NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4274 8.3049 120.3501 54.8703 33.4327 175.1389 2 L 4.0248 8.2501 124.4569 53.8505 42.5191 175.7309 3 K 4.1929 8.7032 121.9341 56.8200 34.1945 175.1351 4 Q 4.9169 8.7122 125.3217 54.8375 30.5057 174.7596 5 V 4.7581 8.9226 125.5766 61.1946 35.6115 173.5841 6 E 4.8527 9.1480 126.1525 54.6289 31.9850 174.9630 7 I 4.9916 8.1044 124.6635 59.3842 40.9797 174.4144 8 F 5.3756 9.3122 125.4437 55.8827 41.9210 174.5329 9 T 5.3104 8.8639 112.4641 60.5116 72.0967 172.6430 10 D 4.8695 9.4160 121.8356 53.1540 45.1995 174.0358 11 G 4.6365 8.7526 110.4748 44.6987 0.0000 172.0924 12 S 4.8832 8.9497 115.9896 56.8552 66.3485 172.3480 13 C 5.0346 8.4895 125.2304 57.9164 34.4839 173.1061 14 L 4.4727 8.7195 125.6563 53.9339 41.2684 176.2865 15 G 3.9516 7.3076 106.9658 45.9837 0.0000 174.0641 16 N 4.9946 8.2760 116.8264 51.7597 39.2896 172.0323 17 P 4.5491 0.0000 0.0000 61.2485 33.6843 175.3242 18 G 3.9507 8.3472 106.7519 45.4457 0.0000 170.2412 19 P 5.0360 0.0000 0.0000 62.4599 32.3993 176.4670 20 G 4.4492 9.1572 110.5942 45.4694 0.0000 171.0100 21 G 4.6944 9.3278 105.3325 45.4613 0.0000 172.1007 22 Y 5.5317 8.2232 118.4874 55.1012 41.7134 174.8085 23 G 4.5605 9.2953 106.5184 45.0120 0.0000 171.5402 24 A 5.5185 9.1304 124.1930 50.6150 23.5283 175.0428 25 I 5.1430 9.3790 120.0679 59.5870 41.7109 174.1321 26 L 5.1140 9.4204 129.4450 53.4154 44.2680 174.7153 27 R 5.1852 9.6231 127.9308 54.8182 32.4810 174.2012 28 Y 4.8151 9.1235 127.3012 56.0576 41.7144 175.0537 29 R 3.5544 9.2277 128.4275 57.2059 27.4721 175.8599 30 G 4.3269 8.1372 108.4487 45.7192 0.0000 173.8028 31 R 4.4301 7.3139 117.4789 55.8379 31.3607 175.9415 32 E 5.3218 8.5896 118.5123 54.7993 33.0672 174.5131 33 K 4.6695 9.5465 120.8830 55.0746 35.4188 175.3917 34 T 5.1593 8.1202 119.2911 62.2100 71.5759 173.8597 35 F 4.9365 8.6033 121.0894 56.4841 43.7265 173.5918 36 S 4.6987 8.8060 114.3686 58.5364 65.4067 173.8687 37 A 4.1969 7.0222 123.5767 50.9490 22.4234 175.2532 38 G 4.3407 8.1759 107.9430 44.5676 0.0000 171.7401 39 Y 5.2679 9.0386 120.4869 55.9996 41.2763 177.0023 40 T 3.8413 8.9798 113.7618 64.4070 70.1246 173.6452 41 R 4.6657 7.9873 123.1587 54.5277 31.9871 173.4412 42 T 4.2313 8.9990 121.2258 60.8352 71.6255 171.7343 43 T 4.6964 7.8967 110.0490 59.2734 72.0377 174.6347 44 N 4.2470 8.7753 120.4306 56.9667 38.9355 176.6098 45 N 4.1743 7.9257 117.1841 56.5479 38.5400 177.2036 46 R 3.8697 7.7740 119.0647 59.6991 30.1815 179.1023 47 M 4.0431 7.9995 117.9512 58.2264 32.1097 178.4892 48 A 4.0864 8.2489 121.0966 55.2842 18.5001 179.7587 49 L 3.8504 7.9194 117.2716 58.0129 41.6510 179.1449 50 M 3.6572 8.0976 118.1972 58.5766 32.0949 177.7005 51 A 3.7232 7.8251 120.3256 55.3341 18.5865 179.2966 52 A 3.9028 7.5206 117.3732 55.3777 18.4346 179.8317 53 I 3.4947 7.7133 118.1393 64.4563 36.9877 178.6220 54 V 3.3298 7.7425 117.5010 65.9849 31.6626 177.5048 55 A 3.3588 7.4611 119.9496 54.8845 18.3199 179.5508 56 L 3.7727 7.5555 117.2137 58.0369 41.5614 179.6026 57 E 4.0781 8.0176 116.1316 58.4742 29.3800 178.7853 58 A 4.1084 7.2861 120.1953 53.5664 18.7248 178.1624 59 L 3.9618 7.1857 117.3806 55.3126 42.0178 177.1537 60 K 4.4722 8.3955 121.5552 55.7264 32.4372 175.7284 61 E 4.6102 7.5446 114.6247 55.0057 31.7089 174.6474 62 H 4.3913 8.5346 117.5964 57.2552 29.5032 174.2031 63 C 4.9514 8.7741 118.4356 58.2803 33.6868 171.9240 64 E 4.8516 9.0329 121.0156 54.8520 30.9471 174.5394 65 V 4.5699 8.8181 128.0653 61.2491 34.1947 174.6795 66 I 4.2936 8.3877 129.7328 59.9568 37.6302 173.9027 67 L 4.3574 8.0510 130.2525 53.8164 43.2875 175.0219 68 S 5.4627 8.6711 122.4193 56.0793 64.5098 172.6881 69 T 5.4976 8.6634 120.8179 60.6973 70.9653 173.4976 