NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.7150 8.4249 119.2031 53.3266 39.1080 172.5908 4 I 4.7671 7.7514 124.2766 58.9256 41.6594 172.6645 5 T 5.0245 9.1736 122.7909 61.6544 72.5216 172.4044 6 I 4.8191 8.4513 125.7358 59.3669 41.0011 173.9208 7 Y 4.8210 9.3527 128.1757 57.8050 38.5777 173.7665 8 H 5.1736 9.5307 125.1709 53.4830 33.3275 172.9315 9 N 4.9564 8.5550 122.3032 50.7750 39.4039 172.8273 10 P 4.1666 0.0000 0.0000 64.7332 31.5985 177.3904 11 A 4.2769 8.2005 119.4543 52.3641 18.7882 176.8291 12 C 4.8584 8.0085 117.8983 57.2561 33.6807 174.6076 13 G 3.6398 8.7207 115.3940 48.1388 0.0000 175.0216 14 T 3.9054 7.9808 117.5380 66.6835 68.3071 176.3526 15 S 4.1702 8.0573 114.3157 61.3692 62.5382 176.1395 16 R 4.0601 8.3018 120.9155 59.4903 29.7870 178.7576 17 N 4.5537 8.5466 116.4792 56.6530 38.4534 177.5869 18 T 3.7587 8.0757 117.0456 66.5520 68.5895 176.2782 19 L 3.8876 8.0897 122.3019 58.4327 42.0200 178.9824 20 E 4.0849 8.4254 118.3737 59.5770 29.1702 179.2489 21 M 3.5628 7.8626 118.4979 57.9452 32.1915 178.2812 22 I 3.7947 7.8750 120.3607 64.7438 37.2716 178.5962 23 R 4.3620 8.0100 119.8553 58.7298 29.8471 178.3754 24 N 4.4858 8.4034 116.2173 55.3413 38.7761 175.9179 25 S 4.6871 7.8445 113.9082 58.9394 63.6297 174.7140 26 G 3.9706 8.3840 111.2639 45.6828 0.0000 173.2296 27 T 4.5343 7.6354 115.2510 61.2136 71.4926 172.5388 28 E 4.4745 8.6395 126.5891 54.2252 30.3043 173.9245 29 P 4.7526 0.0000 0.0000 62.1190 33.3530 175.8186 30 T 4.0554 8.7979 118.0769 63.6917 69.4314 173.7068 31 I 4.6871 8.3203 127.0799 59.6477 39.2755 174.8986 32 I 4.2324 8.3627 128.5627 59.5284 39.3689 175.7021 33 L 4.6869 8.7591 128.0924 52.6274 40.0492 176.8326 34 Y 4.5125 8.4445 121.2149 59.5970 38.3606 178.8527 35 L 3.8784 7.0036 119.6219 57.1245 41.9605 177.7583 36 E 4.2827 7.9653 116.5991 57.8379 30.6502 176.2878 37 N 5.0759 7.9757 114.1667 50.8472 38.9175 172.1685 38 P 4.7186 0.0000 0.0000 61.5040 32.7281 175.3939 39 P 4.9067 0.0000 0.0000 62.1257 31.9109 176.6762 40 S 4.4558 8.6263 114.8195 57.6214 65.2206 175.1957 41 R 3.8386 8.4133 121.2111 59.8386 29.7844 177.9325 42 D 4.3776 8.1010 118.0110 57.5401 40.7116 178.6738 43 E 3.9841 7.9242 118.5777 59.1757 29.5033 179.0724 44 L 3.8214 8.3329 120.8335 58.1620 42.1898 179.0611 45 V 3.5682 8.0954 118.5632 65.9359 31.3020 177.9684 46 K 3.9404 8.0417 119.2198 59.3789 32.0821 178.6688 47 L 3.9435 8.3632 119.6225 57.9696 40.4597 179.6702 48 I 3.6369 7.8191 119.2277 64.2439 36.9879 178.1917 49 A 4.1135 7.9731 121.5325 55.5785 18.0033 179.5507 50 D 4.3651 8.2364 116.1733 57.5465 40.9387 178.5519 51 M 4.5030 7.5336 119.5794 55.0862 32.0368 176.6709 52 G 3.9389 7.6891 106.5776 46.4335 0.0000 173.0283 53 I 4.5394 6.8906 112.0707 57.9096 40.4117 174.9263 54 S 4.4163 8.2353 115.1753 57.5984 64.0547 175.1274 55 V 3.7076 8.4315 120.2748 66.3465 31.2152 178.1100 56 R 3.9566 8.0633 117.6241 59.3195 29.7494 178.0178 57 A 4.1129 8.0707 119.6278 54.3271 18.5505 178.0586 58 L 4.0835 7.9375 118.7611 56.5612 42.6267 176.3065 59 L 4.6239 7.5697 119.4628 54.9116 42.0095 176.7814 60 R 4.0854 8.6928 125.8372 55.8930 30.4923 176.4297 61 K 2.6354 8.1991 125.2880 55.7050 34.2148 176.2940 62 N 5.0881 8.3108 114.6171 55.3893 35.6177 175.4189 63 V 4.5417 6.9972 109.7138 58.4992 36.4918 175.4932 64 E 4.1192 9.0658 123.6565 58.4779 29.3219 177.8049 65 P 4.1251 0.0000 0.0000 65.8694 31.1279 177.5959 66 Y 3.7556 7.9292 118.7973 60.4285 38.4798 177.7010 67 E 4.0681 8.2030 119.2494 59.8384 29.4685 179.5027 68 Q 4.0722 8.2100 117.0610 58.5313 28.9846 177.3763 69 L 4.0257 7.9018 115.7522 54.3567 41.9788 176.8957 70 G 3.8783 7.6977 106.9839 46.5662 0.0000 175.9494 71 L 3.4578 7.1690 120.4146 55.9575 41.6690 178.7107 72 A 4.2422 7.2653 120.3779 54.0966 18.5766 177.7458 73 E 4.3109 7.8382 114.8594 56.0231 30.8111 177.0603 74 D 4.7698 8.3619 122.6341 53.7464 39.7224 176.1098 75 K 4.4671 7.5911 114.1695 55.5068 34.2822 176.4038 76 F 5.1023 7.9424 117.1373 55.1973 42.3445 175.6560 77 T 4.3172 9.1347 