NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.8082 8.4449 117.8366 56.2582 29.9805 172.8962 1D H 4.5534 8.8037 119.5290 55.6957 29.6069 172.7961 1E H 5.0713 7.5676 115.5476 53.6641 33.5953 171.9841 1F H 4.6697 8.8746 116.9566 55.8485 29.0713 174.3557 1G F 4.9238 8.3630 119.3910 57.8818 39.8345 173.9744 2 N 4.6384 8.5347 117.0847 52.3789 39.1887 174.4833 3 L 4.8071 8.0690 123.1293 51.9822 44.1461 174.6386 4 P 4.6263 0.0000 0.0000 61.6021 33.1308 175.8328 5 P 4.5654 0.0000 0.0000 61.2240 30.5589 176.1631 6 G 3.8797 8.7402 111.3179 44.5786 0.0000 171.3501 7 N 4.3668 7.9431 114.3804 51.7641 40.0564 174.1657 8 Y 4.8559 8.0178 116.0506 58.1930 38.5404 176.9302 9 K 4.1315 8.6880 122.4472 58.7506 32.1976 177.1633 10 K 4.7178 7.5965 115.0563 53.2422 35.5716 173.6243 11 P 4.7419 0.0000 0.0000 63.1740 32.3981 175.1176 12 K 4.8860 9.4682 119.1076 55.2038 37.4777 175.0078 13 L 5.0673 9.0101 121.4067 53.3456 44.3668 176.2281 14 L 5.0637 8.6082 122.9290 53.4864 43.3032 174.4506 15 Y 4.9059 9.2637 126.9734 56.7332 40.4853 173.5524 16 C 4.2874 8.7059 128.2056 56.7657 32.5693 174.5392 17 S 3.9960 8.3048 120.9773 60.0799 63.0043 174.7679 18 N 4.1288 7.6844 119.8305 56.0462 38.7099 175.3230 19 G 3.8764 7.6783 104.2052 44.5496 0.0000 172.6838 20 G 3.3292 7.6722 107.2580 44.7755 0.0000 173.2440 21 H 4.8475 7.3830 114.5649 53.5586 32.4316 174.1614 22 F 5.2940 8.9218 120.3226 56.2036 40.4984 175.2213 23 L 4.5208 9.0004 125.6756 55.2631 43.3238 175.6003 24 R 4.9621 9.2807 126.1601 54.6072 33.5745 173.8318 25 I 4.6674 8.2298 126.9866 59.4058 38.7321 175.7812 26 L 4.0917 8.7733 128.0562 53.4696 42.2806 176.7942 27 P 4.1521 0.0000 0.0000 65.8478 31.2760 177.2352 28 D 4.5421 7.9641 114.4691 53.5615 39.6326 177.0488 29 G 4.1508 8.4153 110.0477 45.3580 0.0000 174.0954 30 T 4.2901 8.1659 117.3464 63.3759 69.0723 173.5589 31 V 4.8361 7.9798 124.1851 61.2570 34.5921 174.5078 32 D 4.5892 8.4670 124.7512 53.0125 42.6263 174.1072 33 G 4.5887 8.6632 104.7935 45.4173 0.0000 172.3448 34 T 4.9968 8.8737 114.5145 60.5748 71.1406 174.5894 35 R 4.2328 8.7998 123.9464 56.3883 30.9310 176.4804 36 D 4.6317 8.2389 119.4340 53.2043 40.0352 176.6018 37 R 3.6292 8.6640 127.7632 58.3394 30.2601 177.2212 38 S 4.4114 8.3345 110.8714 58.5353 63.6149 174.0329 39 D 4.3988 7.8098 121.8930 54.9369 41.2846 175.9849 40 Q 4.2888 8.5149 123.3020 57.0770 29.4235 175.9816 41 H 4.8640 9.3875 116.0964 55.4471 29.0087 175.4875 42 I 4.5390 7.0197 110.4907 59.9226 38.4788 175.4574 43 Q 4.2359 7.8306 122.0247 55.7356 29.6521 174.7337 44 L 5.2069 9.0451 124.7132 52.7847 45.5413 175.3227 45 Q 4.7558 9.2200 124.4224 54.5126 30.8731 174.4055 46 L 5.2673 8.6223 126.4259 53.6032 44.1323 176.0257 47 S 4.4109 8.4383 114.4938 56.7085 66.9394 172.5570 48 A 4.6488 8.0028 123.7003 51.0903 19.0536 177.0325 49 E 4.0733 8.7724 123.1469 58.2151 30.3634 176.7749 50 S 4.6671 7.3734 112.3238 56.2362 67.2273 173.2025 51 V 3.8103 8.2884 121.9473 64.5536 31.6246 176.4813 52 G 3.9682 9.2037 114.7867 45.3056 0.0000 171.8409 53 E 5.1787 8.3322 120.2520 54.5962 32.2728 175.6588 54 V 4.8831 9.1480 116.8059 59.9044 36.7143 174.0794 55 Y 5.5963 8.5308 119.4172 56.7549 41.1641 175.2755 56 I 4.5191 8.5028 121.7119 59.5962 40.5684 174.1591 57 K 4.7119 8.7130 128.9598 53.9795 35.3814 175.1230 58 S 4.5442 8.7937 122.9924 58.6687 62.6516 174.9682 59 T 3.9091 8.5943 118.3112 64.4620 68.8316 175.9400 60 E 4.0649 8.3586 122.6839 58.3366 29.8670 177.0087 61 T 4.3514 8.0639 106.2190 60.5725 70.3291 175.2870 62 G 3.8146 8.1795 109.8193 45.3561 0.0000 173.7097 63 Q 4.4241 7.5896 118.7935 55.9899 30.3545 174.5593 64 Y 4.6346 8.9636 120.0418 56.0246 40.3692 175.1496 65 L 4.4586 9.0303 126.3810 55.3909 43.4072 175.5905 66 A 5.1344 8.7029 126.0592 50.6937 23.2265 174.3242 67 M 5.3617 8.7297 119.7489 53.7877 34.6366 175.7757 68 D 5.2475 9.5367 126.7489 52.6854 41.0260 176.9041 69 T 4.0135 8.5670 112.7948 64.7991 67.2733 174.1193 70 D 4.7802 8.5281 118.8911 53.9445 41.2151 176.9640 71 G 3.3776 8.6202 108.0035 45.1086 0.0000 172.9533 72 L 4.7984 