NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.7650 8.4249 117.7893 51.6233 38.3195 173.6472 4 K 3.9059 8.6984 124.2720 58.4231 32.2763 177.1580 5 I 4.2320 7.1713 121.7455 59.2605 36.7901 174.8773 6 T 3.9698 8.2010 114.5208 63.5596 68.6472 174.7240 7 K 4.1967 7.4796 119.6895 56.6076 34.7408 173.8392 8 E 4.4274 8.7083 114.8632 54.5777 30.7694 171.7052 9 A 4.8463 8.3466 125.3501 49.3631 21.4352 175.7402 10 L 4.8821 9.2048 121.5734 53.3168 44.6758 176.7109 11 T 4.3247 8.6978 113.9624 60.0114 71.3395 175.3495 12 F 4.4198 8.2811 118.7409 61.0778 38.9331 177.2274 13 D 4.6574 7.8168 117.8913 56.0394 40.9932 176.6059 14 D 4.7749 7.9415 119.5113 54.1798 40.9576 175.7997 15 V 5.0442 7.2166 116.7621 60.6779 34.6843 174.0442 16 S 4.8251 8.9069 115.1407 57.0075 66.2657 172.7036 17 L 4.7012 8.5089 125.0124 54.0615 42.8195 176.2092 18 I 4.1820 8.1448 124.6235 59.5820 37.7044 174.2791 19 P 4.6633 0.0000 0.0000 63.4456 31.9881 175.5353 20 R 4.7733 8.9417 120.1155 53.7805 34.6730 175.0520 21 K 3.9748 8.7216 121.9131 57.0899 32.3963 175.8852 22 S 4.8445 8.6978 121.4926 56.7532 64.5744 173.4647 23 S 4.6899 8.5236 118.8900 57.8204 64.7264 174.3642 24 V 4.6514 7.2935 112.3704 59.3076 34.3470 175.1999 25 L 4.4978 8.2620 122.3076 52.8361 42.9294 176.1824 26 P 4.2742 0.0000 0.0000 65.8735 31.3824 178.6926 27 S 4.3290 7.9676 110.7641 60.1762 63.3135 174.4785 28 E 4.3551 8.1445 119.5506 56.3167 29.8213 176.5935 29 V 3.9005 7.1616 118.0895 62.6376 32.4817 174.6925 30 S 4.7275 9.1722 120.9457 56.7393 63.9135 174.0094 31 L 4.6595 8.5610 125.8628 54.5372 42.2061 176.7273 32 K 4.2838 7.5462 120.4628 57.3129 33.0335 175.7631 33 T 4.6441 8.7597 119.8696 61.5125 71.5692 171.3788 34 Q 4.8695 8.5223 120.6691 54.3115 30.5212 175.9627 35 L 4.2344 9.1026 126.3192 56.9970 41.3758 176.0108 36 T 4.7550 7.3001 106.4526 59.6316 71.8871 174.2660 37 K 4.1898 8.6173 119.7557 59.2394 32.6982 177.5488 38 N 4.6677 7.4796 115.0925 53.4710 39.6045 174.7431 39 I 4.6440 7.9121 119.8012 59.4126 40.1176 175.4487 40 S 5.1013 8.7557 121.5954 56.9388 65.6527 173.0039 41 L 4.9593 8.9097 119.4055 53.2782 45.2050 177.3338 42 N 4.8352 9.1195 118.0622 54.3252 39.6270 175.7084 43 I 4.9605 7.5979 111.6227 57.6207 40.8839 175.5007 44 P 4.5777 0.0000 0.0000 62.7927 30.2781 175.5397 45 F 5.5181 8.3183 117.4672 56.8894 43.1460 174.7109 46 L 5.2814 8.9855 121.5708 53.0074 45.8583 175.4778 47 S 5.3473 8.6557 117.2791 56.8597 64.9256 173.5919 48 S 4.1879 9.0725 119.3522 58.0462 62.7478 174.4408 49 A 5.0519 8.0821 128.3268 51.5476 17.8420 177.3613 50 M 4.6825 7.4698 122.2095 53.2562 34.6197 177.5757 51 D 3.8333 8.5963 121.4931 54.9134 39.5413 176.4963 52 T 4.4285 7.6191 113.1860 62.3079 68.3693 174.8745 53 V 4.2879 8.2834 111.9424 62.6746 34.8578 175.2377 54 T 4.5680 7.8844 116.4955 61.8273 70.5642 172.4938 55 E 4.8852 8.2298 127.0457 54.2933 33.4851 175.6129 56 S 4.1110 9.0023 113.8765 62.8330 62.6760 176.5974 57 Q 3.9152 7.9659 120.9835 58.7093 28.5334 178.2045 58 M 3.9231 7.9342 118.6491 58.3440 32.4956 177.9105 59 A 3.9511 8.0198 120.9662 55.1595 18.5327 179.7298 60 I 3.3501 7.7108 117.9267 64.3453 37.2803 178.3436 61 A 3.7598 7.5881 121.5357 55.3548 18.1035 179.4920 62 I 3.7049 7.7529 116.4138 63.6280 37.9685 177.8965 63 A 4.7974 7.7300 123.0934 54.4573 18.0178 179.6548 64 K 3.7715 8.1269 116.7528 58.7747 31.7902 178.6301 65 E 4.5050 7.3376 116.5802 55.8891 30.0847 176.5521 66 G 4.2177 7.9478 105.6540 44.9383 0.0000 173.3941 67 G 4.7012 8.5032 109.5406 45.1608 0.0000 172.2116 68 I 4.9617 8.1584 119.7792 59.5008 42.0729 175.5692 69 G 4.7758 8.7123 114.8132 45.5583 0.0000 172.4965 70 I 4.8390 7.9702 123.6590 58.8938 39.5840 175.1687 71 I 4.3037 8.5030 129.4542 61.7207 37.8515 176.1713 72 H 4.8464 8.5791 122.9059 55.5166 29.1869 175.5971 73 K 4.2679 8.6098 117.1391 57.1071 33.6779 176.5520 74 N 4.7235 8.0585 120.0695 52.2360 37.7486 172.9194 75 M 4.6294 7.1923 114.6583 52.9280 34.4490 175.4716 76 S 4.3134 8.3577 114.8122 58.6545 65.0729 175.3947 77 I 3.7956 8.3519 125.6387 65.0600 36.8730 179.2842 78 E 3.9783 8.1175 118.6319 60.9134 29.7014 181.3548 79 A 4.1720 7.8815 121.9780 55.1878 18.3879 179.6164 80 Q 3.8935 8.1630 117.9839 59.0676 29.0562 178.5236 81 R 3.8948 8.0429 122.0799 59.9121 30.1065 179.1660 82 K 4.1399 8.0747 123.5039 59.9269 31.7481 180.5438 83 E 4.1483 8.2674 119.7851 59.3785 29.3014 179.5710 84 I 3.7159 7.5510 119.5135 64.4902 37.1828 178.3721 85 E 3.9671 8.2166 119.3659 59.2119 29.0175 179.4820 86 K 3.9702 8.1205 118.0482 59.5230 32.2096 179.2362 87 V 3.7194 7.6495 117.8850 65.9775 31.3178 178.1227 88 K 4.2286 8.2942 116.7279 58.1344 31.8828 177.8111 89 T 4.5416 7.5118 108.2415 61.1556 68.9752 173.8679 90 Y 4.3084 7.6125 125.0128 58.3247 40.3924 177.1382 91 K 3.5319 7.5031 128.0540 57.0636 30.7428 179.4130 *130 D 4.5070 8.7256 111.6946 53.6046 42.0413 178.1773 131 F 4.7455 8.2287 117.4745 55.0368 39.7822 173.9420 132 P 4.2769 0.0000 0.0000 65.1881 31.5311 177.3725 133 N 4.6506 8.2303 112.8816 52.9359 39.0928 174.1143 134 A 4.2768 7.1852 120.1869 51.6315 19.3664 176.9239 135 C 4.6109 9.5014 122.6061 57.9037 33.0715 172.8045 136 K 5.2633 8.5635 124.9359 54.4123 35.7814 175.6808 137 D 4.7204 9.0854 122.1705 51.9600 40.7432 177.4035 138 L 4.1839 8.4275 118.7808 57.2639 41.5548 178.0201 139 N 4.7340 8.2425 114.4358 52.3690 38.6300 174.0373 140 N 4.2274 8.4949 115.0772 54.4649 38.2100 173.6871 141 K 4.6482 8.4252 115.2984 53.4690 34.1924 176.1600 142 L 4.3915 8.4649 122.4546 55.2958 42.0910 177.5605 143 R 4.4925 8.5606 122.4681 56.6868 31.0112 176.4327 144 V 4.2790 8.3919 118.0731 61.1605 35.1515 171.7566 145 G 4.7580 8.8317 109.1670 43.9774 0.0000 171.0381 146 A 5.2446 