NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3833 8.3344 116.7947 58.4236 64.3738 172.4089 3 S 4.4246 8.1762 117.4781 54.9809 63.0973 173.4969 4 Q 4.2148 8.6545 126.0533 57.7602 29.4427 176.1008 5 I 4.3039 7.1154 110.1546 60.6898 39.4660 176.1642 6 R 4.4123 7.2733 121.1482 56.2597 30.1999 175.5825 7 Q 4.2718 8.7280 122.6018 56.4831 31.5518 172.7207 8 N 4.1947 9.1174 123.9428 54.9740 37.3846 173.4138 9 Y 4.6998 7.6627 118.7671 54.3710 39.2832 173.9621 10 S 4.2482 8.0951 121.8301 58.0494 65.1528 175.1808 11 T 3.8166 8.4264 115.2117 64.5581 68.2446 176.3888 12 D 4.2500 7.8021 122.0166 57.2448 40.8817 178.5432 13 V 3.4315 7.1167 117.5668 65.6580 31.6423 177.4022 14 E 3.7825 7.7404 120.1808 58.6971 29.1418 178.9380 15 A 3.9899 7.8211 119.8277 54.8423 18.2597 179.4959 16 A 3.9328 7.6405 119.6249 55.0867 18.3303 180.0688 17 V 3.5220 8.0021 116.9962 66.3482 31.5623 178.1167 18 N 4.2864 8.0596 115.5997 55.8653 38.2307 177.4237 19 S 4.1510 7.6588 114.7905 61.2124 62.6549 175.8916 20 L 4.1444 8.2532 123.1570 57.8832 41.6264 179.0316 21 V 3.7091 8.1487 118.8439 66.1200 31.3015 177.5047 22 N 4.2915 8.0725 116.7166 56.4494 38.6767 176.6045 23 L 4.0433 8.0238 122.0297 58.2502 42.1926 178.4232 24 Y 4.0812 8.4033 116.8289 60.9561 37.8689 178.0873 25 L 3.8362 8.3585 120.3795 57.4762 41.5644 179.3921 26 Q 3.9658 7.7994 119.0769 59.1653 29.0467 178.0650 27 A 3.7895 7.9200 121.7084 55.1179 18.4501 179.1232 28 S 4.2706 8.6053 112.1314 62.1462 62.4337 175.7884 29 Y 4.5048 8.1326 121.7677 61.1877 38.3888 178.3402 30 T 3.6679 7.9383 116.4236 66.9845 68.5049 176.2160 31 Y 3.9610 8.0386 118.8740 60.7987 37.7202 178.7352 32 L 4.1498 8.1370 121.3027 58.3303 42.1922 178.8615 33 S 4.2734 8.0880 113.0417 61.5071 61.8281 176.0697 34 L 3.7202 7.9513 122.0286 57.5656 41.0192 179.6892 35 G 3.8508 8.3475 104.5865 48.1282 0.0000 175.5647 36 F 4.2475 8.8620 120.1632 58.7840 39.0131 177.1595 37 Y 4.4159 8.1719 120.4203 60.7343 38.7610 176.8343 38 F 4.0937 8.5644 116.0778 58.6077 38.9271 176.1108 39 D 4.5129 7.4837 115.8064 54.1188 41.8343 176.5183 40 R 4.1227 7.2333 118.7460 56.4063 30.6326 177.4916 41 D 3.8612 8.6711 120.8976 55.9323 39.4573 176.7998 42 D 4.6568 7.8985 116.9145 53.2523 40.1149 176.6713 43 V 3.7282 7.2445 118.0069 64.2157 33.8187 176.3766 44 A 3.8094 8.1968 118.2404 53.5641 15.2548 175.8798 45 L 4.7365 8.4915 125.1171 50.8132 42.9741 177.0246 46 E 3.9899 8.5728 123.5280 58.9520 29.5957 178.1369 47 G 3.5642 7.9844 105.2554 47.8736 0.0000 175.7247 48 V 3.1516 7.4774 120.7043 65.1315 31.5566 177.5325 49 S 4.0139 8.1147 113.3302 61.8804 62.1681 175.8005 50 H 4.0676 8.3176 120.6385 59.1788 29.4766 176.7730 51 F 3.9768 7.7743 122.4964 61.5437 39.1456 177.1994 52 F 4.4862 8.2746 117.2789 60.5700 38.1894 178.0326 53 R 4.0422 8.0133 117.8222 58.9609 29.7093 179.0116 54 E 3.8383 7.9781 118.7043 59.3269 29.4794 179.3026 55 L 3.5634 7.1968 118.8635 57.4063 41.5046 179.4065 56 A 4.1231 7.8067 120.8041 54.8839 18.1615 179.1268 57 E 4.0814 7.6932 116.7889 59.0228 29.8337 178.4530 58 E 3.8746 8.1397 118.8143 59.3475 29.3717 179.4778 59 K 4.4149 8.2726 118.5102 59.2388 32.2544 179.4281 60 R 3.0243 7.5876 117.9559 58.9720 29.8755 178.4324 61 E 3.8919 8.3476 119.0543 59.0385 29.4402 179.4888 62 G 3.4628 7.9385 105.9666 48.0428 0.0000 175.4700 63 Y 4.2729 8.2703 121.2509 59.4874 38.0150 177.9880 64 E 4.0418 7.7196 120.4949 59.0303 29.5193 179.0902 65 R 3.9719 8.1410 119.1339 59.2511 30.1023 178.5588 66 L 4.1557 8.2810 118.8076 58.0639 41.5987 179.2768 67 L 4.0227 8.3022 118.9520 57.8298 41.6306 179.9001 68 K 3.9643 8.1056 119.4147 59.8140 31.9616 178.7012 69 M 3.8790 8.0093 118.1773 58.0678 31.7317 178.0615 70 Q 3.8495 7.9872 120.0916 