NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *6 F 4.6071 8.3244 119.0083 56.5966 40.6593 175.4070 7 D 4.5676 7.7838 119.5554 51.9749 39.3170 173.8625 8 T 4.0358 8.1159 113.0986 63.2781 70.6480 175.2119 9 N 4.6739 7.8461 121.5149 51.6710 37.5909 171.3922 10 I 4.1826 7.6666 113.6280 59.2442 39.4438 176.5050 11 V 4.1585 8.4824 128.6328 62.0910 31.9457 175.4473 12 T 5.0650 8.3426 118.7025 60.1118 70.7228 175.7084 13 L 3.2682 8.5911 122.6140 58.4195 41.8549 178.6987 14 T 3.8055 7.8721 115.0639 66.9199 68.2967 176.3026 15 R 3.9343 7.7612 119.9267 59.1897 30.1860 178.4046 16 F 4.0492 8.4842 120.7021 61.4320 39.6661 177.4614 17 V 3.7130 8.5695 118.2870 65.9087 31.0500 177.6925 18 M 3.9600 8.4197 118.4337 58.8429 32.0227 177.9955 19 E 3.8996 7.6221 117.0848 59.2722 29.8476 178.9666 20 Q 4.2540 7.5457 116.9434 58.0666 29.1619 178.0793 21 G 3.7595 7.9439 105.5561 46.9430 0.0000 175.8215 22 R 4.0294 7.7572 120.4839 58.7502 29.8271 178.5356 23 K 4.2195 7.8304 116.9136 58.1335 32.4028 178.4186 24 A 4.0869 7.8738 119.3040 52.0029 19.5454 176.5854 25 R 3.7251 7.3464 115.6709 57.6464 29.0434 174.5842 26 G 4.4443 7.7328 108.6899 44.8767 0.0000 172.3628 27 T 4.2867 8.7516 108.2448 61.3693 70.2842 175.5380 28 G 4.0401 8.2828 111.1168 45.4495 0.0000 175.1263 29 E 4.0907 8.3188 119.4371 59.5904 29.3966 178.6666 30 M 3.8082 8.1818 117.7901 58.9849 32.5537 178.2814 31 T 3.8825 7.8736 115.3695 66.7395 68.6346 176.5486 32 Q 4.0389 8.0223 119.6041 58.4574 28.6180 178.5151 33 L 3.8249 7.7103 121.4958 58.2606 42.2856 179.1029 34 L 3.7370 8.1337 119.1150 57.2042 41.1788 179.1107 35 N 4.1946 7.6590 116.3698 56.7412 39.2013 176.8100 36 S 4.1669 7.8544 116.4848 61.3925 62.8382 176.2551 37 L 3.6772 7.8036 123.1026 58.5046 41.7636 178.9636 38 C 3.9899 7.9656 116.1023 62.7913 27.8888 176.2665 39 T 3.9490 7.9804 117.6748 66.2249 67.9854 176.7135 40 A 3.9153 7.6844 122.3850 55.0416 18.5220 179.4667 41 V 3.6932 7.9652 116.9269 66.3483 31.7379 178.1174 42 K 3.9302 8.4419 117.8341 59.7785 31.9826 179.1806 43 A 4.0109 7.9299 120.3411 55.1372 18.1832 179.8133 44 I 3.5815 7.8825 118.4888 64.1899 37.1123 178.5400 45 S 3.7889 7.9300 114.0861 61.7090 62.1481 176.4011 46 T 3.8354 7.8118 118.0182 66.5593 67.9084 176.5704 47 A 3.9477 7.5597 121.8756 55.0469 18.1835 179.5762 48 V 3.6526 7.8405 116.7255 65.6828 31.3394 178.4393 49 R 4.1579 8.0258 117.5222 57.4968 30.3185 177.0265 50 K 4.4239 7.8317 118.2189 56.1941 32.9477 175.8837 51 A 4.4402 7.9132 123.6050 54.7288 17.7164 177.9385 52 G 4.3767 8.3048 120.0870 47.5146 0.0000 171.7660 53 I 3.9342 6.8572 122.3245 60.7908 36.5970 175.1615 54 A 4.4138 8.1397 129.0693 51.9035 21.9155 176.1937 *55 H 4.6268 8.5028 113.5824 54.3305 30.6422 174.6209 *72 K 4.3112 7.7789 119.2353 56.4596 33.2617 175.9273 73 L 4.0733 8.4662 120.3711 59.0237 42.3733 179.5500 74 D 4.6475 7.9448 116.1910 54.4869 40.1437 178.1912 75 V 3.6839 7.7632 119.8835 65.4502 31.6064 177.1686 76 L 3.8831 7.4799 118.9999 58.3609 41.6244 178.8253 77 S 4.1049 7.8774 114.8883 61.9185 62.8662 176.5186 78 N 4.4925 7.9738 118.9695 57.0216 38.6549 176.6987 79 D 4.4589 8.1497 119.9226 56.6852 40.7904 178.6111 80 L 3.9115 7.9671 121.5303 57.9949 42.1822 179.0342 81 V 3.3389 7.6179 118.1740 65.8731 31.4006 178.0096 82 I 3.7192 7.7707 119.5299 64.3955 37.0547 178.1656 83 N 4.2622 7.8553 117.0677 56.6032 38.2601 178.0546 84 V 3.5935 7.5762 112.1519 64.2202 31.5035 178.3819 85 L 4.0613 7.8945 118.9571 57.3346 41.3243 179.5498 86 K 3.9183 8.0509 118.5080 59.5988 32.0701 179.0361 87 S 3.8337 7.6111 112.1305 59.6765 62.6241 175.0065 88 S 4.2688 7.3610 114.2698 57.9318 63.3808 174.0603 89 F 4.4303 7.4243 118.1405 57.8331 36.9490 175.3250 90 A 5.1791 8.0305 117.7362 51.5484 21.3288 176.0235 91 T 5.7683 8.1695 105.5757 59.2851 72.5606 174.0182 92 C 4.7424 8.6053 111.8690 58.1532 33.8067 173.9749 93 V 4.9997 7.8749 118.9019 60.9745 34.7976 173.9437 94 L 5.3864 9.3341 127.6642 52.9745 44.9683 175.3716 95 V 4.5449 8.8353 124.1145 61.3917 33.5650 174.5548 96 T 3.9698 7.8173 123.1637 60.2731 71.5752 174.7196 97 E 3.5287 7.9285 124.8583 59.4321 29.6228 178.0982 98 E 4.0890 8.0811 116.7875 57.7591 30.0187 176.1077 99 D 4.8854 7.2201 117.7929 51.8596 42.7566 175.8309 100 K 3.8953 8.9583 125.7959 59.1192 32.0993 175.8419 101 N 5.0442 7.7636 112.5629 50.9213 41.2310 173.7206 102 A 4.3174 8.1744 121.1644 52.1389 19.6301 177.1851 103 I 4.3455 8.7350 121.6196 59.8795 39.2014 174.8378 104 I 4.8434 8.2314 128.2456 59.5796 38.4999 175.8184 105 V 3.8393 8.4031 128.1167 62.3439 32.1967 175.8812 106 E 4.1324 8.9403 126.7777 56.1120 30.1600 176.4254 107 P 4.3430 0.0000 0.0000 65.5286 31.7006 178.7762 108 E 4.0479 8.2653 115.2396 58.5471 30.0142 177.6113 109 K 4.9260 8.1790 117.5048 56.0979 32.4092 176.0396 110 R 4.7616 7.7243 118.4206 55.9586 30.7710 175.7068 111 G 4.4177 8.5518 107.8961 44.7056 0.0000 172.4866 112 K 4.2195 9.0214 117.8528 58.6806 33.8219 176.6111 113 Y 5.2003 8.0635 119.7904 57.0740 39.9766 174.6084 114 V 4.8490 9.1817 123.4292 61.5131 34.0748 174.6956 115 V 5.0345 8.7939 126.4716 61.4166 34.8361 173.6858 116 C 5.5447 9.4714 125.7830 58.0763 30.8396 173.0356 117 F 5.5368 8.8656 117.4061 55.6153 42.2153 172.8248 118 D 4.7419 9.4080 119.4405 51.8301 42.7235 174.7021 119 P 4.5600 0.0000 0.0000 65.4801 31.7872 176.8019 120 L 4.7566 7.4232 119.6266 53.7481 42.4183 172.5569 121 D 4.4497 9.5716 123.9492 54.5057 41.9286 176.5395 122 G 3.5751 8.8362 114.8203 46.9687 0.0000 174.6385 123 S 4.5142 8.2170 112.5009 58.6265 63.5981 175.0588 124 S 4.2744 7.9556 116.3250 61.3681 63.1736 174.4781 125 N 4.8227 7.9526 117.5427 53.4497 38.3363 176.9550 126 I 3.7806 7.6847 121.7103 63.6741 37.5822 177.7730 127 D 4.5407 7.9942 119.1691 