NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 39 I 4.1252 8.0244 114.2733 60.7489 38.9220 174.3220 40 Q 4.4611 8.2316 123.1535 53.1562 31.5625 173.2681 41 H 4.2372 8.5214 123.4188 55.4192 31.1306 174.0897 42 P 4.3285 0.0000 0.0000 65.0391 31.4662 176.9016 43 W 4.3944 8.5866 117.3596 56.2739 29.7286 175.6887 44 Q 4.2949 7.9856 121.1478 57.5480 28.7110 176.1736 45 G 4.1622 9.1351 112.6617 46.2674 0.0000 173.4167 46 K 4.4904 7.6610 118.6990 55.1587 34.5289 175.5867 47 K 4.6854 9.0272 121.5369 54.8687 34.0922 175.9368 48 V 4.6370 8.3846 124.8940 60.8688 34.8942 174.2780 49 G 4.2432 8.9155 115.3808 45.3833 0.0000 171.9777 50 Y 5.1837 9.2078 123.2486 56.4253 40.3824 174.6572 51 I 4.8262 8.7734 126.2597 59.0068 39.8147 175.8935 52 G 4.2504 8.0249 114.0279 46.1361 0.0000 169.1163 53 D 5.8500 7.9052 121.3265 51.6960 40.5823 177.6920 54 S 4.1458 8.6795 109.6446 61.5569 63.1761 176.3548 55 I 3.6958 7.9819 120.6598 63.2644 36.9974 176.6001 56 T 4.8284 7.2368 115.5953 64.1625 70.3024 174.5843 57 D 4.7530 8.1694 120.5054 53.3921 41.5615 174.3269 58 P 4.6130 0.0000 0.0000 65.5982 31.4868 176.3318 59 N 4.4859 7.9339 119.4202 52.5648 38.0860 173.9271 *64 N 4.8704 8.5231 123.6349 52.5976 40.7193 175.3459 65 I 4.5549 7.4486 117.3248 59.1327 40.5309 174.2968 66 K 3.9823 8.5484 127.0989 54.9491 32.8368 176.6010 67 K 4.2368 7.4448 125.6701 55.5347 33.0964 177.2850 68 Y 4.2485 9.1692 121.3610 60.3820 37.6479 179.1555 69 W 3.8141 5.8410 117.2802 58.5519 27.9554 177.6077 70 D 4.1150 6.7547 119.5181 56.8449 40.4536 178.1777 71 F 3.3899 7.2472 117.9410 60.0924 38.7972 177.5101 72 L 4.1132 7.6406 118.6555 57.4574 41.4888 179.4461 73 K 4.4287 7.7492 120.9233 59.0700 31.9086 178.8121 74 E 3.9621 7.4676 117.4622 59.1693 29.4870 179.1269 75 W 4.6299 8.2633 118.1706 59.1729 29.6023 177.8634 76 L 4.7537 8.4508 116.5814 53.3144 41.8550 176.9428 77 G 3.9973 8.0927 107.1058 46.6144 0.0000 173.5463 78 I 5.0804 7.5313 121.0252 59.3740 38.5802 175.6732 79 T 4.2201 8.4027 125.4789 62.8311 69.2821 171.8628 80 P 4.9977 0.0000 0.0000 61.8260 33.2244 175.8399 81 F 4.8700 8.9976 122.4453 55.7657 40.5565 173.2818 82 V 4.3175 7.6848 122.9443 61.8160 31.7952 174.7403 83 Y 4.3888 9.0318 125.2674 57.3592 39.2770 176.6169 84 G 3.8873 8.1105 108.1516 46.7435 0.0000 172.7784 85 I 5.0380 8.3992 123.4535 58.8086 41.3003 174.9960 86 S 4.1558 8.9554 120.3144 60.1896 62.4987 175.8341 87 G 4.0148 8.8648 113.9682 45.9296 0.0000 174.0470 88 R 4.1045 7.3554 117.4129 56.2932 30.7050 175.4773 89 Q 4.9394 8.1094 117.9792 53.3703 32.6501 176.4256 90 W 3.9205 9.7937 118.3908 59.7138 28.5688 178.0022 91 D 4.6634 8.2719 117.4563 55.1421 39.4064 176.6527 92 D 4.6230 8.1820 119.3136 54.5257 41.3546 177.7549 93 V 3.3843 7.4752 118.5254 66.3469 31.4150 175.9019 94 P 4.2026 0.0000 0.0000 65.5046 31.2296 178.4721 95 R 3.8413 7.9024 116.9172 59.6321 30.0918 178.4330 96 Q 3.9394 8.0779 117.5722 58.8251 28.6389 178.6083 97 A 4.0053 8.2553 122.1491 55.2326 18.3626 179.5598 98 E 3.8140 8.4152 117.4260 59.3525 29.4179 179.5564 99 K 3.8468 7.9622 119.7402 59.1706 32.1523 178.6390 100 L 3.3769 7.2924 120.6201 57.6921 41.9254 178.8744 101 K 4.0463 8.2333 119.6084 59.3936 31.9304 178.5838 102 K 3.8251 7.8579 118.5305 59.6836 32.2512 178.1788 103 E 4.1868 8.1366 116.9400 58.2643 29.7024 177.3510 104 H 4.7611 8.3521 114.7824 55.3742 30.9399 175.2798 105 G 3.8568 8.4042 111.9216 48.9000 0.0000 175.4737 106 G 3.9512 8.0364 105.3046 45.6453 0.0000 173.4041 107 E 4.5611 8.2214 119.4358 57.3747 31.4885 177.5632 108 V 3.8841 7.9175 117.1373 62.4099 31.3488 175.1733 109 D 4.7580 9.0814 122.7499 55.5967 42.9588 176.0316 110 A 4.9363 7.4117 117.5663 50.6989 23.2658 175.1203 111 I 4.9309 8.7625 119.0406 59.5829 41.5729 174.6239 112 L 5.1946 8.8309 126.4243 52.8606 44.8831 175.5255 113 V 4.6699 8.9846 123.7440 61.1302 33.8700 174.0138 114 F 5.2423 9.3911 131.4497 56.7229 41.4015 175.5912 *116 G 4.5251 8.6687 115.1547 46.0473 0.0000 173.9673 117 T 3.9107 7.9883 113.6392 65.2474 67.2978 175.6297 118 N 4.4889 8.1865 117.7790 55.8878 38.6928 176.9942 119 D 4.4837 8.0124 120.6058 57.2324 40.8649 178.0682 120 Y 2.4400 7.2551 119.4598 60.2623 38.6492 177.4290 121 N 3.8977 7.7020 116.3346 56.2051 39.0281 175.9097 122 S 4.4050 7.8641 114.3755 57.2449 63.6027 174.0805 123 S 3.5104 7.4347 116.6086 59.3670 