NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1B V 4.0114 8.0544 120.3061 61.4577 33.0309 175.0460 1C S 4.3275 8.0413 114.6767 57.0168 64.6619 173.4623 1D A 4.0344 8.5423 127.5585 55.0757 18.7589 179.2380 1E E 3.8746 8.1242 117.6165 59.5126 29.6815 179.0243 1F E 4.0311 8.0862 118.1659 59.3200 29.5844 179.1559 1G I 3.6581 7.6183 119.4130 64.1370 37.1713 178.2542 1H K 3.8907 8.2607 120.6535 59.4736 32.1245 178.4693 1I K 3.8767 7.8993 119.2991 59.9117 31.9825 178.0949 1J H 4.3552 8.4402 118.2937 59.4407 29.8178 177.0179 1K E 4.0955 8.4858 120.4782 59.5843 29.0723 179.2924 1L E 4.0453 8.0621 117.5916 59.3363 29.7989 179.2967 2 K 4.0902 8.0571 118.3956 59.2109 32.1295 179.3278 3 W 4.7651 8.8325 129.0795 60.6032 30.5965 177.5391 4 N 4.5586 8.7504 117.0129 56.2947 38.1198 176.9303 5 K 3.7969 7.6905 118.8092 58.6909 32.0133 177.7351 6 Y 4.2437 7.6031 115.3459 58.1357 39.0486 175.9772 7 Y 4.5837 7.6480 113.8507 57.5254 39.0319 176.4970 8 G 3.7978 8.3045 110.0836 46.8766 0.0000 174.2129 9 V 4.4698 7.1626 111.1579 58.6898 35.3537 174.6032 10 N 4.4049 8.3941 119.1384 53.2836 39.5952 175.4200 11 A 3.4022 8.6139 127.5487 55.3133 18.3640 179.6886 12 F 4.3301 8.9157 113.3671 59.7385 39.0102 175.8024 13 N 4.8374 8.2118 116.7661 52.6563 38.9887 175.2258 14 L 4.0460 7.3543 119.4430 53.5235 42.4413 175.3685 15 P 4.3847 0.0000 0.0000 62.4680 31.7672 177.3245 16 K 4.1008 9.1211 120.0322 58.8998 32.1466 179.0089 17 E 3.7857 8.1735 115.2304 58.5593 29.9672 177.6483 18 L 4.4833 8.1776 119.4348 56.2495 42.4537 176.3270 19 F 5.6474 7.8652 120.4895 57.1823 43.0651 173.5069 20 S 4.3522 8.2923 119.2565 56.9236 66.6388 173.4414 21 K 3.9267 8.1592 122.5986 55.9630 32.9008 176.2378 22 V 3.7735 7.8760 128.0141 61.9319 32.0968 175.7660 23 D 4.5186 8.3970 127.5173 52.3289 40.5880 176.5920 24 E 3.8350 8.8404 119.9604 59.6830 29.4329 178.7188 25 K 4.0696 8.0427 117.4121 59.7971 32.1483 179.0081 26 D 4.3073 7.9979 118.7209 57.1617 40.4374 178.7486 26A R 4.1228 7.8918 117.2397 57.9701 29.9646 177.2937 26B Q 4.9891 7.4447 116.3114 54.5245 29.4273 175.1688 26C K 4.8111 8.0976 117.6463 54.3926 35.4099 175.0504 26D Y 4.6435 8.7210 121.3739 56.4113 39.5205 173.6141 26E P 3.1960 0.0000 0.0000 62.2054 32.2224 176.8790 27 Y 4.0595 7.4515 117.7786 60.6635 37.5801 177.9524 28 N 5.1606 8.6833 115.3842 54.1724 37.6766 176.2920 29 T 4.2341 7.8391 109.3490 62.6420 69.8274 173.9490 30 I 4.7606 7.8173 125.1075 60.3408 38.8920 175.1861 31 G 4.0306 8.8074 112.2252 44.6335 0.0000 170.2556 32 N 4.8368 8.1787 118.9839 51.6143 40.1668 173.9531 33 V 4.6976 8.3987 126.5358 61.8032 33.1599 173.8129 34 F 5.1485 9.1399 131.8201 55.8351 41.1804 174.4798 35 V 4.5228 7.5075 126.4391 60.5449 32.8858 174.7534 36 K 3.3405 8.7674 130.3909 57.0254 32.7774 177.2564 26C G 4.4511 8.1376 106.0463 43.2926 0.0000 173.3504 26D Q 4.4335 8.9210 120.8739 54.2113 31.1205 173.7141 26E T 3.1260 8.2875 116.1837 60.7054 69.9224 174.2790 27 S 3.9795 7.6415 113.1786 61.0635 63.5801 176.6525 28 A 4.7406 8.5233 120.4843 53.5724 17.8766 178.8920 29 T 4.2341 7.8391 109.3490 62.6420 69.8274 173.9490 30 G 4.5506 8.1473 114.0075 44.3408 0.0000 173.6861 31 V 4.1906 8.5074 122.6252 61.7335 36.9593 171.6557 32 L 4.4368 7.9387 122.0839 53.6143 43.6668 176.3531 33 I 4.7476 8.3687 127.2358 60.7032 39.0599 173.9129 34 G 4.4885 9.1699 120.3201 43.2351 0.0000 173.5798 35 K 4.7228 7.7675 127.6391 54.5449 33.0858 175.0534 36 N 3.7605 8.8774 128.6909 53.9254 38.5774 175.8564 51 T 4.9005 7.8720 115.4489 61.6821 71.1015 173.5646 52 V 4.6897 8.6546 126.5577 60.9404 34.0743 173.7950 53 L 5.0077 8.3106 129.5380 54.2696 43.7025 175.1000 54 T 4.5955 8.3058 119.2241 61.4665 71.4002 172.0726 55 N 5.3502 8.6152 117.8237 52.1447 39.7210 176.5450 56 R 3.9695 8.6291 121.3169 59.7399 30.0691 178.5478 57 H 4.3200 8.4529 113.2272 57.8768 28.9838 177.0702 58 I 4.2982 7.4232 122.4223 64.1057 37.5709 177.6821 59 A 4.0841 8.0157 121.5755 54.9690 18.1295 179.5064 60 K 3.8737 8.2029 118.2041 59.6188 31.9074 178.9574 61 F 4.1529 7.9363 116.9579 60.2352 39.0644 177.0027 62 A 4.1090 8.2210 119.7523 52.4289 18.2341 176.8343 62A N 3.9774 8.8675 114.9349 54.7432 37.7920 175.3377 62B G 3.8296 8.3964 103.9280 45.3214 0.0000 173.5766 62C D 4.6553 7.8555 120.5684 51.8915 40.9086 175.0401 62D P 4.4209 0.0000 0.0000 