116.5550 61.1157 70.8424 175.5403 78 D 4.4173 8.5817 120.8853 57.8639 40.7473 178.9559 79 D 4.3325 8.0520 118.7618 57.0900 40.7827 178.4787 80 Q 3.8231 7.8478 118.8617 59.0785 28.7625 179.1408 81 L 4.1397 8.0307 119.6654 57.8037 41.6726 179.4927 82 I 3.6970 8.0007 119.9886 64.7929 37.1323 178.2976 83 D 4.3472 8.2319 119.5241 57.2035 40.5128 178.9343 84 F 4.5029 8.2359 118.7317 60.8247 38.3646 177.4944 85 M 4.1518 8.3798 118.4350 58.5538 31.5517 178.8855 86 L 4.0890 7.8843 117.9459 57.8290 41.9058 179.1756 87 Q 4.2729 8.0760 116.2792 57.4111 30.2225 176.6006 88 H 4.9696 8.0308 117.1045 53.3585 30.2786 172.0894 89 P 4.5331 0.0000 0.0000 64.3744 31.8263 178.5555 90 I 3.9178 7.7543 116.8741 63.0756 38.2116 176.5941 91 L 4.1471 8.3549 120.2372 57.0789 41.6739 176.3993 92 I 4.2665 7.7516 120.6612 60.5090 37.2510 175.7551 93 N 4.7442 8.8610 127.3082 53.7921 39.8629 173.7083 94 R 4.6892 8.4891 116.8674 54.2377 32.6960 172.8941 95 P 4.9016 0.0000 0.0000 61.5970 33.7287 174.5007 96 I 4.7047 8.1696 122.1502 60.2352 39.3186 174.6917 97 V 4.9209 8.8177 126.2794 61.0359 34.7831 174.0987 98 V 5.0005 8.9137 127.8462 61.4167 34.0463 174.4598 99 T 5.2392 8.9447 117.3232 59.0792 72.2701 173.1380 100 P 4.3560 0.0000 0.0000 65.1109 31.4116 178.0366 101 L 4.1457 7.6899 117.2907 54.7509 42.0438 176.9786 102 G 4.0402 6.3564 105.9849 45.6441 0.0000 170.4771 103 T 5.2145 7.6251 114.6726 61.8218 72.0818 173.8931 104 R 4.6265 8.7659 123.2623 54.2306 35.1008 174.3082 105 L 4.2011 8.5582 125.0481 54.9917 41.9649 177.0768 106 C 4.4942 8.7862 128.7113 58.3325 26.6727 172.5702 107 R 4.5307 7.6284 116.4158 53.2630 32.4509 174.0008 108 P 4.5873 0.0000 0.0000 61.6723 32.6342 177.4579 109 S 4.3583 8.9618 115.3452 60.9479 62.5554 175.9954 110 E 4.0608 8.1019 119.3831 57.8232 29.3814 178.5482 111 V 3.5985 7.9428 120.5224 66.2720 31.4149 177.9861 112 V 3.6368 7.9402 118.6072 64.5540 29.4297 178.2939 113 L 4.0044 7.8814 119.7087 57.6461 41.1014 179.0011 114 D 4.6706 8.0466 118.7556 56.2525 40.8333 177.0740 115 I 4.3341 7.3802 109.6213 60.2255 38.7758 175.6493 116 L 4.1457 7.1940 121.4602 54.7614 41.8711 177.1411 117 Q 4.1017 8.8291 123.3379 58.4430 29.0396 176.3427 118 D 4.7837 7.7191 115.9391 52.1455 42.4602 176.2822 119 A 4.1361 8.3513 125.8745 51.8467 17.9321 177.3599 120 Q 4.1606 8.6288 118.8382 56.7677 29.1446 178.5343 121 K 3.9219 8.9692 121.6705 57.9653 32.5158 176.4725 122 G 4.1178 7.0487 103.8564 45.4696 0.0000 173.0928 123 A 4.6313 9.0083 121.9350 52.3430 19.1897 177.2711 124 F 4.7498 9.2358 122.5305 56.6096 42.5713 173.8891 125 T 4.8895 7.4217 121.7299 61.2239 71.2768 174.2574 126 K 4.2823 9.0777 126.7016 56.3016 32.7830 177.8946 127 E 3.9480 9.2049 119.2373 59.0601 29.5630 177.6424 128 D 4.5224 8.0680 117.1493 53.4165 39.6638 177.0413 129 G 3.8600 8.0968 108.7735 45.1552 0.0000 173.5358 130 E 4.0285 8.4611 122.2114 55.6458 29.9179 176.0818 131 K 4.4116 8.5964 126.4680 56.5320 33.1370 175.9567 132 V 4.2519 9.0252 122.7227 64.0014 33.1517 175.7295 133 V 4.9164 7.4311 112.0764 59.3477 35.3379 175.5591 134 D 5.1520 8.4738 122.7866 52.1090 41.2316 176.7167 135 E 3.9644 8.6491 118.6239 59.1653 29.6309 177.5305 136 A 4.1300 7.9983 119.4086 52.9129 18.8907 177.8505 137 G 3.9867 8.3469 104.3148 44.6856 0.0000 173.6615 138 K 4.2110 8.2322 121.8997 55.3179 32.9179 176.5159 139 R 4.5718 8.4394 125.1703 56.4100 30.7525 176.6650 140 L 4.2604 8.4964 121.1013 55.0206 41.7046 176.5995 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 3 N 8.42 4.72 0.00 2.69 2.84 0.00 0.00 6.78 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 I 7.75 4.77 1.85 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 1.33 0.77 0.95 0.00 0.00 5 T 9.17 5.02 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 6 I 8.45 4.82 1.85 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 1.29 1.77 0.91 0.00 0.00 7 Y 9.35 4.82 0.00 2.88 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 8 H 9.53 5.17 0.00 3.24 3.19 0.00 5.76 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 