56.5856 41.1081 176.8233 128 C 4.4315 8.1269 114.0580 58.9258 28.1735 173.0237 129 L 3.7143 7.2034 117.2886 55.6810 39.5236 174.5687 130 V 4.4891 6.9563 115.3290 59.5104 33.9974 175.5482 131 S 4.6161 8.8078 116.7097 58.7751 63.3129 173.8036 132 I 4.6970 8.1544 116.7250 59.5651 41.8301 173.5061 133 G 4.0694 8.1664 107.0270 46.4563 0.0000 172.2171 134 T 5.3203 8.3727 116.5048 61.8309 70.9619 173.9850 135 I 5.0826 8.5661 127.1680 59.5846 39.8625 174.7963 136 F 5.6139 8.5802 120.6334 55.3361 41.9509 173.7260 137 G 4.2395 9.5577 107.4100 44.6893 0.0000 171.2158 138 I 5.0331 8.5624 126.1140 59.8990 39.6776 174.9929 139 Y 4.9897 9.2565 125.0589 56.5219 41.1447 174.2676 140 R 4.9442 8.5369 120.5413 54.4275 32.0989 175.2350 141 K 4.1881 8.7522 128.4967 56.7131 32.0539 176.2204 142 N 4.7817 8.8448 124.3983 53.4523 40.1321 175.5892 143 S 4.3812 7.8054 112.4866 58.2053 63.7629 174.2667 144 T 4.1326 8.2048 110.8068 63.1338 69.2544 174.6743 145 D 4.5985 7.7047 121.7623 53.4216 41.6949 175.1215 146 E 4.1040 8.4119 121.5751 55.0613 30.1608 174.4982 147 P 4.8375 0.0000 0.0000 62.9965 31.8139 175.1704 148 S 4.5832 8.3221 113.1922 56.2455 65.6903 175.0408 149 E 4.0446 8.7179 119.4547 59.3068 28.8946 179.7543 150 K 4.0084 8.0117 118.3964 59.4017 32.2074 178.7129 151 D 4.3486 8.0821 118.5359 57.0823 40.4532 178.3280 152 A 4.1775 7.5586 119.6167 53.2156 20.0084 178.0137 153 L 4.2581 7.3644 119.9464 53.6784 40.3688 175.7532 154 Q 4.5210 6.7503 117.6604 52.8262 32.0935 174.5117 155 P 4.6831 0.0000 0.0000 62.1700 32.1692 178.2312 156 G 3.8525 8.7479 110.0498 48.0159 0.0000 175.6158 157 R 4.1311 8.1143 119.6499 58.8341 30.1450 176.6687 158 N 4.8394 8.0121 113.4369 53.3187 38.8599 175.3252 159 L 3.7706 7.5686 119.4606 54.8757 41.9940 177.7713 160 V 3.9125 8.1699 116.0204 63.4338 32.2770 176.2768 161 A 4.6247 6.9874 119.4271 51.5787 21.8120 174.5460 162 A 4.4495 7.8307 120.7926 51.5668 22.9868 177.1366 163 G 3.3952 6.8974 105.8557 46.3396 0.0000 171.6894 164 Y 5.3006 6.9279 115.8504 55.9192 41.8392 173.7509 165 A 4.9951 9.0549 122.6281 50.2153 22.3422 175.5067 166 L 4.6432 8.9564 122.9171 53.6796 44.7606 175.2500 167 Y 5.0561 8.7244 126.4273 56.0339 37.1108 175.5661 168 G 4.4145 8.4066 117.4782 44.4655 0.0000 172.2892 169 S 4.1875 8.9523 115.0030 60.6260 63.2838 174.3295 170 A 4.7346 7.6534 121.9045 50.5573 22.2937 174.0175 171 T 5.6288 8.2546 115.7066 61.5902 70.7239 173.5226 172 M 5.1345 8.6191 125.8294 53.5295 35.7107 173.5646 173 L 4.9106 9.2006 128.3135 53.4112 44.6773 174.8080 174 V 4.5780 7.9999 126.9254 60.9826 33.7307 174.0654 175 L 5.0636 8.9120 129.2503 53.1120 45.3126 174.6339 176 A 5.2907 9.1605 127.9115 50.7447 22.2790 175.0877 177 M 5.4736 8.8952 120.6757 53.9504 36.6186 176.2769 178 V 3.7248 8.7810 118.2618 64.9038 31.4569 176.8938 179 N 4.5540 8.4166 116.0356 52.7278 38.2693 175.2061 180 G 3.8270 6.4892 105.5215 45.4885 0.0000 170.0691 181 V 4.8554 7.7292 119.3206 61.1863 33.8418 175.2095 182 N 5.2795 9.0771 124.7437 51.5404 42.7186 172.9767 183 C 4.9912 8.4314 119.8176 57.9531 30.9653 172.8198 184 F 5.2743 9.1963 122.3925 55.9334 42.0019 173.8583 185 M 5.0850 9.3383 123.2688 53.5292 34.8015 174.5558 186 L 3.8698 8.5434 128.4576 54.6846 42.9768 176.0047 187 D 4.6557 8.5759 128.3997 52.7874 41.1750 175.2351 188 P 4.2858 0.0000 0.0000 64.8637 32.0199 177.8273 189 A 4.0752 8.0082 122.2141 54.7188 18.2329 178.2891 190 I 4.1427 7.8451 105.7503 59.8679 38.6965 175.3689 191 G 3.8490 7.8910 109.0452 46.7710 0.0000 173.5510 192 E 4.7557 7.5841 116.8575 54.1087 34.4122 175.4592 193 F 4.7306 9.0437 122.7221 57.3312 40.4952 174.3710 194 I 4.9097 8.9469 125.0012 59.3216 39.9638 174.8830 195 L 4.0486 8.7337 128.8543 55.2138 41.3901 176.4125 196 V 4.2306 8.2340 120.3187 61.7610 33.9223 176.1843 197 D 4.6117 7.4956 119.6805 52.4922 44.3746 174.2092 198 R 4.3605 8.6747 124.9111 55.6983 31.4877 176.3457 199 N 4.0364 8.6091 119.5599 54.3069 35.6263 173.0487 200 V 3.8004 8.4363 118.8355 62.5818 32.9641 175.0166 201 K 4.7951 8.4328 127.6166 54.5590 33.8392 176.4099 202 I 4.0079 8.6298 125.3123 60.5518 38.8010 175.7584 203 K 4.1446 8.4301 125.9889 56.3677 32.4278 177.3916 204 K 4.1881 8.8304 123.0132 59.0410 33.0117 177.1017 205 K 5.0411 7.9675 117.9827 54.6097 35.4381 175.1351 206 G 4.3699 8.9874 113.7330 44.0436 0.0000 172.0922 207 S 3.6893 8.3526 111.6893 57.5551 65.5605 173.9398 208 I 5.1825 7.5821 121.0361 59.3606 40.2098 173.8826 209 Y 5.3999 8.5700 123.2803 55.2981 41.1208 174.3613 210 S 5.3154 8.5305 116.3298 55.8985 65.2598 172.4142 211 I 4.3081 7.9863 124.1005 61.0764 40.8783 173.5110 212 N 3.6823 7.6240 125.8678 52.3413 38.0030 175.3017 213 E 4.4222 8.3961 125.1616 57.4334 29.8757 179.0748 214 G 3.5519 7.7287 107.5358 47.3993 0.0000 173.9417 215 Y 4.5400 7.2545 117.5569 57.5773 38.2929 177.2258 216 A 3.1993 7.4059 126.4117 54.8222 18.4569 180.7905 217 K 4.1018 7.6858 113.4077 59.1482 33.0286 177.7170 218 E 4.2013 7.7043 117.7056 57.1394 29.8831 176.8492 219 F 4.7245 6.9149 116.5927 56.9880 39.6145 175.3513 220 D 4.7103 8.5018 123.0924 52.2260 41.5997 175.3336 221 P 4.1701 0.0000 0.0000 66.4341 30.9741 178.3517 222 A 3.5437 7.8723 119.9911 54.2683 17.9777 179.8361 223 I 3.4832 7.4016 118.1003 64.8136 37.4832 178.3062 224 T 3.8916 7.5543 116.6127 66.6912 67.9148 176.2577 225 E 3.8701 8.1052 121.0708 59.4371 29.5076 178.1800 226 Y 3.9268 7.5607 118.0030 60.6781 39.1454 177.8008 227 I 3.4315 7.9690 120.9595 64.2404 37.1144 177.9940 228 Q 4.0023 7.8605 120.2971 59.0329 28.7525 178.0802 229 R 4.4178 7.3822 116.0406 56.6244 29.9164 178.2381 230 K 3.5741 7.3221 119.6705 58.4153 31.9165 178.9502 231 K 4.1124 7.6944 117.5180 57.2889 33.5344 177.0827 232 F 4.6036 8.1584 119.3533 54.1012 