NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2840 8.2549 119.7074 56.1679 31.4340 173.7541 3 R 4.5997 7.9908 117.9120 53.6082 33.6517 173.9122 4 T 4.0917 8.6102 115.2301 64.3686 69.6597 174.0648 5 V 3.8199 8.6496 125.8443 62.7612 31.9059 174.5281 6 R 4.2968 9.0110 125.9912 57.7907 32.6864 174.5887 7 Y 5.1095 8.7563 117.1004 56.6289 40.0368 174.6963 8 I 4.9349 8.6313 124.4295 59.3535 40.8657 174.3348 9 L 4.8415 8.9067 130.2458 54.6437 43.1877 175.4801 10 A 5.7873 9.3561 126.8816 51.1755 23.7587 174.2370 11 T 4.7243 8.1937 112.4235 62.1584 71.1534 171.3315 12 S 4.9705 8.5791 116.7426 56.2043 66.9249 173.2568 13 N 4.4616 8.1508 116.3826 52.9326 39.2708 172.6638 14 P 4.3380 0.0000 0.0000 63.6830 30.6737 179.3186 *16 G 3.8369 9.1876 117.2682 45.6898 0.0000 174.3204 17 D 4.5848 7.9869 120.1339 53.8842 39.2023 176.0389 18 L 3.9976 8.0732 125.3932 56.7128 41.9188 178.6214 19 E 4.0439 8.1517 118.3915 59.4004 29.6298 178.7639 20 A 4.0097 8.9547 121.1289 55.0132 18.4119 179.3341 21 L 3.8259 7.7874 118.6823 58.3698 42.0967 178.9862 22 E 3.9247 8.1465 118.3750 59.4060 29.3167 179.6107 23 K 3.9118 8.0748 118.3333 59.3231 31.9875 178.8141 24 F 3.8458 8.5858 121.2619 61.5409 39.0125 177.2759 25 V 3.3779 8.0988 116.6273 65.8505 31.3729 177.4464 26 K 3.9574 8.0542 118.6417 59.5362 31.7923 178.4089 27 L 3.9885 8.3853 119.1568 58.3774 41.2922 179.8546 28 A 3.5905 7.2526 121.0160 54.5758 19.1542 177.3624 29 P 4.2531 0.0000 0.0000 65.9019 31.4939 178.9015 30 D 4.4090 7.5028 115.3001 56.8292 40.8150 177.9169 31 T 3.8956 7.4051 108.5826 62.4538 69.0950 175.7998 32 G 3.6850 7.8153 109.8067 45.4811 0.0000 173.4430 33 A 4.1409 7.4691 121.6898 52.6017 18.6893 178.1489 34 D 4.7334 9.0185 121.3090 55.5669 42.1943 176.0110 35 A 4.3454 7.3132 118.3426 51.1690 22.7552 174.8049 36 I 5.8069 8.9106 118.6759 58.6018 41.8100 175.0027 37 A 5.3903 8.8305 125.9846 50.2663 22.4200 174.5668 38 L 5.2751 9.4482 124.3870 53.3772 45.8602 175.1399 39 I 4.8299 8.3685 126.1645 59.3660 40.2013 176.3376 40 G 3.9793 8.3609 113.2864 45.7917 0.0000 172.4807 41 N 4.7371 8.6233 116.9313 53.3846 39.0121 176.7044 42 L 3.8203 8.3708 121.8193 55.6898 42.2566 175.2144 *44 P 4.2105 0.0000 0.0000 61.7760 32.4399 177.0561 45 K 4.4787 9.1941 119.9082 59.0146 31.9522 178.1043 46 A 4.0535 7.9271 119.1245 54.1159 18.5267 177.4064 47 A 4.2366 7.6059 118.5436 52.2556 19.0189 176.3050 48 K 5.2991 9.4734 118.4153 52.6704 36.2998 177.9695 49 S 4.3279 9.0452 115.6217 62.3986 62.5467 177.3980 50 R 3.9863 8.2364 117.7886 59.5849 28.8465 178.3692 51 D 4.2928 8.4110 119.5857 57.5234 40.9440 178.3243 52 Y 3.7896 8.0180 116.5196 60.6053 37.8261 178.0022 53 A 4.2012 8.5002 122.0217 55.4133 18.5132 179.6050 54 A 3.9296 8.2346 119.1623 55.0826 18.4431 179.3764 55 F 3.7306 8.4616 119.6248 61.7249 39.3376 177.5600 56 F 4.5373 8.7448 117.4435 60.2864 38.4200 177.7156 57 R 3.8987 8.0655 118.0384 59.4716 30.3377 178.2734 58 I 3.7661 7.7482 119.4810 64.4604 37.2374 178.2445 59 L 3.9682 7.7638 121.1867 57.9976 41.3388 178.9830 60 S 4.1662 8.3553 114.0938 60.8839 62.5708 176.1831 61 E 4.0303 7.8718 121.0502 58.8053 29.1488 178.2399 62 A 4.0267 7.6374 120.4711 53.6853 18.5543 177.4302 63 H 4.0132 7.8070 110.9967 56.9480 26.9591 174.6090 64 L 4.8176 7.6129 115.7837 51.8054 45.6718 174.8577 65 P 4.4906 0.0000 0.0000 63.6059 32.1216 175.5469 66 T 5.4298 9.2901 120.7244 61.8643 72.3273 173.3148 67 A 5.4950 9.8934 127.0289 