N 8.56 4.96 0.00 2.99 2.75 0.00 0.00 7.12 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 10 P 0.00 4.17 0.00 2.05 2.12 0.00 3.62 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 11 A 8.20 4.28 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 C 8.01 4.86 0.00 3.02 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 13 G 8.72 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 T 7.98 3.91 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 1.24 0.00 0.00 15 S 8.06 4.17 0.00 3.97 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 16 R 8.30 4.06 0.00 2.11 2.03 0.00 3.23 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.92 0.00 17 N 8.55 4.55 0.00 2.93 3.01 0.00 0.00 7.09 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 18 T 8.08 3.76 4.38 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 1.19 0.00 0.00 19 L 8.09 3.89 0.00 1.71 1.81 0.86 0.97 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 20 E 8.43 4.08 0.00 2.36 2.28 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 2.69 2.62 0.00 21 M 7.86 3.56 0.00 1.61 1.84 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 1.00 1.31 0.00 22 I 7.88 3.79 1.96 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 1.48 1.05 0.92 0.00 0.00 23 R 8.01 4.36 0.00 2.04 2.00 0.00 3.36 0.00 0.00 3.20 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.63 0.00 24 N 8.40 4.49 0.00 3.05 3.09 0.00 0.00 6.92 7.17 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 25 S 7.84 4.69 0.00 4.28 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.38 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.64 4.53 4.22 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 1.20 0.00 0.00 28 E 8.64 4.47 0.00 1.89 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00 29 P 0.00 4.75 0.00 2.07 2.00 0.00 3.79 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.95 0.00 30 T 8.80 4.06 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 1.14 0.00 0.00 31 I 8.32 4.69 1.85 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 1.29 0.71 0.93 0.00 0.00 32 I 8.36 4.23 1.34 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 1.09 0.55 0.98 0.00 0.00 33 L 8.76 4.69 0.00 1.68 1.56 0.91 1.00 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 34 Y 8.44 4.51 0.00 3.26 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 35 L 7.00 3.88 0.00 1.39 1.59 0.73 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 36 E 7.97 4.28 0.00 2.04 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 2.23 2.26 0.00 37 N 7.98 5.08 0.00 2.70 2.76 0.00 0.00 7.07 7.56 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 38 P 0.00 4.72 0.00 2.25 2.23 0.00 3.88 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 2.03 2.00 0.00 39 P 0.00 4.91 0.00 2.17 2.05 0.00 3.45 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.69 0.00 40 S 8.63 4.46 0.00 4.08 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 41 R 8.41 3.84 0.00 1.89 1.96 0.00 3.17 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 42 D 8.10 4.38 0.00 2.73 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 43 E 7.92 3.98 0.00 2.16 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 2.36 2.34 0.00 44 L 8.33 3.82 0.00 1.74 1.78 0.80 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 45 V 8.10 3.57 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 0.93 0.00 0.00 0.97 0.00 0.00 46 K 8.04 3.94 0.00 1.96 1.96 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.48 7.81 47 L 8.36 3.94 0.00 1.73 1.58 0.43 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 48 I 7.82 3.64 1.97 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 1.41 0.88 0.94 0.00 0.00 49 A 7.97 4.11 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 50 D 8.24 4.37 0.00 2.63 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 51 M 7.53 4.50 0.00 1.97 2.31 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.43 0.00 52 G 7.69 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 53 I 6.89 4.54 