NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9446 8.3501 109.7372 45.7410 0.0000 173.1005 3 A 4.3662 7.7595 121.6640 50.6804 19.2379 175.2434 4 R 3.6951 8.8407 123.7646 56.9478 31.4262 171.5490 5 N 5.1071 8.0715 115.5040 52.1956 41.1352 173.2332 6 S 4.7490 7.9463 113.0945 60.1375 70.0800 176.5369 7 V 3.7575 7.9363 121.4143 64.2037 31.6550 176.3152 8 L 4.7814 7.5856 117.6040 52.2297 44.9195 177.4313 9 R 4.4931 8.3399 120.6028 55.1940 32.8219 176.9337 10 G 3.6008 8.5024 104.3778 48.2388 0.0000 175.3427 11 K 4.1174 7.9291 121.7876 59.1399 32.5033 178.9535 12 K 3.9598 8.0434 118.1290 59.2335 31.9835 178.6880 13 A 4.0006 8.3865 121.6218 55.3327 18.1795 178.9976 14 D 4.2456 7.7559 115.4939 57.7975 41.2760 178.2715 15 E 3.9466 8.2452 118.3580 59.4148 29.1817 178.9710 16 L 3.9123 7.5429 118.6840 58.4270 42.3635 178.8941 17 E 4.3122 8.0218 116.7028 58.7745 29.3577 179.4938 18 R 4.1020 7.6352 118.0537 58.1276 31.0503 177.4110 19 I 3.7885 7.5367 119.8963 61.7862 37.8316 175.4651 20 R 4.7724 8.3823 123.8408 54.9125 31.1936 177.7297 21 L 3.5321 8.6408 122.9480 57.0539 41.7780 177.8136 22 R 4.7759 7.3794 114.4834 53.2794 33.8980 173.5649 23 P 4.8806 0.0000 0.0000 64.6459 31.5567 177.5261 24 G 4.0318 8.1156 105.7698 44.8978 0.0000 172.6438 25 G 4.1419 7.8045 109.5529 43.6745 0.0000 174.2468 26 K 4.5815 8.4108 116.4161 55.6364 33.8151 176.0378 27 K 4.6815 7.7986 118.6337 54.6774 34.8743 175.3727 28 K 5.0525 8.2844 121.4150 54.3757 35.5348 175.3936 29 Y 4.1857 8.3937 118.7118 58.4010 38.5162 176.0287 30 R 4.8018 8.7825 119.6530 53.3116 34.8135 175.8424 31 L 3.9416 8.7906 120.6778 58.7459 41.6598 179.1409 32 K 3.8676 8.2088 117.5307 60.2876 31.7799 178.7150 33 H 4.3987 8.3370 116.0215 58.8938 28.5422 178.0126 34 I 3.9751 8.1114 122.0604 64.1231 36.8708 178.4970 35 V 3.5958 7.8719 118.7435 65.8674 31.5557 177.3766 36 W 4.3292 8.2062 127.5265 60.7476 30.4645 177.8386 37 A 3.9122 8.1255 118.6996 55.2637 17.8212 179.2797 38 A 3.9625 8.1807 119.2421 55.3738 18.3364 179.4762 39 N 4.1858 8.5565 115.6816 56.9453 39.0798 177.0952 40 K 3.4348 7.6034 119.7911 60.0414 31.9689 178.5382 41 L 4.1311 7.9243 119.1484 57.0691 41.2776 178.4791 42 D 4.8976 7.7997 120.3378 57.0518 41.3269 178.9827 43 R 3.8916 7.7374 117.4363 59.5027 30.1890 177.8999 44 F 4.4754 8.0441 116.9126 60.1737 39.1423 175.7593 45 G 3.7812 7.8080 112.6362 45.3971 0.0000 173.1465 46 L 4.3569 7.4991 121.2983 53.3825 42.9227 176.2256 47 A 4.7094 8.2945 124.4084 52.0446 19.4140 176.9355 48 E 4.5779 8.4532 114.8528 57.4992 31.5710 178.1103 49 S 4.3813 7.9414 113.7695 59.8924 63.0589 175.0898 50 L 4.3553 7.7565 119.2180 55.6832 41.5681 177.3104 51 L 4.4276 7.5237 118.1716 55.5896 42.2903 177.9717 52 E 4.1121 8.0125 119.1825 58.8701 29.7021 177.8596 53 S 4.5330 7.6865 113.9697 56.9471 65.5958 175.1589 54 K 3.9256 8.3890 124.4061 59.9207 32.6696 178.7554 55 E 4.2638 8.2335 120.1810 59.2918 29.8230 178.7867 56 G 3.7749 8.2840 105.6879 48.2568 0.0000 175.3023 57 C 4.3256 8.0759 118.6509 62.6029 28.2379 175.9158 58 Q 3.9145 8.3447 121.3492 58.9538 28.1256 178.2742 59 K 4.1356 8.0201 118.9277 58.7109 32.1787 179.0746 60 I 3.7234 7.5695 119.7302 63.6450 37.3562 177.8695 61 L 4.3014 8.1495 119.9874 57.6762 41.3044 179.2184 62 T 3.9637 7.6497 112.2711 64.8674 67.2961 176.2959 63 V 3.7114 7.1136 119.1983 65.9778 32.0133 177.9240 64 L 4.0541 7.8088 117.5340 57.1639 41.5108 178.5091 65 D 3.9147 8.1283 119.8756 56.8946 40.6120 176.6158 66 P 4.3519 0.0000 0.0000 64.5711 31.9100 176.7865 67 M 4.1549 7.2260 118.0385 56.4372 32.7751 178.1546 68 V 3.3630 7.3110 118.7990 65.4647 31.6217 175.5135 69 P 4.3607 0.0000 0.0000 65.4007 31.5589 177.1541 70 T 4.5973 7.5759 115.0063 62.2652 68.8804 174.6653 71 G 4.3863 7.8838 107.9283 42.8797 0.0000 173.1530 72 S 4.3418 8.6255 117.5491 57.9927 63.7267 175.1052 73 E 4.0036 8.8646 119.6806 59.8096 27.8970 179.3218 