49.3228 22.5954 174.4673 68 Y 6.1685 7.7837 117.9061 55.0569 42.4355 174.0598 69 V 4.9615 8.3606 118.2957 59.5235 35.2442 173.0742 70 P 4.5197 0.0000 0.0000 62.4596 33.5052 174.8741 71 G 4.0803 9.0409 107.9501 43.6015 0.0000 172.9202 72 P 4.4027 0.0000 0.0000 65.1772 31.4836 178.2810 73 Q 4.2705 9.0820 116.0936 56.2822 29.6795 175.6330 74 D 4.9890 7.8686 119.1766 53.4578 39.7767 175.6258 75 A 4.8193 7.2192 120.7872 49.3526 22.4935 174.9864 76 P 4.5888 0.0000 0.0000 62.0583 32.3942 177.5952 77 I 3.4636 8.1651 121.5382 64.3230 37.6688 178.5449 78 W 4.4406 7.6181 118.7339 59.3930 28.8585 178.2922 79 E 4.0137 8.0773 118.9159 59.3531 28.8644 178.5223 80 Y 3.3383 7.5106 118.9834 60.4270 38.8919 177.5256 81 L 3.7330 8.2815 121.6663 58.1218 42.0603 179.0006 82 R 3.9041 8.3950 118.9867 59.5947 30.0967 178.4315 83 E 4.0460 8.3153 118.1777 58.9531 29.3814 179.2300 84 A 2.8819 8.1332 121.1991 54.7185 18.2939 179.2153 85 A 3.8420 8.0663 119.6488 55.5652 18.1874 179.5049 86 N 4.2641 8.1389 113.8883 56.5891 39.0843 177.7593 87 V 3.8306 7.6814 120.3969 64.7234 31.4411 178.2530 88 E 4.3213 8.0321 119.5472 57.9814 29.2375 178.2650 89 L 4.0858 7.3694 118.8891 57.7687 41.6780 178.7432 90 V 4.1146 7.6193 107.4350 61.7266 32.5766 175.8863 91 H 4.9899 7.6871 116.9077 53.2804 28.4654 172.7574 92 P 4.3766 0.0000 0.0000 65.0705 32.4273 177.8121 93 E 4.1473 7.8692 119.3907 55.6219 28.8914 176.9797 *95 R 3.9697 7.6235 118.3780 56.5361 31.2175 173.3717 96 N 4.1952 8.5005 124.9349 53.4740 39.4845 174.8417 97 V 4.0177 8.3003 117.9417 61.0569 32.1111 174.6406 98 H 4.3973 8.0709 120.3419 57.6152 29.2332 174.9615 99 E 3.7062 9.1494 126.0463 56.8024 27.7708 174.5912 100 T 4.4303 7.4635 114.0295 61.6530 69.5580 171.6512 101 F 4.7865 7.6475 113.5737 57.0516 40.8719 172.8598 102 T 4.1501 8.3543 111.9430 61.2058 71.0848 171.6387 103 F 5.4272 8.7032 123.9881 55.6779 41.1602 175.1838 104 W 5.3170 9.2880 123.2779 54.5247 32.1873 175.6960 105 R 4.1942 8.9420 122.6505 56.9176 29.7057 176.5281 106 G 4.3984 8.2400 124.1471 46.0441 0.0000 171.1356 107 P 5.0431 0.0000 0.0000 61.3717 33.1621 174.6562 108 Y 4.9420 8.9677 116.2246 56.3814 42.4073 174.2301 109 L 4.5182 8.9745 126.6307 53.8513 43.4551 175.0296 110 V 4.5757 8.2971 127.6449 61.4721 33.3715 174.5265 111 A 4.7088 8.0837 127.4252 51.9268 23.2194 174.8334 112 G 3.8415 7.8860 104.9665 45.6121 0.0000 172.7479 113 V 4.4420 8.4212 119.6915 61.5747 33.9727 174.8710 114 G 3.7586 8.7975 118.5946 45.0889 0.0000 171.8750 115 G 3.7469 8.2526 109.8276 44.3396 0.0000 172.1006 116 E 4.2086 8.5068 120.1125 55.6668 30.6990 175.9119 117 I 4.7902 8.8133 129.1873 60.1096 37.7150 175.2411 118 A 4.4810 8.6818 129.7994 50.8118 20.3801 177.3803 119 D 4.4631 8.9694 120.6092 57.1550 40.8605 176.2106 120 E 4.2940 7.7443 116.0687 57.0064 31.0477 174.8592 121 G 4.0082 8.9589 104.6081 45.3608 0.0000 172.1948 122 E 4.5067 8.1882 117.6094 55.1443 30.5013 175.4100 123 P 4.6365 0.0000 0.0000 62.6010 32.6740 175.5033 124 E 4.6731 8.9758 123.1164 54.7671 33.2520 175.5308 125 E 4.7297 8.6448 121.2235 55.1813 32.4626 175.9944 126 H 4.5257 8.9720 115.9163 57.5684 30.1816 175.9555 127 E 4.0974 8.3541 115.2048 57.3867 29.8546 175.7509 128 A 4.0640 6.9830 120.2833 51.8138 21.5744 174.5900 129 L 4.5964 7.9750 119.7907 53.1980 43.2828 176.1440 130 R 4.6693 8.4721 124.9193 54.3968 33.4964 173.4429 131 Y 5.0646 8.9797 123.9299 55.2404 41.3588 173.9104 132 P 4.6928 