60.6101 173.3727 124 V 3.8745 7.7110 119.5042 61.4997 31.9766 173.7909 125 P 4.3911 0.0000 0.0000 62.7778 32.1194 177.3666 126 I 3.4952 8.4704 123.6205 63.6137 37.8587 176.5885 127 G 3.9734 7.9456 107.2578 45.4844 0.0000 172.0878 128 E 4.6356 8.1808 119.9778 54.2184 33.6598 175.9121 129 W 4.2636 8.7261 122.2145 59.3999 29.4077 175.9320 130 F 5.7537 8.0632 113.4654 56.0227 43.0359 173.9220 131 T 5.0210 9.0263 109.2362 60.1674 71.8675 172.8526 132 E 5.3550 8.4663 119.8380 55.3580 33.1894 173.8226 133 Q 4.6071 8.3562 116.4668 55.3730 32.3529 173.0395 134 E 4.4618 8.7925 119.9490 56.7753 30.3427 176.0900 135 E 4.8209 8.8840 121.1449 55.1454 34.9599 173.8467 136 Q 5.2364 8.5804 119.5049 54.3246 31.0406 175.7925 137 V 4.5857 8.5036 122.0968 59.9239 34.8539 174.6077 138 L 4.4421 8.4578 122.7385 55.1310 42.4743 176.3589 139 S 4.7813 8.8833 116.5975 57.1595 66.4748 172.8039 140 A 4.8848 8.2146 126.7945 51.7862 22.2747 176.8980 141 H 4.7882 8.8115 119.3499 52.4793 29.7400 172.2818 142 G 4.1562 8.2620 109.1644 45.4650 0.0000 171.2271 143 E 4.3777 7.2466 115.2820 56.9106 33.0257 175.4069 *145 K 4.4722 7.6121 120.4520 57.1786 36.0285 174.4786 146 K 4.3927 8.4401 124.4241 57.2501 40.3500 178.6084 *148 V 4.1318 8.9231 109.6150 61.1875 33.6643 173.8999 149 T 4.7597 8.3520 119.6989 63.3106 69.5155 174.6527 150 R 4.6450 8.9185 124.9417 54.1262 34.9320 174.5050 151 K 4.4356 8.7936 125.5327 56.4243 33.1353 175.6470 152 K 4.6983 9.1753 129.0058 54.4902 35.0230 174.7556 153 R 5.0614 8.4187 122.9369 54.9553 32.0720 175.4915 154 T 4.8239 8.9665 117.3247 61.0971 72.2372 171.7980 155 P 4.6137 0.0000 0.0000 63.1772 32.2812 176.7889 156 V 4.0131 8.3139 123.7115 62.0660 34.3314 174.4297 *158 T 4.1139 8.2194 113.2809 62.3295 67.8298 174.5257 159 Q 4.4484 8.5173 124.4764 56.7147 29.2868 176.7677 160 D 4.5375 8.1257 118.5305 56.1854 41.2936 176.6956 161 T 4.9425 7.4407 108.4978 59.1138 72.8493 174.2080 162 Y 4.1579 8.8649 122.7573 61.0925 38.8305 178.3421 163 R 3.2083 7.9268 119.2270 58.7238 29.9419 179.3044 164 G 3.8347 7.8703 106.8852 47.4316 0.0000 176.0194 165 R 4.0329 8.1190 120.6841 59.0132 29.9608 179.2954 166 I 2.9749 7.4607 119.6805 63.8962 36.9301 178.2135 167 N 4.0972 8.2952 117.4547 56.3377 38.4440 177.5537 168 I 3.7543 7.8778 121.2321 64.1733 37.1611 178.7558 169 G 3.7870 8.5195 106.9037 48.1545 0.0000 175.8932 170 I 3.6904 7.8531 123.2759 63.8654 36.8951 178.7059 171 T 3.6449 7.1595 116.6111 66.7411 68.2896 176.6193 172 Q 3.9560 8.0752 119.8111 58.8384 28.6118 178.8663 173 L 4.1407 8.0777 120.0301 58.0219 41.5148 179.8822 174 K 4.0781 8.0403 116.9987 59.2204 32.0135 179.4002 175 K 4.1218 8.0574 118.4070 59.3618 32.0483 179.0116 176 L 3.8999 7.7955 118.1911 56.0444 42.8852 177.3946 177 F 5.0529 8.2586 116.5713 55.5579 39.4239 174.3440 178 P 4.3488 0.0000 0.0000 65.1774 31.7048 177.4148 179 D 4.7363 8.1215 115.8532 52.7662 39.6402 175.5725 180 K 4.8116 7.6032 118.6710 54.9065 35.2218 175.6396 181 Q 4.5122 8.1932 123.9369 55.9161 29.8524 174.5153 182 I 5.0401 8.5303 127.3518 59.5168 39.9812 175.2825 183 V 4.7538 9.1006 126.5586 61.1246 35.0374 174.0017 184 L 5.3166 8.7319 126.6680 53.2124 44.1957 175.2834 185 L 5.3100 8.8927 122.9750 52.9741 44.0557 176.7123 186 T 4.5234 8.4692 113.5064 60.8113 69.7895 172.9009 187 P 4.8214 0.0000 0.0000 62.9735 32.1044 176.3740 188 L 4.5101 8.7074 122.2786 54.2560 42.6841 176.7937 189 H 4.4225 8.6433 117.7790 56.3819 29.3739 175.1225 190 R 4.6466 9.1892 117.5243 55.2335 33.0492 174.2515 191 S 5.1601 8.0503 115.9225 56.6747 65.5843 173.2535 192 L 4.4947 8.5259 117.4635 56.7418 41.7026 176.5116 193 A 4.7636 8.7806 122.7217 51.1153 22.5619 174.9148 194 N 5.0060 8.8693 120.9596 51.4070 40.7764 175.6694 195 F 4.7706 9.0770 124.8052 54.7723 39.3346 175.1287 196 G 4.0308 7.8631 108.8753 44.8961 0.0000 172.2731 197 D 4.5372 8.3788 117.4614 55.8931 40.8435 177.5526 198 K 4.5072 7.9522 116.7678 56.0331 33.0296 176.0269 199 N 4.9652 8.1209 118.4971 51.5331 40.2343 171.3061 200 V 4.6248 8.1734 121.3223 60.6630 34.5829 174.0753 201 Q 4.6284 9.0171 128.0971 53.3909 30.8564 173.8813 202 P 4.7860 0.0000 0.0000 62.0406 32.6371 176.0251 203 D 4.7039 8.8843 122.2133 53.0009 40.7978 176.6581 204 E 4.3297 8.4971 114.7180 57.4491 29.1601 177.7730 205 S 4.4016 8.7518 114.1988 59.3646 63.6971 173.5352 206 Y 4.8843 7.6782 