NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2128 8.3331 121.7098 56.1118 31.0842 175.5470 4 G 3.4500 7.7035 106.2455 44.2488 0.0000 170.4341 5 L 4.9367 8.6832 122.1835 53.5351 45.7845 173.2226 6 Y 5.3575 9.3879 124.9253 56.4009 41.0778 175.3329 7 V 4.8954 8.8774 120.5613 60.0873 34.8993 174.7800 8 G 4.2167 9.7176 109.3364 43.8608 0.0000 171.7866 9 G 3.9326 6.0222 108.8945 45.3985 0.0000 171.6038 10 F 4.6234 7.8940 118.5553 57.1288 39.6233 177.1846 11 V 4.2216 8.3066 117.2198 61.8142 32.5996 175.6505 12 D 4.7250 7.7990 118.6812 53.0023 44.8454 173.7253 13 V 4.5019 8.2192 124.9978 60.9478 33.4246 176.1680 14 V 3.8089 8.7650 129.5155 64.7979 32.1318 176.6866 15 S 4.7532 7.6151 114.1991 58.4595 63.5741 173.3687 16 C 4.8010 7.2033 116.2196 58.0766 30.3448 172.7487 17 P 4.3117 0.0000 0.0000 62.9550 31.4965 176.1359 18 K 4.6546 8.2299 120.9157 55.3254 34.2533 175.0784 19 L 4.5891 8.0508 120.8390 56.5220 48.2573 175.7222 20 E 4.2411 8.0630 120.0985 55.4013 29.9491 177.2714 21 Q 4.0313 8.9174 126.3435 59.0696 29.2591 178.3450 22 E 3.9514 8.1302 114.3146 58.5135 29.7839 177.3583 23 L 4.3280 7.5899 117.8237 55.0999 42.2669 176.1850 24 Y 4.3271 7.7160 120.9985 57.2478 39.0831 174.7878 25 L 4.1977 7.8266 126.9469 52.5403 42.9788 175.6337 26 D 3.9038 7.8383 124.8682 52.5821 40.5083 175.1059 27 P 4.5148 0.0000 0.0000 66.7779 30.9262 178.6153 *28 D 4.4992 8.3068 119.7004 57.3521 39.7254 180.5029 29 Q 4.5783 8.1561 117.4926 58.5100 30.0800 177.6030 30 V 4.0059 7.7228 112.6260 63.6350 31.5459 178.0251 31 T 3.9102 7.4299 110.8191 65.2513 68.1043 175.8401 32 D 4.3020 8.0805 119.3444 55.9088 40.9448 176.3430 33 Y 4.6737 7.9570 115.3922 57.4657 38.8216 175.1772 34 L 5.0717 7.5074 119.9544 52.0115 44.9568 174.7839 35 P 4.5022 0.0000 0.0000 62.6841 33.0289 175.5753 36 V 4.2488 8.0866 121.4345 61.9074 32.1436 176.2137 37 T 4.2221 8.4097 117.6934 61.7499 70.3978 174.6857 38 E 3.9666 8.0274 123.3594 55.3854 30.1151 174.2556 39 P 4.6952 0.0000 0.0000 62.3735 32.0349 175.6552 40 L 4.9619 9.0036 124.8311 52.4272 44.4401 174.4747 41 P 4.1745 0.0000 0.0000 62.6948 33.0003 175.1392 42 I 5.4289 8.2550 124.1228 59.2459 39.2621 175.0220 43 T 5.2285 8.0703 115.6570 58.7970 73.1647 172.3363 44 I 4.3287 8.4448 122.4867 59.9602 38.6701 176.5328 45 E 3.7905 9.4921 128.6793 57.9095 27.5047 174.5552 46 H 3.9765 7.7972 109.9539 56.7509 27.2525 175.3005 47 L 4.4394 7.7674 120.9340 52.5298 41.3077 176.0464 48 P 4.1804 0.0000 0.0000 65.2826 31.5743 176.8259 49 E 4.4983 8.0913 117.9122 55.6787 30.9125 176.9466 50 T 4.6163 7.5053 110.8403 61.0228 68.8642 174.4858 51 E 4.3451 8.0546 121.6490 57.9545 29.9306 178.4811 52 V 3.8988 9.1293 117.0166 60.3927 34.0372 176.2483 53 G 3.5653 6.3880 106.4514 45.6835 0.0000 170.9868 54 W 5.8622 7.9061 118.6129 54.9216 33.5373 175.2419 55 T 4.4771 9.4628 114.6879 62.2467 69.1296 174.6964 56 L 4.6604 9.5743 123.0883 54.0260 43.1126 176.8462 57 G 4.1979 6.9749 112.9989 45.7752 0.0000 171.2391 58 L 5.0195 7.3184 124.9068 52.8197 44.9870 175.1185 59 F 5.1370 9.3011 124.8261 55.5284 42.8162 174.0134 60 Q 4.7330 8.8563 124.5020 55.7697 29.8709 175.1322 61 V 4.5984 8.9275 119.4326 59.0009 35.4808 176.5053 62 S 4.1184 9.0605 115.3668 61.9759 62.2059 174.9516 63 H 4.4279 8.4184 118.8217 56.5356 30.8294 175.1971 64 G 4.0244 6.6346 106.3571 46.2522 0.0000 170.9707 65 I 4.9538 8.1788 124.0834 59.6927 39.5746 174.6616 66 F 4.6080 9.3102 130.3202 56.2871 41.7703 173.6618 67 C 5.2281 7.9018 126.3678 57.6068 34.3938 172.4627 68 T 5.0241 8.7521 114.9523 60.1673 71.9761 172.9387 69 G 4.5489 9.3223 109.8924 45.3622 0.0000 170.9188 70 A 5.1869 9.2645 121.4594 49.9865 22.0112 175.4571 