0.0000 0.0000 62.1236 32.6173 176.8690 133 A 3.9775 8.8181 122.7027 55.4933 18.1950 180.3304 134 W 4.2946 8.3235 114.3663 59.7773 27.9744 178.6211 135 V 3.0296 6.8918 118.8263 65.4101 30.7303 177.8372 136 A 3.8286 7.6743 120.0575 55.1676 18.3738 179.0343 137 E 3.9416 8.4362 117.9669 59.5980 29.4801 178.4064 138 Y 4.1707 8.0325 118.8009 60.6984 39.0234 177.8889 139 R 3.9453 8.0986 119.0798 59.1452 30.2304 178.6995 140 L 3.7798 7.6394 117.7102 56.1307 41.7319 179.1332 141 K 4.0185 7.8077 118.4869 59.4185 32.3988 178.8984 142 A 3.9404 7.3302 121.9537 54.9411 18.0981 179.4692 143 L 3.6991 7.6023 117.5328 57.3604 41.3250 179.4443 144 W 4.6867 7.4285 117.7342 59.6465 28.9718 177.8457 145 E 4.2336 7.9987 117.3736 57.3040 29.0890 176.8134 146 L 4.6308 7.5940 119.7938 53.2925 42.8091 176.0693 147 K 4.5331 8.8080 123.0069 56.2488 33.8305 175.9583 148 D 4.3713 8.5715 120.8269 55.9799 38.4637 173.2812 149 Y 4.7821 7.8182 114.1847 55.3566 41.1273 174.1966 150 P 4.6354 0.0000 0.0000 62.6464 33.1813 175.1832 151 K 5.1728 8.5837 121.3158 54.9595 35.3822 175.2623 152 I 4.8932 8.5114 123.0979 59.7729 40.4580 174.3778 153 F 5.9611 8.7925 126.1164 54.9673 41.7389 174.8103 154 L 5.0004 7.8004 121.8859 53.0171 44.3889 175.5138 155 F 5.4799 9.0971 121.4254 55.3781 43.5767 174.8543 156 H 4.4327 8.9777 119.2240 58.7625 31.4167 175.9403 157 T 4.2390 7.6174 113.8340 62.4295 69.3610 171.2832 *159 P 4.4226 0.0000 0.0000 63.3037 32.4622 176.0714 160 Y 4.2242 8.7657 123.9274 58.5606 39.7264 175.0742 161 H 4.0924 7.8193 120.3445 55.5372 33.7276 174.7030 162 K 4.2579 8.4073 125.7293 58.7337 32.0301 177.8985 163 G 4.1134 7.8541 104.4000 45.1423 0.0000 173.4171 164 L 4.3633 7.5713 119.9535 55.6509 45.0708 175.8263 165 N 4.1435 8.3035 113.7062 53.2312 41.2892 173.5216 166 E 3.6516 8.2372 126.0891 56.4268 29.7366 177.2722 167 Q 4.5525 8.5825 115.9266 56.0833 29.8709 176.0046 168 G 3.7938 7.6518 106.8096 44.8985 0.0000 172.9991 169 S 4.2887 8.3897 114.3221 58.0901 62.9996 174.7654 170 H 4.3596 8.8842 125.3155 58.8299 28.5149 177.6355 171 E 4.0424 8.1490 120.2044 59.4204 29.3979 179.3766 172 V 3.3603 7.9260 118.0786 65.7407 31.4621 177.8020 173 A 4.0846 8.0621 120.1478 55.5128 18.2158 178.8839 174 H 4.1960 8.6997 117.0774 59.4615 30.0824 177.4500 175 L 4.0661 7.9437 120.7697 57.9554 41.4286 179.6912 176 I 3.9881 8.0226 119.7249 64.4325 36.8931 178.7061 177 K 4.1214 8.3553 118.6060 59.4408 31.8548 179.5077 178 T 4.1863 7.9509 115.5799 67.0173 68.6858 176.2030 179 H 4.6080 8.3013 114.8172 55.4833 30.0347 174.8855 180 N 4.2470 8.3279 118.0924 53.4489 36.5842 172.7928 181 P 4.1363 0.0000 0.0000 62.3750 32.6978 177.4390 182 L 4.1148 8.6347 122.9551 57.7942 43.2842 176.5382 183 L 5.2302 7.7335 119.0814 53.2813 46.1777 175.2389 184 V 4.7639 8.8078 124.7779 61.2558 34.5995 173.8490 185 L 5.1050 8.9069 128.6553 53.3642 43.6316 176.2200 186 V 5.7661 8.5140 115.2593 58.1515 35.9227 175.1657 187 A 4.1576 8.1980 123.4389 51.4857 18.7921 177.7953 188 G 4.0249 7.7511 110.6446 45.2170 0.0000 173.0937 189 K 4.1586 8.6069 121.7124 56.3538 33.0532 173.8900 190 G 3.6438 9.3756 117.9488 44.7060 0.0000 173.0716 191 Q 4.2645 8.5364 124.4063 56.4396 29.3408 176.7157 192 K 4.8811 8.6972 122.4889 55.0943 37.5621 174.9375 193 H 4.9749 8.1032 111.5264 54.1880 30.6022 171.6256 194 E 4.5627 8.8771 125.9254 55.6821 32.6290 177.6572 *196 L 4.3157 8.7999 122.4740 55.0943 42.4248 176.1740 197 G 3.8362 