118.8572 56.3692 39.6256 175.7001 207 Q 4.2674 8.3699 122.1526 55.4434 30.0354 176.1489 208 N 4.7858 8.7609 117.8430 51.9712 39.5260 175.8044 209 G 3.6908 8.3004 106.6092 48.0288 0.0000 174.0726 210 C 4.6579 8.0810 114.0342 57.6301 29.9032 173.7118 211 G 3.8738 7.8365 106.1508 46.9911 0.0000 174.1555 212 E 4.6935 8.5232 117.7854 54.2532 33.2057 175.8171 213 Y 4.9313 8.2868 119.6335 56.9821 39.5065 176.4267 214 I 3.4769 8.2272 120.7481 64.1844 37.6490 177.4479 215 D 4.4116 8.3977 119.3272 57.6697 40.7571 178.6558 216 A 4.0148 8.0506 120.4714 55.2718 16.8892 179.1507 217 Y 3.8157 8.0259 115.0106 60.2381 37.9335 178.4437 218 V 3.8488 7.6889 119.1646 66.1542 31.8701 177.9330 219 Q 4.1295 8.6052 117.9710 58.8857 28.5293 178.6748 220 A 4.3691 8.1838 121.6401 55.3428 18.1886 179.8170 221 I 3.7741 7.3289 115.2971 64.4639 37.3944 178.4572 222 K 4.2086 8.0900 118.9454 59.6542 32.0360 179.3188 223 E 4.0309 8.8116 118.8000 58.9878 29.2721 179.0891 224 A 3.8923 8.0486 120.9122 54.3058 18.2918 179.6957 225 G 4.0047 7.8170 104.8129 48.3131 0.0000 175.6391 226 N 4.4325 7.9478 117.4963 55.3521 38.8513 177.2691 227 I 3.5870 7.3023 120.2813 63.5343 37.2485 177.5993 228 W 4.4984 8.2781 116.8292 55.0511 31.4484 175.0707 229 G 3.6696 9.2300 106.4538 44.8785 0.0000 172.3767 230 I 4.7818 8.2377 119.9569 59.0895 42.6687 172.6884 231 P 4.7902 0.0000 0.0000 62.9148 32.8053 175.0890 232 V 4.9596 8.2790 120.9034 61.3724 34.6731 174.3188 233 I 4.2888 8.8068 129.2289 59.2614 38.8681 176.0533 234 D 4.8490 8.3911 129.9815 52.6325 40.0043 175.8924 235 F 4.2175 8.3376 125.8701 61.2825 40.0996 176.2376 236 N 4.3392 8.6098 118.1800 56.6132 39.1198 175.7715 237 A 4.4344 7.9577 118.4365 54.5638 19.6423 179.6370 238 V 3.6524 7.7778 109.4313 64.3949 31.6066 178.6259 239 T 3.8829 7.4728 108.5328 61.5095 69.3801 172.5959 240 G 3.3762 7.4674 113.4945 45.1792 0.0000 171.0472 *242 N 4.3800 8.1843 120.8488 52.5294 39.5258 173.7524 243 P 4.0887 0.0000 0.0000 62.3639 29.2582 177.8760 *245 V 3.7562 7.3370 117.8316 63.1035 32.2441 174.9108 246 E 3.9185 8.8285 128.2743 59.9093 29.0362 179.2602 247 E 3.9747 8.1808 116.7189 58.8457 29.8112 178.1580 248 Q 4.4971 8.1765 116.9823 55.9973 29.1110 176.9353 249 L 4.5171 8.1252 121.2965 55.9825 41.4052 178.5219 250 I 3.7365 7.6301 112.4500 63.0277 37.9033 176.1278 251 Y 4.7565 8.1434 118.3502 57.7183 38.1080 174.8028 252 F 5.2838 7.9617 118.2866 55.2937 42.4423 174.6542 253 Y 4.1526 9.0762 124.0257 60.2357 38.8507 176.5870 254 D 4.2660 8.3999 120.6918 52.5422 43.5976 175.6566 255 A 4.2576 8.7628 130.6839 54.9701 18.6525 178.6045 256 G 3.8361 8.3836 105.1176 48.2714 0.0000 174.2483 257 Y 4.7176 7.4630 113.1351 56.2541 40.3988 173.8774 258 D 4.7903 8.3078 120.7560 52.9005 42.0150 174.8644 259 R 4.6539 9.1575 126.4546 55.5877 31.0064 177.7953 260 L 4.3442 8.4707 119.0965 56.9038 43.7956 176.0923 261 H 4.8233 8.8710 116.7797 54.2561 29.4574 173.6154 262 P 4.3324 0.0000 0.0000 62.3093 31.9840 176.5227 263 D 4.9872 8.2260 121.5542 52.6222 42.7383 177.2313 264 T 3.9491 8.4946 114.8084 67.0230 68.4101 176.3288 265 K 4.0710 8.2789 121.0723 59.5688 32.0113 178.9459 266 G 3.5180 8.5227 105.1525 47.8507 0.0000 175.4376 267 Q 4.2245 8.1934 119.9506 58.7273 28.9118 178.2715 268 E 3.3021 8.4686 120.7654 58.5695 29.5404 179.1530 269 R 4.1180 7.6866 116.9981 56.4403 29.8867 178.0661 *271 A 4.4922 7.9733 121.0790 51.9186 20.4721 180.1744 272 R 4.0483 8.4972 113.7167 59.8029 30.6533 178.7196 273 T 4.0904 8.3924 114.7659 66.7252 68.6301 178.3847 274 L 3.9968 7.5419 123.9426 54.9549 40.9585 178.2081 *276 Y 4.4996 7.9704 116.1255 57.6335 40.0933 177.7472 277 Q 4.1094 8.1401 119.0378 58.5582 28.7820 177.9271 278 L 4.0579 7.9986 119.1164 56.1548 41.3974 178.7072 279 L 3.8769 7.2709 119.3798 57.6108 42.0405 177.7878 280 A 4.3818 7.4873 116.9387 51.6990 18.9587 176.8666 281 L 4.8572 7.6046 117.8166 51.9645 44.7224 175.0105 282 P 4.4510 0.0000 0.0000 62.4773 32.5041 175.2708 283 V 3.2691 7.5980 115.5930 63.9463 33.0446 175.5436 284 A 4.0007 7.2592 121.8214 51.2508 19.0360 177.1452 285 F 4.4617 8.4589 120.9874 57.7629 39.1932 175.9046 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 39 I 8.02 4.13 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.15 0.92 0.00 0.00 40 Q 8.23 4.46 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.92 