74 N 4.6024 8.1056 115.4321 55.9408 38.1852 176.5228 75 L 4.4611 8.1839 121.1070 56.6484 42.3871 178.6979 76 K 4.2299 8.2249 118.9927 59.5877 31.8889 179.4399 77 S 4.9247 8.2054 116.4274 61.0561 62.9436 176.2027 78 L 4.4554 8.1074 123.1421 57.4240 41.8081 178.7542 79 F 4.4520 7.9896 119.9745 61.1307 39.4432 177.0867 80 N 4.1420 8.4590 116.6132 56.2211 36.7919 177.3368 81 T 3.8592 7.7898 118.1505 66.4914 68.5675 176.9061 82 V 3.5885 7.3622 118.7775 66.2737 31.3916 177.6226 83 C 3.8580 7.7292 116.3725 62.8926 27.8822 176.4924 84 V 3.5261 7.2381 119.2067 65.8173 31.0437 178.1292 85 I 3.5731 7.5946 119.6171 64.1774 36.9857 178.2249 86 W 4.0652 8.5439 129.4331 60.5589 30.4216 177.7823 87 C 4.2175 8.2032 116.7350 62.9932 27.3906 176.0937 88 I 3.5962 7.4606 120.0552 64.6902 36.4144 177.9320 89 H 4.3718 7.7544 116.3525 58.4836 28.4762 177.1408 90 A 3.6700 7.5112 119.9729 51.9213 18.4797 176.5692 91 E 3.5340 7.4782 114.3699 57.5549 26.9693 174.6320 92 E 4.5634 8.1357 118.1043 54.0829 31.4600 176.5011 93 K 4.1479 8.6198 125.8705 56.2136 32.7947 176.3410 94 V 4.5371 8.0426 118.7206 59.5759 35.4433 175.7750 95 K 4.1526 8.8462 124.2387 59.0022 32.6505 176.2546 96 D 5.3394 7.4539 114.9867 50.8216 42.7079 175.6305 97 T 3.8906 8.7946 114.5931 67.2546 68.2011 176.1994 98 E 4.0741 8.5044 119.9531 59.7670 29.3219 179.7250 99 G 3.6194 8.7492 105.5125 47.4618 0.0000 175.8094 100 A 4.0962 8.0247 123.1125 54.7598 18.2508 180.0133 101 K 3.8391 8.2227 117.1500 59.6850 32.2237 179.1021 102 Q 3.9672 7.7783 119.9530 59.5814 28.6261 178.8717 103 I 3.7498 7.3980 119.2320 64.3802 37.4196 178.2687 104 V 3.3259 7.5955 118.7492 65.8442 31.4063 177.7866 105 R 3.8439 8.3527 118.5765 59.6472 29.9890 178.4996 106 R 3.9049 7.9521 117.6481 59.9596 29.8983 178.7455 107 H 4.2976 7.9279 114.2398 58.2136 28.7918 177.6678 108 L 4.1593 7.5676 120.6001 57.5381 41.8941 178.9082 109 V 3.5241 8.2207 118.2543 66.1858 31.1465 177.6497 110 A 3.9822 7.6670 118.9330 55.1548 18.4122 178.6088 111 E 4.1859 7.9434 116.6245 58.9258 29.9849 178.4330 112 T 4.0131 8.2248 116.3796 66.2673 68.1806 176.5071 113 G 3.7402 7.9780 107.2135 47.8857 0.0000 174.8914 114 T 4.3581 7.7175 114.9815 64.6280 69.5799 176.5372 115 A 4.2125 7.9687 122.0336 53.7005 18.5622 177.4542 116 E 4.6875 8.4144 118.1480 55.5884 30.4763 178.2681 117 K 3.8586 8.2982 121.7880 57.7083 32.5737 175.5198 118 M 3.1956 7.3620 121.3552 53.3229 31.9813 175.1609 119 P 4.5172 0.0000 0.0000 62.3643 32.7288 175.3979 120 S 4.3210 8.1865 114.3623 58.4758 63.6401 173.5765 121 T 3.9480 8.2533 118.2187 64.6554 67.6631 174.4873 122 S 4.4355 8.0918 119.8397 57.1834 65.2131 174.6640 123 R 4.1166 8.4939 127.4208 55.0204 30.5805 174.5555 124 P 4.3458 0.0000 0.0000 63.2370 31.5502 177.2800 125 T 4.2709 8.1391 115.9006 59.2690 67.5190 173.8736 126 A 4.0799 7.8510 131.2302 52.1740 19.3858 176.1070 127 P 4.4780 0.0000 0.0000 62.3148 32.2852 175.6951 128 S 4.4237 8.2686 113.7877 57.7009 63.0321 173.0714 129 S 4.5395 7.7352 119.6501 57.7842 64.7728 173.1326 130 E 4.7556 7.8157 121.2411 56.2145 31.0523 174.6409 131 K 4.7057 8.2480 118.1839 54.8318 35.7166 175.6657 132 G 4.1226 7.9344 105.9929 45.5597 0.0000 173.9909 133 G 4.1840 8.0580 104.7195 44.6725 0.0000 170.8513 134 N 5.0249 7.6331 117.9145 52.0880 43.1482 173.2753 135 Y 4.1206 8.5795 119.7162 57.7974 38.9109 174.9764 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 8.35 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 3 A 7.76 4.37 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 4 R 8.84 3.70 0.00 1.93 1.94 0.00 3.20 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 5 N 8.07 5.11 0.00 2.72 2.86 0.00 0.00 6.65 7.57 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 6 S 7.95 4.75 0.00 4.17 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 7 V 7.94 3.76 2.11 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 