8.4680 117.8484 46.7200 0.0000 172.4629 198 A 4.4645 8.7548 128.6613 52.3054 18.7532 176.5717 199 S 5.1123 7.8336 114.1215 56.5058 64.8120 174.0255 200 W 4.6699 8.8599 135.0000 56.9452 31.5133 175.1401 201 V 4.4938 8.9534 129.6279 61.5665 32.4808 174.5702 202 V 4.5255 8.4439 128.8127 60.9537 34.3914 174.5825 203 V 4.3642 8.3296 127.9537 60.5129 32.1099 174.5112 204 P 4.2007 0.0000 0.0000 64.2092 31.7987 175.8602 205 G 3.9885 7.7522 104.3184 43.6970 0.0000 171.9015 206 D 5.0201 8.7244 119.1300 52.0281 42.1405 176.8870 207 L 4.2071 8.8896 130.2416 57.5572 42.2529 178.2545 208 S 4.4072 8.9604 111.8042 59.4972 62.6956 174.2240 209 E 4.5230 8.0940 119.9572 55.8347 30.5829 177.4355 210 G 4.0050 8.5609 107.7685 45.6730 0.0000 173.6904 211 E 4.8986 7.4853 118.9830 56.4315 30.7239 175.3587 212 Y 5.0170 7.8828 118.6164 56.9642 41.9912 172.9752 213 S 5.0486 9.4236 115.2010 56.9013 68.2859 173.1443 214 L 5.2389 9.3031 124.1283 53.6262 44.2960 175.1596 215 L 5.1466 9.0300 127.2281 53.7182 44.1921 175.7363 216 D 4.7447 9.4137 123.5370 52.6140 41.5994 176.5414 217 L 4.1294 8.7569 129.0816 58.2592 42.3498 178.5478 218 R 3.9159 8.1013 116.3770 58.9934 29.9415 176.7815 219 A 4.2783 8.1746 118.3198 51.2912 19.4323 177.3015 220 R 2.5100 7.4002 113.4955 56.1539 28.4258 176.0139 221 K 4.4725 7.0298 116.0521 55.0226 34.3274 175.7198 222 L 5.0794 8.6483 125.7250 53.6153 44.1566 175.3462 223 E 4.6906 9.2073 127.9395 55.1453 30.9262 176.2918 224 T 4.5662 8.3984 115.3722 61.0383 71.1679 173.4096 225 G 3.7010 7.6167 107.7600 45.8969 0.0000 171.6027 226 N 5.7152 8.5342 117.3729 52.1241 41.6928 174.2990 227 V 4.1958 9.2883 123.3351 62.8879 32.9550 176.3768 228 R 4.1121 9.7648 125.3268 56.6932 29.9350 176.1347 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 2 R 8.25 4.28 0.00 1.82 1.92 0.00 3.09 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 3 R 7.99 4.60 0.00 1.85 1.87 0.00 3.25 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.73 0.00 4 T 8.61 4.09 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 1.41 0.00 0.00 5 V 8.65 3.82 2.14 0.00 0.00 0.00 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 0.73 0.00 0.00 6 R 9.01 4.30 0.00 1.75 1.71 0.00 3.05 0.00 0.00 3.12 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.19 0.00 7 Y 8.76 5.11 0.00 3.11 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 8 I 8.63 4.93 1.96 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.82 1.08 0.00 0.00 9 L 8.91 4.84 0.00 1.71 1.46 0.95 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 10 A 9.36 5.79 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 11 T 8.19 4.72 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 0.18 0.00 0.00 12 S 8.58 4.97 0.00 3.90 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 13 N 8.15 4.46 0.00 2.78 2.79 0.00 0.00 7.18 7.24 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 14 P 0.00 4.34 0.00 2.38 1.66 0.00 3.87 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.04 0.00 *16 G 9.19 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 17 D 7.99 4.58 0.00 2.72 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 18 L 8.07 4.00 0.00 1.69 1.63 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.15 4.04 0.00 2.17 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 2.38 2.35 0.00 20 A 8.95 4.01 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.79 3.83 0.00 1.58 1.64 0.63 