65.0849 31.6118 178.6755 62E S 4.2793 7.9763 112.8049 60.4434 63.0507 175.0522 63 K 4.3147 7.7227 119.0267 56.7800 32.2139 176.4549 64 V 5.0265 7.5082 118.8332 61.1879 34.0321 174.7406 65 S 5.0524 8.6455 119.1798 56.9294 66.4236 172.6224 66 F 5.2157 9.5050 123.6429 56.7314 42.1796 174.1389 67 R 4.7232 7.9631 124.4428 53.2299 31.7972 172.7430 68 P 4.1847 0.0000 0.0000 63.1380 32.2901 176.5227 69 S 3.9207 8.8511 118.8304 59.4328 60.7268 172.3702 70 I 4.1779 7.2950 118.5006 61.3371 38.8971 174.8819 71 N 5.1777 9.0811 126.0112 52.8659 42.4830 173.0543 72 T 4.9946 8.6645 124.2988 61.6281 70.0481 174.3586 73 D 4.6391 8.8972 127.4268 52.6583 40.2759 176.9973 74 D 4.4344 8.5342 118.1702 56.4964 40.6811 177.1189 75 N 4.5712 8.3270 115.1434 52.9812 39.0750 175.7699 75A G 3.9011 8.4463 107.1190 45.2651 0.0000 172.7501 76 N 4.8199 8.6231 118.1236 52.2067 40.1194 174.3085 77 T 5.0540 8.4397 120.0676 62.1756 70.9328 173.9957 78 E 4.6970 9.2209 124.2787 54.9645 34.0266 174.8719 79 T 5.0248 8.3688 114.0150 58.4370 69.0658 172.1675 80 P 4.0237 0.0000 0.0000 65.9632 31.3631 177.4372 80A Y 4.6077 8.0452 113.6705 57.2402 38.6267 176.1707 81 G 3.8949 8.1659 108.2933 44.3392 0.0000 172.3099 82 E 4.8872 8.1253 116.4657 54.6481 32.7258 175.3871 83 Y 4.7303 9.1431 121.0281 56.2885 41.1175 175.4487 84 E 4.7136 8.8667 122.7379 55.9562 31.7682 175.1710 85 V 4.6212 8.2198 121.1852 61.7460 32.5119 175.4244 86 K 4.3095 9.2681 129.7030 58.7862 33.0174 176.2578 87 E 4.7987 7.8468 118.0535 55.0361 33.2574 173.7253 88 I 4.6734 8.3207 125.0788 59.6679 40.0955 175.5329 89 L 4.4117 8.9455 128.6083 52.8060 41.3559 176.9394 90 Q 3.9607 8.6206 125.5295 58.7908 30.1002 177.4025 91 E 4.8936 7.6557 114.5878 54.6808 29.6167 174.2063 92 P 4.2052 0.0000 0.0000 65.5793 32.0819 177.6906 92A F 4.4632 7.8994 115.8312 56.5946 39.6023 175.7109 93 G 4.2051 7.9195 109.2772 44.2637 0.0000 174.5077 94 A 3.9730 8.8836 124.7822 54.6553 18.5476 179.5801 92A G 3.8032 7.9294 104.3312 43.9946 0.0000 174.8109 93 V 4.3651 7.6195 119.6772 61.3637 32.8688 175.9077 94 D 4.2930 8.9836 121.3822 56.3553 40.5476 178.0801 103 L 5.1658 7.3499 118.0823 53.3091 46.4188 177.4393 104 A 5.0008 9.3896 122.7859 50.5231 23.5099 174.7336 105 L 5.1614 8.8483 119.0743 52.9716 44.9307 175.7432 106 I 4.8166 8.7623 124.5207 59.5859 40.1432 174.6474 107 R 5.3380 8.9507 127.1422 55.0469 31.4731 176.1979 108 L 4.9208 8.4534 123.8605 53.9129 43.4347 176.2676 109 K 4.7104 8.5664 120.7475 54.3058 34.1482 174.7916 110 P 4.7224 0.0000 0.0000 62.0195 32.4052 175.2382 110A D 4.3677 9.0153 119.6001 52.3874 40.0490 176.9675 110B Q 4.0983 8.4214 116.1769 58.0938 28.2730 176.5254 110C N 4.6717 8.4400 114.7151 53.1209 39.7080 175.4019 110D G 3.9181 8.7941 107.1711 45.2465 0.0000 173.0350 110E V 4.3604 8.4749 120.0089 60.7110 33.2274 175.6099 111 S 4.7768 8.4446 122.8451 57.8820 63.9550 174.9267 112 L 3.9696 8.4810 124.9417 58.2324 41.5360 179.3935 113 G 4.0187 7.8525 104.6077 46.0579 0.0000 173.9740 114 D 4.7314 7.9590 119.5060 54.7141 41.8120 177.7029 115 K 4.2214 7.9181 119.6424 56.9789 32.9083 176.4809 113 I 4.2287 7.5225 115.7077 62.0579 38.6001 175.4740 114 S 4.5614 7.9290 114.8060 58.8141 64.5120 176.0029 115 P 4.3214 0.0000 0.0000 64.0789 31.9083 177.1809 121 A 4.4916 8.3522 122.1064 52.0397 19.2017 177.2206 122 K 4.2204 9.3107 123.8764 56.2335 33.6185 175.6522 123 I 4.3041 8.5332 128.9718 60.1563 37.6646 175.4369 124 G 4.2370 8.8544 116.3366 46.0633 0.0000 173.9760 125 T 4.9130 8.2754 118.6242 60.7253 70.3690 173.5963 126 S 4.2656 8.7215 121.3164 59.6171 63.7117 175.2785 *128 N 4.6428 7.9541 118.7128 53.6259 40.2209 174.2086 129 D 4.6862 7.9306 114.9135 54.3095 41.5132 176.4634 130 L 4.3999 7.6344 120.3850 54.4413 42.5826 176.4575 131 K 4.7617 8.7054 120.8764 54.0691 35.8063 175.6877 132 D 4.6146 8.4982 120.7704 56.1064 41.1542 177.3595 133 G 4.0844 9.0589 112.4746 45.1908 0.0000 173.6847 134 D 4.5629 7.9082 120.1198 54.5064 42.0049 175.4192 135 K 5.1367 8.6279 121.7707 54.9398 34.1855 175.4117 136 L 4.9388 8.8303 123.4984 53.0996 46.9039 174.7316 137 E 4.9796 8.7447 118.8858 54.8057 31.9562 175.2377 138 L 5.0500 8.9811 127.7385 53.5880 44.2824 175.0479 139 I 4.9889 8.6478 127.0687 60.0255 40.5733 175.0043 140 G 4.6602 8.1613 112.6566 47.4835 0.0000 171.9830 141 Y 4.9321 