NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.3783 8.3193 115.2850 58.3549 62.7932 172.9935 5 I 3.9650 7.4262 116.9582 58.7039 38.9012 174.2882 6 P 4.5917 0.0000 0.0000 62.4363 33.1132 177.0219 7 L 4.9083 8.2823 118.3803 52.5040 45.0373 176.7120 8 I 3.9909 8.4133 122.1943 63.6109 37.3234 176.5686 9 G 3.9488 9.2582 114.3873 44.8783 0.0000 172.9287 10 E 4.4619 7.9566 121.1018 54.7079 31.4359 175.4801 11 R 4.4073 8.5474 125.7019 56.4727 30.8241 175.8798 12 F 4.2580 9.4332 129.7288 57.3939 40.0033 173.1564 13 P 4.1645 0.0000 0.0000 62.4090 31.4836 175.7089 14 E 4.2067 8.7576 123.5455 57.1370 30.1636 175.5915 15 M 4.4654 8.4963 119.9724 54.8257 34.8083 173.4273 16 E 5.0317 8.8726 120.3232 55.4880 31.5058 175.8116 17 V 4.5725 8.7123 115.4808 60.1709 36.9106 174.0591 18 T 4.8578 8.4291 119.5313 62.2437 70.6490 173.9064 19 T 5.1329 8.7459 116.2162 59.2028 72.4088 174.4131 20 D 4.6457 8.6145 119.6485 55.1748 39.1014 176.5825 21 H 4.6878 8.8527 115.3726 55.1664 30.1868 172.9500 22 G 3.7556 7.3296 105.9059 43.5286 0.0000 172.9558 23 V 4.4222 7.9373 119.3843 62.1967 32.5286 175.2128 24 I 4.4786 8.2767 118.2885 59.6218 41.4280 173.0406 25 K 4.7694 8.4441 124.7126 55.1591 34.0030 174.8493 26 L 5.0095 9.1671 127.8365 52.6178 44.2866 175.4127 27 P 4.5379 0.0000 0.0000 63.2981 31.8401 177.4985 28 D 4.3932 8.1175 120.0357 58.4135 40.5011 178.0826 29 H 3.8994 8.2305 117.5341 58.9234 29.8632 176.1460 30 Y 4.3829 7.3971 117.3253 59.9006 38.4884 177.5460 31 V 3.6350 7.8365 119.2386 66.4226 31.3504 178.2458 32 S 4.0843 7.8844 112.8531 61.2888 62.7528 175.2568 33 Q 4.2867 7.9662 116.2365 55.2331 28.9055 176.1174 34 G 3.9684 8.2273 106.1750 45.8553 0.0000 173.4651 35 K 4.9584 8.1634 119.0600 54.4079 34.5902 176.4254 36 W 4.7448 9.0445 123.5665 56.6110 30.7910 175.2015 37 F 5.1667 8.5632 115.5975 55.3825 41.5547 173.5729 38 V 4.6193 8.5799 120.7311 61.2592 33.3469 174.1570 39 L 4.9037 8.7990 131.9303 53.7976 43.4821 175.0434 40 F 5.5220 7.9523 121.9688 55.0304 40.5098 174.6200 41 S 5.3629 9.0547 117.3650 57.2804 65.5811 173.1564 42 H 4.9845 9.1640 117.2527 53.7972 32.5060 173.0490 43 P 4.2701 0.0000 0.0000 65.4860 31.5073 176.4317 44 A 4.4273 7.1960 116.0270 51.1397 21.3186 175.5486 45 D 3.3700 8.3160 120.2121 54.3958 41.5020 176.4008 46 F 2.9053 5.4600 116.5870 58.8469 36.1737 175.6609 47 T 4.5519 6.8413 108.2931 58.8854 71.9422 172.1518 48 P 4.3508 0.0000 0.0000 66.2083 31.7652 180.0900 49 V 3.6626 7.6840 116.7349 63.1067 31.0307 177.4296 *51 T 4.3074 8.0623 117.0788 63.2770 70.4609 176.4727 52 T 4.0131 8.0682 112.0295 64.7194 68.5577 176.5799 53 E 3.9759 8.3726 121.4001 59.3949 29.5327 179.1602 54 F 4.7695 8.3324 117.3732 60.8997 38.9838 177.8012 55 V 3.6975 8.0937 117.9031 66.0225 31.1095 178.1174 56 S 4.1528 7.9594 112.1619 61.2560 62.6216 175.7745 57 F 4.3175 8.7701 120.8058 60.5300 38.7906 177.3179 58 A 4.3074 8.6717 120.5392 55.6034 17.9610 179.8915 59 R 4.0385 8.1255 115.2532 58.8051 30.4047 178.4824 60 R 4.5117 7.8338 115.5101 56.0036 30.3159 177.2429 61 Y 4.4340 8.0005 121.7270 61.2972 38.6984 178.3007 62 E 4.0686 8.4410 118.7265 59.5073 29.3973 178.8563 63 D 4.3217 8.0536 117.6791 57.2672 41.2105 178.5254 64 F 4.1707 8.0118 118.1815 60.5554 39.0030 177.5407 65 Q 3.9282 8.2507 118.0719 59.3646 28.3583 179.5228 66 R 4.1408 7.9466 117.3177 58.9757 30.1220 178.1469 67 L 4.3107 7.5434 116.1450 53.9868 42.3074 176.6130 68 G 3.8119 8.7913 107.9418 46.6955 0.0000 173.6119 69 V 4.9390 7.7123 118.0026 60.9747 34.3232 174.4308 70 D 4.8079 9.3262 128.0185 53.2963 42.9571 175.3061 71 L 4.8468 8.1634 120.3695 53.0931 44.3456 175.9355 72 I 4.3922 7.9209 122.2518 59.5661 41.8942 174.8131 73 G 4.0809 8.3408 116.7157 44.6526 0.0000 171.9029 74 L 5.2179 8.0745 120.1182 53.8472 45.6470 174.2755 75 S 5.2748 8.9749 118.8708 56.9384 66.5315 173.1514 76 V 4.8097 8.3243 125.7912 60.9930 29.5822 174.1677 77 D 4.8015 7.8303 121.2057 52.6896 45.3696 175.3283 78 S 4.3553 8.5437 116.2454 