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.15 3.92 0.00 2.19 1.95 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 2.26 2.69 0.00 23 K 8.07 3.91 0.00 1.98 1.84 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.64 7.81 24 F 8.59 3.85 0.00 3.01 3.22 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 25 V 8.10 3.38 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 0.81 0.00 0.00 0.97 0.00 0.00 26 K 8.05 3.96 0.00 1.89 1.95 0.00 1.82 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.44 7.81 27 L 8.39 3.99 0.00 1.46 1.49 0.53 1.02 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 28 A 7.25 3.59 1.13 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 0.00 0.00 29 P 0.00 4.25 0.00 2.12 2.07 0.00 3.71 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 30 D 7.50 4.41 0.00 2.64 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 31 T 7.41 3.90 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 1.21 0.00 0.00 32 G 7.82 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 0.00 0.00 0.00 33 A 7.47 4.14 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 34 D 9.02 4.73 0.00 2.59 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.31 4.35 0.21 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 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0.00 62 A 7.64 4.03 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 63 H 7.81 4.01 0.00 3.29 3.40 0.00 5.80 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 7.61 4.82 0.00 1.51 1.39 0.83 1.09 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 65 P 0.00 4.49 0.00 1.13 1.45 0.00 3.51 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.98 0.00 66 T 9.29 5.43 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 67 A 9.89 5.49 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 7.78 6.17 0.00 3.24 3.31 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 69 V 8.36 4.96 2.10 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 0.80 0.00 0.00 0.95 0.00 0.00 70 P 0.00 4.52 0.00 1.50 0.49 0.00 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0.00 7.13 7.79 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 97 V 8.30 4.02 1.86 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 0.43 0.00 0.00 0.83 0.00 0.00 98 H 8.07 4.40 0.00 3.11 3.46 0.00 6.03 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 99 E 9.15 3.71 0.00 1.95 1.91 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 1.73 1.47 0.00 100 T 7.46 4.43 4.12 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 1.03 0.00 0.00 101 F 7.65 4.79 0.00 2.80 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 0.00 102 T 8.35 4.15 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 0.90 0.00 0.00 103 F 8.70 5.43 0.00 2.99 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 0.00 104 W 9.29 5.32 0.00 3.41 3.11 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 0.00 113 V 8.42 4.44 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 0.82 0.00 0.00 0.81 0.00 0.00 114 G 8.80 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 0.00 115 G 8.25 3.75 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 0.00 0.00 0.00 116 E 8.51 4.21 0.00 1.98 1.84 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 2.25 2.26 0.00 117 I 8.81 4.79 1.82 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 1.19 0.77 0.85 0.00 0.00 118 A 8.68 4.48 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 0.00 119 D 8.97 4.46 0.00 