8.1788 119.2568 50.2918 22.5983 175.3383 147 A 5.0559 8.6941 123.7787 51.1545 20.5778 177.2739 148 V 4.6335 8.7674 119.3872 60.3036 35.2476 173.8957 149 S 4.9756 8.4324 116.5304 56.0419 66.6749 173.3483 150 I 3.8602 8.2326 120.9703 61.5490 37.0101 175.4784 151 D 4.6724 8.6765 127.1695 53.9366 44.8305 175.7328 152 I 4.0609 8.3368 116.7451 62.1994 35.8465 171.7639 153 D 5.1095 7.6719 118.7377 53.2894 40.0818 178.5104 154 T 3.8359 8.2480 117.8724 68.1216 68.7212 175.8297 155 I 3.7982 7.7855 121.1785 64.4556 37.0077 177.9697 156 E 3.9809 8.1321 119.6423 59.0826 29.5550 178.6710 157 R 3.8478 8.2174 119.1115 59.4244 30.2224 178.5108 158 V 3.4900 8.2422 120.8968 66.5943 31.5633 178.1594 159 E 4.3491 8.1231 119.2141 60.6939 29.5563 180.6777 160 E 4.1615 7.9348 120.6120 58.9613 29.5478 178.8819 161 L 3.9585 7.9217 119.1544 57.7958 41.6657 179.6938 162 V 3.5705 8.1875 118.5065 65.6811 31.1609 178.2670 163 K 4.0291 7.6918 117.2014 58.8729 31.9836 178.3562 164 A 4.0827 7.4936 118.2346 52.1305 18.9786 176.3951 165 H 4.1477 7.9738 113.3965 56.4717 26.2563 175.9889 166 V 3.8013 7.3384 118.4005 62.0004 32.0404 176.1245 167 D 4.6074 8.5151 122.8413 57.1192 41.4180 176.5278 168 I 4.6742 7.5219 116.2378 59.6150 41.7895 173.1085 169 L 4.9709 8.8638 129.1854 53.2026 45.3405 175.1669 170 V 4.6929 8.4638 125.2161 61.2004 33.6981 174.9039 171 I 4.3181 8.7452 130.8087 60.8670 37.4910 175.0979 172 D 4.8726 9.3002 129.4317 53.2948 41.0660 175.3572 173 S 4.7891 8.3275 119.7409 56.3841 65.8317 174.6275 174 A 4.1424 8.8322 127.6283 54.6000 17.5995 177.4507 175 H 4.8815 8.2348 115.5450 53.8750 30.0903 173.6500 176 G 3.7243 8.9383 114.0830 48.0398 0.0000 171.8269 177 H 4.6653 7.1405 118.9034 54.9416 28.4686 174.8464 178 S 4.7335 7.2733 116.7515 55.7908 68.0020 175.0038 179 T 3.8686 8.4338 113.9086 65.1380 68.4154 176.9021 180 R 3.9279 7.8773 120.3541 59.1971 30.2321 178.9124 181 I 3.7810 7.4538 118.3567 64.2768 37.1573 178.5136 182 I 3.7298 7.9219 120.7740 64.5686 36.9672 178.3949 183 E 4.0353 8.3080 119.3682 59.1455 29.2638 179.1383 184 L 4.0160 7.9309 120.6257 58.0808 42.0274 179.1727 185 I 3.7570 7.8773 119.8755 64.1277 36.9293 178.3169 186 K 3.9083 7.8696 118.8637 59.5224 31.9675 179.3488 187 K 3.9441 8.0496 118.3263 59.7446 32.0056 179.4900 188 I 3.9422 7.8749 119.8808 64.4230 36.8941 178.5047 189 K 4.1679 8.5612 118.8338 58.7835 31.6569 179.2165 190 T 4.1727 7.3986 115.4659 65.7622 68.8441 176.7027 191 K 4.0836 7.9718 119.1070 57.6313 33.6221 177.2675 192 Y 4.7985 8.0536 116.9754 55.1968 39.0801 173.5125 193 P 4.4506 0.0000 0.0000 64.6146 31.7924 177.9575 194 N 4.6950 8.0593 113.3603 52.6156 38.8014 174.1635 195 L 4.2765 7.6254 121.6668 54.0352 42.3787 176.1632 196 D 4.7711 8.6737 126.7155 54.5311 42.2484 175.2519 197 L 5.1527 9.7506 122.8771 53.0329 45.0672 175.3660 198 I 4.7705 9.0435 125.0586 59.9040 38.8553 174.5503 199 A 4.6554 9.6459 129.8064 51.4350 20.6799 175.9989 200 G 3.5352 8.1995 109.0523 41.0000 0.0000 174.1174 201 N 5.7146 8.7350 116.8705 52.3838 39.7762 174.8689 202 I 5.0491 8.2795 115.5356 59.4438 41.7719 175.9849 203 V 4.4241 8.3894 111.9893 60.2438 34.4041 175.7776 204 T 4.7401 7.4612 110.4696 59.0475 73.0446 174.5830 205 K 3.9510 8.4303 122.4308 59.7734 32.4481 179.0062 206 E 3.9637 8.1369 118.2699 59.2236 29.4528 179.0001 207 A 3.3434 7.7328 120.5834 54.7852 18.4138 179.4841 208 A 3.9858 7.9697 121.4228 55.9191 18.4508 180.5487 209 L 3.9883 7.8593 120.7423 59.6028 40.6834 181.2680 210 D 4.5494 7.9562 119.4400 57.3214 40.9359 178.9585 211 L 4.0456 8.0192 119.5004 57.7469 41.6168 179.6107 212 I 3.7299 7.8506 119.8297 64.5114 36.8607 178.5886 213 S 4.2973 8.0258 114.5735 60.5201 62.5510 175.5822 214 V 4.2598 7.2744 113.7997 61.0531 31.7117 176.3721 215 G 3.8895 8.3240 106.8021 45.2470 0.0000 174.1215 216 A 4.1258 7.6072 122.5295 52.2246 19.0049 178.1597 217 D 4.7293 8.9600 122.5333 55.8809 42.5390 176.0095 218 C 5.0264 7.8842 117.4078 57.9501 35.4647 172.2597 219 L 4.9155 8.7732 124.7484 52.8416 44.1978 175.2068 220 K 4.7415 8.4301 125.8098 55.1511 33.7023 175.1099 221 V 4.6198 9.7488 128.8974 60.2339 33.4091 174.1793 222 G 4.3716 7.2743 126.2527 45.5727 0.0000 172.2175 223 I 4.2683 7.5631 128.5754 60.3014 40.3728 175.9521 224 G 4.1065 8.9035 117.0025 45.7786 0.0000 172.8902 225 P 4.3632 0.0000 0.0000 64.3684 32.1115 176.8761 226 G 4.2375 7.5797 106.2470 43.0943 0.0000 173.8822 227 S 4.1243 8.6544 117.3519 61.0552 62.9754 175.8172 228 I 4.0176 7.5848 111.5298 62.1528 38.2154 176.5726 229 C 4.3361 7.9251 120.6099 59.8286 29.8180 174.6061 230 T 3.8668 8.4264 120.9853 67.1551 68.1593 177.2488 231 T 3.9673 7.7867 117.2094 66.5396 68.5595 176.9938 232 R 4.1364 7.7499 120.9121 58.6793 29.9678 179.0816 233 I 3.7002 7.6683 118.5403 64.3833 37.2879 178.4534 234 V 3.7217 8.0996 117.7087 65.3774 30.8802 177.0813 235 A 4.6104 8.1734 118.1443 50.6512 19.4124 177.3604 236 G 4.5243 7.9297 104.3158 45.2415 0.0000 173.5987 237 V 4.3414 8.4122 118.7539 60.3383 33.8905 173.9446 238 G 4.2210 7.4593 110.3705 44.3464 0.0000 172.8132 239 V 4.3161 7.9707 121.3676 59.1536 34.4429 174.2214 240 P 4.2412 0.0000 0.0000 63.1264 32.8088 176.6917 241 Q 3.7793 8.4228 122.5066 59.5033 28.7488 179.1104 242 I 3.5950 7.1959 119.9261 64.6950 37.1434 178.4481 243 T 3.7962 7.5664 116.4042 66.2893 68.2118 176.5392 244 A 3.9486 8.0257 122.7418 55.2832 18.4000 179.6770 245 I 3.6337 8.1369 118.3419 64.8964 37.2506 178.3622 246 C 4.3690 8.3419 117.7098 63.0622 27.7126 176.0780 247 D 4.3349 8.2785 119.6278 57.7134 40.7552 179.0812 248 V 3.7886 7.8485 112.8388 64.3096 31.4910 178.0906 249 Y 4.2389 8.6530 122.3985 61.3061 38.4475 178.2732 250 E 3.9608 8.5014 114.5748 58.6522 