NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4895 8.1633 120.6159 55.3026 34.2633 173.9577 2 K 4.5255 8.4759 124.4599 55.3265 33.9680 174.2647 3 I 5.0705 9.1631 127.0374 59.4739 40.5872 174.2101 4 A 5.8220 8.8148 127.9140 49.1769 22.6958 175.0818 5 G 4.4284 8.5924 105.9475 44.4733 0.0000 171.4139 6 I 5.2323 8.9126 122.9111 59.2760 41.3205 173.5476 7 D 5.4570 8.8466 127.4826 53.1537 45.6227 172.9314 8 E 5.0000 8.7621 119.2465 54.8709 32.7974 173.8046 9 A 4.6722 9.5426 128.1522 50.5228 22.6725 176.4760 10 G 3.5793 8.6941 104.9735 46.7262 0.0000 175.6492 11 R 4.0580 8.3424 122.1390 58.6962 30.5747 177.8495 12 G 3.8417 8.1491 105.8074 47.3576 0.0000 172.4145 13 P 3.8954 0.0000 0.0000 62.6996 31.4632 176.2796 14 V 4.0315 8.7399 118.5762 61.5645 32.2879 175.5835 15 I 4.6636 7.4621 113.8543 60.1918 39.8940 175.2834 16 G 3.7739 8.4967 109.0754 44.0772 0.0000 170.9456 17 P 4.8373 0.0000 0.0000 61.8811 33.3634 175.2782 18 M 4.8142 8.9221 119.5848 54.1763 35.0707 174.2190 19 V 4.8200 8.5652 126.3146 61.3253 34.3010 174.3293 20 I 4.8043 8.7011 127.8525 59.4659 40.1435 174.1066 21 A 5.2524 8.7322 128.9867 49.9472 21.6881 174.8427 22 A 5.1451 8.9705 123.5393 50.1850 22.4576 175.5027 23 V 4.9483 8.6998 114.2132 59.5003 36.6293 174.8493 24 V 4.9565 9.2219 123.0819 61.1846 34.3218 174.8633 25 V 4.7978 9.1639 126.8964 59.8783 35.1276 174.1204 26 D 4.9919 8.5245 122.6908 53.5226 42.5909 177.7052 27 E 3.9647 8.5387 120.8076 59.1813 29.7798 179.4497 28 N 4.8359 8.5336 112.4880 52.9889 38.0085 180.0548 29 S 4.6570 7.9813 113.1528 59.6301 63.5180 175.8537 30 L 3.8778 7.8691 122.4845 57.5922 41.4000 176.9508 31 P 4.2678 0.0000 0.0000 66.6018 31.0941 179.1599 32 K 3.8981 7.3960 120.8685 59.7579 31.7022 180.5821 33 L 4.3600 8.0245 121.7657 59.2518 42.1376 179.4622 34 E 4.1819 8.2305 119.9566 61.2166 29.5950 180.5104 35 E 4.4302 8.1473 115.4600 59.9630 29.9005 182.2668 36 L 4.6538 7.7396 118.7756 54.8026 42.7081 176.8023 37 K 3.8957 8.1802 120.2348 54.9541 29.7420 182.8149 38 V 3.6798 8.2508 117.1140 65.9155 31.9266 179.1117 39 R 3.9864 8.2076 119.2171 59.7539 29.8727 180.1466 40 D 4.8351 7.6750 118.9173 52.1702 38.5509 178.1591 41 S 4.7627 7.4688 116.3119 58.6111 65.6469 177.3027 42 K 3.9604 8.2738 122.2061 59.7451 31.9970 178.8351 43 K 4.1738 7.9776 119.3880 56.8733 32.0481 181.5606 44 L 4.1912 7.3661 117.7953 55.1308 42.1837 177.5822 45 T 4.3471 8.1007 111.3947 60.3164 71.3733 173.9310 46 P 4.2546 0.0000 0.0000 66.5819 31.1836 179.7544 47 K 4.0302 7.9518 121.6990 59.9007 31.7238 181.0650 48 R 4.1884 8.0256 119.3170 58.8743 29.9030 179.1687 49 R 3.9336 8.7387 119.4753 59.4747 29.9753 178.4674 50 E 4.1086 8.6447 118.6438 58.8986 28.9929 179.2437 51 K 4.0103 7.7879 120.1482 59.1646 32.1993 178.6271 52 L 3.9619 7.9699 120.8034 58.0626 41.9879 178.1653 53 F 3.9607 8.5944 120.9415 61.9684 38.7571 176.9953 54 N 4.4328 8.3886 115.6355 56.0717 38.1072 177.2256 55 E 4.0716 7.5624 119.1402 58.8087 29.9143 178.6693 56 I 3.7390 7.9283 120.2777 64.3208 37.2320 178.0500 57 L 3.6894 7.4285 119.8302 57.9071 41.3322 179.8761 58 G 3.8370 7.5109 101.8312 46.4533 0.0000 174.0860 59 V 4.3323 7.7106 112.5548 60.8282 33.2319 175.7037 60 L 4.4502 7.4911 120.7455 53.8228 42.4446 176.7426 61 D 4.5607 8.5700 123.3000 57.6041 41.4538 175.9616 62 D 4.6127 7.9134 114.9647 54.1118 44.5226 173.8734 63 Y 5.2251 7.7040 118.6884 56.3819 40.7668 173.6834 64 V 4.5297 9.0583 119.7989 61.4084 35.6653 174.1435 65 I 4.9160 8.4245 126.5288 59.6457 40.0941 174.2668 66 L 4.5775 9.0950 130.5177 53.5540 43.9690 174.7305 67 E 4.8597 8.7581 126.1645 54.4080 32.1772 174.6558 68 L 4.8195 8.8970 128.2141 52.2297 43.6645 174.7945 69 P 4.6826 0.0000 0.0000 61.4093 32.3125 175.5578 70 P 4.2323 0.0000 0.0000 66.2856 30.4886 178.2841 71 D 4.3180 7.9797 117.7205 56.0317 39.5382 