57.7968 64.1181 175.6602 79 V 3.4394 7.7852 120.4296 64.6387 30.9727 178.4742 80 F 4.3147 7.3104 118.2127 60.3871 38.7688 177.4960 81 S 4.4078 8.1692 114.4057 62.0666 62.6297 176.2017 82 H 4.6313 8.0429 119.6930 58.5497 28.5356 177.8924 83 I 3.7790 7.9095 121.1842 64.3339 36.8876 178.5237 84 K 4.1644 8.3444 119.4239 59.3787 31.9392 179.1959 85 W 3.8501 8.6055 128.7106 60.3719 30.6096 178.0929 86 K 3.7786 8.3358 118.6831 59.5842 31.3923 178.9519 87 E 3.9960 8.5381 119.5112 58.7273 29.5617 178.5450 88 W 4.2180 8.8062 128.8849 60.6084 30.8640 177.9070 89 I 4.0011 8.3151 119.6529 64.6599 36.2016 177.9825 90 E 4.1017 8.2314 121.3465 58.6982 29.1607 178.8927 91 R 3.7793 7.9770 117.9758 59.3828 30.2792 177.5506 92 H 4.1521 7.9770 114.5556 56.8035 28.9960 176.1561 93 I 4.1294 8.0778 119.8927 60.4489 38.5005 176.7376 94 G 3.8209 8.2409 107.0269 44.6408 0.0000 172.7397 95 V 4.2593 7.3893 119.2302 60.3543 33.3377 174.6820 96 R 4.0408 8.4429 127.7438 55.9286 30.5687 175.6719 97 I 3.8006 7.8787 126.6615 59.2678 36.6168 173.7323 98 P 4.1703 0.0000 0.0000 63.4764 31.8852 176.5241 99 F 4.7992 6.2722 113.8675 54.5697 39.7322 173.6037 100 P 4.2647 0.0000 0.0000 62.9517 32.9179 174.8210 101 I 4.8629 8.6026 121.9683 59.2514 40.3804 175.2489 102 I 4.2408 8.8623 128.6195 61.4741 38.2473 174.9375 103 A 4.8182 9.1847 129.6378 50.0254 19.6592 177.3471 104 D 4.9450 8.3157 124.4287 53.0941 41.4725 174.0536 105 P 4.5643 0.0000 0.0000 63.9945 32.3853 177.4248 106 Q 3.9718 8.8635 119.4728 54.8783 27.4450 174.6754 107 G 4.9783 8.4170 105.3745 46.3310 0.0000 175.6151 108 T 3.8476 7.5312 117.4555 66.5433 68.3905 176.3607 109 V 3.5586 8.3100 119.6823 65.9481 31.4244 177.8209 110 A 4.0603 8.2811 120.0208 55.3555 18.2790 179.7236 111 R 3.8137 8.2207 116.5899 59.2140 29.9339 179.1087 112 R 3.8889 7.7808 117.6764 59.2896 30.1943 177.7809 113 L 4.3310 7.9689 115.4595 53.8863 42.0012 176.7783 114 G 3.9803 7.9152 106.9760 46.8686 0.0000 174.6060 115 L 4.5546 8.9564 119.1216 54.4895 42.1430 177.0950 116 L 4.2523 7.7199 119.7604 54.2157 40.5930 175.8188 117 H 4.7207 8.2580 121.7380 53.7236 31.1526 176.2068 118 A 4.0543 8.5321 122.5845 55.4952 18.2409 179.0407 119 E 4.2530 8.1714 112.6446 59.3427 31.1839 178.9006 120 S 4.7718 7.5488 114.1857 56.3476 62.0738 173.5797 121 A 4.4104 9.7644 134.7537 53.2648 15.9698 179.7184 122 T 4.3604 7.6622 108.1120 64.3098 70.7855 174.2665 123 H 4.7911 7.5229 118.6212 54.8481 30.5716 173.2227 124 T 4.1572 8.3549 120.9543 62.8658 67.2114 173.2881 125 V 3.6385 7.8198 127.2925 60.0838 32.5415 176.9224 126 R 4.5666 8.1433 119.8787 55.2976 28.7637 175.6525 127 G 4.1578 8.9807 115.4927 45.5791 0.0000 169.8360 128 V 5.0627 7.7927 119.6313 60.9354 35.1653 174.0500 129 F 5.1919 9.5560 126.4569 55.7572 42.1131 174.1379 130 I 4.6855 8.5045 124.9284 59.7371 39.1033 174.8260 131 V 4.5745 8.3534 127.8109 60.8050 34.3720 175.4152 132 D 3.3700 8.2939 127.5811 51.3267 40.5938 176.6617 133 A 4.5886 7.1782 118.7287 52.9381 18.0609 178.0897 134 R 4.2677 8.4942 115.0949 55.8875 30.7967 177.5152 135 G 3.9528 8.3610 107.8950 45.0732 0.0000 173.1857 136 V 4.3166 7.3595 120.0878 61.5065 32.6529 174.7975 137 I 4.3356 9.0695 129.0172 61.7339 37.3632 176.6315 138 R 4.6007 8.8826 125.4190 56.7318 32.5192 176.2247 139 T 4.6060 7.4761 113.0872 62.8756 73.0595 172.4071 140 M 5.5293 8.3686 123.0836 52.6879 36.0401 174.3900 141 L 4.7190 8.0608 122.5012 53.0622 45.2904 175.0586 142 Y 4.9846 8.7031 120.4501 56.6796 38.9134 174.4978 143 Y 4.7241 8.7371 122.4906 55.5915 40.5418 174.2844 144 P 4.6947 0.0000 0.0000 62.5679 32.3632 177.2251 145 M 4.1088 8.4084 118.5043 58.4747 31.8813 177.6221 146 E 4.2335 8.1122 113.5478 56.3802 30.2999 175.8185 147 L 4.6304 7.9098 121.6784 52.9278 43.7079 176.2074 148 G 3.7783 8.6294 115.3508 45.3930 0.0000 172.5392 149 R 3.4413 8.8885 121.5702 55.5176 30.6781 176.6012 150 L 4.3903 7.7419 121.1448 53.3281 42.2999 176.9230 151 V 3.1974 7.8534 126.8377 65.6262 