8.9911 119.1855 55.5127 38.7548 174.6981 142 P 4.7619 0.0000 0.0000 61.1512 27.9838 175.7952 143 F 4.2107 8.4500 126.3581 62.7728 39.8448 175.8468 144 D 4.5377 8.4525 115.7795 56.9912 40.7011 177.7881 145 H 4.3972 8.3346 119.0792 57.2613 30.2758 174.8354 *151 K 4.2564 7.3119 116.8416 55.9034 33.0847 175.8280 152 V 3.5784 8.2105 123.6251 63.9749 32.3217 175.3187 153 N 4.3274 9.1602 123.9195 54.6763 36.0790 174.4640 154 Q 4.7340 8.2627 115.3460 53.9314 31.7264 175.2700 155 M 3.6778 8.3751 123.9150 55.8851 33.3586 174.7083 156 H 5.2933 9.1173 122.2487 53.8559 33.8092 172.2581 157 R 5.2031 8.6939 117.3483 54.6443 32.2677 174.9149 158 S 5.3898 9.2490 118.0549 56.7330 66.5390 172.8024 159 E 4.7848 9.1600 126.8358 55.8908 30.1766 175.7401 160 I 4.9104 8.8165 120.1211 59.0754 41.4262 173.9865 161 E 5.1785 8.9906 123.8175 54.2976 32.3792 175.1498 162 L 4.8968 9.1580 127.9549 55.6385 42.9500 176.1412 163 T 4.8199 8.9029 115.7157 61.4872 71.0315 173.8189 164 T 3.5896 8.4630 113.9289 63.0558 67.6778 173.2115 165 L 4.9598 8.4104 122.5807 56.7852 42.7077 179.8819 166 S 4.1790 7.6654 113.1537 60.7659 63.1420 175.8297 *179 R 4.6530 7.3033 118.7431 56.1340 31.4157 174.9171 180 G 3.8304 7.7854 104.5222 44.0744 0.0000 173.6192 181 L 4.4286 8.2454 120.1012 54.6405 41.4473 175.4658 182 R 5.1390 8.0900 123.6895 54.4122 33.6785 174.1194 183 Y 5.1395 7.5123 117.0881 56.6680 41.8110 172.9560 184 Y 4.3853 9.1606 119.1158 57.2584 39.8486 175.4155 *188 G 3.2746 8.4019 110.1107 45.0373 0.0000 171.9010 189 F 4.0679 8.2830 122.2533 56.7660 40.0393 175.1019 190 T 4.4020 7.5784 116.8585 60.2620 71.8130 172.8511 191 V 4.4699 8.2571 114.6257 58.5878 36.0118 175.0093 192 P 4.2861 0.0000 0.0000 66.0459 31.1376 179.2914 193 G 3.8809 8.2074 105.4091 48.3697 0.0000 174.1414 194 N 4.6189 8.5472 117.0096 54.5157 38.7425 175.1563 195 S 4.3376 7.9110 115.8198 60.5765 63.0803 174.7366 196 G 4.4655 8.9789 113.9123 44.9915 0.0000 173.6023 197 S 4.4718 8.3755 116.8153 58.4517 64.1567 173.8165 198 G 3.9793 8.7149 110.6750 45.7017 0.0000 172.5560 199 I 4.8646 8.0834 124.4520 59.3692 39.5285 174.7154 200 F 5.3695 9.2636 126.5074 55.6169 42.4511 175.3405 201 N 5.1709 8.7220 120.2056 51.4067 39.4718 175.9714 202 S 3.9778 8.7035 112.2824 61.4544 62.8973 175.6054 *206 N 4.8340 7.5202 115.4614 52.3346 39.9290 174.6651 207 G 3.9850 8.4783 106.3518 45.9191 0.0000 172.9600 208 E 4.9544 8.4952 119.0430 54.2960 31.9138 175.2203 209 L 3.9723 8.9933 127.0055 55.0907 42.8374 177.2683 210 V 4.2395 8.3909 118.9748 61.1807 34.3000 175.2141 211 G 4.1056 7.1166 106.1226 45.6587 0.0000 172.2017 212 I 5.0533 8.0454 120.0961 59.2394 40.8655 175.1582 213 H 4.5336 9.3688 127.5719 56.2533 30.5215 173.6389 214 S 4.8343 8.3521 117.6117 58.4364 64.1838 175.2950 215 S 4.6357 7.1300 112.4108 58.1595 66.3654 172.6781 216 K 5.0572 8.8111 118.5038 55.3843 34.1798 176.1902 217 V 4.5835 8.3794 116.7444 58.8159 36.0494 175.2368 218 S 4.7103 8.4304 116.6179 59.1821 63.5703 173.1737 219 H 4.5601 8.5143 121.4358 56.0274 32.3193 172.2068 220 L 3.9318 9.2714 130.6294 54.9024 40.1459 173.9758 221 D 4.7150 7.1255 114.2425 51.7256 42.4041 175.9552 221A R 4.0262 8.5434 117.6659 58.4872 30.0332 177.2815 222 E 4.6224 7.9456 115.8373 55.5844 30.3564 175.3051 223 H 4.8004 7.5412 113.1584 55.9060 33.8262 173.0011 224 Q 4.8803 7.8387 118.8030 54.4380 32.8679 173.9613 225 I 3.7982 7.7662 118.7362 59.7454 42.1952 173.3586 226 N 4.9619 8.4733 123.1367 53.1667 40.0064 173.7237 227 Y 4.9383 9.1236 122.9666 55.8805 42.2449 174.3912 228 G 4.4584 8.2725 112.3585 44.5179 0.0000 171.3952 229 V 4.1338 8.4667 120.2693 60.8969 33.0457 175.4569 230 G 4.0552 8.5685 115.1030 46.0371 0.0000 173.5082 231 I 4.1721 8.4308 123.6778 60.2173 38.0479 175.1830 232 G 4.4932 8.0181 116.5696 42.9145 0.0000 170.7918 232A N 4.3377 8.6982 116.4548 56.7331 38.5956 176.2981 233 Y 4.1920 8.1188 120.0773 60.9672 38.9027 178.0962 234 V 3.5663 7.9179 118.3680 65.9386 31.5989 177.7193 235 K 3.9005 8.1925 119.2273 59.4284 32.0618 178.6830 236 R 3.8527 8.1961 119.1358 59.6182 30.0525 178.4806 237 I 3.5359 7.4548 119.4001 64.3586 36.9344 178.4813 238 I 3.7065 7.7847 120.5879 64.5510 36.7357 178.2685 239 N 4.3236 8.0292 116.1154 56.3077 38.3884 177.0147 240 E 4.1185 8.0146 119.2118 58.1462 29.7233 178.2560 241 K 4.3320 7.6494 115.7987 55.1501 33.5633 176.2842 242 N 4.4309 7.7029 119.0683 53.7229 39.5492 174.3653 243 E 4.2950 8.3514 122.0455 56.9949 29.6218 174.9192 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 1B V 8.05 4.