178.3882 72 V 3.7900 7.7283 119.0438 65.8086 31.8554 177.8293 73 I 3.2229 7.6987 119.1038 64.0407 36.8090 179.4948 74 G 4.1174 7.8088 103.6297 44.6898 0.0000 174.4973 75 S 4.5659 7.9830 115.5198 58.9813 65.3341 175.3513 76 R 4.0359 7.9428 122.6873 57.2304 29.4725 181.1486 77 E 4.6403 8.8919 117.4798 55.3816 30.4278 174.8536 78 G 3.8982 7.4897 109.4884 46.0821 0.0000 172.1908 79 T 4.3394 8.3546 113.0741 60.6604 71.0079 175.5557 80 L 4.1411 8.4039 121.4691 58.1554 42.2087 177.9472 81 N 4.3391 8.1856 115.9267 56.5626 38.4228 176.8716 82 E 4.0198 8.1286 119.3064 59.3978 29.5609 179.1498 83 F 4.1608 7.8959 119.1315 61.5000 39.3745 176.8258 84 E 4.0975 8.3980 118.0611 59.4775 29.3920 179.1539 85 V 3.6200 7.9684 117.9952 66.5129 31.5015 178.0686 86 E 3.9601 8.4427 118.0700 59.5756 29.2965 179.1344 87 N 4.3407 8.2051 116.4323 56.0276 38.4231 177.6122 88 F 4.0240 9.4432 120.4121 60.2622 38.9013 177.5755 89 A 4.0563 8.0360 120.4962 54.8508 18.0773 179.4577 90 K 3.8412 8.0313 116.9620 59.5797 32.4038 178.3872 91 A 4.1287 7.9411 120.9310 55.3669 18.3008 179.7051 92 L 4.0625 7.7371 117.3620 57.8507 41.5855 178.8157 93 N 4.8003 8.5938 114.0495 54.6562 38.6037 176.2866 94 S 4.6354 7.4551 115.8014 57.5596 63.8800 174.2695 95 L 4.0911 7.0854 122.9559 54.3729 41.6569 177.4237 96 K 3.8844 8.7693 123.8740 58.5359 32.2739 177.2075 97 V 4.0436 7.6767 118.9846 60.8474 31.8485 175.1984 98 K 3.8119 8.2632 127.7602 55.0244 32.6887 175.3479 99 P 4.6864 0.0000 0.0000 62.3809 32.8751 175.0689 100 D 4.8683 9.2008 117.9897 54.7405 43.2783 176.8811 101 V 4.7530 7.6825 117.3231 60.8837 35.2814 174.3679 102 I 4.9337 8.5308 127.6164 59.7823 40.6324 173.8461 103 Y 4.7014 9.7260 126.4286 56.3961 39.4712 174.8093 104 A 5.3950 9.1536 126.3509 50.0445 23.0623 174.6182 105 D 5.0882 8.7904 119.7416 52.8229 41.3738 176.1106 106 A 2.8087 9.0692 129.6070 51.8116 18.6467 177.8399 107 A 3.7553 6.9898 126.4239 55.3957 18.4902 176.4347 108 D 4.3281 7.2331 112.1467 51.8374 41.8443 174.8539 109 V 3.2713 7.6056 119.8306 64.1362 32.0545 174.1376 110 D 4.3294 8.6004 118.6048 55.3092 38.3270 174.5810 111 E 4.2952 7.9331 121.0374 59.1894 30.0411 179.3429 112 E 4.0818 8.1985 122.3858 62.0332 30.0501 185.0000 113 R 4.2067 8.1943 121.9507 60.9545 29.3419 180.5869 114 F 4.3219 8.0413 119.5975 61.4237 39.3238 177.3063 115 A 3.8300 8.2163 120.1754 54.5109 18.0407 179.8372 116 R 3.8293 7.7228 116.9159 59.0795 30.2556 178.2693 117 E 3.8106 8.0317 118.0600 59.4062 29.7328 178.4967 118 L 3.9842 7.5662 120.1627 57.8073 42.1389 178.6273 119 G 3.6208 7.5341 105.9658 47.9743 0.0000 175.1134 120 E 4.1532 7.8858 118.9196 57.5283 29.5434 178.0214 121 R 4.4044 7.5134 117.8475 54.9872 30.7553 175.4962 122 L 4.3822 7.6769 121.5138 53.7428 42.5321 176.5864 123 N 4.8212 9.2970 121.3025 52.5046 37.3499 174.3182 124 F 4.8928 6.9847 112.1335 55.7992 41.1329 173.0004 125 E 4.1615 8.6859 121.8625 55.4158 30.1181 175.1224 126 A 4.5403 7.7994 124.7834 51.6358 21.8174 175.0687 127 E 4.4779 8.6337 120.3716 55.0692 31.8096 175.4503 128 V 4.6241 8.1177 121.9462 61.1067 34.5736 175.3406 129 V 4.2472 9.1042 126.8928 61.1564 33.4047 173.7193 130 A 5.3620 8.5216 129.0306 50.5187 21.3300 176.0175 131 K 4.7605 8.8549 121.4316 55.2083 36.1732 174.6506 132 H 4.6760 9.9950 128.8845 55.8833 30.1436 175.4242 133 K 3.7268 8.6010 125.1804 57.6799 29.1795 176.8197 134 A 4.3405 8.5906 124.8207 51.1181 16.6910 178.1135 135 D 4.4648 7.7848 122.0501 55.0870 39.7443 175.3511 136 D 4.5947 8.4432 118.1919 53.4201 39.1937 174.8657 137 I 3.5149 7.4696 120.4757 63.3538 38.1839 176.6580 138 F 4.7603 7.5977 120.4423 55.2370 40.5698 174.7648 139 P 4.3300 0.0000 0.0000 65.4590 31.2811 179.0878 140 V 3.6849 7.7174 117.7839 64.7595 31.4500 178.5043 141 V 3.8414 7.7909 118.3956 65.5337 31.3212 178.0214 142 S 4.1438 8.1797 