31.3685 177.2300 152 D 4.1406 7.9095 118.3785 57.1895 40.6293 178.1701 153 E 3.9344 7.9206 119.8670 59.0567 29.6369 178.9050 154 I 3.8576 7.5582 120.1977 64.0325 37.1935 178.3054 155 L 3.6232 7.5002 119.5457 57.3064 41.3337 179.1345 156 R 4.1115 7.9833 118.8750 59.5562 29.9731 178.3947 157 I 3.7208 7.8120 119.4574 64.7929 37.1417 178.9036 158 V 3.4378 7.6765 112.8071 63.9188 31.3204 178.4193 159 K 3.7462 8.0838 119.2635 59.6823 32.0793 178.7215 160 A 3.7212 8.4466 121.2886 54.8533 18.2260 179.3225 161 L 4.0116 8.2312 119.3206 58.1033 42.0646 179.5302 162 K 3.9980 8.0539 118.5025 59.3614 32.0614 179.1601 163 L 4.0050 7.8210 119.3397 57.8503 41.5668 179.8063 164 G 3.5814 8.3370 105.6997 47.9307 0.0000 175.2409 165 D 4.4261 8.4944 122.1558 57.2248 40.6946 179.1582 166 S 4.1170 8.1388 113.2953 60.7479 63.4066 175.4997 167 L 4.2573 8.2926 120.1494 53.4248 42.9843 176.3368 168 K 3.8586 7.4647 117.4638 57.0852 29.5683 174.6686 169 R 4.8889 8.2481 115.5156 54.7477 35.1148 176.4117 170 A 4.6392 9.0752 123.3672 50.5893 21.8171 176.1317 171 V 4.4351 7.9314 119.5208 60.0939 33.3598 174.0307 172 P 4.4211 0.0000 0.0000 61.8474 32.1337 175.3298 173 A 3.9746 8.4027 121.5540 54.3079 18.6015 177.3822 174 D 4.5037 9.0211 118.8609 54.4827 38.6528 173.5947 175 W 4.3563 7.8109 129.2632 57.5873 30.9227 173.7845 176 P 2.9700 0.0000 0.0000 62.3194 30.8644 176.0443 177 N 4.8951 7.6988 115.3438 52.8574 39.2487 174.6733 178 N 4.5779 7.9839 117.2636 53.4747 39.9105 175.5225 179 E 4.2600 8.6915 124.1403 58.8116 30.1242 178.2750 180 I 3.9628 7.9867 118.8303 62.9605 37.9895 176.5930 181 I 4.1087 8.2854 111.0497 59.3648 39.6111 177.3996 182 G 3.7951 8.3931 114.9436 47.3098 0.0000 175.2808 183 E 4.2531 9.2198 120.3328 55.5129 30.1269 176.3267 184 G 4.1512 8.0590 107.2616 47.0327 0.0000 173.1734 185 L 4.9900 9.1186 121.4892 52.6569 45.3152 175.6830 186 I 4.7398 8.5957 124.1065 60.3494 38.6523 175.4546 187 V 3.8934 8.4435 128.3854 61.9007 31.8017 174.2325 188 P 4.3279 0.0000 0.0000 61.7959 31.8087 174.5444 189 P 4.5500 0.0000 0.0000 62.0785 31.8262 174.5434 190 P 4.6433 0.0000 0.0000 63.3361 31.7853 176.4346 191 T 4.6544 9.1327 110.3899 61.5062 69.5380 174.4774 192 T 4.7021 7.3549 112.0560 59.2590 73.2657 174.1910 193 E 3.6975 8.5943 121.4897 59.6868 29.4934 179.4742 194 D 4.2878 7.9304 118.1627 57.4818 40.9605 178.5192 195 Q 3.9933 7.9629 118.1638 58.9745 28.6934 178.9960 196 A 4.0331 7.9838 121.5071 55.2495 18.2936 179.5346 197 R 3.7856 8.1339 116.6381 59.6368 30.1289 178.8245 198 A 4.1180 8.4670 120.5103 55.4064 18.0753 179.6283 199 R 3.9193 8.0148 115.9320 60.1469 30.5236 178.3178 200 M 4.2197 8.2256 118.0757 58.5759 31.7625 178.8436 201 E 3.8425 8.2420 118.6696 59.5045 29.8117 179.5987 202 S 4.2483 8.3834 113.6851 59.6804 62.8586 174.6101 203 G 4.0497 8.3626 109.2732 46.1482 0.0000 173.5015 204 Q 4.0650 7.9008 115.3182 56.4253 29.0470 174.9581 205 Y 4.8677 7.1069 114.9300 56.1197 42.3564 175.1714 206 R 3.8133 8.1489 120.8384 56.9691 31.1497 175.6752 207 S 4.9843 7.7538 114.5060 58.1187 65.0804 174.3759 208 L 4.4626 8.2492 119.4132 54.9243 43.7403 175.9326 209 D 4.2874 7.0708 116.0353 52.8970 43.5431 176.2544 210 W 4.3693 8.6888 119.2099 58.5463 28.1291 176.8379 211 W 4.6596 6.6302 113.6481 56.1368 28.1972 176.3900 212 F 4.6656 7.5330 122.0444 56.1246 38.8993 172.2219 213 C 5.6737 8.1775 121.8689 57.3700 32.2243 172.4146 214 W 5.6560 8.3868 118.0522 56.0763 31.5179 172.9976 215 D 4.6278 9.0693 118.3485 52.4580 42.1124 174.1003 216 T 4.7875 8.2558 103.3265 60.0892 68.1478 171.6394 217 P 4.6084 0.0000 0.0000 63.3064 32.6740 176.8604 218 A 4.2685 7.8453 122.9918 51.7593 19.2978 178.2949 219 S 4.3887 8.6765 117.3881 57.8696 65.0445 175.6172 220 R 3.8737 8.5779 122.4828 59.9908 29.7267 178.3005 221 D 4.3149 8.0592 117.7397 57.4606 41.0072 178.2051 222 D 4.3630 7.9504 118.9836 57.5026 40.9161 179.1998 223 V 3.4716 7.8979 118.3550 66.1831 31.5715 177.9651 224 E 3.8547 8.4411 118.6676 59.1678 