NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4157 8.3344 116.7946 57.8109 63.4628 173.1177 3 L 3.8671 8.4733 127.8705 53.5424 42.4536 174.5582 4 M 4.7184 9.1862 123.2310 53.4000 34.6382 174.3121 5 N 4.7821 8.5296 118.6565 51.7490 39.4150 175.4114 6 K 4.2061 8.6101 123.2227 58.1975 33.4290 176.5039 7 S 4.7513 7.6540 112.3935 56.6597 66.2132 172.8699 8 Q 4.4335 8.2877 118.6611 53.9429 31.5081 175.1040 9 Q 4.1414 8.7585 124.2623 55.6788 29.0985 175.1339 10 V 4.4777 8.1714 117.8937 59.4877 34.5501 174.4793 11 Q 4.7364 8.4954 120.7070 54.6082 31.2892 173.7734 12 T 4.9407 8.1519 117.7893 60.1122 70.7635 172.9816 13 I 4.2329 8.2821 126.9093 61.1006 39.0379 175.0591 14 T 4.6277 8.2736 116.7095 59.8034 71.5147 175.0391 15 L 3.9486 8.6393 123.8875 58.4685 42.0075 179.2355 16 A 4.4009 8.2923 121.1781 54.2793 18.3259 179.3736 17 A 3.9812 7.7420 118.7977 55.4212 18.5079 179.7225 18 A 4.1182 8.0665 119.2707 55.3394 18.2285 179.9660 19 Q 4.0192 8.1607 116.8395 59.1933 28.7072 178.5936 20 Q 4.0272 7.9499 119.0615 59.2561 28.8066 179.0371 21 M 4.0657 8.1114 119.4185 58.3611 32.0927 178.6234 22 A 3.5904 8.3950 120.7812 54.8396 18.5539 179.4799 23 A 3.8555 7.9448 118.8627 55.4350 18.5135 179.8305 24 A 3.9251 7.7026 119.1251 54.8671 18.3479 180.1938 25 V 3.2567 7.3620 116.7145 66.1440 31.5252 177.5862 26 E 3.8562 7.8102 119.0531 59.5119 29.2592 178.6741 27 K 3.8568 7.9249 119.2109 59.5685 32.3635 178.8385 28 K 3.9816 8.1444 119.5386 58.9543 32.1007 178.8658 29 A 3.9120 8.5477 121.7578 55.3943 18.1109 179.3140 30 T 3.8260 7.3493 113.0133 67.1136 68.6846 176.2567 31 E 4.1262 7.9777 117.8346 58.5198 29.7482 178.0470 32 I 4.1065 7.5056 111.3577 59.7335 39.1833 174.5339 33 N 4.1949 8.3980 116.5093 53.9794 35.4486 174.2569 34 V 4.4151 7.2645 114.7949 59.9117 35.0821 174.4578 35 A 4.6160 8.2880 124.1757 50.6945 20.8846 176.4074 36 V 4.7021 7.9594 114.3674 59.7128 37.0582 174.1435 37 V 4.9259 8.9324 121.1820 61.3224 34.4471 174.0877 38 F 5.4701 9.3453 128.5704 56.6911 42.7682 173.5714 39 S 5.0359 8.0516 120.7662 56.6315 67.2750 173.1255 40 V 4.7001 8.4916 122.3336 61.1922 34.8714 174.6811 41 V 4.9513 8.6102 119.7670 59.6459 35.9016 175.9903 42 D 4.8685 8.5388 122.2781 52.5068 41.6691 176.6194 43 R 3.8208 8.0547 117.9966 59.6659 30.0238 178.3418 44 G 3.8720 8.4598 104.6655 45.0317 0.0000 174.4478 45 G 4.0170 7.9980 106.6364 45.5742 0.0000 174.1602 46 N 4.7051 7.8872 116.9761 52.5355 39.5496 174.6418 47 T 4.2705 8.2961 117.9042 63.8706 69.1770 174.4189 48 L 4.5258 8.1693 125.3170 55.7867 43.9104 176.8920 49 L 4.3122 7.0669 115.7924 54.3794 45.3703 173.1409 50 I 5.0164 8.6236 126.6961 59.5558 40.6917 174.7894 51 Q 4.4257 9.0928 126.9486 54.5775 32.4200 173.2545 52 R 4.8189 8.6122 127.2431 54.4882 31.8277 175.5642 53 M 