29.5099 178.3439 251 A 4.6600 7.5420 122.0158 54.9166 21.0164 177.6589 252 C 4.4457 8.2978 111.9299 59.7004 28.2474 173.2224 253 N 4.1166 7.5670 121.1695 55.2560 38.9332 175.5517 254 N 4.4828 8.8400 120.0214 52.4747 35.6287 173.2790 255 T 4.6030 7.4395 109.2082 61.8260 71.1892 174.2006 256 N 4.8859 8.4906 115.6973 52.2617 37.8595 173.2983 257 I 4.4622 7.3547 120.0433 61.2042 38.5925 175.9896 258 C 4.8162 8.2816 123.9710 59.0536 30.6925 172.4581 259 I 5.1382 9.2278 120.2293 59.8359 40.7398 174.7519 260 I 4.8374 8.8613 127.5932 59.5303 39.7403 174.5859 261 A 4.7427 9.0409 129.8220 50.8616 20.0432 175.2738 262 D 4.8450 9.1457 123.2216 54.6759 42.4918 177.0248 263 G 3.9008 8.3443 113.2392 47.4081 0.0000 173.4979 264 G 3.9470 8.6853 109.2804 45.0319 0.0000 173.5061 265 I 3.7644 7.4956 120.5164 61.2174 36.9126 175.3919 266 R 4.0178 8.8692 125.5972 56.6045 31.4805 176.7230 267 F 5.0626 7.4851 114.2299 54.4540 42.9858 175.6915 268 S 4.3029 8.8909 117.1913 61.7659 62.5333 176.9017 269 G 3.7277 8.1996 108.7318 47.6458 0.0000 175.2656 270 D 3.9109 8.1758 121.3089 56.8545 40.6541 178.9300 271 V 3.4525 7.4635 118.4446 65.8145 31.5895 177.9775 272 V 3.5686 7.5587 117.4742 66.1184 31.3128 178.1835 273 K 4.2457 8.1295 117.9174 59.4146 31.9782 179.1676 274 A 4.2021 8.3482 121.3987 55.4285 18.3120 179.8468 275 I 3.8971 8.1420 119.3766 63.8568 36.9832 178.5208 276 A 4.1593 8.3187 121.8650 54.4769 18.2104 179.2583 277 A 4.3458 8.2526 118.6514 53.9500 18.5714 177.0028 278 G 2.3263 7.1669 108.3908 44.6480 0.0000 174.0334 279 A 4.2043 7.7251 125.1720 52.3175 19.0056 177.8219 280 D 4.7281 8.9173 120.7385 55.8000 42.3324 176.4709 281 S 4.7612 7.6708 111.5444 57.0833 67.1707 173.2588 282 V 4.8560 8.4732 118.6739 60.1505 34.5710 174.0373 283 M 5.0410 9.3347 124.3692 54.2652 34.1007 174.5323 284 I 4.0856 8.9894 126.9192 59.7218 40.2196 174.4979 285 G 3.9782 8.5457 112.2931 45.7783 0.0000 174.1934 286 N 4.1096 8.0853 116.5308 56.2769 39.0012 177.2133 287 L 4.0172 7.6842 117.6964 56.9032 41.9412 178.2913 288 F 5.0284 8.1540 116.7200 58.0177 39.6822 177.4215 289 A 4.1638 7.9706 120.3571 54.7552 18.3021 178.1267 290 G 4.0539 7.9292 102.5314 46.7409 0.0000 174.3404 291 T 4.3715 7.9807 111.9048 61.1186 69.8836 175.5802 292 K 4.2028 8.5061 124.6020 60.0752 31.9961 178.2620 293 E 4.1240 8.3173 117.1301 58.2123 29.8045 177.5715 294 S 4.5437 7.5765 114.0542 56.9178 63.4561 173.6226 295 P 4.2203 0.0000 0.0000 65.5167 31.2494 176.6859 296 S 4.4761 7.6538 116.3520 59.3630 63.8306 173.8947 297 E 4.8136 8.5085 118.1335 54.7975 32.5047 174.4217 298 E 4.7051 8.8981 125.6393 56.5173 30.4624 177.0110 299 I 4.6469 9.1646 123.7931 58.7468 39.8801 171.8009 300 I 4.6116 8.6835 129.9563 60.0177 38.4458 175.6304 *301 Y 4.3279 9.1086 128.0422 55.8349 38.0811 172.6351 302 N 4.0626 9.7717 123.9782 52.8072 35.9381 174.5082 303 G 4.0331 8.0680 108.1019 45.9275 0.0000 172.1081 304 K 4.4682 8.1755 119.1725 54.8063 34.2691 174.8787 305 K 5.0704 7.8364 120.7249 55.0360 35.5407 174.6508 306 F 5.3815 9.7528 124.2427 56.3557 44.6585 173.0276 307 K 5.2153 9.3876 118.6970 55.1141 34.8463 176.1696 308 S 4.8383 9.2443 122.6720 57.7196 67.4190 174.3654 *345 M 4.6192 8.5550 122.0137 55.2186 32.5825 175.2066 346 V 4.7110 8.4261 124.7448 57.8740 34.2675 173.7694 347 P 4.3601 0.0000 0.0000 63.0151 31.5842 175.4949 348 Y 4.3808 8.2764 124.2827 58.2847 39.1526 176.0055 349 S 4.2865 8.1506 121.6797 57.7927 65.0758 174.7762 350 G 3.4370 5.6450 106.4972 43.5466 0.0000 172.2829 351 K 4.2780 8.3277 117.1146 56.4130 32.7659 177.5240 352 L 3.6460 8.9884 125.2194 58.4370 41.8544 179.2230 353 K 3.7174 8.0949 118.6288 60.0665 31.9499 178.0491 354 D 4.3287 8.1931 118.9450 57.3184 40.6893 178.8229 355 I 3.7310 7.5390 119.8809 64.2599 37.2111 178.2645 356 L 3.7301 8.1222 120.2540 58.0316 41.4197 179.6663 357 T 3.8560 7.9007 115.6302 66.5866 68.3804 176.4442 358 Q 3.9550 7.8887 120.9170 59.2279 29.1963 178.3651 359 L 4.0540 7.9977 120.4355 57.5915 41.5534 179.6179 360 K 4.3656 8.7152 119.3666 59.6248 32.5014 179.5943 361 G 3.7016 8.2613 107.2338 47.7770 0.0000 175.9586 362 G 3.7492 8.0402 110.0099 46.6301 0.0000 175.5569 363 L 4.0158 7.9289 122.4424 58.3302 42.0858 179.0008 364 M 4.0640 8.4155 118.9957 58.3526 31.8818 178.6534 365 S 4.1775 8.4985 113.6902 61.4209 62.4798 176.4455 366 G 3.7765 8.4267 108.5469 48.2626 0.0000 175.5935 367 M 4.2338 8.5441 121.4712 57.8663 31.9173 179.0516 368 G 3.5483 8.3568 106.3911 48.1472 0.0000 175.4112 369 Y 4.1590 8.2583 119.1661 59.7935 37.6003 177.6178 370 L 4.5832 7.4895 117.4181 53.1185 42.6810 176.2377 371 G 3.8097 7.8179 106.2045 46.7415 0.0000 173.9234 372 A 4.6119 8.1476 121.5771 50.0109 21.0328 177.4491 373 A 4.3230 8.6919 126.0123 53.5404 19.9377 176.6527 374 T 5.2071 7.4327 105.6824 58.0284 73.4473 175.0329 375 I 3.6775 8.1728 121.6451 64.6189 36.9487 178.5391 376 S 4.1301 8.0592 113.4443 61.5545 62.0930 175.8828 377 D 4.3559 7.8529 121.7841 57.0299 40.1530 178.3556 378 L 3.8906 7.7794 120.5081 58.1663 41.8330 179.2822 379 K 4.0927 7.8305 117.3981 58.5498 32.0074 178.5875 380 I 4.2608 7.3795 112.2449 61.6638 39.8179 176.4444 381 N 4.7765 7.9007 119.3102 50.5018 37.1095 173.6416 382 S 4.5297 7.3510 112.2229 56.7635 66.1284 173.3190 383 K 4.6829 8.1012 124.6144 54.8479 36.4890 175.1417 384 F 5.5126 8.9499 120.8109 55.9887 42.4475 174.9790 385 V 4.6246 8.7180 113.2267 59.5495 34.9672 175.2513 386 K 4.6733 8.5953 122.9333 56.0534 33.3273 176.4707 387 I 4.1700 8.7116 129.0127 60.2924 38.3059 177.1680 388 S 4.5992 8.7977 126.5738 58.9179 62.5482 172.9183 *389 H 3.7566 8.7232 121.3976 56.9737 26.7284 178.7147 390 S 4.2147 8.7320 111.9683 60.5722 62.0666 168.1478 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 3 N 8.42 4.77 0.00 2.76 2.73 0.00 0.00 6.71 6.56 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 4 K 8.70 3.91 0.00 1.81 1.91 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.46 7.81 5 I 7.17 4.23 1.86 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 1.46 0.79 0.90 0.00 0.00 6 T 8.20 3.97 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 1.27 0.00 0.00 7 K 7.48 4.20 0.00 1.81 1.80 0.00 1.55 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.22 1.33 7.81 8 E 8.71 4.43 0.00 2.