115.0074 61.6393 62.7253 176.5226 143 A 3.9590 7.9817 122.6897 55.0447 18.0313 179.5175 144 A 4.0072 7.6405 118.0597 55.0527 18.4702 179.8275 145 S 4.2921 8.0217 113.3307 60.9403 62.3560 176.3093 146 I 3.7065 7.8582 122.5409 64.4661 36.9411 178.2406 147 L 4.4058 7.8137 118.9218 58.1034 41.6337 179.6483 148 A 4.0604 8.2342 120.6240 54.9640 18.2399 179.6790 149 K 3.9243 8.6745 118.6449 59.4643 32.3132 179.2369 150 V 3.4899 8.5838 119.0985 66.4532 31.3286 177.9755 151 T 3.7899 7.8868 115.3759 66.6621 68.2368 176.5792 152 R 3.8766 7.8877 119.9776 59.4669 30.1477 178.0745 153 D 4.3424 8.1719 118.8139 57.6696 40.3179 179.1432 154 R 3.8334 7.9678 118.0577 59.3086 29.8217 179.0494 155 A 4.0434 7.4589 119.6226 54.6622 18.5196 179.5567 156 V 3.6900 7.6594 116.9714 66.0082 31.4927 178.1151 157 E 3.9808 8.9436 120.8554 59.6007 28.8703 179.8373 158 K 4.2878 7.7330 122.6769 58.9297 32.1050 183.8046 159 L 4.4756 8.0805 118.4399 57.6198 41.4213 179.5651 160 K 4.3666 7.4723 120.5573 58.7353 31.8165 179.0706 161 E 4.0984 7.7606 116.4285 58.2784 29.4300 177.7962 162 E 4.4230 8.1089 116.9982 56.4480 30.8172 175.4884 163 Y 4.6846 8.0773 113.0658 56.7062 41.2939 177.1437 164 G 3.9113 8.6552 107.4939 44.7301 0.0000 174.8653 165 E 4.2619 8.6572 123.4895 56.6978 28.0021 176.3470 166 I 3.2178 7.9068 117.4552 59.3458 38.6030 177.5368 167 G 3.8910 7.1713 110.2990 44.8795 0.0000 173.4514 168 S 4.2006 8.8739 112.9202 59.2708 63.4361 175.4127 169 G 3.8049 8.7096 110.6796 45.5341 0.0000 172.7053 170 Y 4.5840 7.6358 118.2024 56.0568 38.8369 175.0343 171 P 4.2469 0.0000 0.0000 65.1581 31.4229 177.0374 172 S 4.4637 8.0942 111.7008 57.9428 63.6220 173.0161 173 D 4.7423 8.1046 122.6855 52.3642 41.4199 174.6874 174 P 4.2929 0.0000 0.0000 66.1287 31.4280 178.7132 175 R 3.9938 8.4638 116.5499 59.5801 29.9025 179.2263 176 T 4.4506 7.9597 116.9444 65.7276 68.4063 177.3550 177 R 3.8934 7.9205 119.4667 59.1803 30.0712 178.2747 178 A 4.0983 8.7085 120.8939 55.3542 18.3818 179.0361 179 F 4.4747 8.2227 118.0951 61.7630 39.2592 177.7166 180 L 3.4210 7.9010 118.0048 57.5119 41.2188 178.7663 181 E 4.4092 8.6706 118.3979 59.8557 29.7316 178.4664 182 N 4.5104 9.2221 117.3055 56.3833 38.5903 176.9357 183 Y 3.9596 8.0322 121.0483 60.7306 38.7301 176.8229 184 Y 4.6006 9.1901 121.7581 59.5296 38.4493 177.2696 185 R 4.0910 7.7444 119.5360 58.8981 30.1421 177.1734 186 E 4.1675 7.4402 113.3486 57.3971 29.9518 177.0302 187 H 4.5975 7.3535 114.3626 54.3098 31.0144 176.1453 188 G 3.8721 7.5149 107.3294 45.7963 0.0000 173.1181 189 E 4.8347 8.1045 116.4809 54.2247 32.7968 174.8298 190 F 5.2989 8.5771 117.3151 55.9250 40.4307 174.4360 191 P 4.3796 0.0000 0.0000 62.1239 31.6240 175.7391 192 P 4.4368 0.0000 0.0000 63.3688 30.8912 177.1233 193 I 4.2466 7.7454 111.3842 60.5019 38.1818 175.3325 194 V 4.5997 7.2729 114.2148 59.8668 33.5199 176.6707 195 R 4.2271 8.3695 125.6246 55.3782 28.2199 174.9816 196 K 4.2755 8.2572 122.6800 54.3128 30.2226 174.9413 197 G 4.2754 7.9107 123.9506 45.9230 0.0000 172.6893 *198 W 4.0126 7.2291 122.0006 55.5914 28.7623 180.4419 199 K 3.9358 8.8391 124.9053 58.8882 31.6821 178.6162 200 T 3.8415 8.1475 115.3972 66.8446 68.1199 175.9836 201 L 3.9117 7.6784 118.8390 57.4064 41.8088 179.7172 202 K 4.1722 8.2527 121.4773 60.0309 32.0577 179.8184 203 K 3.9895 8.2688 125.8203 60.7509 31.1756 181.3882 204 I 4.1450 7.5117 119.5760 65.5419 35.1258 180.9263 205 T 4.3216 8.0196 112.3494 64.5021 68.8339 176.8165 206 Q 4.3812 7.7692 122.0246 59.7060 28.9332 181.2731 207 D 4.5730 8.4710 119.6984 55.8862 41.0210 176.8961 208 M 4.3266 7.6864 120.7659 55.9149 33.8310 178.3367 209 I 3.2311 8.7409 118.2658 60.0239 33.8149 174.8652 *210 N 4.6087 7.8013 121.7965 53.8404 37.8995 179.0787 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 1 M 8.16 4.49 