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.89 0.00 0.00 1C S 8.04 4.33 0.00 3.99 3.93 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 1D A 8.54 4.03 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E E 8.12 3.87 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 1F E 8.09 4.03 0.00 2.23 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 2.42 2.41 0.00 1G I 7.62 3.66 2.01 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 1.33 0.75 0.86 0.00 0.00 1H K 8.26 3.89 0.00 1.87 1.99 0.00 1.56 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.53 7.81 1I K 7.90 3.88 0.00 2.05 2.06 0.00 1.59 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.55 7.81 1J H 8.44 4.36 0.00 3.42 3.51 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1K E 8.49 4.10 0.00 2.28 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 2.46 2.63 0.00 1L E 8.06 4.05 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.57 0.00 2 K 8.06 4.09 0.00 1.84 1.33 0.00 1.39 0.00 0.00 0.72 0.00 0.00 2.76 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.22 1.29 7.81 3 W 8.83 4.77 0.00 3.55 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 4 N 8.75 4.56 0.00 3.28 2.99 0.00 0.00 7.19 6.60 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 5 K 7.69 3.80 0.00 1.38 1.20 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.52 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.29 1.52 7.81 6 Y 7.60 4.24 0.00 2.37 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 7 Y 7.65 4.58 0.00 2.81 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 8 G 8.30 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 V 7.16 4.47 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.79 0.00 0.00 10 N 8.39 4.40 0.00 2.76 2.72 0.00 0.00 6.92 8.21 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 11 A 8.61 3.40 0.56 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 0.00 0.00 12 F 8.92 4.33 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 13 N 8.21 4.84 0.00 2.77 2.82 0.00 0.00 7.02 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.35 4.05 0.00 1.63 1.51 -0.07 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.38 0.00 2.34 2.14 0.00 3.60 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.90 0.00 16 K 9.12 4.10 0.00 1.82 1.89 0.00 1.93 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.40 7.81 17 E 8.17 3.79 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 18 L 8.18 4.48 0.00 1.90 1.89 0.62 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 19 F 7.87 5.65 0.00 2.97 2.75 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 20 S 8.29 4.35 0.00 3.78 3.93 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 21 K 8.16 3.93 0.00 1.48 1.55 0.00 1.53 0.00 0.00 1.55 0.00 0.00 2.63 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.30 7.81 22 V 7.88 3.77 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.73 0.00 0.00 23 D 8.40 4.52 0.00 2.85 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 24 E 8.84 3.84 0.00 1.93 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 2.26 2.39 0.00 25 K 8.04 4.07 0.00 1.92 1.82 0.00 1.68 0.00 0.00 1.79 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.50 7.81 26 D 8.00 4.31 0.00 2.38 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 0.00 0.00 0.00 26A R 7.89 4.12 0.00 1.91 2.03 0.00 3.13 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.87 0.00 26B Q 7.44 4.99 0.00 2.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 26C K 8.10 4.81 0.00 2.02 1.79 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.59 1.52 7.81 26D Y 8.72 4.64 0.00 2.93 2.81 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 26E P 0.00 3.20 0.00 0.49 0.62 0.00 2.91 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.86 0.00 27 Y 7.45 4.06 0.00 3.32 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 28 N 8.68 5.16 0.00 2.89 3.44 0.00 0.00 6.40 6.70 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 29 T 7.84 4.23 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 30 I 7.82 4.76 2.12 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.12 