8.2429 120.3479 53.2428 43.3541 176.2743 73 L 5.0053 8.5523 123.5671 55.1566 42.6705 175.6859 74 Y 5.0236 9.0993 120.2157 55.8246 42.1383 173.6031 75 G 4.2808 8.9089 108.4983 45.2023 0.0000 173.1138 76 S 5.0849 9.0123 120.8518 56.7031 63.9993 175.3145 77 Q 4.3824 9.0582 125.8681 58.1359 28.9707 176.4003 78 T 4.6674 7.4875 106.1040 58.4813 71.7495 171.6033 79 P 3.4804 0.0000 0.0000 62.3065 32.0625 175.2372 80 N 4.9684 7.9385 118.1021 51.2560 40.3997 174.4871 81 E 4.0116 8.7150 116.3997 59.4239 29.6910 178.1173 82 E 4.1582 8.7745 117.5176 57.6842 29.7508 177.4938 83 C 4.9823 7.8672 115.0854 59.0564 29.0450 173.2708 84 L 4.7819 7.3624 121.1366 53.5925 43.1357 175.5684 85 F 5.2217 9.0209 121.5318 55.5798 43.3213 174.2496 86 L 4.8698 9.2160 123.0779 53.8916 42.7507 175.4100 87 E 4.5714 8.9135 126.7576 55.2159 30.2726 175.6284 88 R 4.8272 8.5780 125.2831 54.0185 34.8532 174.5924 89 L 4.7074 8.5999 123.8655 55.2648 43.0703 175.8424 90 E 4.7135 9.1983 125.0717 55.1913 33.3814 174.8997 91 E 3.9866 9.6581 123.3850 57.8633 27.3289 174.6276 92 N 4.4410 8.4589 110.4935 54.0855 36.5954 173.9330 93 H 4.7914 7.7484 117.7299 57.4036 37.8244 173.5210 94 Y 4.6927 8.1376 116.8288 57.3841 40.0242 173.9482 95 N 5.5495 9.4526 118.7291 52.0415 41.0071 174.6088 96 T 5.2787 8.7569 112.7901 60.1716 72.8929 172.7290 97 Y 4.9938 8.6341 118.9449 56.6526 41.6806 174.1536 98 I 4.5370 8.6050 126.1347 59.2490 39.4249 175.5215 99 S 3.9465 8.9482 122.4886 58.6481 62.4213 174.0835 100 K 3.9826 8.7261 129.2551 59.3316 32.3328 178.6313 101 K 3.8095 7.9591 117.9627 58.9909 32.2104 177.4532 102 H 4.8434 8.1142 116.5500 54.5685 29.9817 176.7099 103 A 3.9735 7.6609 125.9073 55.1023 18.0436 179.9442 104 E 3.6273 7.9236 114.7513 58.4548 29.9251 178.1838 105 K 4.2353 7.5532 117.1800 55.4065 32.7518 175.7658 106 N 3.9751 7.5614 115.6076 54.0017 36.4780 174.5676 107 W 5.1810 7.7204 117.4792 55.8025 31.0701 177.2186 108 F 5.4605 9.2858 123.8046 55.3984 41.6228 175.4764 109 V 3.9877 9.0312 121.6214 63.0507 32.4843 175.2212 110 G 4.4927 8.6395 112.7352 45.2745 0.0000 171.4718 111 L 5.3217 8.4122 121.7507 52.5514 45.1241 176.6799 112 N 4.6286 9.1700 121.0179 52.3776 39.3840 176.4565 113 K 3.8915 8.4627 118.9227 59.3772 32.1029 177.8991 114 N 4.5962 8.0905 113.8157 52.6049 37.6107 175.9121 115 G 3.5322 8.2044 108.6936 45.2294 0.0000 173.8842 116 S 4.5900 8.1006 115.2270 57.5005 64.1522 173.4798 117 C 4.7577 8.2814 117.2572 58.2008 30.5096 173.0618 118 K 4.3810 8.7378 120.8444 55.6371 33.0430 176.8178 119 R 4.0254 8.4709 123.8618 55.9802 31.2185 177.0795 120 G 3.2669 8.5422 116.2529 48.2076 0.0000 174.1399 121 P 4.2545 0.0000 0.0000 64.5810 31.3508 177.5076 122 R 4.2552 7.9168 115.6786 56.6654 30.3980 176.3948 123 T 5.1000 7.5242 108.1638 59.9669 70.7226 173.3939 124 H 4.7696 7.9399 115.1679 54.9699 30.5236 173.0636 125 Y 3.9817 8.8191 118.2766 60.0255 38.0753 177.2975 126 G 4.0372 9.0316 111.3028 45.4052 0.0000 173.9203 127 Q 4.2378 7.3483 118.7798 55.1371 29.8142 177.1706 128 K 3.8181 8.2967 119.0356 58.7825 32.8002 179.4781 129 A 3.9582 8.0532 121.2323 53.9489 18.3303 178.4553 130 I 4.3924 7.1583 105.8858 60.4059 38.1002 175.2362 131 L 4.3889 7.2976 123.3105 53.9060 42.6695 175.7696 132 F 5.1716 9.3997 122.4269 55.5865 43.4114 174.2208 133 L 5.3358 9.2999 121.0880 52.3311 44.9004 174.0925 134 P 5.0904 0.0000 0.0000 62.7139 32.1457 175.6524 135 L 4.9472 9.1432 124.5199 51.8860 45.1188 174.4552 136 P 4.6523 0.0000 0.0000 62.5493 32.3451 177.1106 137 V 3.7411 8.1565 114.2399 61.7978 31.6115 176.3614 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 1C H 8.44 4.81 0.00 3.10 3.43 0.00 5.67 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.80 4.55 0.00 3.17 3.23 0.00 5.84 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 1E H 7.57 5.07 0.00 3.16 3.33 0.00 5.71 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.87 4.67 0.00 3.33 3.41 0.00 5.66 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.36 4.92 0.00 2.86 3.06 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 2 N 8.53 