NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 4.0203 8.3393 109.7523 44.4040 0.0000 173.1444 3 P 4.2438 0.0000 0.0000 62.0747 31.4786 173.8036 4 N 4.8309 8.5671 119.2373 51.6776 40.4180 176.5579 5 P 3.9127 0.0000 0.0000 61.9759 30.4888 175.8406 *7 K 4.0024 7.6128 117.9574 57.5869 32.9957 176.2674 *9 Y 4.4577 8.2326 118.8090 58.1514 37.8399 172.7568 10 P 4.2309 0.0000 0.0000 64.5318 31.7348 176.9033 11 I 4.2166 7.2494 119.6731 58.4962 36.8887 173.4397 12 E 3.9902 8.4400 124.9014 57.9110 29.7540 177.5019 13 G 3.9333 9.1114 113.9461 45.3491 0.0000 172.5026 14 N 4.9059 8.3051 120.9073 52.9042 39.0866 176.3908 15 K 3.2758 7.9726 114.4571 55.9803 32.3485 179.3404 16 S 4.6146 10.4112 117.4709 61.3383 64.6079 174.8465 17 V 4.4358 7.7824 119.7653 62.7823 32.0649 175.4568 18 Q 4.8594 9.7257 127.2163 54.1684 32.2719 174.8883 19 F 5.5665 8.5996 121.8536 57.0709 40.3569 176.6555 20 I 3.8881 8.1120 118.5425 62.6231 37.8715 178.2266 21 K 3.8526 7.9331 120.4347 58.9439 31.9342 176.3528 22 P 4.3686 0.0000 0.0000 65.7729 31.0837 178.6972 23 I 3.7696 6.9108 116.1075 63.9257 37.3067 177.6650 24 L 4.3556 8.3335 118.1411 54.9897 41.6230 177.8109 25 E 4.0997 7.6147 119.6161 57.4037 29.6732 177.1119 26 K 4.2510 7.7201 115.9834 58.5975 34.1180 176.8488 27 L 4.0526 8.1472 123.9035 54.6562 41.7003 177.1584 28 E 4.1808 8.6030 120.2243 56.9312 30.5008 172.3236 29 N 4.3220 8.8251 115.9756 54.1843 36.3342 173.5765 30 V 4.9963 7.3485 115.3043 61.0461 34.2383 174.2558 31 E 4.7596 9.8247 128.8877 54.4872 32.9730 175.0019 32 V 4.7176 8.1743 125.8460 61.5278 33.9578 174.3606 33 G 3.9562 8.9253 116.0322 45.4116 0.0000 172.3070 34 E 3.9702 8.3413 118.6569 56.4479 31.0320 177.9024 35 Y 2.8629 7.2739 115.7794 58.4769 36.6987 170.7147 36 S 4.7083 7.4751 116.5644 59.1083 64.0391 173.2169 37 Y 5.3347 9.0662 121.1063 55.6232 42.0712 173.3239 38 Y 4.9735 9.4185 121.1559 55.8796 42.8300 173.4002 39 D 5.0056 7.8569 125.8624 52.4388 42.8049 175.2898 40 S 4.4538 8.4380 122.3682 58.0689 62.5238 173.7474 41 K 4.1079 9.9086 130.0367 59.2534 32.1186 177.2982 42 N 4.9396 9.5234 110.9219 51.8248 41.5178 176.0593 43 G 5.0018 9.3153 119.4307 46.3353 0.0000 172.6045 44 E 3.8677 8.1007 117.9061 57.0253 29.2328 177.3344 45 T 5.1960 8.3275 111.7445 60.6826 70.1141 174.8073 46 F 3.9336 8.5010 122.3445 59.9157 39.1344 176.5141 47 D 4.2582 7.9184 118.0197 55.7925 39.1372 177.5060 48 K 4.1930 7.3275 117.5757 57.4028 32.7209 177.7480 49 Q 4.3201 7.4662 118.1512 55.1678 29.2369 175.1611 50 I 3.9173 6.5481 120.4411 59.6964 36.1560 174.7702 51 L 4.0806 8.0290 124.9504 54.5423 43.0757 176.5297 52 Y 3.3202 7.7773 117.0108 59.6039 35.1590 169.8572 53 H 4.6398 8.0486 119.0252 54.6913 30.8217 172.4613 54 Y 5.1109 7.9458 124.5659 55.6057 40.6639 175.5628 55 P 4.3139 0.0000 0.0000 65.1207 31.8227 178.4957 56 I 3.8462 7.7497 117.3800 63.3188 37.9356 176.2279 57 L 4.2402 7.9581 118.6283 54.7700 41.7658 176.3761 58 N 3.9639 7.6025 116.1105 54.0259 38.0131 173.0636 59 D 4.8468 7.6997 117.5579 52.6819 41.1235 176.6322 60 K 4.7877 8.8909 124.8034 53.9070 34.5424 173.7915 61 L 5.0687 8.7240 123.0497 53.5285 44.9964 175.2361 62 K 5.1259 8.5837 125.8542 54.6760 35.0996 175.4089 63 I 4.8358 8.7294 125.5630 58.5582 40.4614 175.6597 64 G 4.1763 8.1347 114.7390 45.6304 0.0000 172.3999 65 K 4.5280 8.2103 120.5699 54.7135 36.0631 176.2587 66 F 4.0688 7.9194 118.0277 58.7936 36.9497 175.1431 67 C 4.8605 7.7995 116.2081 59.3425 30.1998 173.4387 68 S 4.2522 9.1668 118.1379 56.6949 65.6769 173.1687 69 I 4.5811 7.7262 126.2338 59.1908 39.8347 176.1585 70 G 4.3066 9.0229 115.6678 44.6802 0.0000 170.7252 71 P 4.8429 0.0000 0.0000 63.1786 31.8756 177.9199 72 G 4.6155 8.7454 107.3029 46.1547 0.0000 173.6521 73 V 4.4222 7.5223 118.9709 63.0718 32.4631 175.5806 74 T 4.7903 8.8550 115.9058 