71 I 4.6953 8.7916 124.3685 60.2668 37.4665 175.8668 72 T 4.4594 9.1149 116.7698 60.4698 70.4016 173.7433 73 S 4.3406 7.8899 117.9909 57.4853 63.1476 172.1393 74 P 4.2045 0.0000 0.0000 65.6819 31.2448 178.3713 75 A 4.0114 8.0060 118.9706 55.1457 18.3212 179.2774 76 F 3.4407 7.6926 118.9473 61.2662 39.3227 177.4032 77 L 3.7005 7.9670 118.5746 57.5444 41.3204 179.4256 78 E 3.8634 8.2833 118.8933 59.1331 29.3629 179.0613 79 L 3.8464 7.8515 120.0752 58.1038 42.1344 178.7705 80 A 3.8385 7.8019 121.0592 55.2750 18.3313 179.5707 81 S 3.9348 8.0855 111.6381 61.4380 60.9174 176.6288 82 R 4.0202 7.8658 120.8577 59.2023 29.8142 179.0318 83 L 4.0438 7.9667 118.6389 57.6767 41.3474 179.3751 84 A 3.9861 7.9173 119.8301 55.2617 18.3077 179.0729 85 D 4.4539 7.8897 116.7144 56.7287 40.9413 177.3868 86 T 4.4706 7.0731 105.8480 60.7626 70.6244 174.6061 87 S 4.2053 8.1193 118.6657 58.5667 63.0290 174.1933 88 H 4.2804 8.8203 127.0716 58.8892 28.4963 177.6178 89 V 3.7682 7.8133 119.5731 65.8445 31.2644 177.7821 90 A 4.0598 7.9276 119.7042 55.0133 18.3400 179.1457 91 R 4.1436 7.6341 113.4217 56.3239 30.8858 177.0829 92 A 4.1854 7.1343 122.3642 50.7237 19.0374 175.6186 93 P 4.3494 0.0000 0.0000 63.2262 31.7314 175.6102 94 V 4.2977 8.1015 118.8905 60.3876 33.3843 174.8127 95 K 3.7704 8.6373 127.8050 58.3457 32.0863 176.0895 96 N 4.4448 9.0700 121.7407 53.4714 36.2055 173.8516 97 L 4.8132 7.3992 117.4742 51.8427 45.2497 174.7981 98 P 4.5535 0.0000 0.0000 62.0224 32.1595 176.3079 99 K 4.3479 8.4646 119.2930 56.9739 32.4638 177.5051 100 E 4.4714 8.8818 122.4881 52.5985 30.8444 174.0424 101 P 4.1872 0.0000 0.0000 65.6280 31.5697 177.9527 102 L 3.9047 7.7135 116.8245 57.7430 41.6832 179.3182 103 L 3.8853 7.6551 118.4084 57.8611 41.6493 179.3591 104 E 4.1012 8.3069 118.7523 59.2783 29.3698 179.2001 105 I 3.7356 7.8952 118.7988 63.9996 37.9716 177.9030 106 L 3.8298 7.7683 119.8654 58.1949 41.1088 179.3458 107 H 4.4676 8.1476 114.6594 58.7520 28.6391 177.7520 108 T 4.2432 7.6521 116.9915 66.0473 68.6082 176.4665 109 W 4.7160 8.5703 129.2790 59.0970 32.3220 176.4933 110 L 4.9386 8.0724 116.2371 52.7245 41.5529 174.8014 111 P 4.6261 0.0000 0.0000 64.6772 33.1832 178.0470 112 G 4.4642 8.5930 108.5378 44.6278 0.0000 172.6272 113 L 5.2657 8.8603 121.4916 52.8741 44.5766 176.4386 114 S 4.5134 8.8621 116.8103 56.6288 65.5734 173.0146 115 L 4.5434 8.7239 129.6526 55.1057 43.0918 175.5830 116 S 4.8664 8.8343 120.2197 56.5375 64.4778 173.0053 117 S 5.0427 8.3670 120.2216 56.5000 66.3122 173.3628 118 I 3.7900 8.1765 121.5604 60.7816 38.5842 175.2582 119 H 4.0346 8.8639 127.6196 55.9354 30.3784 174.1699 120 P 4.2579 0.0000 0.0000 65.6182 31.4610 178.7789 121 R 3.9745 8.2765 113.5493 59.0859 29.4197 177.0008 122 E 4.3774 8.0741 116.0230 56.4329 29.5001 177.7911 123 L 4.2081 7.3971 121.7571 53.4497 39.8719 175.8882 124 S 4.7325 7.4423 116.4941 56.3422 65.8126 176.0060 125 Q 4.1856 8.1872 118.8608 55.3004 27.3431 174.3361 *127 P 4.1837 0.0000 0.0000 62.5769 32.6136 177.1684 128 S 4.3916 8.4623 113.8045 59.7005 63.1199 174.1380 129 G 4.1877 7.4617 107.9208 42.7443 0.0000 170.3534 130 P 4.2869 0.0000 0.0000 63.0769 31.7331 176.7946 131 V 3.2969 8.2307 119.8133 65.5820 32.4113 175.4178 132 F 5.0102 7.7826 118.1756 56.3095 39.9162 174.8638 133 Q 4.4765 9.2361 126.3747 57.7700 29.6740 174.8774 134 H 4.8538 7.6033 111.6203 54.8880 32.3847 171.4265 135 V 4.7767 8.5401 118.0621 61.2135 34.2111 174.3192 136 S 5.2787 9.0794 123.4322 56.6630 66.1577 173.1972 137 L 4.8242 8.5441 123.7183 54.5469 43.0678 175.7733 138 C 4.8702 8.8361 116.6904 56.9733 33.1537 174.8841 139 A 4.0273 8.4733 120.8742 54.8748 18.1257 178.1305 