4.64 0.00 2.95 2.78 0.00 0.00 6.85 6.74 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 3 L 8.07 4.81 0.00 1.46 1.40 0.58 0.38 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 4 P 0.00 4.63 0.00 2.18 2.09 0.00 3.69 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 1.96 1.91 0.00 5 P 0.00 4.57 0.00 2.16 1.89 0.00 3.88 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 1.95 1.93 0.00 6 G 8.74 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 7 N 7.94 4.37 0.00 2.59 2.63 0.00 0.00 5.90 7.55 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 8 Y 8.02 4.86 0.00 3.03 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 9 K 8.69 4.13 0.00 1.88 1.89 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.50 7.81 10 K 7.60 4.72 0.00 1.70 1.68 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.38 7.81 11 P 0.00 4.74 0.00 2.05 2.04 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 12 K 9.47 4.89 0.00 1.64 1.85 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.62 7.81 13 L 9.01 5.07 0.00 1.65 1.57 0.40 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.61 5.06 0.00 1.54 1.54 0.33 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.26 4.91 0.00 3.35 3.18 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 16 C 8.71 4.29 0.00 2.44 2.46 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 17 S 8.30 4.00 0.00 3.97 4.08 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 18 N 7.68 4.13 0.00 2.51 2.64 0.00 0.00 6.80 7.98 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 19 G 7.68 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 20 G 7.67 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 0.00 0.00 0.00 21 H 7.38 4.85 0.00 3.00 3.22 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.92 5.29 0.00 3.06 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 23 L 9.00 4.52 0.00 1.81 1.51 0.90 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.28 4.96 0.00 1.93 2.06 0.00 3.30 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.78 0.00 25 I 8.23 4.67 1.83 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 1.17 0.72 0.88 0.00 0.00 26 L 8.77 4.09 0.00 1.78 1.52 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.15 0.00 1.99 2.11 0.00 3.50 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 28 D 7.96 4.54 0.00 2.77 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 29 G 8.42 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 T 8.17 4.29 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 31 V 7.98 4.84 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 0.89 0.00 0.00 0.94 0.00 0.00 32 D 8.47 4.59 0.00 2.86 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 33 G 8.66 4.59 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 0.00 0.00 0.00 34 T 8.87 5.00 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 1.38 0.00 0.00 35 R 8.80 4.23 0.00 1.86 1.95 0.00 3.19 0.00 0.00 3.04 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 36 D 8.24 4.63 0.00 2.84 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 37 R 8.66 3.63 0.00 1.93 1.93 0.00 3.28 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.04 0.00 38 S 8.33 4.41 0.00 3.99 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 39 D 7.81 4.40 0.00 2.78 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.51 4.29 0.00 1.86 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.03 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 41 H 9.39 4.86 0.00 3.34 3.47 0.00 5.78 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.02 4.54 1.89 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.01 1.06 0.00 0.00 43 Q 7.83 4.24 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 44 L 9.05 5.21 0.00 1.56 1.42 0.80 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 9.22 4.76 0.00 2.08 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 46 L 8.62 5.27 0.00 1.77 1.60 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.44 4.41 0.00 3.84 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 A 8.00 4.65 1.17 