59.4223 29.1389 177.8823 71 N 4.3269 7.5841 115.8885 56.2546 38.5656 177.2257 72 Q 4.0354 7.6242 118.5010 58.6916 29.0389 178.3443 73 R 3.8273 7.3353 118.6098 57.1305 29.8757 177.7001 74 G 3.8705 7.6181 105.5184 45.3911 0.0000 174.4035 75 G 4.4834 7.6715 107.7296 45.2264 0.0000 172.8379 76 R 4.4350 8.5967 117.7841 53.6586 32.3549 176.0460 77 A 4.2618 8.4869 126.4920 52.0757 19.0039 176.3797 78 L 4.4699 9.5100 122.5808 52.7543 44.8293 176.1564 79 F 5.0048 8.4733 122.0230 55.8544 40.8140 175.1101 80 Q 4.8020 8.4177 122.7131 53.4532 31.9103 175.0173 81 D 4.3928 8.5687 118.9813 55.2146 41.3080 176.8169 82 I 4.3399 8.0253 122.9185 59.2717 37.9433 176.0071 83 K 4.1496 8.7014 126.1153 55.7301 32.4839 177.4600 84 K 3.9181 8.4995 122.4247 56.0122 33.0179 174.7285 85 P 4.4248 0.0000 0.0000 62.1083 31.9534 176.6206 86 A 4.0208 8.8141 122.8411 54.6919 18.3252 176.9626 87 E 4.4396 7.1715 112.3973 54.4576 32.7514 174.6743 88 D 4.8185 7.9139 115.5740 54.1415 43.2781 176.2098 89 E 4.3296 7.3381 116.9581 54.2948 32.7836 175.2379 90 W 4.3710 6.5562 121.7277 55.6358 30.6280 177.4487 91 G 3.7158 7.3121 109.7052 47.2340 0.0000 176.8669 92 K 4.5977 9.1477 125.8303 54.5548 35.0506 176.7124 93 T 4.2472 8.6368 116.6235 67.1741 68.4713 174.8933 94 P 4.5497 0.0000 0.0000 65.5941 31.2776 178.5840 95 D 4.3942 8.2138 117.1559 57.5366 40.9712 178.4955 96 A 4.3595 8.4491 121.2666 55.3592 18.4245 179.3677 97 M 4.2855 8.9088 117.4434 58.7906 32.2695 178.6720 98 K 4.0818 8.2783 118.3780 59.2353 32.3199 179.1466 99 A 4.0545 8.1579 121.0147 55.0848 18.1871 179.6213 100 A 3.7955 8.1419 119.3485 55.3898 18.6857 179.3379 101 M 3.9793 8.3267 116.5862 58.8078 32.1348 178.4196 102 A 3.9701 8.2327 120.8332 55.1283 18.6617 179.2787 103 L 3.8130 7.6855 118.6991 58.3942 42.0556 179.1428 104 E 4.0169 8.5551 118.7751 59.2784 29.3445 179.4017 105 K 3.9885 7.9990 118.3076 59.1962 32.0873 178.9857 106 K 3.8407 8.2163 119.9945 59.7670 32.0493 178.6829 107 L 3.9202 7.9411 118.8550 57.8155 41.5179 178.9610 108 N 4.3097 8.7886 117.2675 56.7921 38.7063 176.6927 109 Q 3.9093 8.4493 120.8124 59.2174 29.2361 177.7696 110 A 4.0004 8.0113 121.8047 55.2784 18.2156 179.7092 111 L 3.8963 8.2135 117.2896 58.1606 41.9175 179.6356 112 L 4.0332 8.1156 118.8310 58.0242 41.3879 179.4475 113 D 4.4346 8.4850 119.1532 56.9978 40.9662 178.5090 114 L 3.9576 7.9018 121.0457 58.2077 42.0380 178.5193 115 H 4.1588 8.7389 118.6816 58.8725 29.8033 177.1480 116 A 3.9980 7.8561 122.1783 55.2704 18.2695 179.4176 117 L 4.0452 8.3053 119.0953 58.0108 42.0721 179.5843 118 G 3.5259 7.8671 105.5297 47.8259 0.0000 175.9678 119 S 4.1258 8.1911 117.7869 61.1763 62.6010 176.6847 120 A 4.0417 7.8767 122.4133 54.9381 18.2038 178.9642 121 R 4.2702 7.5745 113.4277 55.0348 31.6426 177.4870 122 T 3.5266 7.2051 106.2700 62.9932 67.7589 172.2868 123 D 4.8722 8.1239 126.2623 51.3746 41.6256 174.0490 124 P 4.3607 0.0000 0.0000 65.0780 31.3154 178.0748 125 H 4.1938 8.2711 118.2814 59.3333 30.1337 176.6258 126 L 4.0314 8.1744 121.6375 58.2531 41.7912 178.6684 127 C 4.1074 7.9267 116.7735 62.9164 28.0981 175.5282 128 D 4.3607 8.1919 119.6447 57.1572 40.8559 177.9058 129 F 4.2254 8.6155 121.6226 61.5064 39.3360 177.2129 130 L 4.0178 8.0920 118.2263 57.5837 41.1987 179.2305 131 E 3.9908 8.3831 118.1666 59.7476 29.5133 179.4187 132 T 3.9477 8.0742 114.5712 66.6557 68.7874 176.0356 133 H 4.5616 7.6032 113.9268 55.5850 29.4764 175.3049 134 F 4.6350 7.7134 117.8281 58.6972 41.9530 176.6997 135 L 4.0269 8.3603 120.5862 58.3434 41.4539 179.3820 136 D 4.4194 8.0502 116.8290 56.8952 41.3035 177.9810 137 E 3.9192 8.1051 119.0763 59.4319 29.4964 178.8939 138 E 4.0079 8.3092 118.5381 59.2851 29.4805 179.3130 139 V 3.5950 