140 L 4.2734 7.3434 112.6410 54.2802 44.9318 174.3008 141 G 3.9753 8.6319 114.6588 44.8177 0.0000 173.8077 142 R 4.1072 8.4941 120.0856 58.1536 30.5853 177.5379 143 R 4.4509 7.7219 116.0718 54.9549 31.3187 176.3586 144 R 4.2710 8.3635 120.8806 57.1183 30.9539 177.0129 145 G 4.0194 9.4510 109.5965 46.0248 0.0000 173.7812 146 T 5.2996 7.3951 108.9352 60.8749 69.6344 174.9536 147 V 4.2765 8.0121 114.7227 62.3917 32.4930 176.5365 148 A 4.4114 8.9126 126.7929 51.6352 19.7439 176.9669 149 V 4.4844 8.7403 119.9754 61.4271 34.0663 174.0564 150 Y 5.2081 8.9113 125.6115 57.0049 39.7941 175.0477 151 G 4.5070 9.2293 108.7799 46.4249 0.0000 173.4742 152 H 5.2921 8.9135 115.3921 55.2945 29.5818 175.5517 153 D 4.8442 8.0078 118.7741 51.7392 43.5094 175.3410 154 A 3.7502 8.1594 130.0051 55.0010 18.3350 178.4492 155 E 3.8551 8.1923 117.3669 59.1328 29.5218 178.7036 156 W 4.2122 8.3301 128.5044 59.8894 31.1756 177.5845 157 V 3.6353 8.2577 118.2502 66.3494 31.0154 178.2646 158 V 3.8729 8.0394 117.9896 65.8363 30.9971 177.8128 159 S 4.2304 8.2617 113.4657 60.5325 62.8477 176.3279 160 R 3.9305 7.5977 121.8830 57.2445 29.8809 175.7595 161 F 4.7855 8.0323 118.5694 55.8132 38.0750 176.5419 162 S 4.2996 8.6801 121.6864 60.0565 63.2159 176.2616 163 S 4.0710 8.1289 115.1980 60.1582 62.9817 174.0663 164 V 4.2115 7.4731 121.8854 61.0746 32.1358 176.2846 165 S 4.3751 8.8000 122.8653 57.6502 65.0618 175.0776 166 K 3.8246 8.4621 122.8306 59.6804 31.9233 178.6662 167 S 4.0187 7.9200 112.6827 61.4934 62.4226 175.6738 168 E 3.8502 8.2268 121.3461 59.4057 29.1115 179.3409 169 R 3.6268 8.2752 118.7296 59.3480 30.0555 178.2895 170 A 3.9086 7.9254 120.4470 55.3665 18.2705 179.0774 171 H 3.9879 8.0433 116.4045 59.4562 29.9095 177.5258 172 I 2.8625 7.5039 121.5073 64.2498 36.8737 178.5506 173 L 3.9232 8.0506 119.9765 57.3250 41.1494 179.0951 174 Q 3.9029 7.9360 119.2812 59.5537 29.2415 177.9459 175 H 4.2760 7.9433 118.5956 59.2663 30.0477 177.2274 176 V 3.6674 8.0171 120.2194 66.3754 31.1121 178.1277 177 S 4.1987 8.4445 113.8035 61.6580 62.7215 176.4338 178 S 4.5316 7.6628 115.6581 59.2939 62.7385 174.0013 179 C 4.3527 7.4389 119.8694 58.1996 27.7071 173.6066 180 R 4.2026 8.3602 125.4025 55.4648 30.1854 178.0769 181 L 4.1085 8.6515 123.9614 57.7097 41.9672 179.4545 182 E 4.0734 8.1241 117.1031 59.1990 29.5219 177.7588 183 D 4.5088 7.7898 117.4019 55.9176 41.2356 176.9446 184 L 4.0165 7.4393 119.6850 54.0301 42.1695 177.1729 185 S 4.3911 7.9038 116.3454 58.0532 63.8279 174.0380 186 T 4.1672 8.3601 118.7353 62.9602 68.6166 173.0741 187 P 4.3715 0.0000 0.0000 62.7313 32.6424 176.4086 188 N 4.6660 9.2898 122.4879 52.6001 38.8483 172.3100 189 F 5.0194 8.5831 126.7360 56.0131 41.4880 174.4421 190 V 4.1277 7.8616 126.4497 60.5866 33.5450 175.1900 191 S 3.6864 8.5070 123.7860 57.8847 62.6516 173.1786 192 P 4.6076 0.0000 0.0000 61.5672 29.8818 175.6154 193 L 4.0366 7.9597 128.4425 58.8320 42.3742 177.8179 194 E 3.9797 8.1207 118.2052 59.6181 29.4617 179.2138 195 T 3.8835 7.8768 115.3011 66.7008 68.6120 176.5028 196 L 4.1694 8.1589 120.8955 57.9686 41.5543 179.3155 197 M 4.0294 8.3955 118.0925 58.5030 32.1237 177.9360 198 A 4.0091 8.2865 121.2183 55.3620 18.5347 179.8141 199 K 3.9715 8.2071 116.6040 59.5148 31.8968 179.4865 200 A 4.1627 8.0638 120.1530 55.1465 18.4396 179.4440 201 I 3.8736 8.1142 118.5491 64.8149 37.2739 178.3566 202 D 4.4314 8.4883 119.6868 57.4420 40.7435 178.7947 203 A 4.2198 8.4168 121.4044 55.0959 18.1506 179.8576 204 G 3.7652 7.9458 103.2837 47.0337 0.0000 174.3174 205 F 4.2958 7.8526 117.7383 57.0008 39.3705 175.6989 206 I 3.9546 7.7162 123.8400 60.5728 36.8779 175.6603 207 R 3.8648 