NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4661 8.1627 120.3646 55.6747 34.5555 177.1906 2 S 4.1266 7.8760 112.3123 60.0588 62.1820 174.5428 3 S 4.6030 8.7976 118.2466 60.9035 62.6146 175.7213 4 S 4.2199 8.2140 117.4859 61.5387 62.7335 176.5838 5 K 4.0698 8.1015 120.8349 59.0462 31.9268 179.4711 6 R 3.9174 7.9229 118.8327 59.4601 29.9268 178.6970 7 I 3.4579 7.4445 118.3503 64.0371 36.9234 178.2329 8 A 3.9999 7.7652 121.8723 54.8008 18.1002 179.6540 9 K 3.8758 8.0268 118.1320 59.8781 31.8656 178.9562 10 E 4.0292 8.1094 118.6526 59.2460 29.2510 179.2264 11 L 4.1729 8.4248 120.6456 58.2728 42.0058 178.8939 12 S 4.0875 8.1022 111.9722 61.6476 62.4988 175.5500 13 D 4.5159 8.4059 121.5272 57.2281 40.5631 178.8226 14 L 4.2552 7.6277 118.7321 57.3851 41.7120 178.4935 15 E 4.1027 8.3707 117.7549 58.7970 29.5456 176.3021 16 R 4.2990 7.8166 113.8441 57.4586 33.1334 175.8402 17 D 4.6151 7.9648 131.4500 52.8876 40.3613 174.4930 18 P 4.5007 0.0000 0.0000 60.7872 32.1842 175.1222 19 P 4.5443 0.0000 0.0000 62.9200 32.0475 176.1236 20 T 4.2312 8.2176 108.0345 63.5077 69.7337 176.1409 21 S 4.4200 7.8119 116.5734 58.2055 64.1670 173.2657 22 C 4.6609 7.6630 120.8458 58.7752 33.3485 172.9735 23 S 4.5153 8.2135 112.8871 57.7375 65.4738 173.7850 24 A 5.1325 8.3648 128.1684 50.7559 22.5035 174.5911 25 G 3.2748 8.1965 106.1238 44.6461 0.0000 171.0966 26 P 4.5170 0.0000 0.0000 62.4911 32.1294 176.1856 27 V 3.8598 8.5731 121.7585 62.0626 32.2633 175.1707 28 G 4.2642 8.8913 118.1588 46.8996 0.0000 173.2703 29 D 4.7742 8.6059 122.8816 53.9097 41.5875 175.6687 30 D 4.6805 7.7104 120.4279 52.9964 40.2773 176.6505 31 L 4.3327 8.6464 128.7021 56.8876 42.4624 176.7376 32 Y 4.5393 8.5828 114.7251 58.6321 39.0464 174.2106 33 H 5.3455 8.4958 120.4452 54.4183 32.2463 172.3932 34 W 5.3209 9.2976 126.1887 55.1969 32.2560 175.0176 35 Q 5.1458 9.0676 121.1955 54.7738 32.4098 173.5955 36 A 5.3296 8.9648 124.8292 50.8294 23.3424 175.0486 37 S 4.9348 8.9739 113.0226 56.8622 66.7662 173.2253 38 I 5.0004 8.6568 114.5495 58.9231 41.3132 173.5863 39 M 5.1011 8.6068 122.5364 53.6168 33.8385 176.3738 40 G 4.6604 8.7800 109.9366 45.2110 0.0000 172.0031 41 P 4.5748 0.0000 0.0000 62.2668 32.1751 177.4847 42 A 4.0848 8.6768 123.5789 55.0535 18.6565 178.2646 43 D 4.9276 7.8719 114.9106 52.9348 40.1954 176.1303 44 S 4.7791 7.6030 112.3114 57.0983 66.4149 172.6768 45 P 4.4170 0.0000 0.0000 64.1827 31.1201 176.7459 46 Y 4.9099 7.8687 115.5542 56.8260 38.3006 175.2769 47 A 4.9744 7.3906 124.2571 53.3846 18.7781 178.7634 48 G 4.0599 9.1765 111.5339 45.3708 0.0000 174.1805 49 G 3.6877 7.6642 106.0134 46.0737 0.0000 172.9089 50 V 4.6177 7.9019 120.5346 60.7960 34.1497 174.1882 51 F 5.1572 9.2425 127.1985 55.7922 41.8995 174.4562 52 F 5.1003 9.3223 122.4236 55.9462 41.0707 174.8216 53 L 4.9623 9.2011 123.8271 52.9945 44.6869 175.2087 54 S 5.1646 9.1221 117.3699 56.7373 64.8971 172.8149 55 I 4.9085 8.8618 127.0325 59.7672 40.7963 173.9371 56 H 5.1332 9.1537 124.1598 53.8594 31.5216 173.0159 57 F 4.4176 8.7703 123.7032 55.8460 39.7716 174.5291 58 P 4.4871 0.0000 0.0000 62.6452 31.9312 177.3643 59 T 3.9808 8.5772 114.6451 64.5151 67.7066 174.2888 60 D 5.0670 7.9954 120.3910 53.0925 40.0429 175.4712 61 Y 4.5756 8.0379 120.6882 58.0668 39.1994 173.4886 62 P 3.4369 0.0000 0.0000 62.6309 31.4285 177.1533 63 F 4.5103 7.9584 116.5494 58.4934 39.2859 175.7478 64 K 4.6801 7.7588 121.4573 53.4090 35.0491 173.9212 65 P 2.9700 0.0000 0.0000 61.4786 31.7123 173.9434 66 P 4.2593 0.0000 0.0000 62.1733 32.9997 175.6167 67 K 4.2249 8.7729 121.4279 55.5114 33.2940 175.8908 68 I 4.7686 8.1951 126.4176 59.5303 39.3541 175.0781 69 S 4.9925 8.8080 121.9470 56.4075 65.6568 172.5343 70 F 4.7854 9.0852 124.3831 56.9609 39.7652 177.0141 71 T 4.1469 9.4000 121.8880 66.9527 68.8636 176.0170 72 T 4.4275 8.2798 116.0647 63.1139 69.6811 174.7955 73 K 4.2468 8.5946 124.2331 55.9966 32.7395 176.5451 74 I 4.8557 8.1900 122.9382 59.4024 40.9857 174.3415 75 Y 4.0263 8.6350 127.5364 55.9864 37.8988 173.6963 76 H 5.0541 7.7520 124.7764 53.1967 33.2153 172.5470 77 P 4.1430 0.0000 0.0000 64.9437 31.5520 177.1464 78 N 4.8398 8.0471 115.0150 52.7931 39.1358 173.8897 79 I 5.2637 7.6604 