38.8312 171.0576 233 P 4.6345 0.0000 0.0000 61.1186 31.6090 174.2362 234 P 4.2027 0.0000 0.0000 66.2937 31.1003 176.0160 235 D 4.4383 7.7921 120.5557 52.7964 41.3645 176.2168 236 N 4.5399 8.6730 126.0426 53.9247 37.8800 173.6510 237 S 4.7683 7.5699 116.3287 56.9892 64.5320 171.8438 238 A 4.6740 8.3942 122.3085 49.7217 20.2203 175.3257 239 P 4.6041 0.0000 0.0000 62.4973 32.2624 175.9232 240 Y 4.5478 8.5919 119.1632 58.3488 38.6194 176.5824 241 G 4.0213 8.9576 110.5741 46.1765 0.0000 172.0870 242 A 4.7612 8.1623 120.7066 49.9744 22.2252 175.9068 243 R 4.5806 8.3357 119.8417 55.1104 35.1630 174.3759 244 Y 4.7504 8.4287 123.9742 56.8645 39.4081 174.0577 245 V 3.5638 9.0064 127.1011 64.0066 31.9140 177.2885 246 G 3.6265 9.1653 106.5571 45.0269 0.0000 173.9729 247 S 4.2118 7.8851 114.2234 56.0217 64.3209 173.5009 248 M 3.5246 8.6793 129.9137 58.8627 31.8744 178.0100 249 V 3.0113 7.2501 117.3154 65.8321 31.6406 177.8838 250 A 3.9065 7.6596 119.8228 55.2948 18.4158 179.2199 251 D 4.2009 7.8105 117.4615 57.3316 40.8190 179.1909 252 V 3.4027 7.4505 118.8920 65.8086 31.4016 177.6491 253 H 4.3009 8.3370 119.8883 58.6630 29.6396 177.1616 254 R 3.8669 7.9278 120.5416 59.8930 29.9110 178.6714 255 T 3.9593 7.8027 115.2761 66.2814 68.1295 176.5464 256 L 3.9545 7.6975 121.7125 58.1582 42.3351 178.9245 257 V 3.8743 7.8797 110.6670 62.8508 31.7827 176.2632 258 Y 4.2674 8.3675 117.9643 56.1853 40.2957 175.3520 259 G 4.1381 7.6004 107.6811 45.1974 0.0000 174.7519 260 G 3.8833 6.7352 106.9693 45.1902 0.0000 171.1090 261 I 5.0941 8.1797 119.9359 59.2680 42.1452 175.5007 262 F 5.4839 9.1512 128.6373 56.8687 43.1167 173.3481 263 M 4.9199 8.3452 124.4810 53.9307 36.3736 173.6223 264 Y 4.5498 8.8097 125.0281 54.9623 39.9078 172.6597 265 P 5.1262 0.0000 0.0000 60.3809 33.9874 175.6432 266 A 4.2695 8.5990 123.7300 52.5163 18.8199 176.6709 267 N 5.4174 8.3363 123.4010 51.7400 39.4415 174.2060 268 K 4.3697 7.9360 114.9567 57.1785 33.3159 177.5941 269 K 4.1156 8.1631 119.4102 58.7041 32.5790 176.8226 270 S 4.5865 8.2089 114.9668 55.7126 63.9666 172.4364 271 P 4.3588 0.0000 0.0000 64.8341 31.4805 178.2024 272 K 4.2855 8.1969 116.1093 55.7016 32.1923 177.0538 273 G 4.1071 8.0576 104.1227 45.5945 0.0000 173.4578 274 K 4.1665 8.2901 118.4943 57.1246 33.1365 176.6214 275 L 4.2814 7.4174 119.3765 53.2982 42.6693 176.4174 276 R 4.2619 8.5279 123.0113 56.2101 30.9017 177.6083 277 L 3.8904 8.9013 124.4247 58.0690 42.3613 179.3914 278 L 4.0792 7.5727 116.6599 56.9874 41.7276 177.3182 279 Y 4.9250 7.0049 113.1912 56.3989 39.2695 175.1134 280 E 4.5231 7.9329 118.6544 58.2175 32.7280 177.7371 281 C 4.2393 8.4013 116.3223 62.9627 28.2240 175.9100 282 N 4.3561 8.2825 118.1358 55.7542 38.0973 175.6599 283 P 4.1782 0.0000 0.0000 66.0657 31.5775 178.6581 284 M 4.1327 7.7179 115.8680 58.2412 31.7676 178.8039 285 A 4.0688 8.3814 121.4285 55.1486 18.5583 179.0268 286 Y 3.9555 8.3105 118.2947 60.6627 38.8151 178.5177 287 V 3.5384 8.0822 119.2040 66.2490 31.6394 177.7063 288 M 3.9990 8.0880 118.3043 58.7570 31.8909 178.6258 289 E 4.3884 8.2042 119.7324 58.9355 29.3994 179.7316 290 K 3.9445 7.7543 117.3131 58.5709 32.4020 178.2960 291 A 4.6852 7.3021 120.9778 51.3275 18.5487 178.1667 292 G 3.9123 8.1031 105.8000 45.3505 0.0000 173.4787 293 G 4.3563 8.1650 108.5592 44.0330 0.0000 172.7126 294 L 5.2494 8.6777 117.9075 52.8581 46.1606 176.2607 295 A 5.0159 8.3051 121.6349 50.9571 22.2206 175.0877 296 T 5.1345 9.0417 116.6175 61.2046 71.6512 174.1815 297 T 4.2843 8.9624 113.2629 61.0700 69.3117 175.3103 298 G 3.3619 8.0380 111.3310 44.8785 0.0000 174.6215 299 K 4.2591 7.2901 116.8512 57.2036 34.3398 175.5592 300 E 4.5782 7.9469 114.1789 54.7281 32.1704 174.2464 301 A 4.4370 8.2786 122.7476 52.0855 19.3403 178.9306 302 V 3.6433 8.4127 122.6102 65.9949 32.0014 178.5401 303 L 4.1304 8.0053 119.0396 57.3853 41.5837 177.9744 304 D 4.7502 7.5299 115.1759 54.2098 41.6063 176.6621 305 I 3.8111 7.7202 122.7067 61.0636 37.4989 175.0328 306 V 4.0043 8.2633 125.6757 60.7930 32.3353 173.6404 307 P 4.8842 0.0000 0.0000 62.1448 32.7645 175.5045 308 T 4.4533 9.0959 108.0293 61.6862 70.9457 173.9971 309 D 4.9054 7.9164 120.4384 51.6938 43.9616 176.1486 310 I 3.8435 8.4876 118.9459 63.3673 37.7586 176.2372 311 H 4.9010 8.0475 117.2139 55.3574 29.1530 174.4989 312 Q 4.2324 7.7923 118.7253 56.4372 29.6745 175.8146 313 R 4.9469 8.3694 119.6441 55.2339 32.6853 175.1607 314 A 4.8424 8.6675 121.3812 49.8753 22.3146 174.7958 315 P 4.5417 0.0000 0.0000 63.1931 32.5992 175.6723 316 I 4.7499 8.4128 120.6283 59.9947 42.1519 173.6186 317 I 5.0127 9.2143 129.9695 59.5415 40.2378 173.9737 318 L 5.2201 9.1658 127.8169 53.4851 43.6363 177.0828 319 G 4.1492 8.2905 107.2021 46.0962 0.0000 172.0288 320 S 4.4213 8.0592 115.9588 58.1034 63.7078 173.5750 321 P 4.2891 0.0000 0.0000 66.5726 30.7306 178.7886 322 E 4.0481 8.2627 118.8754 58.6536 29.3619 179.2347 323 D 4.5232 8.1028 118.7531 57.3470 41.1326 178.7543 324 V 3.5849 7.6633 118.9458 66.1318 31.5337 178.2597 325 T 3.9123 8.0837 115.7314 66.2733 68.2495 176.2472 326 E 4.0737 7.8669 121.4455 59.4294 29.7932 178.8018 327 L 3.8810 7.5856 119.5983 57.8267 41.7460 178.8939 328 L 4.1485 7.6738 118.6404 57.7285 41.9233 178.8753 329 E 4.1796 8.2695 118.6215 59.3541 29.4933 179.3342 330 I 3.8481 7.8474 119.5949 64.2320 36.8397 177.8598 331 Y 4.0802 7.6042 116.5386 60.3971 38.0502 177.5826 332 Q 4.2516 7.9912 119.1796 58.4373 28.7986 178.3385 333 K 3.9706 7.9916 118.2710 60.5125 32.7568 178.5765 334 H 4.2827 7.7578 114.8597 57.4814 28.6055 175.3461 335 A 4.2324 7.7128 128.1279 52.3329 18.3209 177.0083 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 *6 F 8.32 4.61 0.00 2.32 2.28 