8.5475 126.5417 57.7036 30.5186 175.5923 208 D 4.4925 8.9414 122.5451 55.5588 38.7201 175.7233 209 R 3.8931 7.8143 121.6748 59.8340 29.9938 178.5362 210 L 4.0391 7.8778 118.0925 57.6502 41.5633 179.0687 211 D 4.3745 8.0456 118.6017 57.3946 40.7710 178.6140 212 L 4.0139 8.1960 119.6435 57.7422 41.6208 179.5533 213 L 4.0175 8.3136 119.3679 57.5631 41.3657 179.5188 214 K 3.9597 8.1667 119.5880 59.8220 32.1057 178.9723 215 T 3.9686 8.1962 116.2895 66.8520 68.2872 176.2164 216 D 4.3823 8.4342 120.9981 57.4398 40.8423 178.8639 217 R 4.0061 8.0265 118.8726 59.3258 30.0283 178.9270 218 G 3.5608 7.8033 104.1890 47.7908 0.0000 175.8695 219 V 3.6140 7.8830 119.8234 65.6325 31.6309 177.5539 220 A 4.2145 8.3433 118.8483 52.3334 19.3878 176.9971 221 S 3.6601 7.9591 113.1082 59.5603 60.6891 171.9323 222 I 4.2659 7.6798 120.0467 60.8617 38.1363 177.0389 223 L 4.5449 8.3477 126.9356 53.2940 42.8558 177.0421 224 S 4.4766 8.5077 119.4167 57.5284 63.7913 172.3578 225 P 4.5103 0.0000 0.0000 63.0216 32.0492 175.8492 226 V 4.6466 7.5980 111.4506 60.8810 35.4301 173.8247 227 Y 4.4992 8.6987 117.7751 58.2287 37.8403 176.1954 228 L 4.0051 7.6736 120.5543 55.1513 42.0732 177.1932 229 K 4.4127 8.6882 120.3080 56.4955 33.0731 176.5331 230 A 4.2871 7.7084 126.7896 52.2798 19.2835 175.6707 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 3 Q 8.33 4.21 0.00 2.03 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.00 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 4 G 7.70 3.45 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 0.00 5 L 8.68 4.94 0.00 1.69 1.49 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 6 Y 9.39 5.36 0.00 3.10 2.91 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 7 V 8.88 4.90 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 0.88 0.00 0.00 0.36 0.00 0.00 8 G 9.72 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 0.00 0.00 0.00 0.00 9 G 6.02 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 F 7.89 4.62 0.00 3.37 3.18 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 11 V 8.31 4.22 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 0.54 0.00 0.00 0.92 0.00 0.00 12 D 7.80 4.73 0.00 2.80 2.50 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 13 V 8.22 4.50 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 0.59 0.00 0.00 0.75 0.00 0.00 14 V 8.77 3.81 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 0.94 0.00 0.00 15 S 7.62 4.75 0.00 3.98 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 16 C 7.20 4.80 0.00 3.11 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 17 P 0.00 4.31 0.00 2.03 1.98 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 18 K 8.23 4.65 0.00 1.58 1.70 0.00 1.96 0.00 0.00 1.71 0.00 0.00 3.25 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.51 1.53 7.81 19 L 8.05 4.59 0.00 1.52 1.60 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.06 4.24 0.00 2.09 1.89 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 2.40 2.30 0.00 21 Q 8.92 4.03 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.91 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 22 E 8.13 3.95 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 23 L 7.59 4.33 0.00 1.89 1.79 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 7.72 4.33 0.00 2.83 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 25 L 7.83 4.20 0.00 1.52 1.50 0.96 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 26 D 7.84 3.90 0.00 2.46 2.44 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 27 P 0.00 4.51 0.00 2.32 2.31 0.00 3.77 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.07 0.00 *28 D 8.31 4.50 0.00 2.82 