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.61 0.00 2 K 8.48 4.53 0.00 1.72 1.70 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.71 7.81 3 I 9.16 5.07 1.95 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 1.31 0.75 1.15 0.00 0.00 4 A 8.81 5.82 1.26 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 0.00 0.00 0.00 5 G 8.59 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 0.00 0.00 0.00 0.00 6 I 8.91 5.23 1.91 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 1.46 1.22 0.00 0.00 7 D 8.85 5.46 0.00 2.88 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.76 5.00 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 9 A 9.54 4.67 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 10 G 8.69 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 R 8.34 4.06 0.00 2.24 2.02 0.00 3.26 0.00 0.00 3.57 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 12 G 8.15 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 13 P 0.00 3.90 0.00 2.03 1.34 0.00 3.57 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.65 0.00 14 V 8.74 4.03 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 0.73 0.00 0.00 0.79 0.00 0.00 15 I 7.46 4.66 1.70 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 1.36 0.57 0.83 0.00 0.00 16 G 8.50 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 0.00 0.00 0.00 17 P 0.00 4.84 0.00 1.95 2.11 0.00 3.58 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 18 M 8.92 4.81 0.00 2.17 1.94 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.65 0.00 19 V 8.57 4.82 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 1.00 0.00 0.00 0.97 0.00 0.00 20 I 8.70 4.80 1.75 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.50 0.42 0.00 0.00 21 A 8.73 5.25 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 22 A 8.97 5.15 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.70 4.95 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 0.64 0.00 0.00 0.95 0.00 0.00 24 V 9.22 4.96 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 1.03 0.00 0.00 0.98 0.00 0.00 25 V 9.16 4.80 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 0.66 0.00 0.00 0.93 0.00 0.00 26 D 8.52 4.99 0.00 3.12 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 27 E 8.54 3.96 0.00 2.07 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 0.00 2.26 2.14 0.00 28 N 8.53 4.84 0.00 2.73 2.73 0.00 0.00 6.97 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 29 S 7.98 4.66 0.00 4.05 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.87 3.88 0.00 1.69 1.74 0.94 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 31 P 0.00 4.27 0.00 2.15 2.12 0.00 3.63 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 2.12 2.18 0.00 32 K 7.40 3.90 0.00 1.68 1.76 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.35 7.81 33 L 8.02 4.36 0.00 1.69 1.90 0.91 0.74 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 34 E 8.23 4.18 0.00 2.02 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 2.31 1.94 0.00 35 E 8.15 4.43 0.00 2.07 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 2.26 2.22 0.00 36 L 7.74 4.65 0.00 1.85 1.71 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 37 K 8.18 3.90 0.00 1.82 1.81 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.26 7.81 38 V 8.25 3.68 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.93 0.00 0.00 39 R 8.21 3.99 0.00 1.83 1.85 0.00 3.25 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 40 D 7.68 4.84 0.00 2.71 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 41 S 7.47 4.76 0.00 3.97 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 42 K 8.27 3.96 0.00 1.77 1.92 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.45 7.81 43 K 7.98 4.17 0.00 1.78 1.72 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.36 1.03 7.81 44 L 7.37 4.19 0.00 1.68 1.65 