118.6073 58.2789 40.6135 175.0175 80 N 4.8240 8.2979 121.9852 51.0984 39.7783 175.0844 81 A 4.0897 8.4972 119.7226 55.2770 18.4706 178.2487 82 N 4.5693 8.1612 110.8397 53.5718 39.2912 175.9875 83 G 4.2040 8.0730 106.8957 46.3258 0.0000 173.3650 84 N 4.7673 7.9132 117.3632 53.0635 39.2786 173.6767 85 I 4.8625 8.1233 122.0222 59.7324 39.9853 174.9978 86 C 4.4318 8.7249 128.4876 58.1789 31.4935 172.0394 87 L 4.8096 8.0966 127.9018 52.9597 44.8247 176.1210 88 D 4.4191 9.2675 126.5957 56.7634 39.0111 178.5263 89 I 4.1839 7.7868 109.6346 61.3669 37.6969 175.9017 90 L 4.7268 7.9036 120.4633 54.7586 43.8074 175.6308 91 K 4.7663 7.8286 120.0758 56.5633 32.5897 178.4954 92 D 4.5221 9.6498 119.0555 56.6672 41.1281 176.8296 93 Q 4.6245 8.0427 116.8123 55.1127 29.2170 175.5573 94 W 4.4757 8.1188 128.0508 57.6384 31.5393 175.5061 95 S 4.0931 5.8100 115.4158 56.2560 64.5862 173.7262 96 P 4.1508 0.0000 0.0000 64.3758 31.1000 177.3189 97 A 3.9433 7.1822 119.1966 53.6653 18.5197 177.6523 98 L 4.2446 7.1263 116.2282 54.0568 42.9652 176.1575 99 T 4.9111 7.8569 110.0136 59.2815 73.1738 174.7928 100 L 4.0927 9.0615 122.3912 58.3345 42.0959 178.9565 101 S 4.3350 8.2010 113.7829 61.3695 62.7995 176.2716 102 K 4.0238 7.9033 123.3656 59.1652 31.7759 179.0703 103 V 3.7134 7.7768 118.5408 65.8099 31.3601 178.0388 104 L 3.9896 8.4681 119.3109 57.5828 41.4282 179.4118 105 L 3.9817 7.8837 118.7677 58.1557 41.6795 179.8256 106 S 4.1788 7.9207 114.3307 61.4237 62.7593 177.0727 107 I 3.7680 7.4397 122.8093 64.4403 37.1294 177.7401 108 C 4.0237 8.2608 117.8112 63.3725 27.9646 176.6710 109 S 4.2903 8.3017 116.4194 61.3475 62.2378 176.4325 110 L 4.1510 7.9107 123.2136 58.1324 41.5520 179.0657 111 L 3.9476 7.5832 117.8130 57.6578 41.5457 179.2451 112 T 4.4959 7.3440 113.9227 65.1485 69.2701 174.6766 113 D 4.6592 8.5924 120.9865 51.6404 41.9014 175.1283 114 A 4.3366 8.2507 126.4105 51.3529 19.3124 176.8475 115 N 4.6875 7.9662 115.5404 51.1993 39.6234 172.9279 116 P 4.2630 0.0000 0.0000 64.1812 31.5762 177.1317 117 D 4.5671 7.8127 117.7877 55.2845 41.7698 175.7962 118 D 5.0031 7.4459 118.1574 52.4411 40.9671 176.6386 119 P 4.5029 0.0000 0.0000 63.1066 29.1346 177.1677 120 L 3.6584 8.0201 126.5642 57.7420 42.7774 177.7363 121 V 4.2000 7.2364 116.9563 59.9229 33.1892 173.0845 122 P 4.2275 0.0000 0.0000 65.2327 31.2891 178.0471 123 E 3.9384 8.0617 117.6190 59.5359 29.8710 178.9113 124 I 3.7388 7.6405 118.9454 63.9386 36.9908 178.2737 125 A 3.8663 7.8380 122.0510 55.2953 18.2543 179.1670 126 H 4.1958 8.5754 117.1886 59.5725 29.9115 177.5586 127 I 3.7400 7.9175 121.6821 64.3158 36.6457 177.8296 128 Y 3.6553 7.5793 119.2153 60.7193 38.7531 178.0765 129 K 4.1503 8.3213 118.3407 58.8224 32.1935 178.5261 130 T 4.4165 7.7835 108.2593 61.7015 71.5999 174.3765 131 D 4.7145 8.1532 120.5321 51.2173 41.5256 175.2219 132 R 3.7130 7.9593 123.7124 59.3823 30.3560 175.2498 133 P 4.1967 0.0000 0.0000 65.4855 31.3944 178.3363 134 K 3.8771 7.9626 118.2982 59.6402 31.9560 178.2138 135 Y 4.0034 7.9265 119.1874 60.7881 39.0699 177.2603 136 E 3.5244 8.9699 120.3380 58.9817 29.5218 178.6751 137 A 3.8911 8.2548 121.4168 55.4244 18.4208 179.7934 138 T 3.6394 7.6057 113.9542 66.0880 68.2426 177.1350 139 A 3.6117 7.4473 123.2205 55.0667 18.3771 179.9269 140 R 4.2154 7.4596 117.5479 58.6604 30.1513 179.1015 141 E 3.9741 7.9242 118.3659 59.4972 29.6188 179.6029 142 W 4.4711 8.4297 118.1877 59.8398 28.6899 178.9313 143 T 4.2056 7.9642 115.8864 66.5750 67.7439 176.6796 144 K 3.9384 7.7598 118.9133 59.5855 32.1855 179.2731 145 K 3.8071 7.5468 116.4768 59.4364 32.0169 178.4963 146 Y 4.4663 7.4833 114.9652 59.6685 39.7415 176.8908 147 A 4.3876 8.0001 123.2449 50.6525 17.5534 177.8524 148 V 4.0238 7.2141 119.0490 61.6541 32.7666 175.9785 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 4.47 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 2 S 7.88 4.13 0.00 4.08 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 3 S 8.80 4.60 0.00 4.21 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 4 S 8.21 4.22 0.00 3.98 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 5 K 8.10 4.07 0.00 1.99 1.87 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.60 7.81 