2.57 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 0.00 120 E 7.74 4.29 0.00 2.08 1.91 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 2.20 2.33 0.00 121 G 8.96 4.01 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 0.00 0.00 0.00 122 E 8.19 4.51 0.00 1.89 1.93 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 2.34 2.32 0.00 123 P 0.00 4.64 0.00 1.95 1.97 0.00 3.69 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 2.11 2.06 0.00 124 E 8.98 4.67 0.00 1.91 1.55 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 2.12 2.43 0.00 125 E 8.64 4.73 0.00 1.78 1.55 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 2.07 2.16 0.00 126 H 8.97 4.53 0.00 3.21 3.35 0.00 5.84 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 E 8.35 4.10 0.00 1.93 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 2.30 2.24 0.00 128 A 6.98 4.06 1.16 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 0.00 0.00 129 L 7.98 4.60 0.00 1.36 1.33 0.75 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.47 4.67 0.00 1.58 1.50 0.00 2.96 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.66 0.00 131 Y 8.98 5.06 0.00 2.87 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 P 0.00 4.69 0.00 2.21 2.44 0.00 3.56 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.97 0.00 133 A 8.82 3.98 1.46 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 0.00 134 W 8.32 4.29 0.00 3.63 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 V 6.89 3.03 1.72 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 0.63 0.00 0.00 -0.85 0.00 0.00 136 A 7.67 3.83 1.29 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 0.00 0.00 0.00 137 E 8.44 3.94 0.00 2.17 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 2.50 2.48 0.00 138 Y 8.03 4.17 0.00 3.30 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 0.00 139 R 8.10 3.95 0.00 1.82 1.78 0.00 3.21 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.52 0.00 140 L 7.64 3.78 0.00 1.45 1.15 0.63 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 141 K 7.81 4.02 0.00 2.20 2.29 0.00 1.38 0.00 0.00 1.66 0.00 0.00 2.46 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.26 1.37 7.81 142 A 7.33 3.94 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 0.00 143 L 7.60 3.70 0.00 1.30 1.44 0.62 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 144 W 7.43 4.69 0.00 3.38 3.15 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 0.00 145 E 8.00 4.23 0.00 2.03 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 2.38 2.49 0.00 146 L 7.59 4.63 0.00 1.70 1.78 0.12 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.81 4.53 0.00 1.73 1.73 0.00 1.97 0.00 0.00 1.81 0.00 0.00 3.28 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.42 7.81 148 D 8.57 4.37 0.00 2.52 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 0.00 149 Y 7.82 4.78 0.00 3.00 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 0.00 150 P 0.00 4.64 0.00 2.22 2.19 0.00 3.71 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 1.96 1.79 0.00 151 K 8.58 5.17 0.00 1.34 1.43 0.00 1.49 0.00 0.00 1.73 0.00 0.00 2.71 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.60 7.81 152 I 8.51 4.89 1.69 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 1.22 1.06 0.79 0.00 0.00 153 F 8.79 5.96 0.00 2.61 1.86 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 0.00 154 L 7.80 5.00 0.00 1.38 1.45 0.92 0.96 