1.12 0.00 0.00 31 G 8.81 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 32 N 8.18 4.84 0.00 1.74 2.26 0.00 0.00 6.73 8.09 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 33 V 8.40 4.70 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.24 0.00 0.00 34 F 9.14 5.15 0.00 3.29 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 35 V 7.51 4.52 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 0.80 0.00 0.00 0.88 0.00 0.00 36 K 8.77 3.34 0.00 2.00 1.73 0.00 1.87 0.00 0.00 2.04 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.54 7.81 26C G 8.14 4.45 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 0.00 0.00 0.00 26D Q 8.92 4.43 0.00 2.02 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.96 0.00 0.00 0.00 0.00 0.00 2.34 2.25 0.00 26E T 8.29 3.13 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 27 S 7.64 3.98 0.00 4.18 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 28 A 8.52 4.74 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 7.84 4.23 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 30 G 8.15 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 0.00 0.00 0.00 0.00 31 V 8.51 4.19 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 0.74 0.00 0.00 0.93 0.00 0.00 32 L 7.94 4.44 0.00 0.53 1.13 0.92 0.98 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 33 I 8.37 4.75 1.98 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 1.35 1.32 1.22 0.00 0.00 34 G 9.17 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 7.77 4.72 0.00 1.88 1.51 0.00 1.19 0.00 0.00 1.63 0.00 0.00 2.13 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.31 0.96 7.81 36 N 8.88 3.76 0.00 2.99 2.73 0.00 0.00 6.72 7.81 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 51 T 7.87 4.90 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 1.16 0.00 0.00 52 V 8.65 4.69 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 -0.27 0.00 0.00 53 L 8.31 5.01 0.00 1.66 1.51 0.97 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.31 4.60 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 1.23 0.00 0.00 55 N 8.62 5.35 0.00 2.68 2.79 0.00 0.00 7.49 7.93 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 56 R 8.63 3.97 0.00 2.17 2.17 0.00 3.24 0.00 0.00 3.43 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.93 0.00 57 H 8.45 4.32 0.00 3.31 3.42 0.00 5.57 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 7.42 4.30 2.04 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 1.34 1.38 0.95 0.00 0.00 59 A 8.02 4.08 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.20 3.87 0.00 1.90 1.56 0.00 1.57 0.00 0.00 1.51 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.43 7.81 61 F 7.94 4.15 0.00 3.26 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.22 4.11 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 62A N 8.87 3.98 0.00 2.87 2.87 0.00 0.00 7.19 8.09 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 62B G 8.40 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 62C D 7.86 4.66 0.00 2.79 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 62D P 0.00 4.42 0.00 2.47 2.31 0.00 3.76 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 62E S 7.98 4.28 0.00 4.03 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.72 4.31 0.00 1.83 1.89 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.60 1.53 7.81 64 V 7.51 5.03 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 0.92 0.00 0.00 0.97 0.00 0.00 65 S 8.65 5.05 0.00 4.04 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 66 F 9.51 5.22 0.00 3.12 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 67 R 7.96 4.72 0.00 1.42 1.69 0.00 3.26 0.00 0.00 3.23 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.59 0.00 68 P 0.00 4.18 0.00 2.17 2.07 0.00 4.12 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.14 0.00 69 S 8.85 3.92 0.00 4.29 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 I 7.29 4.18 1.76 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.83 0.61 0.00 0.00 71 N 9.08 5.18 0.00 2.81 2.60 0.00 0.00 7.15 6.65 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 72 T 8.66 4.99 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 1.21 0.00 0.00 73 D 8.90 4.64 0.00 2.88 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 74 D 8.53 4.43 0.00 2.69 