0.93 1.16 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 45 T 8.10 4.35 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 46 P 0.00 4.25 0.00 2.16 2.14 0.00 3.59 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 2.11 2.16 0.00 47 K 7.95 4.03 0.00 1.76 1.82 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.10 7.81 48 R 8.03 4.19 0.00 1.88 2.01 0.00 3.09 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 49 R 8.74 3.93 0.00 2.04 2.07 0.00 3.11 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 50 E 8.64 4.11 0.00 2.23 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 2.16 2.39 0.00 51 K 7.79 4.01 0.00 1.93 2.00 0.00 1.54 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.50 7.81 52 L 7.97 3.96 0.00 2.02 1.71 0.93 0.76 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 53 F 8.59 3.96 0.00 3.20 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 54 N 8.39 4.43 0.00 2.80 2.91 0.00 0.00 7.17 7.55 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 55 E 7.56 4.07 0.00 2.08 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 2.33 2.62 0.00 56 I 7.93 3.74 1.73 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 1.44 0.79 0.72 0.00 0.00 57 L 7.43 3.69 0.00 1.63 1.51 0.61 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 58 G 7.51 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 59 V 7.71 4.33 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 0.78 0.00 0.00 0.98 0.00 0.00 60 L 7.49 4.45 0.00 1.84 1.66 0.78 1.03 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 61 D 8.57 4.56 0.00 2.75 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 62 D 7.91 4.61 0.00 2.68 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 0.00 0.00 0.00 0.00 63 Y 7.70 5.23 0.00 2.99 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 64 V 9.06 4.53 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 0.95 0.00 0.00 0.86 0.00 0.00 65 I 8.42 4.92 2.00 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 1.33 0.98 0.99 0.00 0.00 66 L 9.09 4.58 0.00 1.76 1.49 0.88 0.66 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 67 E 8.76 4.86 0.00 1.99 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 2.18 2.31 0.00 68 L 8.90 4.82 0.00 1.76 1.79 1.00 0.92 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 69 P 0.00 4.68 0.00 2.44 2.19 0.00 3.78 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.98 0.00 70 P 0.00 4.23 0.00 2.38 2.31 0.00 3.68 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 2.05 2.10 0.00 71 D 7.98 4.32 0.00 2.85 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.73 3.79 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 1.11 0.00 0.00 1.00 0.00 0.00 73 I 7.70 3.22 1.74 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 1.69 0.77 0.61 0.00 0.00 74 G 7.81 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 0.00 0.00 0.00 75 S 7.98 4.57 0.00 3.94 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.94 4.04 0.00 1.73 1.82 0.00 3.24 0.00 0.00 3.37 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.20 0.00 77 E 8.89 4.64 0.00 1.98 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 0.00 2.22 1.87 0.00 78 G 7.49 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 79 T 8.35 4.34 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 80 L 8.40 4.14 0.00 1.77 1.70 0.88 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 81 N 8.19 4.34 0.00 2.81 2.90 0.00 0.00 7.09 7.66 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 82 E 8.13 4.02 0.00 2.08 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 2.51 0.00 83 F 7.90 4.16 0.00 3.34 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.40 4.10 0.00 2.21 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 2.54 2.62 0.00 85 V 7.97 3.62 2.21 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 