6 R 7.92 3.92 0.00 2.00 2.06 0.00 3.15 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.86 0.00 7 I 7.44 3.46 1.47 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.18 0.46 0.00 0.00 8 A 7.77 4.00 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 9 K 8.03 3.88 0.00 2.04 1.97 0.00 1.67 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.63 7.81 10 E 8.11 4.03 0.00 2.25 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 2.39 2.57 0.00 11 L 8.42 4.17 0.00 2.13 1.82 0.78 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.10 4.09 0.00 3.98 4.07 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 0.00 0.00 0.00 13 D 8.41 4.52 0.00 2.94 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 14 L 7.63 4.26 0.00 2.00 1.73 1.10 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.37 4.10 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 16 R 7.82 4.30 0.00 1.84 1.79 0.00 3.22 0.00 0.00 3.23 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 17 D 7.96 4.62 0.00 2.63 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 18 P 0.00 4.50 0.00 2.04 1.98 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.14 0.00 19 P 0.00 4.54 0.00 2.20 2.11 0.00 3.77 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.99 0.00 20 T 8.22 4.23 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 21 S 7.81 4.42 0.00 4.05 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 C 7.66 4.66 0.00 3.02 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.21 4.52 0.00 3.92 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 24 A 8.36 5.13 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 25 G 8.20 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 0.00 0.00 0.00 26 P 0.00 4.52 0.00 1.94 1.81 0.00 2.95 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 27 V 8.57 3.86 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 0.90 0.00 0.00 0.77 0.00 0.00 28 G 8.89 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 0.00 0.00 0.00 0.00 29 D 8.61 4.77 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 30 D 7.71 4.68 0.00 2.82 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 31 L 8.65 4.33 0.00 1.66 1.66 1.02 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 8.58 4.54 0.00 3.33 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 33 H 8.50 5.35 0.00 3.20 3.40 0.00 5.75 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 W 9.30 5.32 0.00 3.22 3.19 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 35 Q 9.07 5.15 0.00 2.08 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.63 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 36 A 8.96 5.33 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 37 S 8.97 4.93 0.00 3.01 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 38 I 8.66 5.00 1.93 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.89 0.00 0.00 39 M 8.61 5.10 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.61 0.00 40 G 8.78 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 41 P 0.00 4.57 0.00 2.29 2.07 0.00 3.78 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.17 0.00 42 A 8.68 4.08 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 D 7.87 4.93 0.00 2.83 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 7.60 4.78 0.00 4.22 4.09 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 45 P 0.00 4.42 0.00 1.74 2.10 0.00 3.69 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.81 0.00 46 Y 7.87 4.91 0.00 3.20 3.29 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 47 A 7.39 4.97 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 48 G 9.18 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 49 G 7.66 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 V 7.90 4.62 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 0.74 0.00 0.00 0.86 0.00 0.00 51 F 9.24 5.16 0.00 3.13 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 9.32 5.10 0.00 3.18 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 53 L 9.20 4.96 0.00 1.38 1.34 -0.48 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 54 S 9.12 5.16 0.00 3.90 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.86 4.91 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.58 0.03 0.00 