60.1206 72.6969 172.4670 75 I 4.8022 8.2172 125.0484 59.8544 39.1499 175.5320 76 I 4.4499 9.1029 129.2935 60.2839 39.5219 176.6355 *78 N 4.5959 8.7048 119.1323 52.8817 40.1479 176.8638 79 G 3.3635 7.6636 106.6725 47.2912 0.0000 174.7835 80 A 3.3388 7.5046 121.8121 53.7318 18.9765 177.4204 81 N 4.5054 7.2503 112.7901 53.0017 39.1867 175.1752 82 H 4.4425 8.4872 120.0834 55.1049 29.9401 174.6969 83 R 4.2034 8.0548 121.2407 55.7048 30.8432 176.3450 *85 D 4.6819 8.4204 118.9359 52.5484 42.7264 176.3096 86 G 4.0368 8.4728 103.1597 45.8793 0.0000 173.8622 87 S 4.6872 9.2911 113.7850 56.3869 64.0223 172.8841 88 T 4.8259 8.6743 118.0293 63.9804 68.5658 174.1421 89 Y 3.9097 7.5135 123.1101 57.2880 39.3997 174.9964 90 P 4.6247 0.0000 0.0000 60.7233 30.5043 175.4291 91 F 4.4163 8.3472 125.3485 61.7162 39.1551 176.4877 92 N 4.9644 8.4477 117.2203 55.3843 36.6474 176.6784 93 L 3.7564 7.9261 121.1320 57.1734 41.6756 178.4672 94 F 4.7813 8.4933 113.9888 55.4907 40.4262 177.9373 95 G 3.8566 9.4906 109.1128 45.0890 0.0000 174.6109 96 N 4.2281 9.8973 115.5623 54.4743 36.3773 173.8305 97 G 4.2936 8.3272 109.4237 46.3974 0.0000 176.4153 98 W 4.9954 9.3343 119.3045 57.8139 29.4653 178.0849 99 E 4.2371 7.9405 116.1933 58.6746 29.4616 178.3812 100 K 4.0008 8.2115 118.2000 59.8386 32.6259 177.2095 101 H 4.0750 7.8987 116.9354 54.9982 28.8945 172.8639 *103 P 4.1940 0.0000 0.0000 62.0267 32.4625 176.6781 104 K 4.1892 8.2863 119.9838 56.3274 33.0958 178.0828 105 L 3.9567 8.8408 121.0376 58.9314 41.9088 179.8902 106 D 4.3797 8.0073 116.6436 57.7822 40.7666 178.2576 107 Q 4.2713 7.8135 114.3832 56.2179 28.4882 175.7059 108 L 4.5000 7.4555 118.9544 52.2350 43.7644 174.5911 109 P 4.3771 0.0000 0.0000 61.9341 30.2597 176.6629 110 I 4.0054 8.1704 125.3725 60.9675 37.2145 176.1518 111 K 4.3168 8.6713 124.7819 55.5010 34.4688 176.0297 112 G 3.8001 8.0862 102.5514 43.6622 0.0000 172.3658 113 D 5.1057 8.3564 117.3000 54.3226 42.2221 176.3297 114 T 4.6655 8.4398 119.0492 63.0721 69.8761 173.6546 115 I 4.6479 8.5653 128.4635 59.5089 39.5813 174.8685 116 I 4.6789 8.5725 128.5100 59.4922 39.7155 176.5911 117 G 3.9807 8.3952 115.6525 45.9156 0.0000 172.4242 118 N 4.2740 8.9657 118.3143 51.4409 40.7394 174.8901 119 D 4.9316 8.5254 117.6807 54.6953 40.2652 173.0848 120 V 4.8647 7.1554 118.7479 59.5734 35.4353 175.3350 121 W 5.4487 8.8817 132.6211 55.9199 33.2633 173.9684 122 I 4.6059 9.4443 128.4737 59.4242 40.0297 175.4860 123 G 4.2344 7.9574 112.9026 44.8293 0.0000 172.5435 124 K 4.9387 7.9383 117.4111 55.4770 32.6464 176.3154 125 D 5.0221 9.6423 124.9628 54.6902 39.1607 173.6873 126 V 4.0700 7.5657 118.5169 62.9577 33.0705 174.6213 127 V 4.8688 8.8973 127.5514 61.4356 33.7612 175.1167 128 I 4.5193 8.3641 128.2956 59.1158 40.3463 172.7558 *130 P 4.3073 0.0000 0.0000 63.8933 32.0443 177.0382 131 G 4.2279 8.2839 108.4813 45.9385 0.0000 173.7015 132 V 4.3584 7.4446 112.0536 59.8626 33.9196 175.5195 133 K 4.9931 9.3271 123.7355 54.9144 34.4329 175.0512 134 I 4.3723 8.7358 127.7055 60.0588 38.6754 176.3638 135 G 4.1293 8.9850 114.6007 45.3316 0.0000 172.5352 136 D 4.2014 8.5526 120.0487 55.7875 41.9361 178.2175 137 G 3.0550 8.4598 109.6660 44.4412 0.0000 173.1841 138 A 4.4798 7.2603 121.7399 51.6591 20.1562 177.0258 139 I 4.7991 8.1274 119.4690 59.4934 40.6697 174.7044 140 V 4.5078 8.1970 127.5775 61.0848 32.6055 175.3787 141 A 4.1838 9.4251 130.7588 51.6545 19.3700 176.8890 142 A 3.9303 8.3789 120.8156 51.8792 20.0814 177.0290 143 N 4.6282 8.6298 113.5795 53.0122 37.1939 175.2735 144 S 4.6329 7.3439 111.5456 58.2134 64.9907 173.8258 145 V 4.4980 8.6005 122.6107 61.3539 33.5659 174.9066 146 V 4.3799 8.8931 130.2244 61.7824 31.4622 175.6787 147 V 4.3043 8.4550 122.2477 61.4535 32.3775 175.8686 148 K 4.7352 7.4019 122.0092 53.5682 35.9845 