29.1491 178.9198 225 E 3.6311 8.6267 119.6103 59.1231 29.1347 178.8189 226 A 3.5390 7.5866 120.3145 54.8039 18.3926 179.5954 227 R 3.7273 7.7863 117.2963 59.3229 29.9682 178.7661 228 R 3.7686 7.7240 118.7267 59.3354 30.0323 177.9787 229 Y 4.3165 7.1602 116.2201 61.2642 37.9565 178.7293 230 L 4.0047 7.6163 118.6255 57.7689 41.7958 179.5075 231 R 3.8525 8.1877 118.8328 59.5512 29.7895 178.5417 232 R 3.8864 8.1248 117.2396 59.3655 30.1329 178.0064 233 A 4.0963 7.9352 119.5813 55.0598 18.4261 179.1713 234 A 4.0899 7.9521 118.5076 53.6826 18.8356 177.8683 235 E 4.2410 7.5163 116.9363 54.8802 30.4803 176.4797 236 K 3.8901 8.6754 124.9421 55.8258 32.6382 174.5069 237 P 4.2419 0.0000 0.0000 62.3816 31.7488 175.7901 238 A 3.8164 8.4154 125.5314 53.0577 18.4217 173.1360 239 K 4.1717 8.7414 130.6340 57.0384 31.7310 175.3742 240 L 4.6117 8.5100 126.1111 53.4722 43.0581 178.2399 241 L 4.0812 8.5989 122.4214 57.7884 41.8910 179.1728 242 Y 4.1574 8.2052 115.8766 59.5246 37.4511 176.1727 243 E 2.9010 6.5817 119.7828 59.7817 30.1775 178.9871 244 E 3.7845 7.9373 118.5457 59.2616 30.2946 177.0540 245 A 4.1027 8.0433 126.4174 52.3782 18.3540 176.8658 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 4 S 8.32 4.38 0.00 3.83 3.86 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 5 I 7.43 3.97 2.05 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.89 0.91 0.00 0.00 6 P 0.00 4.59 0.00 2.25 1.99 0.00 3.92 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.03 0.00 7 L 8.28 4.91 0.00 1.63 1.53 0.95 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.41 3.99 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.49 0.92 0.00 0.00 9 G 9.26 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 0.00 0.00 0.00 10 E 7.96 4.46 0.00 2.29 1.82 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 2.26 2.25 0.00 11 R 8.55 4.41 0.00 1.88 1.85 0.00 3.32 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.68 0.00 12 F 9.43 4.26 0.00 3.12 3.05 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 0.00 0.00 0.00 0.00 13 P 0.00 4.16 0.00 2.00 1.87 0.00 2.20 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.57 0.00 14 E 8.76 4.21 0.00 1.94 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 2.31 2.40 0.00 15 M 8.50 4.47 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.73 0.00 16 E 8.87 5.03 0.00 1.86 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 17 V 8.71 4.57 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 0.72 0.00 0.00 0.92 0.00 0.00 18 T 8.43 4.86 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 1.14 0.00 0.00 19 T 8.75 5.13 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 1.15 0.00 0.00 20 D 8.61 4.65 0.00 2.71 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 21 H 8.85 4.69 0.00 3.06 3.28 0.00 5.66 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 22 G 7.33 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 23 V 7.94 4.42 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 0.85 0.00 0.00 0.89 0.00 0.00 24 I 8.28 4.48 1.48 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.25 0.55 0.00 0.00 25 K 8.44 4.77 0.00 1.85 1.65 0.00 1.56 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.53 1.50 7.81 26 L 9.17 5.01 0.00 1.73 1.49 0.85 0.67 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 27 P 0.00 4.54 0.00 2.50 2.56 0.00 3.98 0.00 0.00 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 28 D 8.12 4.39 0.00 2.75 2.76 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 55 V 8.09 3.70 2.32 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 1.07 0.00 0.00 1.07 0.00 0.00 56 S 7.96 4.15 0.00 3.96 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 57 F 8.77 4.32 0.00 3.43 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 A 8.67 4.31 1.48 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 0.00 0.00 0.00 59 R 8.13 4.04 0.00 2.02 2.06 0.00 3.33 0.00 0.00 3.35 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 