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 41 H 8.52 4.24 0.00 3.23 3.21 0.00 5.73 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.33 0.00 2.18 2.19 0.00 3.68 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.25 0.00 43 W 8.59 4.39 0.00 3.42 3.35 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 44 Q 7.99 4.29 0.00 2.07 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.53 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 45 G 9.14 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 K 7.66 4.49 0.00 1.73 1.57 0.00 1.48 0.00 0.00 1.55 0.00 0.00 2.77 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.52 1.27 7.81 47 K 9.03 4.69 0.00 1.79 1.44 0.00 1.89 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.23 1.30 7.81 48 V 8.38 4.64 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 0.47 0.00 0.00 1.07 0.00 0.00 49 G 8.92 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 50 Y 9.21 5.18 0.00 2.66 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 51 I 8.77 4.83 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.81 0.80 0.00 0.00 52 G 8.02 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 0.00 0.00 0.00 0.00 53 D 7.91 5.85 0.00 2.91 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 54 S 8.68 4.15 0.00 3.92 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 7.98 3.70 1.89 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 1.42 0.61 1.14 0.00 0.00 56 T 7.24 4.83 4.55 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 1.39 0.00 0.00 57 D 8.17 4.75 0.00 2.77 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 58 P 0.00 4.61 0.00 2.10 2.26 0.00 3.69 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.84 0.00 59 N 7.93 4.49 0.00 2.70 2.74 0.00 0.00 7.30 7.80 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 *64 N 8.52 4.87 0.00 2.88 3.10 0.00 0.00 6.93 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 I 7.45 4.55 1.83 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 1.47 0.67 0.98 0.00 0.00 66 K 8.55 3.98 0.00 1.49 1.51 0.00 1.36 0.00 0.00 0.93 0.00 0.00 2.23 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.78 7.81 67 K 7.44 4.24 0.00 0.79 0.74 0.00 1.98 0.00 0.00 1.77 0.00 0.00 3.25 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.12 1.31 7.81 68 Y 9.17 4.25 0.00 3.25 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 W 5.84 3.81 0.00 2.66 1.74 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 70 D 6.75 4.11 0.00 1.58 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 7.25 3.39 0.00 2.60 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 7.64 4.11 0.00 1.91 1.83 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 73 K 7.75 4.43 0.00 2.01 1.93 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.42 7.81 74 E 7.47 3.96 0.00 1.81 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.39 0.00 75 W 8.26 4.63 0.00 3.38 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 76 L 8.45 4.75 0.00 1.84 1.69 0.71 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 77 G 8.09 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 0.00 0.00 0.00 78 I 7.53 5.08 1.99 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 1.61 1.60 1.10 0.00 0.00 79 T 8.40 4.22 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 80 P 0.00 5.00 0.00 1.71 2.12 0.00 3.62 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 2.11 0.00 81 F 9.00 4.87 0.00 3.03 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 82 V 7.68 4.32 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 0.27 0.00 0.00 -0.85 0.00 0.00 83 Y 9.03 4.39 0.00 2.84 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 84 G 8.11 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 85 I 8.40 5.04 1.87 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 1.36 0.99 0.90 0.00 0.00 86 S 8.96 4.16 0.00 3.80 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 87 G 8.86 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 R 7.36 4.10 0.00 1.93 1.87 0.00 3.38 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.86 0.00 89 Q 8.11 4.94 0.00 2.38 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 90 W 9.79 3.92 0.00 3.70 3.30 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 91 D 8.27 4.66 0.00 3.04 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 92 D 8.18 4.62 0.00 2.75 