7.6340 117.7919 66.2528 31.5667 178.1413 140 K 3.9512 7.9934 117.9141 59.4223 31.8368 179.1726 141 L 4.0056 7.9305 120.3286 58.2146 42.0831 179.0825 142 I 3.7907 8.2186 120.2787 64.2682 37.0264 178.3412 143 K 3.9792 8.4985 120.9703 59.2736 32.0430 178.8493 144 K 4.0759 8.0584 120.0273 59.8820 32.1826 178.8575 145 M 4.4097 8.7408 119.5088 58.1027 31.7239 179.1061 146 G 3.5941 8.1665 106.2300 47.9796 0.0000 175.6191 147 D 4.3562 8.1084 121.6272 57.1508 40.6450 178.7626 148 H 4.1518 7.9958 116.7197 58.8972 28.7745 177.8105 149 L 4.0236 8.1066 120.8116 58.1686 41.2390 179.8067 150 T 3.9198 8.1974 115.8609 66.6922 68.1483 176.5539 151 N 4.4231 8.0570 117.5259 55.8962 38.7591 177.3183 152 L 4.1428 8.2325 120.9546 58.0653 41.5180 178.9567 153 H 4.1869 8.0423 117.0962 59.1441 29.8488 176.9921 154 R 4.0500 7.5769 119.5177 58.4149 29.9770 176.6491 155 L 4.3379 7.4242 122.7893 54.9280 41.9338 176.2391 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 S 8.33 4.38 0.00 3.88 3.87 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 3 S 8.18 4.42 0.00 3.92 3.73 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 4 Q 8.65 4.21 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.63 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 5 I 7.12 4.30 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.66 0.88 0.00 0.00 6 R 7.27 4.41 0.00 1.75 2.00 0.00 3.22 0.00 0.00 3.05 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 7 Q 8.73 4.27 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 8 N 9.12 4.19 0.00 2.89 2.91 0.00 0.00 6.94 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Y 7.66 4.70 0.00 2.93 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 10 S 8.10 4.25 0.00 3.99 3.91 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 11 T 8.43 3.82 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 12 D 7.80 4.25 0.00 2.66 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 13 V 7.12 3.43 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 0.92 0.00 0.00 0.83 0.00 0.00 14 E 7.74 3.78 0.00 1.72 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 2.29 2.52 0.00 15 A 7.82 3.99 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 16 A 7.64 3.93 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 17 V 8.00 3.52 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 1.13 0.00 0.00 1.02 0.00 0.00 18 N 8.06 4.29 0.00 2.90 2.78 0.00 0.00 6.74 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 S 7.66 4.15 0.00 3.88 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 20 L 8.25 4.14 0.00 1.97 1.85 1.11 1.15 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 21 V 8.15 3.71 2.36 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 1.25 0.00 0.00 1.05 0.00 0.00 22 N 8.07 4.29 0.00 2.83 2.99 0.00 0.00 6.99 6.55 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 23 L 8.02 4.04 0.00 2.04 1.90 0.93 0.83 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 24 Y 8.40 4.08 0.00 3.49 3.30 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 0.00 25 L 8.36 3.84 0.00 1.72 1.53 0.83 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 7.80 3.97 0.00 2.41 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 27 A 7.92 3.79 1.28 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 28 S 8.61 4.27 0.00 4.19 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 0.00 29 Y 8.13 4.50 0.00 3.20 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 30 T 7.94 3.67 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 0.64 0.00 0.00 31 Y 8.04 3.96 0.00 3.21 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 32 L 8.14 4.15 0.00 1.98 2.16 1.20 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.09 4.27 