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 1.33 0.77 0.90 0.00 0.00 54 S 8.24 4.42 0.00 4.02 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.43 3.71 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 1.08 0.00 0.00 0.94 0.00 0.00 56 R 8.06 3.96 0.00 1.97 1.95 0.00 3.29 0.00 0.00 3.42 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.79 0.00 57 A 8.07 4.11 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 58 L 7.94 4.08 0.00 1.72 1.81 0.82 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.57 4.62 0.00 1.82 1.77 1.01 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.69 4.09 0.00 1.76 1.80 0.00 3.27 0.00 0.00 3.44 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 61 K 8.20 2.64 0.00 1.43 1.17 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.70 1.11 7.81 62 N 8.31 5.09 0.00 2.80 2.92 0.00 0.00 7.06 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 63 V 7.00 4.54 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 0.91 0.00 0.00 1.00 0.00 0.00 64 E 9.07 4.12 0.00 2.03 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 2.46 2.25 0.00 65 P 0.00 4.13 0.00 2.13 2.11 0.00 3.67 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 66 Y 7.93 3.76 0.00 2.96 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 67 E 8.20 4.07 0.00 2.25 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 0.00 2.41 2.54 0.00 68 Q 8.21 4.07 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 69 L 7.90 4.03 0.00 1.22 0.99 0.24 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 70 G 7.70 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 L 7.17 3.46 0.00 0.27 1.00 0.51 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.27 4.24 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 73 E 7.84 4.31 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 2.34 2.36 0.00 74 D 8.36 4.77 0.00 2.67 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 75 K 7.59 4.47 0.00 0.80 1.23 0.00 1.58 0.00 0.00 1.52 0.00 0.00 2.90 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.16 1.26 7.81 76 F 7.94 5.10 0.00 3.04 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 T 9.13 4.32 4.27 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 1.23 0.00 0.00 78 D 8.58 4.42 0.00 2.76 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 79 D 8.05 4.33 0.00 2.75 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 80 Q 7.85 3.82 0.00 2.34 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 81 L 8.03 4.14 0.00 1.92 1.77 1.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 82 I 8.00 3.70 1.98 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 1.51 0.94 0.89 0.00 0.00 83 D 8.23 4.35 0.00 2.57 2.55 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 84 F 8.24 4.50 0.00 3.18 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 85 M 8.38 4.15 0.00 2.09 2.29 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.63 0.00 86 L 7.88 4.09 0.00 1.78 1.73 0.91 0.87 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 87 Q 8.08 4.27 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.17 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 88 H 8.03 4.97 0.00 3.26 3.20 0.00 5.63 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.53 0.00 2.23 2.33 0.00 3.91 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.09 0.00 90 I 7.75 3.92 1.90 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 1.46 0.78 0.96 0.00 0.00 91 L 8.35 4.15 0.00 1.90 1.77 0.94 1.15 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 92 I 7.75 4.27 1.90 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 1.09 0.52 0.63 0.00 0.00 93 N 8.86 4.74 0.00 2.86 2.67 0.00 0.00 7.06 7.46 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 94 R 8.49 4.69 0.00 1.77 1.63 0.00 3.36 0.00 0.00 3.29 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.88 0.00 95 P 0.00 4.90 0.00 2.18 2.28 0.00 4.03 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 2.05 1.87 0.00 96 I 8.17 4.70 1.80 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.47 