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 7 D 7.78 4.57 0.00 2.70 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 8 T 8.12 4.04 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 1.28 0.00 0.00 9 N 7.85 4.67 0.00 2.70 2.79 0.00 0.00 6.97 7.97 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 10 I 7.67 4.18 1.91 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 1.40 0.78 1.04 0.00 0.00 11 V 8.48 4.16 2.19 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 1.26 0.00 0.00 1.03 0.00 0.00 12 T 8.34 5.06 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 13 L 8.59 3.27 0.00 0.88 1.41 -0.15 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 14 T 7.87 3.81 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 1.25 0.00 0.00 15 R 7.76 3.93 0.00 1.94 2.17 0.00 3.15 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.67 0.00 16 F 8.48 4.05 0.00 3.51 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 17 V 8.57 3.71 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.03 0.00 0.00 18 M 8.42 3.96 0.00 2.10 2.11 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 2.59 2.57 0.00 19 E 7.62 3.90 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 20 Q 7.55 4.25 0.00 2.21 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.68 0.00 0.00 0.00 0.00 0.00 1.96 2.01 0.00 21 G 7.94 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 22 R 7.76 4.03 0.00 1.99 1.97 0.00 3.10 0.00 0.00 3.14 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 23 K 7.83 4.22 0.00 1.88 1.85 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.59 7.81 24 A 7.87 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 25 R 7.35 3.73 0.00 2.03 1.97 0.00 3.43 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 26 G 7.73 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 T 8.75 4.29 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 28 G 8.28 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 0.00 0.00 0.00 29 E 8.32 4.09 0.00 2.26 2.28 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 2.50 2.44 0.00 30 M 8.18 3.81 0.00 2.11 1.93 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.60 0.00 31 T 7.87 3.88 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 32 Q 8.02 4.04 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.89 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 33 L 7.71 3.82 0.00 1.89 1.73 0.86 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.13 3.74 0.00 1.64 1.50 0.85 0.23 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 35 N 7.66 4.19 0.00 3.02 2.87 0.00 0.00 7.20 6.96 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 36 S 7.85 4.17 0.00 3.96 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 37 L 7.80 3.68 0.00 1.56 1.54 0.42 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 38 C 7.97 3.99 0.00 3.08 3.04 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 39 T 7.98 3.95 4.41 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 1.18 0.00 0.00 40 A 7.68 3.92 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.97 3.69 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 1.40 0.00 0.00 0.91 0.00 0.00 42 K 8.44 3.93 0.00 1.89 1.87 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.92 7.81 43 A 7.93 4.01 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 44 I 7.88 3.58 1.81 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 1.33 0.69 0.52 0.00 0.00 45 S 7.93 3.79 0.00 4.11 4.06 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 0.00 0.00 0.00 46 T 7.81 3.84 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 47 A 7.56 3.95 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 48 V 7.84 3.65 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 1.01 0.00 0.00 0.72 0.00 0.00 49 R 8.03 4.16 0.00 1.97 1.96 0.00 3.16 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 50 K 7.83 4.42 0.00 1.82 1.94 0.00 1.28 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.32 7.81 51 A 7.91 4.44 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 52 G 8.30 4.38 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 0.00 53 I 6.86 3.93 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.57 0.90 0.00 0.00 54 A 8.14 4.41 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *55 H 8.50 4.63 0.00 2.69 2.89 0.00 5.87 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *72 K 7.78 4.31 0.00 2.05 1.81 0.00 1.52 0.00 0.00 1.89 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.50 7.81 73 L 8.47 4.07 0.00 1.71 1.65 0.88 1.07 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 74 D 7.94 4.65 0.00 2.89 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 75 V 7.76 3.68 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 1.03 0.00 0.00 0.93 0.00 0.00 76 L 7.48 3.88 0.00 1.82 1.85 0.90 0.90 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 77 S 7.88 4.10 0.00 4.16 3.96 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 78 N 7.97 4.49 0.00 3.00 3.01 0.00 0.00 7.34 9.28 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 79 D 8.15 4.46 0.00 2.93 2.70 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 80 L 7.97 3.91 0.00 1.94 1.82 0.88 0.63 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 81 V 7.62 3.34 1.58 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 -0.04 0.00 0.00 0.83 0.00 0.00 82 I 7.77 3.72 1.91 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.11 0.94 0.00 0.00 83 N 7.86 4.26 0.00 2.87 2.80 0.00 0.00 7.26 8.39 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 84 V 7.58 3.59 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.89 0.00 0.00 85 L 7.89 4.06 0.00 1.79 1.63 0.64 0.35 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 86 K 8.05 3.92 0.00 1.75 1.78 