179.7792 149 D 4.5284 8.6514 118.4935 55.7465 41.6807 176.1961 150 I 4.6569 7.8915 121.7646 59.2289 39.3347 175.5677 151 A 4.5053 8.8824 129.2559 50.9825 19.3100 175.1943 152 P 4.0773 0.0000 0.0000 64.4347 32.3004 175.8613 153 Y 4.1857 8.6666 121.1315 57.2898 35.3503 167.7873 *155 L 4.5999 7.7224 123.0492 54.6854 43.5729 174.8164 156 A 5.0558 8.9745 126.7720 50.6729 23.2351 174.8418 157 G 3.9441 8.9206 104.4345 46.1828 0.0000 172.2410 158 G 4.1606 8.1452 106.9342 43.5591 0.0000 172.7706 159 N 5.1902 8.1034 117.6400 51.0845 39.5605 171.3329 160 P 4.8123 0.0000 0.0000 61.4189 32.8878 176.1860 161 A 4.3543 8.9415 124.3853 52.5609 19.0935 176.5424 162 N 5.1187 8.8618 116.8281 51.0557 43.4869 174.1968 163 E 4.2773 8.8044 120.0062 56.8748 30.2693 176.1030 164 I 4.2769 8.7467 124.5817 62.7969 39.2111 176.7721 165 K 4.6300 7.3342 118.3176 53.0440 35.3542 177.4796 166 Q 4.2528 8.4301 120.0479 55.9808 29.3261 177.1244 167 R 3.7543 8.3308 122.2663 58.6027 30.1425 176.4740 168 F 5.0731 7.3155 113.2941 54.4721 43.0302 173.4049 169 D 4.5927 8.6370 120.7994 54.8142 42.6086 176.4655 170 Q 4.2557 8.4923 118.7649 57.6587 28.7677 178.1595 171 D 4.3137 8.7995 120.4488 57.4646 41.3738 178.2070 172 T 3.7354 7.7894 115.6202 67.4653 68.5790 175.7056 173 I 3.1607 7.5138 118.8200 65.0549 37.1640 177.8310 174 N 4.0595 8.3629 115.6759 57.0690 38.7496 176.9965 175 Q 4.0156 8.8380 119.1989 59.5382 29.1501 179.8369 176 L 4.0592 8.2859 119.9558 57.7119 41.4472 179.4820 177 L 4.3483 8.6899 120.5449 57.7090 41.5372 179.4671 178 D 4.5520 7.5639 120.4229 58.1609 40.2534 183.5876 179 I 3.9296 8.1420 120.7382 62.1142 38.6655 176.9467 180 K 2.4800 7.4354 116.9156 56.2830 29.5335 175.0526 181 W 2.0000 6.0820 119.8820 57.9801 28.4472 179.2229 182 W 3.5257 5.5080 114.3748 58.2611 27.5050 176.4479 183 N 4.6714 7.1562 115.8223 54.4238 38.4692 175.7254 184 W 4.7009 8.4974 119.3276 56.0643 29.8817 174.7730 185 P 4.4766 0.0000 0.0000 62.6675 32.3529 177.3612 186 I 3.6288 8.8409 122.0919 64.7494 37.5359 177.6980 187 D 4.1321 8.0637 118.4216 56.4265 39.6389 178.1976 188 I 3.8511 7.7328 120.7946 63.8874 37.2105 177.9808 189 I 4.0296 8.6683 121.7951 64.8620 36.8731 178.0859 190 N 4.5903 8.8993 118.2694 56.0181 38.4708 177.3178 191 E 4.3202 7.7252 118.7926 59.3591 30.1764 182.2199 192 N 5.2025 7.8742 113.0181 53.5392 40.5840 176.0596 193 I 3.4657 8.0028 120.9678 64.7867 35.9433 178.1212 194 D 4.2756 8.1968 121.5212 57.3297 39.4283 178.8131 195 K 4.4802 7.6620 118.5778 55.0042 32.4630 181.9522 196 I 3.6897 7.6137 117.7482 63.7937 37.1551 176.9977 197 L 4.1616 7.3243 118.8869 55.6695 41.7264 176.9568 198 D 4.6796 7.1220 114.2370 52.3580 39.8739 176.0529 199 N 4.1908 7.7325 117.0720 54.3712 37.9131 174.5757 200 S 4.9185 8.3289 109.8091 58.0709 63.2025 175.2813 201 I 3.9910 7.5662 116.6134 63.9228 38.0163 176.9497 202 I 3.7378 7.3151 123.8602 64.5842 37.1353 176.6982 203 R 4.2231 7.7994 121.2089 56.1988 29.4313 177.7336 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 2 G 8.34 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 3 P 0.00 4.24 0.00 2.72 2.25 0.00 3.88 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.24 0.00 4 N 8.57 4.83 0.00 2.79 2.87 0.00 0.00 7.04 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 5 P 0.00 3.91 0.00 1.70 0.80 0.00 3.86 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 1.79 1.60 0.00 *7 K 7.61 4.00 0.00 1.86 1.92 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.54 7.81 *9 Y 8.23 4.46 0.00 2.99 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 10 P 0.00 4.23 0.00 1.57 1.77 0.00 3.29 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 0.49 0.53 0.00 11 I 7.25 4.22 1.81 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 1.23 0.57 0.87 0.00 0.00 12 E 8.44 3.99 0.00 1.93 