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 0.00 155 F 9.10 5.48 0.00 2.97 2.76 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 0.00 156 H 8.98 4.43 0.00 3.23 3.50 0.00 5.67 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 T 7.62 4.24 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 1.18 0.00 0.00 *159 P 0.00 4.42 0.00 2.16 2.12 0.00 3.78 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 1.90 2.02 0.00 160 Y 8.77 4.22 0.00 2.94 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 0.00 161 H 7.82 4.09 0.00 3.16 2.96 0.00 5.66 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 K 8.41 4.26 0.00 1.65 1.81 0.00 1.69 0.00 0.00 2.37 0.00 0.00 3.28 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.47 1.75 7.81 163 G 7.85 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 0.00 0.00 0.00 0.00 164 L 7.57 4.36 0.00 1.41 1.55 0.87 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 165 N 8.30 4.14 0.00 2.59 2.57 0.00 0.00 6.89 7.52 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 0.00 166 E 8.24 3.65 0.00 1.89 1.84 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 2.49 2.19 0.00 167 Q 8.58 4.55 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 168 G 7.65 3.79 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 0.00 0.00 0.00 169 S 8.39 4.29 0.00 3.86 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 0.00 170 H 8.88 4.36 0.00 3.19 3.27 0.00 5.68 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 E 8.15 4.04 0.00 1.98 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 0.00 2.43 2.34 0.00 172 V 7.93 3.36 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 0.55 0.00 0.00 0.67 0.00 0.00 173 A 8.06 4.08 1.53 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 0.00 0.00 174 H 8.70 4.20 0.00 3.26 3.66 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 0.00 175 L 7.94 4.07 0.00 1.90 1.85 0.70 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 176 I 8.02 3.99 2.12 0.00 0.00 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 1.85 1.01 1.01 0.00 0.00 177 K 8.36 4.12 0.00 1.93 1.96 0.00 1.80 0.00 0.00 1.80 0.00 0.00 3.09 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.82 7.81 178 T 7.95 4.19 4.53 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 1.58 0.00 0.00 179 H 8.30 4.61 0.00 3.30 3.27 0.00 5.80 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 N 8.33 4.25 0.00 2.90 2.88 0.00 0.00 6.98 7.62 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 0.00 181 P 0.00 4.14 0.00 1.92 0.72 0.00 3.80 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.49 0.00 182 L 8.63 4.11 0.00 1.89 1.97 1.02 0.63 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 0.00 183 L 7.73 5.23 0.00 1.90 1.45 0.54 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 184 V 8.81 4.76 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 1.26 0.00 0.00 0.98 0.00 0.00 185 L 8.91 5.10 0.00 1.55 1.52 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 186 V 8.51 5.77 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 0.91 0.00 0.00 0.98 0.00 0.00 187 A 8.20 4.16 1.07 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 0.00 0.00 0.00 0.00 0.00 188 G 7.75 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 0.00 189 K 8.61 4.16 0.00 1.75 1.73 0.00 1.91 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.42 7.81 190 G 9.38 3.64 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 0.00 191 Q 8.54 4.26 0.00 1.92 