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 29 Q 8.16 4.58 0.00 1.98 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.97 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 30 V 7.72 4.01 2.35 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 0.90 0.00 0.00 1.03 0.00 0.00 31 T 7.43 3.91 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 32 D 8.08 4.30 0.00 2.28 2.27 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 33 Y 7.96 4.67 0.00 3.01 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 59 F 9.30 5.14 0.00 2.97 2.92 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 60 Q 8.86 4.73 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 61 V 8.93 4.60 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 1.23 0.00 0.00 62 S 9.06 4.12 0.00 3.84 3.93 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 0.00 0.00 0.00 0.00 63 H 8.42 4.43 0.00 3.21 3.26 0.00 6.04 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 6.63 4.02 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 0.00 0.00 0.00 65 I 8.18 4.95 1.90 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 1.15 0.79 0.77 0.00 0.00 66 F 9.31 4.61 0.00 2.66 2.77 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 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 F 7.69 3.44 0.00 1.73 2.79 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 0.00 0.00 0.00 77 L 7.97 3.70 0.00 1.78 1.61 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.28 3.86 0.00 2.14 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 2.29 2.46 0.00 79 L 7.85 3.85 0.00 1.84 1.78 0.86 1.17 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 80 A 7.80 3.84 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.09 3.93 0.00 3.86 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 82 R 7.87 4.02 0.00 1.99 1.89 0.00 3.14 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 83 L 7.97 4.04 0.00 1.61 1.45 -0.13 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 84 A 7.92 3.99 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.89 4.45 0.00 2.88 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 86 T 7.07 4.47 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 1.18 0.00 0.00 87 S 8.12 4.21 0.00 3.91 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 88 H 8.82 4.28 0.00 3.13 3.34 0.00 5.77 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 7.81 3.77 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.97 0.00 0.00 90 A 7.93 4.06 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 91 R 7.63 4.14 0.00 1.82 1.98 0.00 3.15 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.86 0.00 92 A 7.13 4.19 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 93 P 0.00 4.35 0.00 2.20 2.12 0.00 3.74 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 94 V 8.10 4.30 2.12 0.00 0.00 0.00 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 1.20 0.00 0.00 95 K 8.64 3.77 0.00 1.74 1.72 0.00 1.91 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.48 7.81 96 N 9.07 4.44 0.00 2.91 2.95 0.00 0.00 6.92 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 97 L 7.40 4.81 0.00 1.23 1.27 0.18 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 98 P 0.00 4.55 0.00 2.21 2.07 0.00 3.80 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 2.07 1.99 0.00 99 K 8.46 4.35 0.00 2.05 1.81 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.03 7.81 100 E 8.88 4.47 0.00 1.20 1.52 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 109 W 8.57 4.72 0.00 3.21 3.28 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 0.00 110 L 8.07 4.94 0.00 1.45 1.42 0.05 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 111 P 