0.00 56 H 9.15 5.13 0.00 2.93 3.14 0.00 5.80 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 F 8.77 4.42 0.00 2.83 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 58 P 0.00 4.49 0.00 2.52 2.19 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 2.41 2.27 0.00 59 T 8.58 3.98 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 60 D 8.00 5.07 0.00 2.97 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 61 Y 8.04 4.58 0.00 3.35 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 3.44 0.00 1.71 1.21 0.00 3.62 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.54 0.00 63 F 7.96 4.51 0.00 3.32 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 64 K 7.76 4.68 0.00 1.89 1.66 0.00 1.76 0.00 0.00 1.84 0.00 0.00 3.17 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.45 7.81 65 P 0.00 2.97 0.00 1.71 1.32 0.00 3.68 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 1.75 1.83 0.00 66 P 0.00 4.26 0.00 1.37 1.34 0.00 2.60 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 67 K 8.77 4.22 0.00 1.71 1.69 0.00 1.53 0.00 0.00 1.58 0.00 0.00 2.74 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.47 7.81 68 I 8.20 4.77 1.74 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 0.98 0.36 0.72 0.00 0.00 69 S 8.81 4.99 0.00 3.87 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 70 F 9.09 4.79 0.00 3.18 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 71 T 9.40 4.15 4.57 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 1.30 0.00 0.00 72 T 8.28 4.43 4.75 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 1.55 0.00 0.00 73 K 8.59 4.25 0.00 1.00 1.22 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.23 0.77 7.81 74 I 8.19 4.86 1.57 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.81 0.36 0.00 0.00 75 Y 8.63 4.03 0.00 1.75 2.45 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 76 H 7.75 5.05 0.00 3.03 2.88 0.00 5.92 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 P 0.00 4.14 0.00 1.92 1.95 0.00 3.11 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.03 0.00 78 N 8.05 4.84 0.00 2.81 2.83 0.00 0.00 6.92 7.48 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 79 I 7.66 5.26 1.67 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.58 0.79 0.00 0.00 80 N 8.30 4.82 0.00 2.88 2.95 0.00 0.00 6.15 7.70 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 81 A 8.50 4.09 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 82 N 8.16 4.57 0.00 2.72 2.88 0.00 0.00 7.12 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 83 G 8.07 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 0.00 0.00 0.00 84 N 7.91 4.77 0.00 2.91 2.75 0.00 0.00 6.85 6.91 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 85 I 8.12 4.86 1.89 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 1.49 0.86 0.95 0.00 0.00 86 C 8.72 4.43 0.00 2.98 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 87 L 8.10 4.81 0.00 1.76 1.45 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 88 D 9.27 4.42 0.00 2.88 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 7.79 4.18 2.02 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 1.48 0.71 0.93 0.00 0.00 90 L 7.90 4.73 0.00 1.85 1.69 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.83 4.77 0.00 1.74 1.09 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.46 7.81 92 D 9.65 4.52 0.00 2.73 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 93 Q 8.04 4.62 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.90 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 94 W 8.12 4.48 0.00 3.53 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 95 S 5.81 4.09 0.00 3.58 3.22 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 96 P 0.00 4.15 0.00 1.73 1.41 0.00 3.53 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.83 0.00 97 A 7.18 3.94 1.11 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 98 L 7.13 4.24 0.00 0.67 1.37 0.57 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 99 T 7.86 4.91 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 1.24 0.00 0.00 100 L 9.06 4.09 0.00 1.87 1.79 0.72 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 101 S 8.20 4.33 0.00 4.14 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 