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.86 0.00 9 A 8.35 4.85 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 10 L 9.20 4.88 0.00 1.38 1.42 0.80 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.70 4.32 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 1.18 0.00 0.00 12 F 8.28 4.42 0.00 3.19 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 13 D 7.82 4.66 0.00 2.71 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 14 D 7.94 4.77 0.00 2.58 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 15 V 7.22 5.04 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 0.33 0.00 0.00 0.70 0.00 0.00 16 S 8.91 4.83 0.00 3.94 3.71 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 17 L 8.51 4.70 0.00 1.49 1.43 0.86 -0.03 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 18 I 8.14 4.18 1.83 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 1.23 0.61 0.90 0.00 0.00 19 P 0.00 4.66 0.00 1.98 2.17 0.00 3.61 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 2.03 2.07 0.00 20 R 8.94 4.77 0.00 1.62 1.78 0.00 3.16 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 21 K 8.72 3.97 0.00 1.77 1.73 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.71 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.44 7.81 22 S 8.70 4.84 0.00 3.90 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.52 4.69 0.00 3.83 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 24 V 7.29 4.65 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 0.70 0.00 0.00 0.95 0.00 0.00 25 L 8.26 4.50 0.00 1.68 1.53 0.88 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 26 P 0.00 4.27 0.00 2.15 2.12 0.00 3.54 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 27 S 7.97 4.33 0.00 3.97 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 28 E 8.14 4.36 0.00 2.01 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 2.28 2.22 0.00 29 V 7.16 3.90 2.30 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 0.73 0.00 0.00 0.98 0.00 0.00 30 S 9.17 4.73 0.00 3.88 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 31 L 8.56 4.66 0.00 1.75 1.73 1.04 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 32 K 7.55 4.28 0.00 1.83 1.72 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.56 7.81 33 T 8.76 4.64 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 1.22 0.00 0.00 34 Q 8.52 4.87 0.00 1.95 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 6.74 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 35 L 9.10 4.23 0.00 1.55 1.86 0.93 0.89 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 36 T 7.30 4.76 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 1.22 0.00 0.00 37 K 8.62 4.19 0.00 1.89 2.16 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.47 7.81 38 N 7.48 4.67 0.00 2.97 2.91 0.00 0.00 6.77 7.33 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 39 I 7.91 4.64 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 1.29 0.82 0.92 0.00 0.00 40 S 8.76 5.10 0.00 4.02 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.91 4.96 0.00 1.54 1.83 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 42 N 9.12 4.84 0.00 2.72 2.90 0.00 0.00 6.70 8.05 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 43 I 7.60 4.96 2.25 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.91 1.02 0.00 0.00 44 P 0.00 4.58 0.00 1.78 2.15 0.00 3.70 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.79 0.00 45 F 8.32 5.52 0.00 3.11 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 46 L 8.99 5.28 0.00 1.68 1.58 0.95 0.58 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 47 S 8.66 5.35 0.00 4.12 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 S 9.07 4.19 0.00 3.89 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 49 A 8.08 5.05 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 50 M 7.47 4.68 0.00 2.06 1.97 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 2.60 2.49 0.00 51 D 8.60 3.83 0.00 2.48 2.46 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 52 T 7.62 4.43 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 1.22 0.00 0.00 53 V 8.28 4.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.11 0.00 0.00 54 T 7.88 4.57 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 55 E 8.23 4.89 0.00 1.99 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 2.28 2.36 0.00 56 S 9.00 4.11 0.00 4.01 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 7.97 3.92 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.96 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 58 M 7.93 3.92 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.78 0.00 59 A 8.02 3.95 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 60 I 7.71 3.35 1.57 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 1.17 0.60 -0.03 0.00 0.00 61 A 7.59 3.76 1.25 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 0.00 0.00 62 I 7.75 3.70 1.70 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 1.46 1.51 0.93 0.00 0.00 63 A 7.73 4.80 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 64 K 8.13 3.77 0.00 1.63 1.22 0.00 0.82 0.00 0.00 1.16 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.01 1.21 7.81 65 E 7.34 4.51 0.00 2.19 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 2.53 2.40 0.00 66 G 7.95 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.50 4.