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 0.00 0.00 49 E 8.77 4.07 0.00 1.67 1.78 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 1.47 1.47 0.00 50 S 7.37 4.67 0.00 3.97 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.29 3.81 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.02 0.00 0.00 52 G 9.20 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 53 E 8.33 5.18 0.00 1.90 1.76 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 2.23 2.28 0.00 54 V 9.15 4.88 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 0.75 0.00 0.00 1.25 0.00 0.00 55 Y 8.53 5.60 0.00 3.04 2.94 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 56 I 8.50 4.52 1.70 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.58 0.66 0.00 0.00 57 K 8.71 4.71 0.00 1.20 1.45 0.00 1.24 0.00 0.00 0.61 0.00 0.00 2.56 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.99 1.00 7.81 58 S 8.79 4.54 0.00 3.85 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 59 T 8.59 3.91 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 60 E 8.36 4.06 0.00 1.98 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 2.15 2.36 0.00 61 T 8.06 4.35 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 62 G 8.18 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 63 Q 7.59 4.42 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.74 0.00 0.00 0.00 0.00 0.00 2.51 2.33 0.00 64 Y 8.96 4.63 0.00 2.77 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 65 L 9.03 4.46 0.00 1.57 1.45 0.79 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.70 5.13 0.44 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 0.00 0.00 67 M 8.73 5.36 0.00 2.26 2.26 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.72 0.00 68 D 9.54 5.25 0.00 2.91 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 69 T 8.57 4.01 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 70 D 8.53 4.78 0.00 2.70 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.62 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 0.00 0.00 0.00 72 L 8.24 4.80 0.00 1.85 1.63 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.55 5.01 0.00 1.57 1.62 0.91 0.96 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 74 Y 9.10 5.02 0.00 2.96 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 75 G 8.91 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 76 S 9.01 5.08 0.00 3.72 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 77 Q 9.06 4.38 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.54 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 78 T 7.49 4.67 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 79 P 0.00 3.48 0.00 1.50 0.49 0.00 3.47 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.58 0.00 80 N 7.94 4.97 0.00 2.89 2.90 0.00 0.00 6.28 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 81 E 8.72 4.01 0.00 1.96 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 2.29 2.32 0.00 82 E 8.77 4.16 0.00 2.29 2.31 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 2.40 2.35 0.00 83 C 7.87 4.98 0.00 3.11 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.36 4.78 0.00 1.46 1.45 0.82 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 85 F 9.02 5.22 0.00 3.13 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 86 L 9.22 4.87 0.00 1.53 1.62 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.91 4.57 0.00 2.17 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 2.19 1.93 0.00 88 R 8.58 4.83 0.00 1.78 1.81 0.00 3.18 0.00 0.00 2.90 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 89 L 8.60 4.71 0.00 1.60 1.61 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.20 4.71 0.00 2.20 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 2.29 2.43 0.00 91 E 9.66 3.99 0.00 2.51 2.14 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 2.38 2.40 0.00 92 N 8.46 4.44 0.00 2.84 2.89 0.00 0.00 6.88 8.16 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 93 H 7.75 4.79 0.00 3.01 2.90 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.14 4.69 0.00 3.06 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 