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.66 7.81 87 S 7.61 3.83 0.00 3.72 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.36 4.27 0.00 3.94 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.42 4.43 0.00 3.13 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.03 5.18 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 91 T 8.17 5.77 4.38 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 1.26 0.00 0.00 92 C 8.61 4.74 0.00 2.98 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 93 V 7.87 5.00 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 1.04 0.00 0.00 1.02 0.00 0.00 94 L 9.33 5.39 0.00 1.66 1.76 0.98 0.71 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 95 V 8.84 4.54 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 1.11 0.00 0.00 0.97 0.00 0.00 96 T 7.82 3.97 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 0.89 0.00 0.00 97 E 7.93 3.53 0.00 1.55 1.78 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 2.44 2.68 0.00 98 E 8.08 4.09 0.00 1.94 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 2.25 2.26 0.00 99 D 7.22 4.89 0.00 2.61 2.66 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 0.00 100 K 8.96 3.90 0.00 1.70 1.87 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.51 7.81 101 N 7.76 5.04 0.00 2.72 2.73 0.00 0.00 7.06 7.36 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 0.00 102 A 8.17 4.32 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 0.00 103 I 8.73 4.35 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.47 0.94 0.00 0.00 104 I 8.23 4.84 1.88 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 1.24 0.82 0.95 0.00 0.00 105 V 8.40 3.84 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 0.80 0.00 0.00 0.96 0.00 0.00 106 E 8.94 4.13 0.00 2.13 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 2.42 2.42 0.00 107 P 0.00 4.34 0.00 2.19 2.11 0.00 3.62 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 2.12 2.09 0.00 108 E 8.27 4.05 0.00 2.14 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 2.34 2.33 0.00 109 K 8.18 4.93 0.00 1.88 1.95 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.50 7.81 110 R 7.72 4.76 0.00 1.94 1.88 0.00 3.14 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 1.67 1.91 0.00 111 G 8.55 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 0.00 0.00 0.00 0.00 112 K 9.02 4.22 0.00 1.57 1.87 0.00 0.91 0.00 0.00 1.43 0.00 0.00 2.83 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.32 0.21 7.81 113 Y 8.06 5.20 0.00 3.19 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 0.00 114 V 9.18 4.85 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 0.93 0.00 0.00 1.01 0.00 0.00 115 V 8.79 5.03 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.99 0.00 0.00 116 C 9.47 5.54 0.00 3.16 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 F 8.87 5.54 0.00 3.14 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 0.00 118 D 9.41 4.74 0.00 2.83 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 0.00 119 P 0.00 4.56 0.00 2.35 2.51 0.00 3.83 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 2.07 2.25 0.00 120 L 7.42 4.76 0.00 1.62 1.62 0.95 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 121 D 9.57 4.45 0.00 2.81 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 0.00 122 G 8.84 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 0.00 123 S 8.22 4.51 0.00 4.02 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 S 7.96 4.27 0.00 4.03 4.07 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 0.00 125 N 7.95 4.82 0.00 3.04 2.87 0.00 0.00 6.95 7.12 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 0.00 126 I 7.68 3.78 1.88 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 1.23 0.91 0.00 0.00 127 D 7.99 4.54 0.00 2.67 2.73 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 0.00 128 C 8.13 4.43 0.00 2.97 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 0.00 129 L 7.20 3.71 0.00 1.81 1.72 0.93 0.85 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 0.00 130 V 6.96 4.49 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.92 0.00 0.00 131 S 8.81 4.62 0.00 3.75 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 0.00 132 I 8.15 4.70 2.01 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 1.63 1.07 0.00 0.00 133 G 8.17 4.07 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 0.00 134 T 8.37 5.32 4.41 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 1.37 0.00 0.00 135 I 8.57 5.08 2.12 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.87 0.99 0.00 0.00 136 F 8.58 5.61 0.00 3.07 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 G 9.56 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 I 8.56 5.03 1.85 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 1.22 1.09 0.82 0.00 0.00 139 Y 9.26 4.99 0.00 2.86 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 0.00 140 R 8.54 4.94 0.00 2.00 1.91 0.00 3.29 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.46 0.00 141 K 8.75 4.19 0.00 1.83 1.83 0.00 1.99 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.60 7.81 142 N 8.84 4.78 0.00 2.72 2.83 0.00 0.00 7.19 7.60 0.00 0.00 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 S 7.81 4.38 0.00 3.96 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 0.00 144 T 8.20 4.13 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 1.20 0.00 0.00 145 D 7.70 4.60 0.00 2.66 2.66 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 0.00 146 E 8.41 4.10 0.00 1.91 1.85 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 2.29 2.36 0.00 147 P 0.00 4.84 0.00 2.23 2.08 0.00 3.46 0.00 0.00 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.95 0.00 148 S 8.32 4.58 0.00 3.98 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 