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 I 8.16 4.96 1.89 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 1.17 1.35 0.94 0.00 0.00 69 G 8.71 4.78 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 70 I 7.97 4.84 1.90 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 1.24 0.92 0.00 0.00 71 I 8.50 4.30 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 1.47 0.82 0.84 0.00 0.00 72 H 8.58 4.85 0.00 3.16 3.20 0.00 5.74 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 K 8.61 4.27 0.00 1.88 2.10 0.00 1.58 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.43 7.81 74 N 8.06 4.72 0.00 2.74 2.90 0.00 0.00 6.88 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 M 7.19 4.63 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 76 S 8.36 4.31 0.00 4.06 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 77 I 8.35 3.80 1.87 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 1.11 0.90 0.00 0.00 78 E 8.12 3.98 0.00 1.97 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 2.31 1.94 0.00 79 A 7.88 4.17 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 80 Q 8.16 3.89 0.00 2.26 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 81 R 8.04 3.89 0.00 1.94 2.05 0.00 3.23 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 82 K 8.07 4.14 0.00 1.82 1.81 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.38 1.36 7.81 83 E 8.27 4.15 0.00 2.11 2.01 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 2.54 2.47 0.00 84 I 7.55 3.72 2.02 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 1.79 0.88 0.93 0.00 0.00 85 E 8.22 3.97 0.00 2.20 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 2.32 2.45 0.00 86 K 8.12 3.97 0.00 1.90 1.90 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.68 7.81 87 V 7.65 3.72 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 0.98 0.00 0.00 0.94 0.00 0.00 88 K 8.29 4.23 0.00 1.86 1.89 0.00 1.75 0.00 0.00 1.94 0.00 0.00 3.17 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.58 1.76 7.81 89 T 7.51 4.54 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 1.27 0.00 0.00 90 Y 7.61 4.31 0.00 2.94 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.50 3.53 0.00 1.81 1.45 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.36 1.02 7.81 *130 D 8.73 4.51 0.00 2.72 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 0.00 131 F 8.23 4.75 0.00 3.09 3.24 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 0.00 132 P 0.00 4.28 0.00 2.06 2.13 0.00 3.67 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 2.01 2.10 0.00 133 N 8.23 4.65 0.00 2.94 2.88 0.00 0.00 6.99 7.25 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 0.00 134 A 7.19 4.28 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 C 9.50 4.61 0.00 2.98 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 0.00 136 K 8.56 5.26 0.00 1.65 1.76 0.00 1.82 0.00 0.00 1.88 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.41 7.81 137 D 9.09 4.72 0.00 2.85 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.43 4.18 0.00 1.65 1.79 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.24 4.73 0.00 2.82 2.81 0.00 0.00 6.88 8.00 0.00 0.00 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 N 8.49 4.23 0.00 2.79 2.87 0.00 0.00 6.96 6.55 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 0.00 141 K 8.43 4.65 0.00 2.15 1.70 0.00 1.96 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.53 1.54 7.81 142 L 8.46 4.39 0.00 1.79 1.58 0.74 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 0.00 143 R 8.56 4.49 0.00 1.68 1.86 0.00 3.39 0.00 0.00 3.37 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 144 V 8.39 4.28 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 0.58 0.00 0.00 0.97 0.00 0.00 145 G 8.83 4.76 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 0.00 146 A 8.18 5.24 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 A 8.69 5.06 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 0.00 148 V 8.77 4.63 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 0.75 0.00 0.00 0.92 0.00 0.00 149 S 8.43 4.98 0.00 3.85 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 I 8.23 3.86 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 1.42 0.54 0.92 0.00 0.00 151 D 8.68 4.67 0.00 2.59 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 0.00 152 I 8.34 4.06 1.87 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 1.47 0.62 0.91 0.00 0.00 153 D 7.67 5.11 0.00 2.93 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 T 8.25 3.84 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 155 I 7.79 3.80 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.23 1.01 0.00 0.00 156 E 8.13 3.98 0.00 2.05 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 0.00 2.39 2.38 0.00 157 R 8.22 3.85 0.00 2.00 2.09 0.00 3.15 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 1.59 1.62 0.00 158 V 8.24 3.49 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 0.24 0.00 0.00 0.89 0.00 0.00 159 E 8.12 4.35 0.00 2.03 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 2.07 0.00 160 E 7.93 4.16 0.00 2.16 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 2.30 2.38 0.00 161 L 7.92 3.96 0.00 1.80 1.63 0.91 0.63 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 0.00 162 V 8.19 3.57 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 1.13 0.00 0.00 0.41 0.00 0.00 163 K 7.69 4.03 0.00 1.99 1.82 0.00 1.91 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.68 7.81 164 A 7.49 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 