60 R 7.83 4.51 0.00 2.05 1.81 0.00 3.11 0.00 0.00 2.89 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 61 Y 8.00 4.43 0.00 3.38 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 62 E 8.44 4.07 0.00 2.20 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 0.00 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0.87 0.72 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.92 4.39 1.71 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 0.95 1.34 0.62 0.00 0.00 73 G 8.34 4.08 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 0.00 0.00 0.00 74 L 8.07 5.22 0.00 1.63 1.47 1.01 0.71 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 75 S 8.97 5.27 0.00 4.21 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.32 4.81 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 0.89 0.00 0.00 1.00 0.00 0.00 77 D 7.83 4.80 0.00 2.82 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 78 S 8.54 4.36 0.00 4.10 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 79 V 7.79 3.44 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 -0.24 0.00 0.00 0.77 0.00 0.00 80 F 7.31 4.31 0.00 3.27 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 81 S 8.17 4.41 0.00 4.19 4.16 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 82 H 8.04 4.63 0.00 3.47 3.58 0.00 5.82 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 83 I 7.91 3.78 1.99 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 1.02 0.98 0.00 0.00 84 K 8.34 4.16 0.00 2.34 2.38 0.00 2.03 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.88 1.84 7.81 85 W 8.61 3.85 0.00 2.70 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 K 8.34 3.78 0.00 2.01 1.75 0.00 1.56 0.00 0.00 1.42 0.00 0.00 2.25 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.12 1.39 7.81 87 E 8.54 4.00 0.00 2.33 2.31 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 2.38 2.37 0.00 88 W 8.81 4.22 0.00 3.90 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 89 I 8.32 4.00 2.07 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.99 1.02 0.00 0.00 90 E 8.23 4.10 0.00 2.06 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 0.00 2.26 2.13 0.00 91 R 7.98 3.78 0.00 1.74 1.82 0.00 3.22 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.46 0.00 92 H 7.98 4.15 0.00 1.40 2.69 0.00 5.68 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 8.08 4.13 2.07 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.59 0.98 0.00 0.00 94 G 8.24 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 0.00 0.00 0.00 95 V 7.39 4.26 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 1.00 0.00 0.00 0.96 0.00 0.00 96 R 8.44 4.04 0.00 1.73 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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 0.00 105 P 0.00 4.56 0.00 2.10 1.99 0.00 3.77 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 2.03 2.11 0.00 106 Q 8.86 3.97 0.00 2.27 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.30 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 107 G 8.42 4.98 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 0.00 108 T 7.53 3.85 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 1.21 0.00 0.00 109 V 8.31 3.56 2.32 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 1.03 0.00 0.00 0.99 0.00 0.00 110 A 8.28 4.06 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 0.00 111 R 8.22 3.81 0.00 2.09 1.99 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 112 R 7.78 3.89 0.00 1.86 2.06 0.00 3.26 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 1.55 1.60 0.00 113 L 7.97 4.33 0.00 1.70 1.72 0.80 0.09 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 0.00 114 G 7.92 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 0.00 115 L 8.96 4.55 0.00 1.83 1.87 1.13 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 116 L 7.72 4.25 0.00 1.67 1.68 0.95 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.26 4.72 0.00 3.23 3.25 0.00 5.82 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 