70 D 5.0041 8.9445 123.1705 53.1087 41.1402 176.8948 71 S 4.2715 8.1681 116.3561 58.5935 63.2604 174.2939 72 Q 3.9682 8.8280 130.1966 58.9910 28.9374 177.2081 73 Y 4.2584 8.0772 120.5452 60.6617 38.9528 178.0327 74 V 3.7323 8.0029 119.1663 66.0326 31.6316 177.9700 75 R 2.7530 7.7634 118.4513 58.9604 29.4962 178.1405 76 Q 3.5342 7.9829 118.5793 59.0037 29.2231 178.3535 77 G 3.2168 7.9832 106.6497 47.5097 0.0000 175.8120 78 I 3.6651 7.5362 122.5173 64.2098 36.9632 178.0790 79 T 4.1246 7.1974 106.6600 62.2706 68.4999 174.2028 80 Q 3.8069 7.0287 118.9168 56.3667 31.4074 176.7345 81 W 4.1405 6.5690 114.6502 55.9274 30.7197 177.3760 82 I 3.6149 7.0990 119.6874 64.6433 37.2327 176.6758 83 H 3.9678 7.9496 118.0023 59.5271 29.7937 176.7320 84 N 4.2399 7.9159 117.5537 55.8489 38.3219 177.4609 85 W 4.0678 7.8132 120.6235 59.6664 28.9256 178.3963 86 K 2.9917 6.8094 117.5515 58.9522 31.5967 178.1100 87 A 4.1742 7.3970 119.2423 53.4273 18.6141 178.5623 88 R 4.5525 7.5184 116.5124 55.2879 30.9908 176.5779 89 G 4.1617 8.4783 104.7443 46.7183 0.0000 174.0614 90 W 3.4901 7.9487 115.9058 57.3276 27.4103 174.4707 91 K 4.7103 7.6021 115.1176 54.5877 35.1485 176.6472 92 T 4.3209 8.5195 111.1371 60.5163 70.6726 175.2767 93 A 4.0334 8.5249 123.3583 54.8757 18.3783 177.8385 94 D 4.8198 7.9057 113.9816 53.1559 39.9012 176.3081 95 K 3.8828 7.7496 115.6713 58.3770 30.4168 175.5353 96 K 4.6381 7.5577 116.4582 53.5353 34.5023 174.1454 97 P 4.5528 0.0000 0.0000 63.2346 31.7409 176.8387 98 V 3.7271 8.1334 117.7895 60.6345 32.7743 175.6691 99 K 3.8946 8.6451 124.6782 57.8392 32.9469 175.7903 100 N 4.5663 9.3452 121.4776 52.5332 36.6201 176.8280 101 V 3.6678 7.5914 120.1050 64.9900 30.7775 176.8622 102 D 4.1989 7.9952 119.0937 56.5277 39.0597 178.6010 103 L 4.0027 7.7264 120.0981 56.6861 41.6653 179.2917 104 W 4.2842 8.1411 119.0824 59.8997 29.0089 178.6007 105 Q 2.9395 7.9275 118.2803 58.4808 27.9942 178.8399 106 R 3.8078 7.5284 119.7797 59.1259 30.1241 178.3674 107 L 3.9411 8.2198 120.5262 58.2319 42.1516 178.2949 108 D 4.6301 8.7354 118.1626 57.5968 40.9591 178.2035 109 A 4.0603 7.9656 120.0283 55.0077 18.6347 179.2343 110 A 4.0919 7.9891 119.3177 55.1372 18.4485 179.7164 111 L 4.0577 8.6482 118.0624 58.0699 41.6343 179.9696 112 G 3.8125 8.1145 103.4853 47.1993 0.0000 174.8423 113 Q 4.2519 7.7594 118.8457 57.3597 29.0536 174.5466 114 H 4.9457 7.9627 115.6141 54.3870 33.9779 173.0623 115 Q 4.3480 9.3021 118.8489 55.2271 28.9918 175.4464 116 I 4.2857 8.0903 125.2292 60.0972 38.9124 176.0325 117 K 4.3050 8.5325 127.1285 54.3763 34.6707 175.1566 118 W 4.3347 8.5580 127.5337 56.4559 30.3491 176.5831 119 E 4.2074 8.7348 124.4305 53.8167 31.0953 173.1305 120 W 4.8510 7.9236 125.5988 56.9591 30.4277 174.1126 121 V 3.9673 8.3249 127.7953 62.6280 29.7048 175.0900 122 K 4.6007 9.0017 123.6978 55.9598 34.4960 178.0088 123 G 3.8537 8.1868 107.5968 45.3770 0.0000 174.3829 124 H 3.8377 8.1269 116.3345 57.0013 26.9230 175.7892 125 A 4.2527 8.6889 127.8434 54.1384 18.0849 179.1014 126 G 3.7368 8.0995 106.0713 47.7848 0.0000 174.1726 127 H 4.7274 7.8278 117.2148 52.1402 29.5806 172.1161 128 P 4.2971 0.0000 0.0000 64.7909 31.2556 177.6189 129 E 3.7128 7.6060 117.5564 59.1113 29.1843 178.6715 130 N 4.4551 8.0664 116.6307 56.3305 38.6406 177.1259 131 E 3.9510 8.0747 120.2591 59.2615 29.8507 178.5822 132 R 3.9213 8.2374 119.0019 59.6400 30.0092 178.3417 133 C 4.2571 8.4935 117.1377 62.6426 28.0966 175.4243 134 D 5.0235 7.9840 121.1262 56.8458 40.7044 178.1549 135 E 3.9616 8.2044 118.9963 59.5694 29.6194 179.2958 136 L 3.9515 7.9377 118.6562 57.8111 41.6461 179.5865 137 A 4.0808 8.2869 120.7852 55.3281 18.1384 179.9611 138 R 3.9676 8.0506 115.3079 58.9702 30.5086 