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 E 8.04 3.90 0.00 1.97 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 2.31 2.33 0.00 212 K 7.96 4.04 0.00 1.97 1.86 0.00 1.86 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.48 7.81 213 S 7.89 4.45 0.00 3.82 3.87 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 0.00 214 A 6.87 4.48 1.18 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 0.00 0.00 0.00 215 N 8.49 4.65 0.00 2.71 2.81 0.00 0.00 6.69 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 I 7.78 4.79 1.99 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 1.34 0.51 0.90 0.00 0.00 217 T 9.06 4.77 4.34 0.00 0.00 0.00 0.00 0.00 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 0.00 218 I 8.88 4.14 1.83 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 1.13 0.68 0.60 0.00 0.00 219 I 8.39 4.21 2.00 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 1.25 1.46 0.92 0.00 0.00 220 D 7.50 4.77 0.00 2.56 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 V 8.29 4.64 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.42 0.00 0.00 222 K 9.34 4.47 0.00 1.76 1.81 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.46 7.81 223 A 8.52 4.61 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 V 8.37 4.49 2.22 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 0.98 0.00 0.00 1.26 0.00 0.00 225 G 8.94 4.56 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 0.00 0.00 0.00 226 A 8.57 4.28 1.30 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 0.00 0.00 0.00 227 F 8.04 5.08 0.00 2.92 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 G 9.18 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 0.00 0.00 0.00 0.00 229 R 9.12 5.14 0.00 1.69 1.79 0.00 3.12 0.00 0.00 3.08 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 230 L 9.03 4.96 0.00 1.66 1.43 0.87 0.73 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 0.00 231 T 8.73 5.18 4.20 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 1.18 0.00 0.00 232 L 8.94 5.24 0.00 1.74 1.59 1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 233 A 9.73 4.88 1.21 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 0.00 0.00 234 G 7.65 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 235 K 7.89 4.17 0.00 2.01 1.73 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.49 7.81 236 E 8.99 4.02 0.00 2.03 1.97 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 2.41 2.43 0.00 237 G 8.01 3.58 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 0.00 0.00 0.00 238 D 7.99 4.32 0.00 2.83 2.84 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 0.00 239 V 8.12 3.56 2.22 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 1.16 0.00 0.00 1.04 0.00 0.00 240 E 8.31 3.87 0.00 2.24 1.94 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 2.30 2.30 0.00 241 E 8.09 3.79 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 242 A 8.28 3.87 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.83 2.58 0.84 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 0.00 244 A 7.65 3.79 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 A 7.94 3.86 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 A 7.99 3.95 1.44 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 0.00 247 I 7.85 3.71 1.84 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.88 0.91 0.00 0.00 248 R 8.26 3.88 0.00 2.00 1.99 0.00 3.13 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.93 0.00 249 A 8.09 4.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 I 7.74 3.66 2.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.09 0.87 0.00 0.00 251 D 8.52 4.37 0.00 2.79 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 0.00 252 Q 8.28 4.09 0.00 2.06 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.97 0.00 0.00 0.00 0.00 0.00 2.43 2.53 0.00 253 I 7.38 3.83 1.91 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.48 0.57 0.00 0.00 254 S 7.47 4.23 0.00 3.99 3.85 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 0.00 255 N 8.17 4.78 0.00 2.73 2.80 0.00 0.00 6.88 7.05 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 0.00 256 Y 7.63 4.25 0.00 3.11 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.