0.00 4.63 0.00 2.23 2.62 0.00 3.94 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 2.33 2.08 0.00 112 G 8.59 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.86 5.27 0.00 1.51 1.49 0.72 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 114 S 8.86 4.51 0.00 3.85 3.66 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 0.00 0.00 0.00 0.00 115 L 8.72 4.54 0.00 1.67 1.57 0.95 1.06 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 0.00 116 S 8.83 4.87 0.00 3.69 3.23 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 0.00 117 S 8.37 5.04 0.00 3.79 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 0.00 118 I 8.18 3.79 1.68 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.61 0.64 0.00 0.00 119 H 8.86 4.03 0.00 3.17 3.13 0.00 5.74 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.26 0.00 2.23 2.10 0.00 3.18 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.13 0.00 121 R 8.28 3.97 0.00 1.92 2.12 0.00 2.94 0.00 0.00 3.00 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 122 E 8.07 4.38 0.00 2.09 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 2.29 2.24 0.00 123 L 7.40 4.21 0.00 1.68 1.61 0.88 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 124 S 7.44 4.73 0.00 3.97 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 0.00 125 Q 8.19 4.19 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.64 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 *127 P 0.00 4.18 0.00 2.17 2.06 0.00 3.72 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.96 0.00 128 S 8.46 4.39 0.00 3.83 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 0.00 129 G 7.46 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 P 0.00 4.29 0.00 2.17 2.09 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 131 V 8.23 3.30 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 -0.23 0.00 0.00 -0.35 0.00 0.00 132 F 7.78 5.01 0.00 2.94 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 0.00 133 Q 9.24 4.48 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.61 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 134 H 7.60 4.85 0.00 3.43 3.37 0.00 5.64 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 V 8.54 4.78 2.02 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 0.89 0.00 0.00 0.85 0.00 0.00 136 S 9.08 5.28 0.00 3.48 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 8.54 4.82 0.00 1.38 1.50 0.82 0.94 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 0.00 138 C 8.84 4.87 0.00 2.93 2.93 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 0.00 0.00 0.00 0.00 139 A 8.47 4.03 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 0.00 140 L 7.34 4.27 0.00 1.58 1.54 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.63 3.98 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 0.00 0.00 0.00 142 R 8.49 4.11 0.00 1.84 2.02 0.00 3.22 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 143 R 7.72 4.45 0.00 1.83 1.88 0.00 3.44 0.00 0.00 3.43 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 144 R 8.36 4.27 0.00 1.81 1.87 0.00 3.39 0.00 0.00 3.55 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 145 G 9.45 4.02 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 0.00 0.00 0.00 146 T 7.40 5.30 4.42 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 147 V 8.01 4.28 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 0.75 0.00 0.00 1.04 0.00 0.00 148 A 8.91 4.41 0.77 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 0.00 0.00 0.00 0.00 0.00 149 V 8.74 4.48 2.29 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 1.04 0.00 0.00 0.64 0.00 0.00 150 Y 8.91 5.21 0.00 2.95 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 