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 93 V 7.48 3.38 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 0.89 0.00 0.00 0.01 0.00 0.00 94 P 0.00 4.20 0.00 2.19 2.07 0.00 3.84 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 95 R 7.90 3.84 0.00 1.86 2.18 0.00 3.19 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 1.69 1.72 0.00 96 Q 8.08 3.94 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.46 2.61 0.00 97 A 8.26 4.01 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 98 E 8.42 3.81 0.00 2.18 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 99 K 7.96 3.85 0.00 1.91 1.64 0.00 1.73 0.00 0.00 1.88 0.00 0.00 2.97 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.67 1.49 7.81 100 L 7.29 3.38 0.00 0.96 1.67 0.99 0.22 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 0.00 101 K 8.23 4.05 0.00 1.88 1.75 0.00 1.58 0.00 0.00 1.48 0.00 0.00 2.70 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.58 1.16 7.81 102 K 7.86 3.83 0.00 1.81 1.90 0.00 1.81 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.44 7.81 103 E 8.14 4.19 0.00 1.84 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 0.00 2.28 2.50 0.00 104 H 8.35 4.76 0.00 2.80 2.59 0.00 5.64 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 0.00 105 G 8.40 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 0.00 0.00 0.00 106 G 8.04 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 0.00 107 E 8.22 4.56 0.00 2.17 2.23 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 2.34 2.27 0.00 108 V 7.92 3.88 2.23 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 0.74 0.00 0.00 0.92 0.00 0.00 109 D 9.08 4.76 0.00 2.56 2.52 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 0.00 110 A 7.41 4.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.76 4.93 1.73 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.40 0.83 0.00 0.00 112 L 8.83 5.19 0.00 1.60 1.55 0.94 0.77 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 0.00 113 V 8.98 4.67 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.89 0.00 0.00 114 F 9.39 5.24 0.00 3.01 2.95 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 *116 G 8.67 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 T 7.99 3.91 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 118 N 8.19 4.49 0.00 2.98 2.86 0.00 0.00 7.17 8.08 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 0.00 119 D 8.01 4.48 0.00 3.01 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 0.00 120 Y 7.26 2.44 0.00 2.05 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 0.00 121 N 7.70 3.90 0.00 2.77 2.90 0.00 0.00 7.32 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 0.00 122 S 7.86 4.41 0.00 3.87 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 0.00 123 S 7.43 3.51 0.00 3.94 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 0.00 124 V 7.71 3.87 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.01 0.00 0.00 125 P 0.00 4.39 0.00 2.22 1.96 0.00 3.87 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 126 I 8.47 3.50 1.73 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.58 0.68 0.00 0.00 127 G 7.95 3.97 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 0.00 0.00 0.00 128 E 8.18 4.64 0.00 1.90 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 2.17 2.25 0.00 129 W 8.73 4.26 0.00 3.41 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 0.00 130 F 8.06 5.75 0.00 2.90 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 0.00 131 T 9.03 5.02 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 0.00 132 E 8.47 5.36 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.30 0.00 133 Q 8.36 4.61 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.03 0.00 0.00 0.00 0.00 0.00 2.18 2.40 0.00 134 E 8.79 4.46 0.00 1.87 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 135 E 8.88 4.82 0.00 1.84 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 2.38 2.42 0.00 136 Q 8.58 5.24 0.00 1.90 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.74 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 137 V 8.50 4.59 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 0.65 0.00 0.00 0.92 0.00 0.00 138 L 8.46 4.44 0.00 1.55 1.64 0.92 0.76 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 0.00 139 S 8.88 4.78 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 0.00 