178.8323 139 A 4.1021 8.3443 120.9640 55.0396 18.4046 179.5382 140 A 3.8795 7.9646 118.9896 55.1651 18.2108 179.6698 141 A 4.2039 7.6940 117.7111 54.8984 18.5138 178.9853 142 M 4.2608 7.6354 115.5558 56.2082 33.2912 175.7354 143 N 4.9870 7.8303 117.2417 51.3941 39.2029 173.1108 144 P 4.2527 0.0000 0.0000 63.5215 31.9134 176.4580 145 T 4.4413 8.3063 111.3085 60.8717 70.2435 172.9616 146 L 4.7703 7.5336 121.4698 52.8889 45.4236 174.4589 147 E 5.0310 8.5080 119.7317 54.7441 32.0506 175.9724 148 D 4.7349 8.5315 126.2634 52.5139 39.6617 176.6475 149 T 4.0303 8.1337 111.8713 63.4342 69.0765 175.9756 150 G 3.8161 7.7237 108.9504 45.2459 0.0000 173.1837 151 Y 4.1289 8.1817 121.6538 57.2900 38.0781 175.5256 152 Q 3.9307 8.1594 129.4523 55.6968 27.3882 175.7060 153 V 3.1218 7.5937 116.8003 61.0819 32.1895 175.3249 154 E 4.5682 7.8767 119.8438 54.7962 32.8326 175.9142 155 V 3.6427 8.3210 117.1173 63.4946 32.4545 171.3993 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 8.30 4.43 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.64 0.00 2 L 8.25 4.02 0.00 1.75 1.58 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 3 K 8.70 4.19 0.00 1.61 1.64 0.00 1.41 0.00 0.00 1.32 0.00 0.00 2.78 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.56 1.41 7.81 4 Q 8.71 4.92 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.50 0.00 5 V 8.92 4.76 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.85 0.00 0.00 6 E 9.15 4.85 0.00 1.99 1.65 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 2.14 2.26 0.00 7 I 8.10 4.99 1.63 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 1.17 0.65 0.82 0.00 0.00 8 F 9.31 5.38 0.00 2.99 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 9 T 8.86 5.31 4.33 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 1.27 0.00 0.00 10 D 9.42 4.87 0.00 2.84 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.75 4.64 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 12 S 8.95 4.88 0.00 3.92 3.68 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 13 C 8.49 5.03 0.00 2.97 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 14 L 8.72 4.47 0.00 1.63 1.65 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 15 G 7.31 3.95 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 0.00 0.00 0.00 16 N 8.28 4.99 0.00 2.64 2.67 0.00 0.00 6.93 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 17 P 0.00 4.55 0.00 1.87 1.77 0.00 3.97 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 2.01 2.15 0.00 18 G 8.35 3.95 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 0.00 0.00 0.00 19 P 0.00 5.04 0.00 2.08 2.00 0.00 3.83 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.05 0.00 20 G 9.16 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 9.33 4.69 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 22 Y 8.22 5.53 0.00 3.12 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 9.30 4.56 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 0.00 0.00 0.00 24 A 9.13 5.52 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 25 I 9.38 5.14 2.12 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 1.21 0.96 1.13 0.00 0.00 26 L 9.42 5.11 0.00 1.89 1.77 1.