0.00 151 G 9.23 4.51 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 0.00 0.00 0.00 152 H 8.91 5.29 0.00 3.19 3.41 0.00 5.70 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.01 4.84 0.00 2.72 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 0.00 154 A 8.16 3.75 0.64 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 0.00 0.00 155 E 8.19 3.86 0.00 2.14 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 0.00 2.38 1.94 0.00 156 W 8.33 4.21 0.00 3.49 3.51 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 0.00 157 V 8.26 3.64 2.36 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 1.19 0.00 0.00 1.34 0.00 0.00 158 V 8.04 3.87 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 0.68 0.00 0.00 1.06 0.00 0.00 159 S 8.26 4.23 0.00 4.03 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 0.00 160 R 7.60 3.93 0.00 1.28 1.40 0.00 2.21 0.00 0.00 2.77 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.84 0.00 161 F 8.03 4.79 0.00 3.11 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 0.00 162 S 8.68 4.30 0.00 3.94 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 0.00 163 S 8.13 4.07 0.00 3.74 3.68 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 0.00 0.00 0.00 0.00 164 V 7.47 4.21 2.02 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 0.46 0.00 0.00 0.52 0.00 0.00 165 S 8.80 4.38 0.00 4.06 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 K 8.46 3.82 0.00 1.81 1.82 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.47 7.81 167 S 7.92 4.02 0.00 3.90 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 0.00 168 E 8.23 3.85 0.00 2.15 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 0.00 169 R 8.28 3.63 0.00 1.74 1.99 0.00 3.05 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 170 A 7.93 3.91 1.35 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 0.00 0.00 0.00 171 H 8.04 3.99 0.00 3.23 3.38 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 I 7.50 2.86 1.62 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 -0.18 0.65 0.00 0.00 173 L 8.05 3.92 0.00 1.65 1.65 0.87 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 174 Q 7.94 3.90 0.00 2.15 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 175 H 7.94 4.28 0.00 3.29 3.60 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 V 8.02 3.67 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.07 0.00 0.00 177 S 8.44 4.20 0.00 4.01 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 0.00 178 S 7.66 4.53 0.00 3.92 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 0.00 179 C 7.44 4.35 0.00 3.17 2.93 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 0.00 0.00 0.00 0.00 180 R 8.36 4.20 0.00 1.88 1.88 0.00 3.13 0.00 0.00 3.51 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.66 0.00 181 L 8.65 4.11 0.00 1.72 1.73 0.72 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 182 E 8.12 4.07 0.00 1.94 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 0.00 2.33 2.41 0.00 183 D 7.79 4.51 0.00 2.84 2.68 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 0.00 0.00 0.00 0.00 184 L 7.44 4.02 0.00 1.80 1.48 1.05 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 185 S 7.90 4.39 0.00 4.04 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 0.00 186 T 8.36 4.17 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 1.28 0.00 0.00 187 P 0.00 4.37 0.00 1.98 1.58 0.00 3.73 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.87 0.00 188 N 9.29 4.67 0.00 2.81 2.83 0.00 0.00 6.77 7.27 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 0.00 189 F 8.58 5.02 0.00 3.24 2.96 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 0.00 