140 A 8.21 4.88 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 0.00 141 H 8.81 4.79 0.00 3.05 3.21 0.00 5.87 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.26 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 E 7.25 4.38 0.00 1.92 1.81 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 2.19 2.25 0.00 *145 K 7.61 4.47 0.00 1.88 1.84 0.00 1.60 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.43 7.81 146 K 8.44 4.39 0.00 1.85 1.29 0.00 1.34 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.41 7.81 *148 V 8.92 4.13 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 0.75 0.00 0.00 1.01 0.00 0.00 149 T 8.35 4.76 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 1.23 0.00 0.00 150 R 8.92 4.65 0.00 1.65 1.73 0.00 3.26 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 151 K 8.79 4.44 0.00 1.74 1.68 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.42 7.81 152 K 9.18 4.70 0.00 1.79 1.57 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.28 1.30 7.81 153 R 8.42 5.06 0.00 1.43 1.58 0.00 2.21 0.00 0.00 2.51 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.00 0.00 154 T 8.97 4.82 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 155 P 0.00 4.61 0.00 2.10 2.05 0.00 3.82 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.30 0.00 156 V 8.31 4.01 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.95 0.00 0.00 *158 T 8.22 4.11 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 1.21 0.00 0.00 159 Q 8.52 4.45 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 160 D 8.13 4.54 0.00 2.69 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 T 7.44 4.94 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 162 Y 8.86 4.16 0.00 3.02 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 R 7.93 3.21 0.00 1.41 0.93 0.00 2.76 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.82 0.00 164 G 7.87 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 0.00 165 R 8.12 4.03 0.00 2.02 2.18 0.00 3.41 0.00 0.00 3.47 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.98 0.00 166 I 7.46 2.97 1.72 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.61 0.00 0.00 167 N 8.30 4.10 0.00 3.01 3.14 0.00 0.00 7.02 6.95 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 0.00 168 I 7.88 3.75 2.03 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 1.47 0.84 0.92 0.00 0.00 169 G 8.52 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 I 7.85 3.69 0.84 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 1.57 0.60 0.73 0.00 0.00 171 T 7.16 3.64 4.29 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 1.23 0.00 0.00 172 Q 8.08 3.96 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 173 L 8.08 4.14 0.00 1.89 1.81 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 174 K 8.04 4.08 0.00 1.77 1.93 0.00 1.87 0.00 0.00 1.85 0.00 0.00 3.16 0.00 0.00 3.47 0.00 0.00 0.00 0.00 1.55 1.54 7.81 175 K 8.06 4.12 0.00 1.82 1.82 0.00 1.71 0.00 0.00 1.83 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.67 7.81 176 L 7.80 3.90 0.00 1.03 0.65 0.80 0.44 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 0.00 177 F 8.26 5.05 0.00 3.16 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 0.00 178 P 0.00 4.35 0.00 2.18 2.32 0.00 3.80 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 179 D 8.12 4.74 0.00 2.82 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 K 7.60 4.81 0.00 1.71 1.78 0.00 1.70 0.00 0.00 1.81 0.00 0.00 3.14 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.40 1.59 7.81 181 Q 8.19 4.51 0.00 2.35 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 182 I 8.53 5.04 1.95 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 1.24 1.05 1.01 0.00 0.00 183 V 9.10 4.75 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 1.13 0.00 0.00 1.17 0.00 0.00 184 L 8.73 5.32 0.00 1.80 1.78 1.11 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.89 5.31 0.00 1.20 0.97 -0.38 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 186 T 8.47 4.52 4.43 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 1.42 0.00 0.00 187 P 0.00 4.82 0.00 2.11 2.18 0.00 3.92 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 188 L 8.71 4.51 0.00 1.86 1.81 1.12 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 189 H 8.64 4.42 0.00 3.21 3.25 0.00 5.68 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 