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 2.28 2.33 0.00 13 G 9.11 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 0.00 0.00 0.00 14 N 8.31 4.91 0.00 2.63 2.76 0.00 0.00 7.21 6.48 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 15 K 7.97 3.28 0.00 1.81 1.70 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.37 1.05 7.81 16 S 10.41 4.61 0.00 3.76 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 17 V 7.78 4.44 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 0.69 0.00 0.00 0.94 0.00 0.00 18 Q 9.73 4.86 0.00 2.39 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.61 0.00 19 F 8.60 5.57 0.00 3.25 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 I 8.11 3.89 1.92 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 1.56 1.12 0.77 0.00 0.00 21 K 7.93 3.85 0.00 1.85 1.73 0.00 1.60 0.00 0.00 1.56 0.00 0.00 3.15 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.34 1.59 7.81 22 P 0.00 4.37 0.00 2.18 2.07 0.00 3.72 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 2.19 2.22 0.00 23 I 6.91 3.77 2.00 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 1.46 0.49 0.90 0.00 0.00 24 L 8.33 4.36 0.00 1.65 1.69 1.04 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 25 E 7.61 4.10 0.00 2.13 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 2.27 0.00 26 K 7.72 4.25 0.00 1.88 1.89 0.00 1.61 0.00 0.00 1.69 0.00 0.00 3.13 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.48 1.42 7.81 27 L 8.15 4.05 0.00 1.79 1.62 0.87 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.60 4.18 0.00 1.99 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 2.23 1.90 0.00 29 N 8.83 4.32 0.00 2.84 2.93 0.00 0.00 6.38 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 30 V 7.35 5.00 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 0.75 0.00 0.00 0.97 0.00 0.00 31 E 9.82 4.76 0.00 2.02 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 2.16 2.20 0.00 32 V 8.17 4.72 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 0.74 0.00 0.00 0.93 0.00 0.00 33 G 8.93 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 0.00 0.00 0.00 34 E 8.34 3.97 0.00 1.18 1.71 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 2.11 1.98 0.00 35 Y 7.27 2.86 0.00 1.91 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 36 S 7.48 4.71 0.00 3.67 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 9.07 5.33 0.00 3.36 3.50 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 38 Y 9.42 4.97 0.00 2.51 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 39 D 7.86 5.01 0.00 2.92 2.38 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 40 S 8.44 4.45 0.00 4.31 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 41 K 9.91 4.11 0.00 1.85 1.94 0.00 1.71 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.50 7.81 42 N 9.52 4.94 0.00 2.73 2.80 0.00 0.00 6.78 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 43 G 9.32 5.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.10 3.87 0.00 2.12 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 2.52 2.72 0.00 45 T 8.33 5.20 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 1.29 0.00 0.00 46 F 8.50 3.93 0.00 2.64 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 7.92 4.26 0.00 2.83 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 48 K 7.33 4.19 0.00 1.68 1.81 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.59 7.81 49 Q 7.47 4.32 0.00 0.93 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.84 0.00 0.00 0.00 0.00 0.00 1.94 2.29 0.00 50 I 6.55 3.92 1.70 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.52 0.81 0.00 0.00 51 L 8.03 4.08 0.00 1.52 0.83 0.78 0.62 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 52 Y 7.78 3.32 0.00 3.04 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 H 8.05 4.64 0.00 2.95 3.12 0.00 5.69 