0.00 0.00 190 V 7.86 4.13 1.92 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 0.72 0.00 0.00 0.88 0.00 0.00 191 S 8.51 3.69 0.00 4.11 3.82 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 0.00 192 P 0.00 4.61 0.00 2.28 2.13 0.00 3.70 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.91 0.00 193 L 7.96 4.04 0.00 1.80 1.71 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 194 E 8.12 3.98 0.00 2.05 1.99 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 2.40 2.40 0.00 195 T 7.88 3.88 4.40 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 1.23 0.00 0.00 196 L 8.16 4.17 0.00 2.00 2.04 1.30 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 197 M 8.40 4.03 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 198 A 8.29 4.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 K 8.21 3.97 0.00 2.11 2.03 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.73 7.81 200 A 8.06 4.16 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.11 3.87 2.06 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 1.55 0.79 0.93 0.00 0.00 202 D 8.49 4.43 0.00 2.89 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 A 8.42 4.22 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 0.00 204 G 7.95 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 205 F 7.85 4.30 0.00 3.08 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 0.00 206 I 7.72 3.95 2.01 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 1.24 1.04 0.95 0.00 0.00 207 R 8.55 3.86 0.00 1.79 1.86 0.00 3.39 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 208 D 8.94 4.49 0.00 2.92 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.81 3.89 0.00 1.95 1.94 0.00 3.14 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 210 L 7.88 4.04 0.00 1.74 1.72 0.93 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 211 D 8.05 4.37 0.00 2.86 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 0.00 212 L 8.20 4.01 0.00 1.85 1.74 0.94 0.73 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 0.00 213 L 8.31 4.02 0.00 1.85 1.77 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 214 K 8.17 3.96 0.00 1.93 1.97 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 215 T 8.20 3.97 4.40 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 1.22 0.00 0.00 216 D 8.43 4.38 0.00 2.90 2.79 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 0.00 0.00 0.00 217 R 8.03 4.01 0.00 1.90 2.14 0.00 3.21 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 218 G 7.80 3.56 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 0.00 219 V 7.88 3.61 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 0.82 0.00 0.00 1.01 0.00 0.00 220 A 8.34 4.21 1.69 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 0.00 0.00 221 S 7.96 3.66 0.00 4.07 3.90 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 0.00 222 I 7.68 4.27 1.73 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.32 0.62 0.00 0.00 223 L 8.35 4.54 0.00 1.29 1.48 0.84 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 224 S 8.51 4.48 0.00 3.72 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 0.00 225 P 0.00 4.51 0.00 2.16 2.03 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.03 0.00 226 V 7.60 4.65 2.06 0.00 0.00 0.00 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 0.86 0.00 0.00 227 Y 8.70 4.50 0.00 3.21 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.67 4.01 0.00 1.59 1.77 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 229 K 8.69 4.41 0.00 1.84 1.92 0.00 1.78 0.00 0.00 1.79 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.68 1.48 7.81 230 A 7.71 4.29 1.22 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.