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 27 R 9.62 5.19 0.00 2.05 1.88 0.00 3.33 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.80 0.00 28 Y 9.12 4.82 0.00 2.93 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 29 R 9.23 3.55 0.00 1.45 1.65 0.00 3.06 0.00 0.00 2.91 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.50 0.00 30 G 8.14 4.33 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 0.00 31 R 7.31 4.43 0.00 1.99 1.89 0.00 3.10 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 32 E 8.59 5.32 0.00 2.06 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.34 0.00 33 K 9.55 4.67 0.00 1.77 1.48 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.32 1.42 7.81 34 T 8.12 5.16 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 1.27 0.00 0.00 35 F 8.60 4.94 0.00 3.05 3.11 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 36 S 8.81 4.70 0.00 3.81 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.02 4.20 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 8.18 4.34 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 0.00 39 Y 9.04 5.27 0.00 2.91 2.89 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 40 T 8.98 3.84 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 1.26 0.00 0.00 41 R 7.99 4.67 0.00 1.80 1.91 0.00 3.25 0.00 0.00 3.18 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 42 T 9.00 4.23 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 1.21 0.00 0.00 43 T 7.90 4.70 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 0.98 0.00 0.00 44 N 8.78 4.25 0.00 2.83 2.82 0.00 0.00 6.91 6.71 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 45 N 7.93 4.17 0.00 2.42 1.89 0.00 0.00 7.11 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 R 7.77 3.87 0.00 1.76 1.87 0.00 3.42 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 1.67 1.66 0.00 47 M 8.00 4.04 0.00 2.32 2.27 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.84 0.00 48 A 8.25 4.09 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.92 3.85 0.00 1.68 1.41 0.17 -0.72 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 50 M 8.10 3.66 0.00 1.81 2.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.53 0.00 51 A 7.83 3.72 1.52 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 0.00 0.00 52 A 7.52 3.90 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.71 3.49 1.83 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.55 0.79 0.00 0.00 54 V 7.74 3.33 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 0.69 0.00 0.00 0.59 0.00 0.00 55 A 7.46 3.36 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 7.56 3.77 0.00 1.85 1.67 0.86 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.02 4.08 0.00 1.83 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 58 A 7.29 4.11 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 59 L 7.19 3.96 0.00 1.76 1.57 0.58 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.40 4.47 0.00 1.70 1.79 0.00 1.87 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.34 7.81 61 E 7.54 4.61 0.00 1.97 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.22 0.00 62 H 8.53 4.39 0.00 3.03 3.29 0.00 5.84 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 C 8.77 4.95 0.00 2.70 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 64 E 9.03 4.85 0.00 1.99 1.77 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 2.14 2.18 0.00 65 V 8.82 4.57 1.80 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 0.71 0.00 0.00 0.69 0.00 0.00 66 I 8.39 4.29 1.63 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.91 0.72 0.00 0.00 67 L 8.05 4.36 0.00 0.82 0.58 0.11 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.67 5.46 0.00 3.60 3.41 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 69 T 8.66 5.50 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 70 D 8.94 5.00 0.00 2.91 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 71 S 8.17 4.27 0.00 4.08 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 72 Q 8.83 3.97 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.68 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 73 Y 8.08 4.26 0.00 3.15 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 74 V 8.00 3.73 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 1.12 0.00 