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 54 Y 7.95 5.11 0.00 3.02 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 55 P 0.00 4.31 0.00 2.18 2.09 0.00 3.65 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 2.06 0.00 56 I 7.75 3.85 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.64 0.96 0.00 0.00 57 L 7.96 4.24 0.00 2.06 1.76 1.04 0.53 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 58 N 7.60 3.96 0.00 2.80 2.82 0.00 0.00 7.10 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 59 D 7.70 4.85 0.00 2.70 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.89 4.79 0.00 1.48 1.71 0.00 1.75 0.00 0.00 1.57 0.00 0.00 2.70 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.30 1.24 7.81 61 L 8.72 5.07 0.00 1.64 1.52 0.96 0.50 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 62 K 8.58 5.13 0.00 1.63 1.63 0.00 1.64 0.00 0.00 1.90 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.36 7.81 63 I 8.73 4.84 1.83 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.52 0.84 0.00 0.00 64 G 8.13 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.21 4.53 0.00 1.59 1.69 0.00 2.17 0.00 0.00 1.86 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.38 7.81 66 F 7.92 4.07 0.00 3.19 3.27 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 67 C 7.80 4.86 0.00 2.82 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 68 S 9.17 4.25 0.00 3.79 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 69 I 7.73 4.58 1.65 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 1.04 1.15 0.79 0.00 0.00 70 G 9.02 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 P 0.00 4.84 0.00 2.19 1.93 0.00 3.98 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 2.10 2.32 0.00 72 G 8.75 4.62 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 73 V 7.52 4.42 2.42 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 0.98 0.00 0.00 1.07 0.00 0.00 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0.00 0.00 3.41 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.73 0.00 *85 D 8.42 4.68 0.00 2.85 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 8.47 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 9.29 4.69 0.00 3.92 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 88 T 8.67 4.83 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 1.23 0.00 0.00 89 Y 7.51 3.91 0.00 2.74 2.44 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 90 P 0.00 4.62 0.00 2.04 1.92 0.00 2.32 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 91 F 8.35 4.42 0.00 2.99 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.45 4.96 0.00 2.98 3.20 0.00 0.00 6.71 6.67 0.00 0.00 0.00 0.00 0.00 0.00 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101 H 7.90 4.08 0.00 3.32 3.25 0.00 5.73 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 *103 P 0.00 4.19 0.00 2.21 2.11 0.00 3.79 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 1.89 2.00 0.00 104 K 8.29 4.19 0.00 1.84 1.78 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.47 7.81 105 L 8.84 3.96 0.00 1.68 1.72 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 106 D 8.01 4.38 0.00 2.65 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 0.00 107 Q 7.81 4.27 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 108 L 7.46 4.50 0.00 1.81 1.61 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 109 P 0.00 4.38 0.00 2.02 2.01 0.00 3.66 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 110 I 8.17 4.01 1.87 0.00 0.00 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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 8.53 4.93 0.00 2.35 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 0.00 120 V 7.16 4.86 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 0.77 0.00 0.00 0.89 0.00 0.00 121 W 8.88 5.45 0.00 3.38 