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 75 N 8.33 4.57 0.00 2.94 2.84 0.00 0.00 7.09 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75A G 8.45 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 76 N 8.62 4.82 0.00 2.95 2.73 0.00 0.00 6.91 7.84 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 77 T 8.44 5.05 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 78 E 9.22 4.70 0.00 1.78 1.73 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 2.19 2.34 0.00 79 T 8.37 5.02 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 80 P 0.00 4.02 0.00 1.36 1.97 0.00 3.75 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.85 0.00 80A Y 8.05 4.61 0.00 3.17 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 81 G 8.17 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 82 E 8.13 4.89 0.00 1.75 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 2.15 2.25 0.00 83 Y 9.14 4.73 0.00 3.11 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 E 8.87 4.71 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 85 V 8.22 4.62 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.01 0.00 0.00 86 K 9.27 4.31 0.00 1.78 1.99 0.00 1.90 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.39 7.81 87 E 7.85 4.80 0.00 2.05 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 88 I 8.32 4.67 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 1.36 0.81 0.92 0.00 0.00 89 L 8.95 4.41 0.00 1.70 1.55 0.94 0.60 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 90 Q 8.62 3.96 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.39 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 91 E 7.66 4.89 0.00 2.19 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 0.00 2.27 2.31 0.00 92 P 0.00 4.21 0.00 1.65 2.01 0.00 3.83 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.81 0.00 92A F 7.90 4.46 0.00 3.07 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 7.92 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 0.00 0.00 0.00 0.00 94 A 8.88 3.97 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92A G 7.93 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 7.62 4.37 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 0.63 0.00 0.00 0.93 0.00 0.00 94 D 8.98 4.29 0.00 2.70 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.35 5.17 0.00 1.17 1.26 0.24 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 104 A 9.39 5.00 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 0.00 105 L 8.85 5.16 0.00 1.55 1.52 0.78 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.76 4.82 1.77 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 0.76 0.88 0.00 0.00 107 R 8.95 5.34 0.00 1.83 1.83 0.00 3.22 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 108 L 8.45 4.92 0.00 1.52 1.69 0.72 0.97 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 0.00 109 K 8.57 4.71 0.00 1.73 1.79 0.00 1.74 0.00 0.00 1.79 0.00 0.00 3.02 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.45 1.50 7.81 110 P 0.00 4.72 0.00 2.22 2.15 0.00 3.82 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 2.03 1.99 0.00 110A D 9.02 4.37 0.00 2.67 2.51 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 110B Q 8.42 4.10 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 110C N 8.44 4.67 0.00 2.86 2.89 0.00 0.00 7.19 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110D G 8.79 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 0.00 0.00 0.00 110E V 8.47 4.36 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.98 0.00 0.00 111 S 8.44 4.78 0.00 4.09 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 0.00 112 L 8.48 3.97 0.00 0.68 1.31 0.80 0.88 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 0.00 113 G 7.85 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 D 7.96 4.73 0.00 2.85 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 0.00 115 K 7.92 4.22 0.00 1.93 1.93 0.00 1.95 0.00 0.00 1.94 0.00 0.00 3.13 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.50 1.69 7.81 113 I 7.52 4.23 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 1.65 1.93 0.91 0.00 0.00 114 S 7.93 4.56 0.00 4.02 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.32 0.00 2.38 2.12 0.00 3.90 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.27 0.00 121 A 8.35 4.49 