1.00 0.00 0.00 0.96 0.00 0.00 8 L 7.59 4.78 0.00 1.63 1.52 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 9 R 8.34 4.49 0.00 2.03 2.10 0.00 2.96 0.00 0.00 3.33 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 10 G 8.50 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 7.93 4.12 0.00 1.83 1.80 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.52 7.81 12 K 8.04 3.96 0.00 2.06 1.83 0.00 1.78 0.00 0.00 1.89 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.50 7.81 13 A 8.39 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 14 D 7.76 4.25 0.00 2.93 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 15 E 8.25 3.95 0.00 2.18 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 2.38 2.37 0.00 16 L 7.54 3.91 0.00 1.67 1.89 1.05 0.70 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 17 E 8.02 4.31 0.00 2.02 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 2.37 2.39 0.00 18 R 7.64 4.10 0.00 2.00 1.99 0.00 3.35 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 19 I 7.54 3.79 1.95 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 1.29 1.17 1.02 0.00 0.00 20 R 8.38 4.77 0.00 2.05 1.97 0.00 3.20 0.00 0.00 3.41 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 21 L 8.64 3.53 0.00 1.44 1.41 0.72 -0.49 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 22 R 7.38 4.78 0.00 1.68 1.75 0.00 3.16 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 23 P 0.00 4.88 0.00 2.18 2.29 0.00 3.31 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.93 0.00 24 G 8.12 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.80 4.14 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 0.00 26 K 8.41 4.58 0.00 1.68 1.76 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.35 7.81 27 K 7.80 4.68 0.00 1.60 1.62 0.00 1.56 0.00 0.00 1.78 0.00 0.00 2.83 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.39 7.81 28 K 8.28 5.05 0.00 1.62 1.85 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.69 1.44 7.81 29 Y 8.39 4.19 0.00 3.05 2.91 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 R 8.78 4.80 0.00 1.87 1.78 0.00 3.17 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 31 L 8.79 3.94 0.00 1.78 1.73 0.95 0.67 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 32 K 8.21 3.87 0.00 1.69 1.81 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.47 7.81 33 H 8.34 4.40 0.00 3.61 3.58 0.00 5.81 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 8.11 3.98 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.88 0.96 0.00 0.00 35 V 7.87 3.60 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 1.17 0.00 0.00 1.04 0.00 0.00 36 W 8.21 4.33 0.00 3.45 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 37 A 8.13 3.91 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 38 A 8.18 3.96 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 39 N 8.56 4.19 0.00 2.81 2.76 0.00 0.00 7.08 6.40 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 40 K 7.60 3.43 0.00 1.54 1.72 0.00 1.52 0.00 0.00 1.04 0.00 0.00 2.64 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.21 7.81 41 L 7.92 4.13 0.00 1.94 1.88 0.98 0.91 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 42 D 7.80 4.90 0.00 2.62 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 43 R 7.74 3.89 0.00 1.81 1.55 0.00 2.99 0.00 0.00 2.99 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 44 F 8.04 4.48 0.00 3.29 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 45 G 7.81 3.78 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 0.00 0.00 0.00 46 L 7.50 4.36 0.00 1.77 1.62 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.29 4.71 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 48 E 8.45 4.58 0.00 2.13 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 0.00 2.25 2.29 0.00 49 S 7.94 4.38 0.00 3.91 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 50 L 7.76 4.36 0.00 1.67 