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 0.00 122 I 9.44 4.61 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.56 0.88 0.00 0.00 123 G 7.96 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 0.00 0.00 0.00 124 K 7.94 4.94 0.00 1.73 1.72 0.00 1.84 0.00 0.00 1.84 0.00 0.00 2.84 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.51 7.81 125 D 9.64 5.02 0.00 2.95 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 0.00 126 V 7.57 4.07 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 0.87 0.00 0.00 0.92 0.00 0.00 127 V 8.90 4.87 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 0.79 0.00 0.00 0.94 0.00 0.00 128 I 8.36 4.52 1.86 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 1.24 1.13 0.89 0.00 0.00 *130 P 0.00 4.31 0.00 2.02 1.96 0.00 3.76 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.02 0.00 131 G 8.28 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 0.00 0.00 0.00 132 V 7.44 4.36 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 0.85 0.00 0.00 0.90 0.00 0.00 133 K 9.33 4.99 0.00 1.67 1.70 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.40 7.81 134 I 8.74 4.37 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.90 0.84 0.00 0.00 135 G 8.99 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 0.00 0.00 0.00 136 D 8.55 4.20 0.00 2.65 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 0.00 0.00 0.00 0.00 137 G 8.46 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 0.00 0.00 0.00 138 A 7.26 4.48 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 I 8.13 4.80 1.83 0.00 0.00 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 1.54 0.77 0.52 0.00 0.00 140 V 8.20 4.51 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 0.84 0.00 0.00 0.85 0.00 0.00 141 A 9.43 4.18 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.38 3.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.63 4.63 0.00 2.76 2.85 0.00 0.00 6.99 7.11 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 0.00 144 S 7.34 4.63 0.00 3.84 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 0.00 145 V 8.60 4.50 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 0.95 0.00 0.00 146 V 8.89 4.38 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 0.81 0.00 0.00 0.89 0.00 0.00 147 V 8.46 4.30 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 0.78 0.00 0.00 0.91 0.00 0.00 148 K 7.40 4.74 0.00 1.48 1.52 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.26 1.04 7.81 149 D 8.65 4.53 0.00 2.54 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 0.00 150 I 7.89 4.66 1.83 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 1.13 0.79 0.87 0.00 0.00 151 A 8.88 4.51 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.08 0.00 2.14 2.15 0.00 3.89 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 153 Y 8.67 4.19 0.00 3.30 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 *155 L 7.72 4.60 0.00 1.75 1.53 0.84 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 156 A 8.97 5.06 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 0.00 157 G 8.92 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 0.00 0.00 0.00 158 G 8.15 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 0.00 159 N 8.10 5.19 0.00 2.66 2.66 0.00 0.00 6.97 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 0.00 160 P 0.00 4.81 0.00 2.10 2.01 0.00 3.81 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 161 A 8.94 4.35 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 N 8.86 5.12 0.00 2.67 2.64 0.00 0.00 7.03 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 E 8.80 4.28 0.00 1.94 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 2.30 2.31 0.00 164 I 8.75 4.28 1.95 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 1.13 0.71 0.89 0.00 0.00 165 K 7.33 4.63 0.00 1.72 1.51 