95 N 9.45 5.55 0.00 2.89 2.52 0.00 0.00 6.93 6.76 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 96 T 8.76 5.28 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 1.38 0.00 0.00 97 Y 8.63 4.99 0.00 2.82 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 98 I 8.61 4.54 1.68 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.41 0.58 0.00 0.00 99 S 8.95 3.95 0.00 4.07 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.73 3.98 0.00 1.73 1.70 0.00 1.64 0.00 0.00 1.49 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.33 7.81 101 K 7.96 3.81 0.00 1.77 1.66 0.00 1.53 0.00 0.00 1.60 0.00 0.00 3.05 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.24 1.08 7.81 102 H 8.11 4.84 0.00 3.04 2.21 0.00 5.69 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 0.00 103 A 7.66 3.97 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 0.00 104 E 7.92 3.63 0.00 1.81 1.72 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 2.16 2.12 0.00 105 K 7.55 4.24 0.00 0.99 1.59 0.00 1.60 0.00 0.00 1.48 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.00 7.81 106 N 7.56 3.98 0.00 3.04 3.08 0.00 0.00 6.88 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 W 7.72 5.18 0.00 3.28 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 0.00 108 F 9.29 5.46 0.00 2.87 3.06 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 0.00 109 V 9.03 3.99 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 0.65 0.00 0.00 0.52 0.00 0.00 110 G 8.64 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 0.00 0.00 0.00 0.00 111 L 8.41 5.32 0.00 1.47 1.45 1.01 0.71 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 N 9.17 4.63 0.00 2.84 2.69 0.00 0.00 6.79 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 0.00 113 K 8.46 3.89 0.00 1.70 1.85 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.43 7.81 114 N 8.09 4.60 0.00 2.78 2.89 0.00 0.00 6.20 7.00 0.00 0.00 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 G 8.20 3.53 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 0.00 116 S 8.10 4.59 0.00 3.99 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 0.00 117 C 8.28 4.76 0.00 3.01 2.98 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 0.00 118 K 8.74 4.38 0.00 1.61 1.72 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.33 7.81 119 R 8.47 4.03 0.00 1.78 1.62 0.00 3.19 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.54 0.00 120 G 8.54 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 0.00 121 P 0.00 4.25 0.00 1.91 2.17 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 1.74 1.84 0.00 122 R 7.92 4.26 0.00 1.82 1.93 0.00 3.29 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 123 T 7.52 5.10 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 1.26 0.00 0.00 124 H 7.94 4.77 0.00 3.40 3.53 0.00 5.48 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.82 3.98 0.00 3.14 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 0.00 126 G 9.03 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 0.00 127 Q 7.35 4.24 0.00 1.84 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.77 0.00 0.00 0.00 0.00 0.00 2.17 2.12 0.00 128 K 8.30 3.82 0.00 1.78 1.64 0.00 1.58 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.33 7.81 129 A 8.05 3.96 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 0.00 130 I 7.16 4.39 1.61 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.80 0.51 0.00 0.00 131 L 7.30 4.39 0.00 1.09 0.54 0.30 0.83 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 0.00 132 F 9.40 5.17 0.00 3.41 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 L 9.30 5.34 0.00 1.86 1.68 1.15 0.80 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 0.00 134 P 0.00 5.09 0.00 2.16 2.21 0.00 3.81 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 135 L 9.14 4.95 0.00 1.63 1.61 0.96 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.65 0.00 1.92 1.97 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 137 V 8.16 3.74 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 0.66 0.00 0.00 0.91 0.00 0.00