1.74 0.94 1.00 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 51 L 7.52 4.43 0.00 1.80 1.76 0.96 1.36 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 52 E 8.01 4.11 0.00 1.88 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 2.35 2.42 0.00 53 S 7.69 4.53 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 54 K 8.39 3.93 0.00 1.34 1.69 0.00 1.25 0.00 0.00 1.49 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.46 7.81 55 E 8.23 4.26 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.36 0.00 56 G 8.28 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 57 C 8.08 4.33 0.00 3.44 3.33 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 58 Q 8.34 3.91 0.00 2.46 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.80 0.00 0.00 0.00 0.00 0.00 2.21 2.55 0.00 59 K 8.02 4.14 0.00 2.05 1.86 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.64 7.81 60 I 7.57 3.72 2.02 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 1.67 1.27 0.96 0.00 0.00 61 L 8.15 4.30 0.00 1.63 1.74 0.63 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 62 T 7.65 3.96 4.40 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 1.25 0.00 0.00 63 V 7.11 3.71 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 0.79 0.00 0.00 0.98 0.00 0.00 64 L 7.81 4.05 0.00 1.96 1.73 1.08 1.09 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 65 D 8.13 3.91 0.00 2.79 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 4.35 0.00 2.11 2.11 0.00 3.64 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 2.05 1.93 0.00 67 M 7.23 4.15 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 68 V 7.31 3.36 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 0.73 0.00 0.00 -0.05 0.00 0.00 69 P 0.00 4.36 0.00 2.17 2.11 0.00 3.61 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.90 0.00 70 T 7.58 4.60 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 1.18 0.00 0.00 71 G 7.88 4.39 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 0.00 72 S 8.63 4.34 0.00 4.06 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 73 E 8.86 4.00 0.00 2.05 2.11 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 2.44 2.38 0.00 74 N 8.11 4.60 0.00 3.05 3.14 0.00 0.00 6.75 6.73 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 75 L 8.18 4.46 0.00 1.69 1.85 0.69 0.45 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 76 K 8.22 4.23 0.00 2.08 1.94 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.53 1.50 7.81 77 S 8.21 4.92 0.00 4.06 3.85 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 78 L 8.11 4.46 0.00 2.11 2.00 0.94 0.95 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 79 F 7.99 4.45 0.00 3.21 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 80 N 8.46 4.14 0.00 3.01 3.32 0.00 0.00 7.25 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 81 T 7.79 3.86 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 82 V 7.36 3.59 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 1.11 0.00 0.00 1.03 0.00 0.00 83 C 7.73 3.86 0.00 2.87 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 84 V 7.24 3.53 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 0.58 0.00 0.00 0.76 0.00 0.00 85 I 7.59 3.57 2.01 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.36 0.91 0.00 0.00 86 W 8.54 4.07 0.00 3.38 3.14 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 87 C 8.20 4.22 0.00 3.28 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 88 I 7.46 3.60 1.79 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 1.43 0.54 0.80 0.00 0.00 89 H 7.75 4.37 0.00 3.00 3.10 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 A 7.51 3.67 -0.02 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 91 E 7.48 3.53 0.00 2.10 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 2.22 2.33 0.00 92 E 8.14 4.56 0.00 2.07 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 2.23 2.49 0.00 93 K 8.62 