0.00 1.05 0.00 0.00 75 R 7.76 2.75 0.00 0.74 1.36 0.00 2.30 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.50 0.00 76 Q 7.98 3.53 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.74 0.00 0.00 0.00 0.00 0.00 1.83 2.02 0.00 77 G 7.98 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 0.00 0.00 0.00 78 I 7.54 3.67 1.43 0.00 0.00 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 1.84 0.22 0.57 0.00 0.00 79 T 7.20 4.12 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 0.91 0.00 0.00 80 Q 7.03 3.81 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 6.79 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 81 W 6.57 4.14 0.00 1.78 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 82 I 7.10 3.61 1.91 0.00 0.00 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 1.72 1.97 1.00 0.00 0.00 83 H 7.95 3.97 0.00 3.21 3.15 0.00 5.93 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 7.92 4.24 0.00 2.54 2.75 0.00 0.00 6.97 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 85 W 7.81 4.07 0.00 3.03 2.17 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 86 K 6.81 2.99 0.00 1.40 1.74 0.00 2.17 0.00 0.00 1.76 0.00 0.00 3.15 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.69 7.81 87 A 7.40 4.17 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 R 7.52 4.55 0.00 2.06 1.89 0.00 3.27 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 89 G 8.48 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 90 W 7.95 3.49 0.00 3.52 3.23 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 91 K 7.60 4.71 0.00 1.79 1.68 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.58 7.81 92 T 8.52 4.32 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 1.21 0.00 0.00 93 A 8.52 4.03 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 7.91 4.82 0.00 2.77 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 95 K 7.75 3.88 0.00 1.96 1.93 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.53 7.81 96 K 7.56 4.64 0.00 1.81 1.66 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.70 7.81 97 P 0.00 4.55 0.00 1.90 1.99 0.00 3.66 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 2.01 2.13 0.00 98 V 8.13 3.73 1.48 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 0.56 0.00 0.00 0.52 0.00 0.00 99 K 8.65 3.89 0.00 1.80 1.83 0.00 2.16 0.00 0.00 1.80 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.56 7.81 100 N 9.35 4.57 0.00 3.23 2.90 0.00 0.00 7.35 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 0.00 101 V 7.59 3.67 2.18 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 0.83 0.00 0.00 0.85 0.00 0.00 102 D 8.00 4.20 0.00 2.82 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 0.00 103 L 7.73 4.00 0.00 1.47 1.51 0.80 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 104 W 8.14 4.28 0.00 3.37 3.51 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 0.00 105 Q 7.93 2.94 0.00 1.60 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.59 0.00 106 R 7.53 3.81 0.00 1.93 1.96 0.00 3.03 0.00 0.00 3.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.57 0.00 107 L 8.22 3.94 0.00 1.83 1.97 1.04 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 108 D 8.74 4.63 0.00 3.31 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.97 4.06 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 A 7.99 4.09 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 0.00 111 L 8.65 4.06 0.00 2.00 1.89 1.39 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.11 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 7.76 4.25 0.00 2.02 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.61 0.00 0.00 0.00 0.00 0.00 2.49 2.48 0.00 114 H 7.96 4.95 0.00 2.90 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 