0.00 118 A 8.53 4.05 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 0.00 119 E 8.17 4.25 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 120 S 7.55 4.77 0.00 4.08 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 0.00 121 A 9.76 4.41 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 0.00 122 T 7.66 4.36 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 123 H 7.52 4.79 0.00 3.18 3.31 0.00 5.65 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 T 8.35 4.16 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 1.37 0.00 0.00 125 V 7.82 3.64 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 0.90 0.00 0.00 0.90 0.00 0.00 126 R 8.14 4.57 0.00 2.17 2.22 0.00 3.22 0.00 0.00 3.29 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.92 0.00 127 G 8.98 4.16 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 0.00 128 V 7.79 5.06 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 1.03 0.00 0.00 0.93 0.00 0.00 129 F 9.56 5.19 0.00 3.02 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 8.50 4.69 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.66 1.18 0.00 0.00 131 V 8.35 4.57 0.67 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 0.63 0.00 0.00 0.63 0.00 0.00 132 D 8.29 3.37 0.00 1.58 1.54 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.18 4.59 1.38 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 0.00 0.00 134 R 8.49 4.27 0.00 1.82 1.91 0.00 3.15 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 135 G 8.36 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 0.00 0.00 0.00 136 V 7.36 4.32 2.25 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 1.03 0.00 0.00 0.88 0.00 0.00 137 I 9.07 4.34 2.17 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.68 1.07 0.00 0.00 138 R 8.88 4.60 0.00 1.63 1.96 0.00 3.26 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.33 0.00 139 T 7.48 4.61 4.27 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 1.22 0.00 0.00 140 M 8.37 5.53 0.00 1.16 1.80 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 1.99 0.00 141 L 8.06 4.72 0.00 1.51 1.75 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 142 Y 8.70 4.98 0.00 2.81 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 0.00 143 Y 8.74 4.72 0.00 2.89 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 P 0.00 4.69 0.00 2.64 2.20 0.00 3.79 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 2.12 1.98 0.00 145 M 8.41 4.11 0.00 2.10 2.23 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.53 0.00 146 E 8.11 4.23 0.00 2.09 2.08 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 2.28 2.25 0.00 147 L 7.91 4.63 0.00 1.66 1.71 0.96 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.63 3.78 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 0.00 0.00 0.00 149 R 8.89 3.44 0.00 1.52 1.41 0.00 2.98 0.00 0.00 2.90 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.27 0.00 150 L 7.74 4.39 0.00 1.72 1.57 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 151 V 7.85 3.20 1.70 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 0.23 0.00 0.00 0.09 0.00 0.00 152 D 7.91 4.14 0.00 2.66 2.80 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 0.00 153 E 7.92 3.93 0.00 2.05 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 0.00 2.36 2.43 0.00 154 I 7.56 3.86 2.11 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 1.44 1.19 1.13 0.00 0.00 155 L 7.50 3.62 0.00 1.01 0.21 0.13 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.98 4.11 0.00 2.10 2.27 0.00 3.50 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.90 0.00 157 I 7.81 3.72 2.07 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.69 0.98 0.00 0.00 158 V 7.68 3.44 1.67 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 0.81 0.00 0.00 0.50 0.00 0.00 159 K 8.08 3.75 0.00 2.10 2.19 0.00 1.52 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.61 1.68 7.81 160 A 8.45 3.72 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 