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 0.00 122 K 9.31 4.22 0.00 1.93 1.85 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.54 1.49 7.81 123 I 8.53 4.30 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 1.26 0.68 0.89 0.00 0.00 124 G 8.85 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 0.00 125 T 8.28 4.91 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 1.24 0.00 0.00 126 S 8.72 4.27 0.00 4.03 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 0.00 *128 N 7.95 4.64 0.00 2.72 2.93 0.00 0.00 7.04 8.48 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 0.00 129 D 7.93 4.69 0.00 2.71 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 7.63 4.40 0.00 1.72 1.60 0.89 0.56 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 0.00 131 K 8.71 4.76 0.00 1.94 1.67 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.53 7.81 132 D 8.50 4.61 0.00 2.69 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.06 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 D 7.91 4.56 0.00 2.87 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 0.00 135 K 8.63 5.14 0.00 1.66 1.77 0.00 1.73 0.00 0.00 1.90 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.50 7.81 136 L 8.83 4.94 0.00 1.45 1.63 0.83 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 137 E 8.74 4.98 0.00 1.94 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 138 L 8.98 5.05 0.00 1.62 1.71 0.93 0.77 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 0.00 139 I 8.65 4.99 2.00 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.32 1.00 0.00 0.00 140 G 8.16 4.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 8.99 4.93 0.00 3.06 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 4.76 0.00 2.48 2.53 0.00 4.05 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 143 F 8.45 4.21 0.00 3.13 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 0.00 144 D 8.45 4.54 0.00 2.77 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 0.00 145 H 8.33 4.40 0.00 3.34 3.57 0.00 5.81 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *151 K 7.31 4.26 0.00 1.79 1.81 0.00 1.89 0.00 0.00 0.61 0.00 0.00 3.10 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.29 7.81 152 V 8.21 3.58 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 0.91 0.00 0.00 0.37 0.00 0.00 153 N 9.16 4.33 0.00 2.98 2.89 0.00 0.00 6.86 7.90 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 0.00 154 Q 8.26 4.73 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.61 0.00 155 M 8.38 3.68 0.00 1.85 1.43 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.37 0.00 156 H 9.12 5.29 0.00 3.08 2.71 0.00 5.82 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 R 8.69 5.20 0.00 1.92 2.11 0.00 2.77 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.52 0.00 158 S 9.25 5.39 0.00 3.83 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 0.00 159 E 9.16 4.78 0.00 2.17 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 2.42 2.32 0.00 160 I 8.82 4.91 1.92 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.58 0.92 0.00 0.00 161 E 8.99 5.18 0.00 2.22 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 2.36 2.48 0.00 162 L 9.16 4.90 0.00 1.69 1.67 0.98 0.28 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 0.00 163 T 8.90 4.82 4.56 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 1.10 0.00 0.00 164 T 8.46 3.59 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 1.28 0.00 0.00 165 L 8.41 4.96 0.00 1.87 1.78 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 166 S 7.67 4.18 0.00 4.14 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 *179 R 7.30 4.65 0.00 1.87 2.04 0.00 3.19 0.00 0.00 3.86 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 180 G 7.79 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 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0.00 2.41 2.19 0.00 3.81 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 2.19 2.17 0.00 193 G 8.21 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 N 8.55 4.62 0.00 3.04 2.87 0.00 0.00 6.93 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 7.91 4.34 0.00 3.96 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 0.00 196 G 8.98 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 S 8.38 4.47 0.00 3.90 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 G 