0.86 0.00 0.00 97 V 8.82 4.92 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 0.94 0.00 0.00 0.94 0.00 0.00 98 V 8.91 5.00 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 1.06 0.00 0.00 1.07 0.00 0.00 99 T 8.94 5.24 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 100 P 0.00 4.36 0.00 2.06 2.16 0.00 3.75 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.11 0.00 101 L 7.69 4.15 0.00 1.78 1.72 0.91 0.75 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 0.00 102 G 6.36 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 0.00 103 T 7.63 5.21 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 1.26 0.00 0.00 104 R 8.77 4.63 0.00 1.67 1.73 0.00 3.27 0.00 0.00 3.08 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 105 L 8.56 4.20 0.00 1.59 1.57 0.89 0.90 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 0.00 106 C 8.79 4.49 0.00 2.90 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 0.00 107 R 7.63 4.53 0.00 1.72 1.82 0.00 3.45 0.00 0.00 3.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 108 P 0.00 4.59 0.00 2.45 2.19 0.00 3.70 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 1.95 0.00 109 S 8.96 4.36 0.00 4.05 4.36 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 0.00 110 E 8.10 4.06 0.00 2.16 2.24 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 2.35 2.31 0.00 111 V 7.94 3.60 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.94 0.00 0.00 112 V 7.94 3.64 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 0.68 0.00 0.00 0.89 0.00 0.00 113 L 7.88 4.00 0.00 1.77 1.73 0.89 0.68 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 0.00 114 D 8.05 4.67 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 0.00 115 I 7.38 4.33 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.63 0.90 0.00 0.00 116 L 7.19 4.15 0.00 1.62 1.63 0.85 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 8.83 4.10 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 118 D 7.72 4.78 0.00 2.80 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 0.00 119 A 8.35 4.14 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 Q 8.63 4.16 0.00 2.11 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.90 0.00 0.00 0.00 0.00 0.00 2.42 2.34 0.00 121 K 8.97 3.92 0.00 1.83 1.87 0.00 1.75 0.00 0.00 1.85 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.44 7.81 122 G 7.05 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 0.00 123 A 9.01 4.63 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 0.00 124 F 9.24 4.75 0.00 3.16 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 0.00 125 T 7.42 4.89 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 126 K 9.08 4.28 0.00 1.93 1.82 0.00 1.85 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.71 1.67 7.81 127 E 9.20 3.95 0.00 2.04 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 2.49 2.26 0.00 128 D 8.07 4.52 0.00 2.81 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.10 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 E 8.46 4.03 0.00 2.11 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 2.33 2.30 0.00 131 K 8.60 4.41 0.00 1.80 1.74 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.42 7.81 132 V 9.03 4.25 2.48 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 1.03 0.00 0.00 1.13 0.00 0.00 133 V 7.43 4.92 2.12 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 0.77 0.00 0.00 1.02 0.00 0.00 134 D 8.47 5.15 0.00 2.88 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 0.00 135 E 8.65 3.96 0.00 1.94 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 2.37 0.00 136 A 8.00 4.13 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 G 8.35 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 K 8.23 4.21 0.00 1.84 1.99 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.41 7.81 139 R 8.44 4.57 0.00 1.85 1.86 0.00 3.67 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 140 L 8.50 4.26 0.00 1.65 1.58 0.93 0.75 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