0.89 0.00 0.00 1.06 0.00 0.00 86 E 8.44 3.96 0.00 2.18 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 2.32 2.48 0.00 87 N 8.21 4.34 0.00 2.83 2.76 0.00 0.00 7.05 7.74 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 88 F 9.44 4.02 0.00 3.29 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 89 A 8.04 4.06 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 90 K 8.03 3.84 0.00 1.75 1.83 0.00 1.79 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.46 7.81 91 A 7.94 4.13 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.74 4.06 0.00 1.99 2.03 1.03 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 93 N 8.59 4.80 0.00 2.72 3.08 0.00 0.00 6.99 7.14 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 94 S 7.46 4.64 0.00 3.94 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 95 L 7.09 4.09 0.00 1.59 1.74 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.77 3.88 0.00 1.64 1.79 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.34 7.81 97 V 7.68 4.04 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 0.73 0.00 0.00 0.87 0.00 0.00 98 K 8.26 3.81 0.00 1.58 1.27 0.00 0.61 0.00 0.00 1.17 0.00 0.00 2.91 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.13 0.98 7.81 99 P 0.00 4.69 0.00 2.39 2.07 0.00 3.40 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.05 0.00 100 D 9.20 4.87 0.00 2.76 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 0.00 101 V 7.68 4.75 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 0.57 0.00 0.00 0.91 0.00 0.00 102 I 8.53 4.93 1.80 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.89 0.95 0.00 0.00 103 Y 9.73 4.70 0.00 2.63 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 0.00 0.00 0.00 0.00 104 A 9.15 5.39 1.55 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 0.00 105 D 8.79 5.09 0.00 2.90 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 0.00 106 A 9.07 2.81 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 6.99 3.76 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 D 7.23 4.33 0.00 2.65 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 0.00 109 V 7.61 3.27 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 0.76 0.00 0.00 0.86 0.00 0.00 110 D 8.60 4.33 0.00 2.88 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 0.00 111 E 7.93 4.30 0.00 2.37 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.53 0.00 112 E 8.20 4.08 0.00 2.00 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 2.31 1.94 0.00 113 R 8.19 4.21 0.00 1.84 1.97 0.00 3.23 0.00 0.00 3.09 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 114 F 8.04 4.32 0.00 3.07 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 0.00 115 A 8.22 3.83 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 0.00 116 R 7.72 3.83 0.00 1.97 1.91 0.00 3.12 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.87 0.00 117 E 8.03 3.81 0.00 2.13 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 2.31 2.33 0.00 118 L 7.57 3.98 0.00 1.21 1.20 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 119 G 7.53 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 0.00 0.00 0.00 120 E 7.89 4.15 0.00 2.07 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 2.30 2.49 0.00 121 R 7.51 4.40 0.00 1.95 1.91 0.00 3.10 0.00 0.00 3.19 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 122 L 7.68 4.38 0.00 1.31 0.66 0.55 0.33 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 0.00 123 N 9.30 4.82 0.00 2.85 2.93 0.00 0.00 6.78 7.37 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 0.00 124 F 6.98 4.89 0.00 3.11 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 0.00 125 E 8.69 4.16 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 126 A 7.80 4.54 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 0.00 127 E 8.63 4.48 0.00 1.84 1.75 