0.00 165 H 7.97 4.15 0.00 3.36 3.42 0.00 5.68 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 V 7.34 3.80 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 0.63 0.00 0.00 1.00 0.00 0.00 167 D 8.52 4.61 0.00 2.70 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 I 7.52 4.67 1.87 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 1.23 1.32 0.91 0.00 0.00 169 L 8.86 4.97 0.00 1.72 1.42 0.91 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 170 V 8.46 4.69 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 1.01 0.00 0.00 0.94 0.00 0.00 171 I 8.75 4.32 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.18 0.92 0.00 0.00 172 D 9.30 4.87 0.00 2.69 2.62 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 0.00 173 S 8.33 4.79 0.00 3.89 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 0.00 174 A 8.83 4.14 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 H 8.23 4.88 0.00 3.15 3.15 0.00 5.79 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 0.00 176 G 8.94 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 0.00 0.00 0.00 177 H 7.14 4.67 0.00 3.01 3.11 0.00 5.72 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 S 7.27 4.73 0.00 4.01 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 0.00 179 T 8.43 3.87 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 0.00 180 R 7.88 3.93 0.00 1.88 2.02 0.00 3.13 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 181 I 7.45 3.78 1.93 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 1.52 0.71 1.00 0.00 0.00 182 I 7.92 3.73 2.02 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 1.53 1.11 0.92 0.00 0.00 183 E 8.31 4.04 0.00 2.15 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 2.49 2.46 0.00 184 L 7.93 4.02 0.00 1.96 1.78 0.93 1.08 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 0.00 185 I 7.88 3.76 2.02 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 1.53 0.78 0.97 0.00 0.00 186 K 7.87 3.91 0.00 2.04 1.88 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.67 7.81 187 K 8.05 3.94 0.00 1.98 1.89 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.80 7.81 188 I 7.87 3.94 1.93 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 1.61 0.79 0.99 0.00 0.00 189 K 8.56 4.17 0.00 1.91 1.88 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.29 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.64 7.81 190 T 7.40 4.17 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 1.18 0.00 0.00 191 K 7.97 4.08 0.00 1.60 1.13 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.54 7.81 192 Y 8.05 4.80 0.00 3.13 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 0.00 193 P 0.00 4.45 0.00 2.19 2.20 0.00 3.37 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.95 0.00 194 N 8.06 4.69 0.00 2.77 2.90 0.00 0.00 6.84 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 L 7.63 4.28 0.00 1.79 1.62 0.78 1.61 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 0.00 196 D 8.67 4.77 0.00 2.65 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 L 9.75 5.15 0.00 1.52 1.54 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 198 I 9.04 4.77 1.98 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 1.17 0.78 0.92 0.00 0.00 199 A 9.65 4.66 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 0.00 200 G 8.20 3.54 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 0.00 0.00 0.00 201 N 8.73 5.71 0.00 2.89 2.91 0.00 0.00 6.42 8.69 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 0.00 202 I 8.28 5.05 1.85 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 1.34 0.79 0.89 0.00 0.00 203 V 8.39 4.42 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 0.77 0.00 0.00 0.94 0.00 0.00 204 T 7.46 4.74 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 205 K 8.43 3.95 0.00 1.84 1.84 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.51 7.81 206 E 8.14 3.96 0.00 2.13 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 2.42 2.44 0.00 207 A 7.73 3.34 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 A 7.97 3.99 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 0.00 209 L 7.86 3.99 0.00 1.70 1.69 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 210 D 7.96 4.55 0.00 2.92 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 L 8.02 4.05 0.00 1.68 1.71 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 212 I 7.85 3.73 2.09 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 1.52 1.02 0.91 0.00 0.00 213 S 8.03 4.30 0.00 4.05 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 V 7.27 4.26 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 1.04 0.00 0.00 215 G 8.32 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 A 7.61 4.13 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 0.00 217 D 8.96 4.73 0.00 2.82 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 0.00 218 C 7.88 5.03 0.00 3.06 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 0.00 219 L 8.77 4.92 0.00 1.64 1.54 0.92 0.61 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 0.00 220 K 8.43 4.74 0.00 1.83 1.80 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.38 7.81 221 V 9.75 4.62 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 1.03 0.00 0.00 0.95 0.00 0.00 222 G 7.27 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 0.00 223 I 7.56 4.27 1.87 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.61 0.91 0.00 0.00 224 G 8.90 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 0.00 225 P 0.00 4.36 0.00 2.08 2.07 0.00 3.42 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.04 0.00 226 G 7.58 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 0.00 227 S 8.65 4.12 0.00 3.86 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 