0.00 161 L 8.23 4.01 0.00 2.08 1.85 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 162 K 8.05 4.00 0.00 1.83 1.72 0.00 0.86 0.00 0.00 1.29 0.00 0.00 2.79 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 0.93 7.81 163 L 7.82 4.00 0.00 1.62 1.53 0.86 0.79 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 0.00 164 G 8.34 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 0.00 165 D 8.49 4.43 0.00 2.97 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 0.00 166 S 8.14 4.12 0.00 4.04 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 0.00 167 L 8.29 4.26 0.00 1.68 1.74 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 168 K 7.46 3.86 0.00 1.98 1.85 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.41 7.81 169 R 8.25 4.89 0.00 1.56 1.69 0.00 3.47 0.00 0.00 3.27 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 170 A 9.08 4.64 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 0.00 171 V 7.93 4.44 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 0.46 0.00 0.00 0.63 0.00 0.00 172 P 0.00 4.42 0.00 2.32 2.19 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 173 A 8.40 3.97 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 0.00 174 D 9.02 4.50 0.00 2.90 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 0.00 175 W 7.81 4.36 0.00 3.39 3.19 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 0.00 176 P 0.00 2.97 0.00 1.43 0.49 0.00 3.49 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.37 0.00 177 N 7.70 4.90 0.00 2.58 2.71 0.00 0.00 6.82 8.72 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 0.00 178 N 7.98 4.58 0.00 2.97 2.82 0.00 0.00 7.30 7.67 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 0.00 179 E 8.69 4.26 0.00 1.97 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 2.30 0.00 180 I 7.99 3.96 1.85 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.47 0.50 0.00 0.00 181 I 8.29 4.11 0.96 0.00 0.00 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 1.20 0.80 -0.55 0.00 0.00 182 G 8.39 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 E 9.22 4.25 0.00 2.10 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 0.00 2.20 2.36 0.00 184 G 8.06 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 0.00 0.00 0.00 0.00 185 L 9.12 4.99 0.00 1.60 1.48 0.80 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 186 I 8.60 4.74 1.92 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.57 0.86 0.00 0.00 187 V 8.44 3.89 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 -0.09 0.00 0.00 188 P 0.00 4.33 0.00 2.09 1.99 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 189 P 0.00 4.55 0.00 2.35 2.36 0.00 3.80 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 2.05 2.04 0.00 190 P 0.00 4.64 0.00 2.27 2.09 0.00 4.21 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.28 0.00 191 T 9.13 4.65 4.28 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 1.27 0.00 0.00 192 T 7.35 4.70 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 0.00 193 E 8.59 3.70 0.00 1.94 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 2.27 2.24 0.00 194 D 7.93 4.29 0.00 2.66 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 0.00 195 Q 7.96 3.99 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 196 A 7.98 4.03 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 0.00 197 R 8.13 3.79 0.00 2.05 1.98 0.00 3.28 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 198 A 8.47 4.12 1.38 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 0.00 0.00 199 R 8.01 3.92 0.00 2.07 2.25 0.00 3.67 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.96 0.00 200 M 8.23 4.22 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 3.08 0.00 201 E 8.24 3.84 0.00 2.17 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 2.35 2.38 0.00 202 S 8.38 4.25 0.00 3.93 4.16 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 0.00 203 G 8.36 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 Q 7.90 4.07 