0.00 3.99 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 34 L 7.95 3.72 0.00 1.45 1.33 -0.16 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.35 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 36 F 8.86 4.25 0.00 3.30 3.28 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 37 Y 8.17 4.42 0.00 3.48 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 38 F 8.56 4.09 0.00 3.10 3.25 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 39 D 7.48 4.51 0.00 2.61 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 40 R 7.23 4.12 0.00 1.81 1.87 0.00 3.30 0.00 0.00 3.09 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 41 D 8.67 3.86 0.00 2.77 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 42 D 7.90 4.66 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 43 V 7.24 3.73 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 0.18 0.00 0.00 0.31 0.00 0.00 44 A 8.20 3.81 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 45 L 8.49 4.74 0.00 1.97 1.68 1.12 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.57 3.99 0.00 2.01 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 2.34 2.35 0.00 47 G 7.98 3.56 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 48 V 7.48 3.15 1.62 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 -0.76 0.00 0.00 0.59 0.00 0.00 49 S 8.11 4.01 0.00 3.97 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 H 8.32 4.07 0.00 3.28 3.40 0.00 5.65 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 51 F 7.77 3.98 0.00 3.03 2.88 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 52 F 8.27 4.49 0.00 3.18 3.15 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 53 R 8.01 4.04 0.00 1.92 1.95 0.00 2.84 0.00 0.00 3.07 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.95 0.00 54 E 7.98 3.84 0.00 1.86 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 2.11 2.24 0.00 55 L 7.20 3.56 0.00 0.64 0.32 0.55 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 56 A 7.81 4.12 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.69 4.08 0.00 2.23 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 2.25 2.33 0.00 58 E 8.14 3.87 0.00 2.09 1.92 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 2.22 2.41 0.00 59 K 8.27 4.41 0.00 2.03 2.27 0.00 1.85 0.00 0.00 1.88 0.00 0.00 2.96 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.81 1.89 7.81 60 R 7.59 3.02 0.00 1.93 1.96 0.00 3.04 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.46 0.00 61 E 8.35 3.89 0.00 2.12 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 62 G 7.94 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.27 4.27 0.00 3.23 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 64 E 7.72 4.04 0.00 2.10 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 2.28 1.86 0.00 65 R 8.14 3.97 0.00 1.99 2.21 0.00 2.72 0.00 0.00 2.74 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.68 0.00 66 L 8.28 4.16 0.00 2.04 1.77 0.81 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.30 4.02 0.00 2.02 1.87 1.32 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.11 3.96 0.00 2.13 1.97 0.00 1.54 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.48 7.81 69 M 8.01 3.88 0.00 1.67 1.36 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 2.08 0.00 70 Q 7.99 3.85 0.00 2.20 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 71 N 7.58 4.33 0.00 2.66 2.83 0.00 0.00 7.17 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 72 Q 7.62 4.04 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.00 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 73 R 7.34 3.83 0.00 0.83 0.66 0.00 2.95 0.00 0.00 2.96 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.97 0.00 74 G 7.62 3.87 