I 7.58 4.02 1.87 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 1.41 0.52 0.91 0.00 0.00 229 C 7.93 4.34 0.00 3.02 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 0.00 230 T 8.43 3.87 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 1.21 0.00 0.00 231 T 7.79 3.97 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 1.25 0.00 0.00 232 R 7.75 4.14 0.00 2.01 1.96 0.00 3.62 0.00 0.00 3.42 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.76 0.00 233 I 7.67 3.70 1.86 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 1.66 0.73 0.90 0.00 0.00 234 V 8.10 3.72 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.94 0.00 0.00 235 A 8.17 4.61 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 0.00 236 G 7.93 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 V 8.41 4.34 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 0.93 0.00 0.00 0.96 0.00 0.00 238 G 7.46 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 V 7.97 4.32 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 0.79 0.00 0.00 0.91 0.00 0.00 240 P 0.00 4.24 0.00 2.17 1.90 0.00 3.61 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 2.18 2.10 0.00 241 Q 8.42 3.78 0.00 1.73 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 242 I 7.20 3.60 1.83 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.73 0.55 0.00 0.00 243 T 7.57 3.80 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 1.18 0.00 0.00 244 A 8.03 3.95 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 0.00 245 I 8.14 3.63 1.88 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.78 0.96 0.00 0.00 246 C 8.34 4.37 0.00 3.19 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 0.00 247 D 8.28 4.33 0.00 2.86 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 0.00 248 V 7.85 3.79 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 0.88 0.00 0.00 1.04 0.00 0.00 249 Y 8.65 4.24 0.00 3.08 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 E 8.50 3.96 0.00 2.06 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 2.19 0.00 251 A 7.54 4.66 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 C 8.30 4.45 0.00 2.96 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 0.00 253 N 7.57 4.12 0.00 2.26 2.47 0.00 0.00 7.08 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 N 8.84 4.48 0.00 2.97 2.86 0.00 0.00 6.59 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 255 T 7.44 4.60 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 1.22 0.00 0.00 256 N 8.49 4.89 0.00 2.76 2.71 0.00 0.00 6.60 7.72 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 0.00 257 I 7.35 4.46 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 1.23 1.28 0.92 0.00 0.00 258 C 8.28 4.82 0.00 3.16 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 0.00 259 I 9.23 5.14 1.93 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.74 0.95 0.00 0.00 260 I 8.86 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 1.17 0.81 0.92 0.00 0.00 261 A 9.04 4.74 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 262 D 9.15 4.85 0.00 2.67 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 0.00 263 G 8.34 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 0.00 0.00 0.00 264 G 8.69 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 0.00 265 I 7.50 3.76 1.75 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 1.41 0.81 0.84 0.00 0.00 266 R 8.87 4.02 0.00 0.88 0.84 0.00 3.03 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.61 0.00 267 F 7.49 5.06 0.00 3.07 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 268 S 8.89 4.30 0.00 4.12 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 269 G 8.20 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 0.00 0.00 0.00 270 D 8.18 3.91 0.00 2.46 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 0.00 271 V 7.46 3.45 2.30 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 0.89 0.00 0.00 1.06 0.00 0.00 272 V 7.56 3.57 2.24 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 1.05 0.00 0.00 1.02 0.00 0.00 273 K 8.13 4.25 0.00 2.11 2.17 0.00 1.83 0.00 0.00 1.91 0.00 0.00 3.14 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.78 1.74 7.81 274 A 8.35 4.20 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 0.00 275 I 8.14 3.90 1.82 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 1.31 1.37 0.90 0.00 0.00 276 A 8.32 4.16 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 277 A 8.25 4.35 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 0.00 278 G 7.17 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 279 A 7.73 4.20 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 0.00 280 D 8.92 4.73 0.00 2.64 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 0.00 281 S 7.67 4.76 0.00 3.87 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 0.00 282 V 8.47 4.86 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 0.71 0.00 0.00 0.99 0.00 0.00 283 M 9.33 5.04 0.00 2.23 1.99 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 2.56 2.52 0.00 284 I 8.99 4.09 1.25 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 1.04 0.58 -0.10 0.00 0.00 285 G 8.55 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 0.00 286 N 8.09 4.11 0.00 2.78 2.76 0.00 0.00 6.95 6.66 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 0.00 287 L 7.68 4.02 0.00 1.19 1.59 0.77 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 288 F 8.15 5.03 0.00 3.15 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 0.00 289 A 7.97 4.16 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 290 G 7.93 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 0.00 291 T 7.98 4.37 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 292 