Q 9.30 4.35 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 116 I 8.09 4.29 1.77 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.68 -0.09 0.00 0.00 117 K 8.53 4.31 0.00 1.65 1.58 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.20 1.31 7.81 118 W 8.56 4.33 0.00 2.62 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 0.00 119 E 8.73 4.21 0.00 1.76 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 2.16 2.21 0.00 120 W 7.92 4.85 0.00 3.43 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 0.00 121 V 8.32 3.97 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.14 0.00 0.00 122 K 9.00 4.60 0.00 1.88 1.96 0.00 1.70 0.00 0.00 1.82 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.68 1.39 7.81 123 G 8.19 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 0.00 0.00 0.00 124 H 8.13 3.84 0.00 3.33 3.15 0.00 5.73 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.69 4.25 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 G 8.10 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 0.00 127 H 7.83 4.73 0.00 3.34 3.19 0.00 5.65 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 P 0.00 4.30 0.00 2.07 2.07 0.00 3.51 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 2.07 2.16 0.00 129 E 7.61 3.71 0.00 1.16 1.12 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 1.70 2.10 0.00 130 N 8.07 4.46 0.00 2.90 2.98 0.00 0.00 6.63 6.95 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 0.00 131 E 8.07 3.95 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 132 R 8.24 3.92 0.00 2.08 2.05 0.00 3.17 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 133 C 8.49 4.26 0.00 3.31 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 0.00 134 D 7.98 5.02 0.00 2.93 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 0.00 135 E 8.20 3.96 0.00 2.30 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 136 L 7.94 3.95 0.00 1.89 1.74 0.98 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 0.00 137 A 8.29 4.08 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 R 8.05 3.97 0.00 1.81 2.01 0.00 3.24 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.93 0.00 139 A 8.34 4.10 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 0.00 140 A 7.96 3.88 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 0.00 141 A 7.69 4.20 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 0.00 142 M 7.64 4.26 0.00 2.02 2.28 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.87 0.00 143 N 7.83 4.99 0.00 2.60 2.63 0.00 0.00 7.17 7.32 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 0.00 144 P 0.00 4.25 0.00 2.24 2.15 0.00 3.80 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 145 T 8.31 4.44 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 1.18 0.00 0.00 146 L 7.53 4.77 0.00 1.12 1.37 0.75 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.51 5.03 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 2.27 2.33 0.00 148 D 8.53 4.73 0.00 2.57 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 0.00 149 T 8.13 4.03 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 1.27 0.00 0.00 150 G 7.72 3.82 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 0.00 0.00 0.00 151 Y 8.18 4.13 0.00 3.02 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 0.00 152 Q 8.16 3.93 0.00 1.89 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.67 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 153 V 7.59 3.12 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 0.88 0.00 0.00 0.84 0.00 0.00 154 E 7.88 4.57 0.00 2.01 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 2.19 2.32 0.00 155 V 8.32 3.64 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 0.75 0.00 0.00 0.96 0.00 0.00