0.00 149 E 8.72 4.04 0.00 2.03 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 0.00 2.41 2.41 0.00 150 K 8.01 4.01 0.00 1.78 1.83 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.52 7.81 151 D 8.08 4.35 0.00 2.85 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 0.00 152 A 7.56 4.18 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 153 L 7.36 4.26 0.00 1.71 1.60 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 154 Q 6.75 4.52 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.56 6.92 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 155 P 0.00 4.68 0.00 2.23 2.02 0.00 3.83 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.05 0.00 156 G 8.75 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 0.00 0.00 0.00 157 R 8.11 4.13 0.00 2.06 2.06 0.00 3.35 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 158 N 8.01 4.84 0.00 3.19 3.00 0.00 0.00 6.98 7.89 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 0.00 159 L 7.57 3.77 0.00 0.98 0.69 0.56 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 160 V 8.17 3.91 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 0.79 0.00 0.00 1.00 0.00 0.00 161 A 6.99 4.62 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 A 7.83 4.45 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 G 6.90 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 Y 6.93 5.30 0.00 3.10 2.88 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 0.00 165 A 9.05 5.00 1.15 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 0.00 166 L 8.96 4.64 0.00 1.75 1.56 0.89 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 167 Y 8.72 5.06 0.00 2.95 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 G 8.41 4.41 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 0.00 169 S 8.95 4.19 0.00 3.99 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 A 7.65 4.73 1.23 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 0.00 0.00 171 T 8.25 5.63 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 1.47 0.00 0.00 172 M 8.62 5.13 0.00 2.04 1.85 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 173 L 9.20 4.91 0.00 1.60 1.46 0.78 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 174 V 8.00 4.58 0.82 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 0.66 0.00 0.00 0.73 0.00 0.00 175 L 8.91 5.06 0.00 1.85 1.61 1.05 1.03 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 0.00 176 A 9.16 5.29 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 0.00 177 M 8.90 5.47 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.55 0.00 178 V 8.78 3.72 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.98 0.00 0.00 179 N 8.42 4.55 0.00 2.88 3.01 0.00 0.00 5.94 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 G 6.49 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 V 7.73 4.86 2.19 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 1.05 0.00 0.00 0.93 0.00 0.00 182 N 9.08 5.28 0.00 2.39 1.91 0.00 0.00 6.11 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 0.00 183 C 8.43 4.99 0.00 2.71 2.73 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 0.00 184 F 9.20 5.27 0.00 3.02 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 M 9.34 5.08 0.00 2.05 1.91 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.44 0.00 186 L 8.54 3.87 0.00 1.12 1.39 0.13 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 187 D 8.58 4.66 0.00 2.75 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.29 0.00 2.18 2.11 0.00 3.78 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 1.95 1.93 0.00 189 A 8.01 4.08 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 I 7.85 4.14 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.68 0.90 0.00 0.00 191 G 7.89 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 0.00 0.00 0.00 192 E 7.58 4.76 0.00 1.82 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 2.43 2.27 0.00 193 F 9.04 4.73 0.00 2.96 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 0.00 194 I 8.95 4.91 1.92 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 1.25 1.12 0.96 0.00 0.00 195 L 8.73 4.05 0.00 1.57 1.59 0.02 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 196 V 8.23 4.23 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 0.73 0.00 0.00 0.90 0.00 0.00 197 D 7.50 4.61 0.00 2.65 2.34 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 0.00 198 R 8.67 4.36 0.00 1.70 1.83 0.00 3.42 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 199 N 8.61 4.04 0.00 2.80 2.81 0.00 0.00 7.01 7.68 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 0.00 200 V 8.44 3.80 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 0.90 0.00 0.00 0.90 0.00 0.00 201 K 8.43 4.80 0.00 1.64 1.68 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.33 7.81 202 I 8.63 4.01 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.91 0.95 0.00 0.00 203 K 8.43 4.14 0.00 1.62 1.66 0.00 1.73 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.38 7.81 204 K 8.83 4.19 0.00 1.68 2.02 0.00 1.64 0.00 0.00 1.75 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.39 7.81 205 K 7.97 5.04 0.00 1.69 1.65 0.00 1.94 0.00 0.00 1.81 0.00 0.00 3.06 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.49 1.66 7.81 206 G 8.99 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 S 8.35 3.69 0.00 3.69 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 0.00 208 I 7.58 5.18 1.95 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.78 0.90 0.00 0.00 209 Y 8.57 5.40 0.00 3.19 3.32 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 0.00 210 S 8.53 5.32 0.00 4.17 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 I 7.99 4.31 1.79 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.95 0.98 0.00 0.00 212 N 