K 8.51 4.20 0.00 2.04 1.94 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.52 1.80 7.81 293 E 8.32 4.12 0.00 1.89 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 294 S 7.58 4.54 0.00 4.16 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 295 P 0.00 4.22 0.00 2.08 2.35 0.00 3.79 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 296 S 7.65 4.48 0.00 3.78 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 0.00 297 E 8.51 4.81 0.00 1.63 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 0.00 2.22 1.88 0.00 298 E 8.90 4.71 0.00 1.80 1.80 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 2.14 2.34 0.00 299 I 9.16 4.65 1.87 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 1.23 0.87 0.91 0.00 0.00 300 I 8.68 4.61 1.88 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.28 0.97 0.00 0.00 *301 Y 9.11 4.33 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 302 N 9.77 4.06 0.00 2.92 3.02 0.00 0.00 6.39 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 303 G 8.07 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 0.00 0.00 0.00 304 K 8.18 4.47 0.00 2.16 1.56 0.00 1.83 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.58 7.81 305 K 7.84 5.07 0.00 1.65 1.47 0.00 1.12 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.12 1.21 7.81 306 F 9.75 5.38 0.00 2.95 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 0.00 307 K 9.39 5.22 0.00 1.75 1.76 0.00 1.85 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.58 1.64 7.81 308 S 9.24 4.84 0.00 3.69 3.71 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 *345 M 8.56 4.62 0.00 1.83 1.93 0.00 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.12 0.00 346 V 8.43 4.71 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.98 0.00 0.00 347 P 0.00 4.36 0.00 2.02 2.04 0.00 3.88 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 348 Y 8.28 4.38 0.00 2.81 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 349 S 8.15 4.29 0.00 3.63 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 0.00 350 G 5.65 3.44 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 0.00 351 K 8.33 4.28 0.00 1.85 1.72 0.00 1.63 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.70 7.81 352 L 8.99 3.65 0.00 1.50 1.49 -0.26 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 353 K 8.09 3.72 0.00 1.85 1.80 0.00 1.76 0.00 0.00 2.08 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.57 7.81 354 D 8.19 4.33 0.00 2.77 2.64 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 0.00 355 I 7.54 3.73 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.86 1.07 0.00 0.00 356 L 8.12 3.73 0.00 1.67 1.54 0.74 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 357 T 7.90 3.86 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 1.19 0.00 0.00 358 Q 7.89 3.96 0.00 2.13 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 359 L 8.00 4.05 0.00 1.52 1.54 0.83 0.62 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 0.00 360 K 8.72 4.37 0.00 2.01 2.20 0.00 1.28 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.60 1.46 7.81 361 G 8.26 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 362 G 8.04 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 363 L 7.93 4.02 0.00 2.13 1.93 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 364 M 8.42 4.06 0.00 2.30 2.26 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.58 0.00 365 S 8.50 4.18 0.00 3.93 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 0.00 366 G 8.43 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 0.00 367 M 8.54 4.23 0.00 2.28 2.26 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.55 0.00 368 G 8.36 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 0.00 369 Y 8.26 4.16 0.00 3.29 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 0.00 370 L 7.49 4.58 0.00 1.52 1.65 1.02 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 371 G 7.82 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 0.00 0.00 0.00 372 A 8.15 4.61 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 0.00 373 A 8.69 4.32 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 374 T 7.43 5.21 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 1.21 0.00 0.00 375 I 8.17 3.68 1.85 0.00 0.00 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 1.58 1.37 0.86 0.00 0.00 376 S 8.06 4.13 0.00 3.89 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 377 D 7.85 4.36 0.00 2.83 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 0.00 378 L 7.78 3.89 0.00 1.74 1.83 0.87 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 379 K 7.83 4.09 0.00 1.89 1.63 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.60 1.62 7.81 380 I 7.38 4.26 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 1.73 0.59 1.02 0.00 0.00 381 N 7.90 4.78 0.00 2.77 2.79 0.00 0.00 6.79 8.40 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 0.00 382 S 7.35 4.53 0.00 3.74 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 383 K 8.10 4.68 0.00 1.64 1.61 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.42 7.81 384 F 8.95 5.51 0.00 2.79 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 0.00 385 V 8.72 4.62 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 0.92 0.00 0.00 1.04 0.00 0.00 386 K 8.60 4.67 0.00 1.64 1.73 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.47 7.81 387 I 8.71 4.17 2.01 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 1.11 0.91 0.96 0.00 0.00 388 S 8.80 4.60 0.00 3.63 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 *389 H 8.72 3.76 0.00 3.07 2.91 0.00 7.31 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 0.00 390 S 8.73 4.21 0.00 3.79 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.