K 7.90 4.02 0.00 1.87 1.96 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.49 7.81 103 V 7.78 3.71 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.23 0.00 0.00 104 L 8.47 3.99 0.00 1.93 1.72 0.88 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 105 L 7.88 3.98 0.00 1.87 1.73 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 106 S 7.92 4.18 0.00 4.00 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 0.00 107 I 7.44 3.77 2.03 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.25 0.91 0.00 0.00 108 C 8.26 4.02 0.00 3.17 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 0.00 109 S 8.30 4.29 0.00 4.06 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 0.00 110 L 7.91 4.15 0.00 1.90 1.75 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 111 L 7.58 3.95 0.00 1.79 1.55 0.55 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 112 T 7.34 4.50 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 0.00 113 D 8.59 4.66 0.00 2.59 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 0.00 114 A 8.25 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 N 7.97 4.69 0.00 2.65 2.58 0.00 0.00 6.66 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 P 0.00 4.26 0.00 2.20 2.05 0.00 3.73 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 117 D 7.81 4.57 0.00 2.66 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 0.00 118 D 7.45 5.00 0.00 2.77 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 P 0.00 4.50 0.00 2.16 2.17 0.00 3.74 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 2.03 1.92 0.00 120 L 8.02 3.66 0.00 1.55 1.83 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 121 V 7.24 4.20 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 0.90 0.00 0.00 0.88 0.00 0.00 122 P 0.00 4.23 0.00 2.18 2.06 0.00 3.63 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.25 0.00 123 E 8.06 3.94 0.00 2.05 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 2.44 2.46 0.00 124 I 7.64 3.74 1.61 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.59 0.59 0.00 0.00 125 A 7.84 3.87 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 H 8.58 4.20 0.00 3.28 3.34 0.00 5.61 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 0.00 127 I 7.92 3.74 2.04 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.68 1.09 0.00 0.00 128 Y 7.58 3.66 0.00 2.78 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 K 8.32 4.15 0.00 1.81 1.89 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.66 7.81 130 T 7.78 4.42 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 1.18 0.00 0.00 131 D 8.15 4.71 0.00 2.61 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 0.00 132 R 7.96 3.71 0.00 1.74 1.84 0.00 2.61 0.00 0.00 2.60 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.72 0.00 133 P 0.00 4.20 0.00 2.18 2.06 0.00 3.85 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 134 K 7.96 3.88 0.00 1.99 1.99 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.45 7.81 135 Y 7.93 4.00 0.00 3.20 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 0.00 136 E 8.97 3.52 0.00 2.24 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 2.23 2.28 0.00 137 A 8.25 3.89 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 7.61 3.64 3.31 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 -0.08 0.00 0.00 139 A 7.45 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 R 7.46 4.22 0.00 1.81 1.94 0.00 3.11 0.00 0.00 3.21 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.52 0.00 141 E 7.92 3.97 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 142 W 8.43 4.47 0.00 3.62 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 0.00 143 T 7.96 4.21 4.51 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 1.45 0.00 0.00 144 K 7.76 3.94 0.00 1.92 1.85 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.68 7.81 145 K 7.55 3.81 0.00 0.79 1.02 0.00 1.51 0.00 0.00 1.24 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.24 1.57 7.81 146 Y 7.48 4.47 0.00 3.23 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 0.00 147 A 8.00 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 7.21 4.02 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 0.72 0.00 0.00 0.98 0.00 0.00