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 0.00 0.00 0.00 75 G 7.67 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.60 4.43 0.00 1.75 1.79 0.00 3.32 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 77 A 8.49 4.26 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 9.51 4.47 0.00 1.29 1.44 0.87 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 79 F 8.47 5.00 0.00 3.06 2.90 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 80 Q 8.42 4.80 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.87 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 81 D 8.57 4.39 0.00 2.68 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 8.03 4.34 1.87 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 1.38 0.50 0.98 0.00 0.00 83 K 8.70 4.15 0.00 1.96 1.77 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.46 7.81 84 K 8.50 3.92 0.00 1.70 1.82 0.00 1.53 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.41 7.81 85 P 0.00 4.42 0.00 2.41 2.22 0.00 3.36 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 86 A 8.81 4.02 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 87 E 7.17 4.44 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 1.47 1.47 0.00 88 D 7.91 4.82 0.00 2.48 2.62 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 89 E 7.34 4.33 0.00 1.68 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 0.00 2.28 2.23 0.00 90 W 6.56 4.37 0.00 2.98 3.25 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 91 G 7.31 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 0.00 0.00 0.00 92 K 9.15 4.60 0.00 2.03 1.83 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.52 7.81 93 T 8.64 4.25 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 1.21 0.00 0.00 94 P 0.00 4.55 0.00 2.23 2.18 0.00 3.70 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 95 D 8.21 4.39 0.00 3.21 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 96 A 8.45 4.36 1.92 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 0.00 0.00 97 M 8.91 4.29 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.65 0.00 98 K 8.28 4.08 0.00 2.19 1.90 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.60 7.81 99 A 8.16 4.05 1.61 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 0.00 0.00 100 A 8.14 3.80 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 0.00 101 M 8.33 3.98 0.00 2.37 2.16 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.66 0.00 102 A 8.23 3.97 1.41 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 0.00 0.00 103 L 7.69 3.81 0.00 1.76 1.67 0.80 0.41 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 0.00 104 E 8.56 4.02 0.00 2.06 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 2.62 2.59 0.00 105 K 8.00 3.99 0.00 2.01 1.87 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.62 7.81 106 K 8.22 3.84 0.00 1.90 1.94 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.48 7.81 107 L 7.94 3.92 0.00 1.81 1.55 0.35 -0.03 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 0.00 108 N 8.79 4.31 0.00 2.92 3.03 0.00 0.00 6.88 7.28 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 0.00 109 Q 8.45 3.91 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.36 2.64 0.00 110 A 8.01 4.00 1.41 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 0.00 0.00 111 L 8.21 3.90 0.00 1.99 1.77 1.16 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 112 L 8.12 4.03 0.00 1.87 1.75 0.97 0.95 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 0.00 113 D 8.49 4.43 0.00 2.88 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 0.00 114 L 7.90 3.96 0.00 1.92 1.85 0.91 0.95 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 0.00 115 H 8.74 4.16 0.00 3.24 3.45 0.00 5.64 