0.00 1.78 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.67 6.61 0.00 0.00 0.00 0.00 0.00 1.56 1.16 0.00 205 Y 7.11 4.87 0.00 2.72 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 0.00 206 R 8.15 3.81 0.00 0.67 0.66 0.00 3.03 0.00 0.00 3.32 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.24 0.00 207 S 7.75 4.98 0.00 4.09 3.73 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 0.00 208 L 8.25 4.46 0.00 1.07 1.34 0.89 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 209 D 7.07 4.29 0.00 2.05 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 W 8.69 4.37 0.00 3.68 3.33 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 0.00 211 W 6.63 4.66 0.00 3.22 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 0.00 0.00 0.00 212 F 7.53 4.67 0.00 1.78 2.25 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 0.00 213 C 8.18 5.67 0.00 2.76 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 0.00 214 W 8.39 5.66 0.00 3.44 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 0.00 215 D 9.07 4.63 0.00 2.87 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 0.00 216 T 8.26 4.79 4.36 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 1.41 0.00 0.00 217 P 0.00 4.61 0.00 2.24 2.25 0.00 3.86 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.10 0.00 218 A 7.85 4.27 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.68 4.39 0.00 4.12 4.04 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 0.00 0.00 0.00 0.00 220 R 8.58 3.87 0.00 1.90 1.98 0.00 3.17 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 221 D 8.06 4.31 0.00 2.72 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 0.00 222 D 7.95 4.36 0.00 2.99 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 V 7.90 3.47 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 0.82 0.00 0.00 1.03 0.00 0.00 224 E 8.44 3.85 0.00 2.05 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 2.25 2.23 0.00 225 E 8.63 3.63 0.00 1.91 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 1.79 2.09 0.00 226 A 7.59 3.54 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 0.00 227 R 7.79 3.73 0.00 1.87 1.78 0.00 2.94 0.00 0.00 2.97 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.44 0.00 228 R 7.72 3.77 0.00 2.02 1.71 0.00 3.06 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 229 Y 7.16 4.32 0.00 3.12 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 L 7.62 4.00 0.00 1.85 1.70 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 231 R 8.19 3.85 0.00 1.92 2.02 0.00 3.06 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 232 R 8.12 3.89 0.00 1.84 2.13 0.00 3.32 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 233 A 7.94 4.10 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 0.00 234 A 7.95 4.09 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 0.00 235 E 7.52 4.24 0.00 2.00 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 2.52 2.37 0.00 236 K 8.68 3.89 0.00 1.70 1.75 0.00 1.68 0.00 0.00 1.77 0.00 0.00 3.17 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.52 7.81 237 P 0.00 4.24 0.00 2.24 2.07 0.00 3.84 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 2.02 1.99 0.00 238 A 8.42 3.82 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 0.00 239 K 8.74 4.17 0.00 1.90 1.94 0.00 1.66 0.00 0.00 0.74 0.00 0.00 3.05 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.56 7.81 240 L 8.51 4.61 0.00 2.05 1.84 1.08 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 241 L 8.60 4.08 0.00 1.79 1.76 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 242 Y 8.21 4.16 0.00 3.22 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 E 6.58 2.90 0.00 1.91 1.70 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 2.07 1.84 0.00 244 E 7.94 3.78 0.00 2.02 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 2.41 2.22 0.00 245 A 8.04 4.10 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 * Residues marked with a * may have inaccurate shift predictions.