4.15 0.00 1.71 1.73 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.40 7.81 94 V 8.04 4.54 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 0.83 0.00 0.00 0.93 0.00 0.00 95 K 8.85 4.15 0.00 1.88 1.86 0.00 1.54 0.00 0.00 1.88 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.50 7.81 96 D 7.45 5.34 0.00 2.87 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 T 8.79 3.89 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 1.26 0.00 0.00 98 E 8.50 4.07 0.00 2.20 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 0.00 2.44 2.37 0.00 99 G 8.75 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 0.00 100 A 8.02 4.10 1.36 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 0.00 0.00 101 K 8.22 3.84 0.00 1.84 1.91 0.00 1.70 0.00 0.00 1.61 0.00 0.00 3.13 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.32 7.81 102 Q 7.78 3.97 0.00 2.08 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 103 I 7.40 3.75 2.10 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.88 1.09 0.00 0.00 104 V 7.60 3.33 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 0.54 0.00 0.00 0.83 0.00 0.00 105 R 8.35 3.84 0.00 1.92 1.93 0.00 3.17 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 1.63 1.68 0.00 106 R 7.95 3.90 0.00 2.02 1.89 0.00 3.31 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 107 H 7.93 4.30 0.00 3.22 3.32 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 7.57 4.16 0.00 1.74 1.66 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.22 3.52 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 0.94 0.00 0.00 110 A 7.67 3.98 1.36 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 0.00 0.00 111 E 7.94 4.19 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 112 T 8.22 4.01 4.32 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 1.20 0.00 0.00 113 G 7.98 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 0.00 0.00 0.00 114 T 7.72 4.36 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 0.00 115 A 7.97 4.21 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 0.00 116 E 8.41 4.69 0.00 2.08 1.90 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 2.19 2.33 0.00 117 K 8.30 3.86 0.00 1.89 1.85 0.00 1.91 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.47 7.81 118 M 7.36 3.20 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.45 0.00 119 P 0.00 4.52 0.00 2.17 2.10 0.00 3.76 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 1.98 1.98 0.00 120 S 8.19 4.32 0.00 3.88 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 0.00 121 T 8.25 3.95 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 0.00 122 S 8.09 4.44 0.00 3.78 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 0.00 123 R 8.49 4.12 0.00 1.82 1.84 0.00 3.31 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 124 P 0.00 4.35 0.00 2.17 2.08 0.00 3.75 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 1.98 1.95 0.00 125 T 8.14 4.27 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 1.27 0.00 0.00 126 A 7.85 4.08 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 0.00 127 P 0.00 4.48 0.00 2.19 2.07 0.00 3.76 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 1.98 1.95 0.00 128 S 8.27 4.42 0.00 3.85 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 0.00 129 S 7.74 4.54 0.00 3.81 3.65 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 0.00 130 E 7.82 4.76 0.00 2.05 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 2.05 2.18 0.00 131 K 8.25 4.71 0.00 1.72 1.74 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.39 7.81 132 G 7.93 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 0.00 133 G 8.06 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 0.00 134 N 7.63 5.02 0.00 2.64 2.71 0.00 0.00 7.33 7.58 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 0.00 135 Y 8.58 4.12 0.00 2.90 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