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 2.19 2.19 0.00 128 V 8.12 4.62 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 0.68 0.00 0.00 0.79 0.00 0.00 129 V 9.10 4.25 1.42 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 0.73 0.00 0.00 0.59 0.00 0.00 130 A 8.52 5.36 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.85 4.76 0.00 2.25 1.89 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.73 7.81 132 H 10.00 4.68 0.00 3.18 3.21 0.00 5.82 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 8.60 3.73 0.00 1.80 1.74 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.22 0.98 7.81 134 A 8.59 4.34 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 0.00 135 D 7.78 4.46 0.00 2.69 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 0.00 136 D 8.44 4.59 0.00 2.80 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 0.00 137 I 7.47 3.51 1.60 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 -0.36 0.50 0.00 0.00 138 F 7.60 4.76 0.00 3.18 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 0.00 139 P 0.00 4.33 0.00 2.14 2.09 0.00 3.58 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 140 V 7.72 3.68 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.98 0.00 0.00 141 V 7.79 3.84 2.40 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 1.25 0.00 0.00 1.15 0.00 0.00 142 S 8.18 4.14 0.00 4.09 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 A 7.98 3.96 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 0.00 144 A 7.64 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 0.00 145 S 8.02 4.29 0.00 4.16 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 0.00 146 I 7.86 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 1.77 0.99 1.01 0.00 0.00 147 L 7.81 4.41 0.00 1.70 1.79 0.43 0.50 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 0.00 148 A 8.23 4.06 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 0.00 149 K 8.67 3.92 0.00 1.88 2.03 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.46 7.81 150 V 8.58 3.49 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 0.47 0.00 0.00 1.05 0.00 0.00 151 T 7.89 3.79 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 1.22 0.00 0.00 152 R 7.89 3.88 0.00 2.10 1.90 0.00 3.24 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.80 0.00 153 D 8.17 4.34 0.00 2.83 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 R 7.97 3.83 0.00 1.95 1.92 0.00 2.92 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 155 A 7.46 4.04 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 0.00 156 V 7.66 3.69 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 1.03 0.00 0.00 0.90 0.00 0.00 157 E 8.94 3.98 0.00 2.21 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 2.30 2.35 0.00 158 K 7.73 4.29 0.00 1.79 1.81 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.34 7.81 159 L 8.08 4.48 0.00 1.76 1.60 0.80 0.83 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 0.00 160 K 7.47 4.37 0.00 2.02 1.83 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.48 7.81 161 E 7.76 4.10 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 162 E 8.11 4.42 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.10 0.00 163 Y 8.08 4.68 0.00 2.92 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 0.00 164 G 8.66 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 E 8.66 4.26 0.00 1.93 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 2.32 2.37 0.00 166 I 7.91 3.22 1.24 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.78 -0.05 0.00 0.00 167 G 7.17 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 0.00 168 S 8.87 4.20 0.00 4.17 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 0.00 169 G 8.71 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 0.00 170 Y 7.64 4.58 0.00 3.05 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 0.00 