7.62 3.68 0.00 2.27 2.53 0.00 0.00 7.16 7.53 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 0.00 213 E 8.40 4.42 0.00 2.08 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 2.59 2.39 0.00 214 G 7.73 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 Y 7.25 4.54 0.00 2.84 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 A 7.41 3.20 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 K 7.69 4.10 0.00 1.82 1.89 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.41 7.81 218 E 7.70 4.20 0.00 1.99 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 2.27 2.21 0.00 219 F 6.91 4.72 0.00 3.05 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 0.00 220 D 8.50 4.71 0.00 2.97 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 0.00 221 P 0.00 4.17 0.00 2.31 2.40 0.00 3.70 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.08 0.00 222 A 7.87 3.54 0.43 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 0.00 223 I 7.40 3.48 1.64 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.68 0.24 0.00 0.00 224 T 7.55 3.89 4.39 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 1.23 0.00 0.00 225 E 8.11 3.87 0.00 2.17 1.90 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 2.28 2.30 0.00 226 Y 7.56 3.93 0.00 2.87 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 0.00 227 I 7.97 3.43 1.97 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.05 0.91 0.00 0.00 228 Q 7.86 4.00 0.00 2.33 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.39 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 229 R 7.38 4.42 0.00 1.90 2.03 0.00 2.97 0.00 0.00 3.16 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.19 0.00 230 K 7.32 3.57 0.00 1.23 1.21 0.00 0.66 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.76 0.51 7.81 231 K 7.69 4.11 0.00 1.88 1.68 0.00 1.77 0.00 0.00 1.85 0.00 0.00 3.19 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.47 1.54 7.81 232 F 8.16 4.60 0.00 3.12 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 0.00 233 P 0.00 4.63 0.00 2.02 1.96 0.00 3.73 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.97 0.00 234 P 0.00 4.20 0.00 2.15 2.15 0.00 3.80 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 235 D 7.79 4.44 0.00 2.66 2.66 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 0.00 236 N 8.67 4.54 0.00 2.68 2.79 0.00 0.00 7.08 7.64 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 0.00 237 S 7.57 4.77 0.00 4.01 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 0.00 238 A 8.39 4.67 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 P 0.00 4.60 0.00 2.18 2.10 0.00 3.79 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 1.99 1.93 0.00 240 Y 8.59 4.55 0.00 2.92 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 G 8.96 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 0.00 242 A 8.16 4.76 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 R 8.34 4.58 0.00 1.65 1.75 0.00 3.25 0.00 0.00 3.04 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.62 0.00 244 Y 8.43 4.75 0.00 2.85 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 0.00 245 V 9.01 3.56 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 0.74 0.00 0.00 0.92 0.00 0.00 246 G 9.17 3.63 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 0.00 0.00 0.00 247 S 7.89 4.21 0.00 3.81 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 M 8.68 3.52 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.31 0.00 249 V 7.25 3.01 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 0.64 0.00 0.00 0.83 0.00 0.00 250 A 7.66 3.91 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 251 D 7.81 4.20 0.00 2.17 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 V 7.45 3.40 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 0.83 0.00 0.00 0.36 0.00 0.00 253 H 8.34 4.30 0.00 3.33 3.27 0.00 5.89 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 0.00 254 R 7.93 3.87 0.00 2.00 2.04 0.00 3.03 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 1.63 1.61 0.00 255 T 7.80 3.96 4.41 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 1.34 0.00 0.00 256 L 7.70 3.95 0.00 1.75 1.87 0.93 0.83 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 0.00 257 V 7.88 3.87 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 1.01 0.00 0.00 258 Y 8.37 4.27 0.00 2.85 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 G 7.60 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 0.00 0.00 0.00 260 G 6.74 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 261 I 8.18 5.09 2.07 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 1.22 1.55 1.37 0.00 0.00 262 F 9.15 5.48 0.00 3.21 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 263 M 8.35 4.92 0.00 1.75 1.69 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.35 0.00 264 Y 8.81 4.55 0.00 2.98 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 0.00 265 P 0.00 5.13 0.00 2.07 1.96 0.00 3.51 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 266 A 8.60 4.27 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 0.00 267 N 8.34 5.42 0.00 2.76 2.76 0.00 0.00 6.47 6.76 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 0.00 268 K 7.94 4.37 0.00 1.68 1.87 0.00 1.59 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.39 7.81 269 K 8.16 4.12 0.00 1.68 1.91 0.00 1.85 0.00 0.00 1.68 0.00 0.00 3.11 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.42 1.48 7.81 270 S 8.21 4.59 0.00 3.98 3.83 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 0.00 271 P 0.00 4.36 0.00 2.18 2.19 0.00 3.75 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 1.99 1.99 0.00 272 K 8.20 4.29 0.00 1.76 1.85 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.35 7.81 273 G 8.06 