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 192 K 8.70 4.88 0.00 1.65 1.64 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.33 1.64 7.81 193 H 8.10 4.97 0.00 3.01 3.25 0.00 5.66 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 E 8.88 4.56 0.00 2.01 1.12 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 2.34 2.35 0.00 *196 L 8.80 4.32 0.00 1.88 1.71 1.11 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 0.00 197 G 8.47 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 0.00 198 A 8.75 4.46 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 0.00 199 S 7.83 5.11 0.00 3.98 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 0.00 200 W 8.86 4.67 0.00 3.37 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 0.00 201 V 8.95 4.49 2.15 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 0.84 0.00 0.00 1.03 0.00 0.00 202 V 8.44 4.53 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 0.67 0.00 0.00 -0.39 0.00 0.00 203 V 8.33 4.36 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 0.91 0.00 0.00 0.89 0.00 0.00 204 P 0.00 4.20 0.00 2.41 2.17 0.00 3.91 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 1.99 1.97 0.00 205 G 7.75 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 0.00 206 D 8.72 5.02 0.00 2.69 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.89 4.21 0.00 1.56 1.56 0.99 0.38 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 0.00 208 S 8.96 4.41 0.00 3.97 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 8.09 4.52 0.00 2.17 1.93 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 2.21 2.25 0.00 210 G 8.56 4.01 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 0.00 0.00 0.00 211 E 7.49 4.90 0.00 1.93 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 2.33 2.42 0.00 212 Y 7.88 5.02 0.00 3.55 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 0.00 213 S 9.42 5.05 0.00 3.78 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 0.00 214 L 9.30 5.24 0.00 1.83 1.62 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 215 L 9.03 5.15 0.00 1.86 1.88 0.48 1.01 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 0.00 216 D 9.41 4.74 0.00 2.84 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.76 4.13 0.00 1.82 1.65 1.03 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 218 R 8.10 3.92 0.00 1.76 1.99 0.00 3.27 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 219 A 8.17 4.28 1.29 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 0.00 0.00 0.00 220 R 7.40 2.51 0.00 1.25 0.66 0.00 2.68 0.00 0.00 2.87 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.21 0.00 221 K 7.03 4.47 0.00 1.65 1.75 0.00 1.62 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.46 7.81 222 L 8.65 5.08 0.00 1.85 1.71 0.98 0.92 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 0.00 223 E 9.21 4.69 0.00 2.16 1.91 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 2.30 2.32 0.00 224 T 8.40 4.57 4.13 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 1.21 0.00 0.00 225 G 7.62 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.53 5.72 0.00 2.66 2.65 0.00 0.00 6.89 7.71 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 0.00 227 V 9.29 4.20 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.97 0.00 0.00 228 R 9.76 4.11 0.00 1.87 1.93 0.00 3.37 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.76 0.00 * Residues marked with a * may have inaccurate shift predictions.