R 9.19 4.65 0.00 1.84 2.02 0.00 2.74 0.00 0.00 2.94 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.53 0.00 191 S 8.05 5.16 0.00 3.73 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 0.00 192 L 8.53 4.49 0.00 1.80 1.81 0.89 0.51 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 0.00 193 A 8.78 4.76 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 N 8.87 5.01 0.00 2.44 2.65 0.00 0.00 6.86 7.35 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 0.00 195 F 9.08 4.77 0.00 2.98 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 7.86 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 0.00 197 D 8.38 4.54 0.00 2.68 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 0.00 198 K 7.95 4.51 0.00 1.73 1.81 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.39 7.81 199 N 8.12 4.97 0.00 2.81 2.93 0.00 0.00 6.56 8.23 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 0.00 200 V 8.17 4.62 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 0.93 0.00 0.00 0.94 0.00 0.00 201 Q 9.02 4.63 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.72 0.00 0.00 0.00 0.00 0.00 2.51 2.41 0.00 202 P 0.00 4.79 0.00 1.81 1.40 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 1.79 1.88 0.00 203 D 8.88 4.70 0.00 2.85 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 0.00 204 E 8.50 4.33 0.00 1.99 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 0.00 2.48 2.25 0.00 205 S 8.75 4.40 0.00 3.80 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 Y 7.68 4.88 0.00 3.24 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 0.00 207 Q 8.37 4.27 0.00 1.96 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.76 0.00 0.00 0.00 0.00 0.00 1.16 1.60 0.00 208 N 8.76 4.79 0.00 2.54 2.23 0.00 0.00 7.22 6.68 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 0.00 209 G 8.30 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 0.00 0.00 0.00 210 C 8.08 4.66 0.00 3.06 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 0.00 211 G 7.84 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 0.00 0.00 0.00 212 E 8.52 4.69 0.00 2.22 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 213 Y 8.29 4.93 0.00 3.09 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 I 8.23 3.48 0.91 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.11 0.82 0.00 0.00 215 D 8.40 4.41 0.00 2.83 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 0.00 216 A 8.05 4.01 1.14 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 0.00 217 Y 8.03 3.82 0.00 3.14 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 0.00 218 V 7.69 3.85 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 1.17 0.00 0.00 1.04 0.00 0.00 219 Q 8.61 4.13 0.00 2.14 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.63 2.58 0.00 220 A 8.18 4.37 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 I 7.33 3.77 2.23 0.00 0.00 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 1.58 0.92 1.12 0.00 0.00 222 K 8.09 4.21 0.00 2.04 1.93 0.00 1.75 0.00 0.00 1.90 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.80 7.81 223 E 8.81 4.03 0.00 2.37 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 2.39 2.48 0.00 224 A 8.05 3.89 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 G 7.82 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 0.00 0.00 0.00 226 N 7.95 4.43 0.00 2.64 2.82 0.00 0.00 6.91 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 I 7.30 3.59 1.33 0.00 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.21 0.15 0.00 0.00 228 W 8.28 4.50 0.00 3.35 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 0.00 229 G 9.23 3.67 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 0.00 0.00 0.00 230 I 8.24 4.78 1.99 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.36 1.03 0.00 0.00 231 P 0.00 4.79 0.00 2.25 2.25 0.00 3.89 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 2.33 2.10 0.00 232 V 8.28 4.96 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 0.94 0.00 0.00 1.08 0.00 0.00 233 I 8.81 4.29 1.77 0.00 0.00 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 1.11 0.82 0.96 0.00 0.00 234 D 8.39 4.85 0.00 2.82 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 0.00 235 F 8.34 4.22 0.00 2.91 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 N 8.61 4.34 0.00 3.01 3.15 0.00 0.00 7.15 8.27 