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.26 1.03 7.81 166 Q 8.43 4.25 0.00 2.04 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.05 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 167 R 8.33 3.75 0.00 1.33 0.66 0.00 3.12 0.00 0.00 3.39 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 168 F 7.32 5.07 0.00 2.93 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 D 8.64 4.59 0.00 2.83 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.49 4.26 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.71 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 171 D 8.80 4.31 0.00 2.87 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 0.00 172 T 7.79 3.74 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 0.85 0.00 0.00 173 I 7.51 3.16 1.90 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.10 1.09 0.00 0.00 174 N 8.36 4.06 0.00 2.93 2.84 0.00 0.00 7.17 7.15 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 0.00 175 Q 8.84 4.02 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 176 L 8.29 4.06 0.00 1.72 1.87 0.59 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 177 L 8.69 4.35 0.00 1.80 1.84 1.06 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 178 D 7.56 4.55 0.00 2.81 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 0.00 179 I 8.14 3.93 1.97 0.00 0.00 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 1.66 0.99 0.91 0.00 0.00 180 K 7.44 2.48 0.00 1.51 1.04 0.00 1.63 0.00 0.00 1.69 0.00 0.00 3.38 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.10 1.34 7.81 181 W 6.08 2.00 0.00 2.18 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 0.00 182 W 5.51 3.53 0.00 3.34 2.36 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 0.00 183 N 7.16 4.67 0.00 2.76 2.95 0.00 0.00 6.98 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 W 8.50 4.70 0.00 3.54 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 P 0.00 4.48 0.00 2.31 2.04 0.00 3.68 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 186 I 8.84 3.63 2.11 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 1.89 1.34 1.04 0.00 0.00 187 D 8.06 4.13 0.00 2.89 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 0.00 188 I 7.73 3.85 1.94 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 1.52 0.96 0.45 0.00 0.00 189 I 8.67 4.03 2.20 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.42 0.95 0.00 0.00 190 N 8.90 4.59 0.00 2.83 2.89 0.00 0.00 7.01 5.12 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 0.00 191 E 7.73 4.32 0.00 2.02 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 2.25 2.21 0.00 192 N 7.87 5.20 0.00 2.84 2.82 0.00 0.00 6.81 6.97 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 0.00 193 I 8.00 3.47 1.80 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.11 0.81 0.00 0.00 194 D 8.20 4.28 0.00 2.65 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 K 7.66 4.48 0.00 1.67 1.79 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.01 7.81 196 I 7.61 3.69 1.45 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.53 -0.69 0.00 0.00 197 L 7.32 4.16 0.00 1.76 1.64 0.84 0.82 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 0.00 198 D 7.12 4.68 0.00 2.64 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 0.00 199 N 7.73 4.19 0.00 2.71 2.65 0.00 0.00 6.83 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 0.00 200 S 8.33 4.92 0.00 3.93 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 0.00 201 I 7.57 3.99 2.03 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.51 1.01 0.00 0.00 202 I 7.32 3.74 1.93 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.47 0.91 0.00 0.00 203 R 7.80 4.22 0.00 1.82 1.68 0.00 3.30 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.18 0.00 * Residues marked with a * may have inaccurate shift predictions.