171 P 0.00 4.25 0.00 2.18 2.17 0.00 3.93 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.99 0.00 172 S 8.09 4.46 0.00 3.99 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 0.00 173 D 8.10 4.74 0.00 2.79 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 P 0.00 4.29 0.00 2.22 2.13 0.00 3.67 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 175 R 8.46 3.99 0.00 1.98 2.02 0.00 3.14 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 176 T 7.96 4.45 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 1.28 0.00 0.00 177 R 7.92 3.89 0.00 2.06 2.01 0.00 3.47 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 178 A 8.71 4.10 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 0.00 0.00 179 F 8.22 4.47 0.00 3.38 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 0.00 180 L 7.90 3.42 0.00 1.87 1.67 0.57 0.55 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 0.00 181 E 8.67 4.41 0.00 2.30 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 2.42 2.47 0.00 182 N 9.22 4.51 0.00 2.73 2.92 0.00 0.00 6.76 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 Y 8.03 3.96 0.00 2.93 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 0.00 184 Y 9.19 4.60 0.00 2.97 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 0.00 185 R 7.74 4.09 0.00 2.08 1.79 0.00 3.31 0.00 0.00 3.35 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 186 E 7.44 4.17 0.00 1.90 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 2.02 1.49 0.00 187 H 7.35 4.60 0.00 2.77 3.02 0.00 5.75 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 0.00 188 G 7.51 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 0.00 189 E 8.10 4.83 0.00 2.18 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 2.35 2.42 0.00 190 F 8.58 5.30 0.00 3.16 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 P 0.00 4.38 0.00 1.86 1.77 0.00 3.44 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.44 0.00 192 P 0.00 4.44 0.00 2.13 2.13 0.00 3.85 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 193 I 7.75 4.25 1.62 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.64 0.67 0.00 0.00 194 V 7.27 4.60 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 0.51 0.00 0.00 0.84 0.00 0.00 195 R 8.37 4.23 0.00 1.78 1.79 0.00 3.05 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 1.56 1.59 0.00 196 K 8.26 4.28 0.00 1.77 1.66 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.02 7.81 197 G 7.91 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 0.00 0.00 0.00 0.00 *198 W 7.23 4.01 0.00 2.42 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 0.00 0.00 0.00 0.00 199 K 8.84 3.94 0.00 1.76 1.84 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.48 7.81 200 T 8.15 3.84 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 1.23 0.00 0.00 201 L 7.68 3.91 0.00 1.65 1.68 0.86 0.21 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 0.00 202 K 8.25 4.17 0.00 2.05 1.85 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 203 K 8.27 3.99 0.00 1.76 1.84 0.00 1.81 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.10 7.81 204 I 7.51 4.14 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 1.58 0.53 0.91 0.00 0.00 205 T 8.02 4.32 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 0.67 0.00 0.00 206 Q 7.77 4.38 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.13 0.00 0.00 0.00 0.00 0.00 2.22 2.00 0.00 207 D 8.47 4.57 0.00 2.78 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 0.00 208 M 7.69 4.33 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.51 0.00 209 I 8.74 3.23 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 1.27 0.50 0.91 0.00 0.00 *210 N 7.80 4.61 0.00 2.81 2.65 0.00 0.00 6.79 7.83 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 * Residues marked with a * may have inaccurate shift predictions.