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 0.00 237 A 7.96 4.43 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 0.00 238 V 7.78 3.65 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.05 0.00 0.00 239 T 7.47 3.88 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 -0.06 0.00 0.00 240 G 7.47 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *242 N 8.18 4.38 0.00 2.61 2.80 0.00 0.00 7.29 7.69 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 0.00 243 P 0.00 4.09 0.00 1.62 0.49 0.00 3.81 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.34 0.00 *245 V 7.34 3.76 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 1.12 0.00 0.00 0.91 0.00 0.00 246 E 8.83 3.92 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 247 E 8.18 3.97 0.00 1.92 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 2.31 2.45 0.00 248 Q 8.18 4.50 0.00 2.49 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.89 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 249 L 8.13 4.52 0.00 1.78 1.75 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 250 I 7.63 3.74 1.56 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 -0.36 0.85 0.00 0.00 251 Y 8.14 4.76 0.00 3.15 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 0.00 252 F 7.96 5.28 0.00 3.06 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 0.00 253 Y 9.08 4.15 0.00 3.09 3.09 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 0.00 0.00 0.00 0.00 254 D 8.40 4.27 0.00 2.30 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 255 A 8.76 4.26 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 G 8.38 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 Y 7.46 4.72 0.00 3.18 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 0.00 258 D 8.31 4.79 0.00 2.39 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 R 9.16 4.65 0.00 1.71 1.68 0.00 3.07 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 1.47 1.56 0.00 260 L 8.47 4.34 0.00 1.63 1.91 1.00 1.20 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 0.00 261 H 8.87 4.82 0.00 3.51 3.25 0.00 5.87 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 262 P 0.00 4.33 0.00 1.99 1.70 0.00 3.76 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.85 0.00 263 D 8.23 4.99 0.00 3.06 3.06 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 0.00 264 T 8.49 3.95 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 265 K 8.28 4.07 0.00 1.85 2.03 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.72 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.73 1.58 7.81 266 G 8.52 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 0.00 0.00 0.00 267 Q 8.19 4.22 0.00 2.38 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.93 0.00 0.00 0.00 0.00 0.00 2.61 2.68 0.00 268 E 8.47 3.30 0.00 1.21 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.86 0.00 269 R 7.69 4.12 0.00 1.74 1.63 0.00 2.81 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.42 0.00 *271 A 7.97 4.49 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 272 R 8.50 4.05 0.00 1.94 2.03 0.00 3.15 0.00 0.00 2.95 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.56 0.00 273 T 8.39 4.09 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 1.24 0.00 0.00 274 L 7.54 4.00 0.00 1.97 1.84 0.47 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 *276 Y 7.97 4.50 0.00 3.12 3.06 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 0.00 277 Q 8.14 4.11 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.85 0.00 0.00 0.00 0.00 0.00 2.59 2.64 0.00 278 L 8.00 4.06 0.00 1.22 0.38 -0.16 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 279 L 7.27 3.88 0.00 1.63 1.82 0.76 1.11 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 0.00 280 A 7.49 4.38 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 0.00 281 L 7.60 4.86 0.00 2.02 2.00 1.06 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 282 P 0.00 4.45 0.00 1.87 2.00 0.00 3.84 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 283 V 7.60 3.27 1.63 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 0.31 0.00 0.00 -0.68 0.00 0.00 284 A 7.26 4.00 1.09 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 0.00 0.00 0.00 0.00 0.00 0.00 285 F 8.46 4.46 0.00 3.05 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 * Residues marked with a * may have inaccurate shift predictions.