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 0.00 274 K 8.29 4.17 0.00 1.69 1.07 0.00 1.79 0.00 0.00 1.30 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.22 1.42 7.81 275 L 7.42 4.28 0.00 1.70 1.52 1.06 0.76 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 0.00 276 R 8.53 4.26 0.00 1.80 0.98 0.00 3.17 0.00 0.00 3.05 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 277 L 8.90 3.89 0.00 1.64 1.63 0.91 0.61 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 0.00 278 L 7.57 4.08 0.00 1.64 1.85 1.04 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 279 Y 7.00 4.93 0.00 3.03 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 280 E 7.93 4.52 0.00 2.15 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 281 C 8.40 4.24 0.00 2.94 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 282 N 8.28 4.36 0.00 2.85 2.85 0.00 0.00 7.15 8.04 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 0.00 283 P 0.00 4.18 0.00 2.13 2.15 0.00 3.67 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 284 M 7.72 4.13 0.00 2.07 2.21 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.74 0.00 285 A 8.38 4.07 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 0.00 286 Y 8.31 3.96 0.00 3.18 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 0.00 287 V 8.08 3.54 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.04 0.00 0.00 288 M 8.09 4.00 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.92 0.00 289 E 8.20 4.39 0.00 2.00 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 2.50 2.33 0.00 290 K 7.75 3.94 0.00 1.78 1.73 0.00 1.65 0.00 0.00 1.52 0.00 0.00 2.64 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.91 1.02 7.81 291 A 7.30 4.69 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 0.00 292 G 8.10 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 0.00 0.00 0.00 293 G 8.16 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 0.00 0.00 0.00 0.00 294 L 8.68 5.25 0.00 1.57 1.53 0.92 0.71 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 0.00 295 A 8.31 5.02 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 0.00 296 T 9.04 5.13 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 1.16 0.00 0.00 297 T 8.96 4.28 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 1.24 0.00 0.00 298 G 8.04 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 299 K 7.29 4.26 0.00 1.60 1.75 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.25 1.23 7.81 300 E 7.95 4.58 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 2.15 2.21 0.00 301 A 8.28 4.44 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 0.00 302 V 8.41 3.64 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 0.96 0.00 0.00 0.95 0.00 0.00 303 L 8.01 4.13 0.00 1.80 1.85 1.08 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 304 D 7.53 4.75 0.00 2.71 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 305 I 7.72 3.81 1.97 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.43 0.90 0.00 0.00 306 V 8.26 4.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.97 0.00 0.00 307 P 0.00 4.88 0.00 2.20 2.01 0.00 3.73 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.06 0.00 308 T 9.10 4.45 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 309 D 7.92 4.91 0.00 2.72 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 310 I 8.49 3.84 1.86 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.51 0.91 0.00 0.00 311 H 8.05 4.90 0.00 3.39 3.36 0.00 5.66 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 312 Q 7.79 4.23 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.40 6.64 0.00 0.00 0.00 0.00 0.00 2.45 2.30 0.00 313 R 8.37 4.95 0.00 1.69 1.94 0.00 3.30 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 314 A 8.67 4.84 1.15 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 0.00 315 P 0.00 4.54 0.00 2.09 2.09 0.00 3.75 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 1.96 1.95 0.00 316 I 8.41 4.75 1.93 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 1.36 1.29 1.10 0.00 0.00 317 I 9.21 5.01 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.38 0.85 0.00 0.00 318 L 9.17 5.22 0.00 1.82 1.82 1.02 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 319 G 8.29 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 0.00 320 S 8.06 4.42 0.00 4.09 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 0.00 321 P 0.00 4.29 0.00 2.27 2.33 0.00 3.92 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 2.25 2.08 0.00 322 E 8.26 4.05 0.00 2.25 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 0.00 2.36 2.38 0.00 323 D 8.10 4.52 0.00 2.83 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 0.00 324 V 7.66 3.58 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.04 0.00 0.00 325 T 8.08 3.91 4.47 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 1.23 0.00 0.00 326 E 7.87 4.07 0.00 2.27 2.34 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 2.54 2.41 0.00 327 L 7.59 3.88 0.00 0.86 1.52 0.64 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 328 L 7.67 4.15 0.00 1.90 1.73 0.91 0.74 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 0.00 329 E 8.27 4.18 0.00 2.21 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 0.00 2.35 2.50 0.00 330 I 7.85 3.85 1.99 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.90 0.85 0.00 0.00 331 Y 7.60 4.08 0.00 3.22 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 0.00 332 Q 7.99 4.25 0.00 2.35 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 333 K 7.99 3.97 0.00 1.89 1.95 0.00 1.66 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.57 7.81 334 H 7.76 4.28 0.00 3.33 3.37 0.00 5.65 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 335 A 7.71 4.23 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.