8.71 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 0.00 199 I 8.08 4.86 1.73 0.00 0.00 0.57 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 0.67 0.68 0.00 0.00 200 F 9.26 5.37 0.00 2.85 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 0.00 201 N 8.72 5.17 0.00 2.88 2.98 0.00 0.00 7.12 7.09 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 0.00 202 S 8.70 3.98 0.00 4.04 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *206 N 7.52 4.83 0.00 2.93 2.98 0.00 0.00 7.38 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 G 8.48 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 0.00 208 E 8.50 4.95 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 209 L 8.99 3.97 0.00 1.48 1.41 0.16 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 210 V 8.39 4.24 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 0.74 0.00 0.00 0.89 0.00 0.00 211 G 7.12 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 0.00 212 I 8.05 5.05 1.76 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.90 0.88 0.00 0.00 213 H 9.37 4.53 0.00 3.34 3.26 0.00 5.77 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 S 8.35 4.83 0.00 3.86 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 0.00 215 S 7.13 4.64 0.00 3.87 3.93 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 0.00 216 K 8.81 5.06 0.00 1.64 1.72 0.00 1.74 0.00 0.00 1.90 0.00 0.00 2.56 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.59 1.51 7.81 217 V 8.38 4.58 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.76 0.00 0.00 218 S 8.43 4.71 0.00 3.77 3.77 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 0.00 219 H 8.51 4.56 0.00 2.75 2.84 0.00 6.04 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 L 9.27 3.93 0.00 1.69 1.71 0.77 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 221 D 7.13 4.72 0.00 2.81 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 221A R 8.54 4.03 0.00 1.77 1.99 0.00 3.29 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.53 0.00 222 E 7.95 4.62 0.00 1.90 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 2.24 2.20 0.00 223 H 7.54 4.80 0.00 3.27 2.97 0.00 5.75 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 Q 7.84 4.88 0.00 1.36 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.75 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 225 I 7.77 3.80 1.24 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.74 0.60 0.00 0.00 226 N 8.47 4.96 0.00 2.19 2.12 0.00 0.00 6.99 8.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 Y 9.12 4.94 0.00 2.81 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 0.00 228 G 8.27 4.46 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 0.00 229 V 8.47 4.13 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 0.80 0.00 0.00 0.81 0.00 0.00 230 G 8.57 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 I 8.43 4.17 1.80 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.89 0.86 0.00 0.00 232 G 8.02 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232A N 8.70 4.34 0.00 2.81 2.94 0.00 0.00 6.50 7.51 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 0.00 233 Y 8.12 4.19 0.00 3.07 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 0.00 234 V 7.92 3.57 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.84 0.00 0.00 235 K 8.19 3.90 0.00 2.05 1.93 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.45 7.81 236 R 8.20 3.85 0.00 1.97 2.01 0.00 3.17 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 1.70 1.66 0.00 237 I 7.45 3.54 1.63 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.21 0.20 0.00 0.00 238 I 7.78 3.71 2.08 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 1.72 1.03 0.93 0.00 0.00 239 N 8.03 4.32 0.00 2.85 2.86 0.00 0.00 7.12 7.06 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 0.00 240 E 8.01 4.12 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.52 0.00 241 K 7.65 4.33 0.00 1.58 1.72 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.85 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.33 1.30 7.81 242 N 7.70 4.43 0.00 2.91 2.69 0.00 0.00 7.14 7.22 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 0.00 243 E 8.35 4.29 0.00 2.01 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 2.17 2.20 0.00 * Residues marked with a * may have inaccurate shift predictions.