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 0.00 116 A 7.86 4.00 1.44 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 0.00 117 L 8.31 4.05 0.00 1.74 1.89 0.89 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 118 G 7.87 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 0.00 119 S 8.19 4.13 0.00 4.04 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 0.00 120 A 7.88 4.04 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 0.00 121 R 7.57 4.27 0.00 1.74 1.93 0.00 3.41 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 122 T 7.21 3.53 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 123 D 8.12 4.87 0.00 2.79 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 0.00 124 P 0.00 4.36 0.00 2.34 2.33 0.00 3.83 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 2.12 2.06 0.00 125 H 8.27 4.19 0.00 3.23 3.49 0.00 5.68 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.17 4.03 0.00 2.02 1.86 1.01 1.02 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 0.00 127 C 7.93 4.11 0.00 3.12 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 0.00 128 D 8.19 4.36 0.00 2.94 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 0.00 129 F 8.62 4.23 0.00 3.02 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.09 4.02 0.00 2.01 1.74 0.97 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.38 3.99 0.00 2.14 2.04 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 2.39 2.63 0.00 132 T 8.07 3.95 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 0.89 0.00 0.00 133 H 7.60 4.56 0.00 2.69 2.83 0.00 5.60 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 7.71 4.64 0.00 3.09 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.36 4.03 0.00 1.71 1.76 0.92 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 136 D 8.05 4.42 0.00 2.74 2.64 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 0.00 137 E 8.11 3.92 0.00 2.19 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 2.29 2.29 0.00 138 E 8.31 4.01 0.00 2.22 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 0.00 2.66 2.61 0.00 139 V 7.63 3.60 2.23 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 1.12 0.00 0.00 1.00 0.00 0.00 140 K 7.99 3.95 0.00 2.01 1.86 0.00 1.71 0.00 0.00 1.56 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.58 7.81 141 L 7.93 4.01 0.00 1.81 1.85 0.96 1.05 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 0.00 142 I 8.22 3.79 2.08 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 1.46 0.96 0.95 0.00 0.00 143 K 8.50 3.98 0.00 1.85 2.05 0.00 1.53 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.62 7.81 144 K 8.06 4.08 0.00 2.09 2.06 0.00 1.78 0.00 0.00 1.86 0.00 0.00 3.28 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.50 7.81 145 M 8.74 4.41 0.00 2.19 2.32 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.97 2.86 0.00 146 G 8.17 3.59 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 0.00 147 D 8.11 4.36 0.00 2.76 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 H 8.00 4.15 0.00 3.37 3.21 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 L 8.11 4.02 0.00 1.87 1.75 0.97 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 150 T 8.20 3.92 4.37 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 1.22 0.00 0.00 151 N 8.06 4.42 0.00 2.80 2.87 0.00 0.00 7.09 7.95 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 0.00 152 L 8.23 4.14 0.00 1.71 1.74 0.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 153 H 8.04 4.19 0.00 3.25 3.56 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 R 7.58 4.05 0.00 1.95 2.15 0.00 3.31 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 155 L 7.42 4.34 0.00 1.72 1.55 0.91 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00