4.1745 8.5370 126.4801 55.4746 32.7370 177.2323 54 D 4.4116 8.7889 122.2242 57.4859 41.0179 177.9570 55 E 4.3124 7.8738 114.5532 56.1313 30.4512 176.2502 56 A 3.8021 7.4743 122.2609 51.7531 19.0083 177.3589 57 F 4.3767 7.7663 120.2199 58.4680 39.8017 177.0899 58 V 3.9433 8.5350 116.6269 63.2565 30.6714 178.0045 59 S 4.4401 8.1069 113.7603 59.7596 63.6410 175.7841 60 S 4.5504 7.9532 117.4503 60.8083 62.7633 175.2922 61 C 3.9995 7.7208 119.1581 63.4381 27.9531 175.6332 62 D 4.4055 8.0842 119.3662 57.5349 40.4127 179.2439 63 I 3.7084 7.3426 117.8494 64.3983 37.2245 177.9000 64 S 4.1041 8.5187 114.3996 61.6936 62.0299 176.0585 65 L 3.9048 7.8162 122.3332 58.4032 41.9031 178.5712 66 N 4.5753 8.1086 114.9599 55.1795 38.5275 177.7895 67 K 3.9001 8.3966 120.7883 59.3060 32.2986 178.6669 68 A 3.9282 7.8374 121.0695 55.1675 18.2417 179.3480 69 W 4.0554 8.4801 126.7305 60.8307 30.7556 178.2648 70 S 3.6267 8.3335 114.6895 61.5331 62.0931 176.6355 71 A 4.5015 7.8994 124.4069 54.5696 18.1002 178.6002 72 C 4.0315 7.8299 117.9880 62.4440 31.3929 175.6938 73 S 3.8677 7.6203 118.0734 60.8627 62.5494 176.0142 74 L 4.2668 7.8768 119.4565 53.2756 42.2865 176.3745 75 K 3.7823 7.7497 116.4550 55.3247 30.2580 174.3452 76 Q 4.4880 7.4057 113.7975 54.8166 31.7901 173.4287 77 G 3.8760 9.0937 107.9687 45.2232 0.0000 175.2995 78 T 3.9376 8.6583 113.1511 64.3240 68.4492 176.7012 79 H 4.4082 8.2031 117.6251 58.2767 28.3931 177.0403 80 E 4.0844 7.7829 120.9633 58.2227 29.6538 177.9496 81 I 4.1873 7.2792 110.5522 61.6740 38.5586 177.6147 82 T 4.0525 7.5376 117.6460 67.0376 68.0386 176.2357 83 S 4.0376 8.0238 114.5850 60.9431 63.5412 175.5430 84 A 4.3376 8.0552 123.0509 53.0714 18.3956 178.4451 85 V 4.6414 7.4182 108.2554 60.5618 33.8469 175.7399 86 Q 4.2117 7.4935 118.4615 54.8543 29.1835 174.1138 87 P 3.1229 0.0000 0.0000 64.2319 31.6009 177.0355 88 G 3.8811 8.5544 110.8190 45.2330 0.0000 173.5075 89 Q 4.4824 7.6444 118.9170 54.4572 30.0326 176.9049 90 S 4.3885 8.5367 113.6380 60.4290 63.5306 174.7998 91 L 4.7828 8.2370 121.5852 54.2596 42.5368 175.3002 92 Y 4.8266 7.3680 120.1375 58.3305 38.9109 175.9610 93 G 3.7764 9.0718 115.1626 45.6193 0.0000 175.6600 94 L 3.9593 8.0100 122.1817 57.8357 42.5837 178.9135 95 Q 4.0064 8.0511 116.3217 58.7722 28.5609 177.8744 96 L 4.2289 7.4311 117.5096 56.0934 42.1702 176.9024 97 T 4.1049 7.9647 110.1752 61.3887 69.7633 173.3001 98 N 4.2690 9.3890 115.3768 55.0972 36.0883 174.5798 99 Q 3.6088 8.7906 109.0319 57.1863 26.6466 174.0276 100 Q 3.7942 8.0523 111.5106 56.5426 26.7395 175.2487 101 R 4.1164 7.5703 116.6731 56.8996 30.7422 177.1264 102 I 4.2261 7.7457 118.7641 60.5260 36.5876 175.1738 103 I 3.9692 8.0464 127.2799 60.4992 37.6660 176.3880 104 I 4.3762 7.9707 117.8451 60.2281 37.7645 174.6867 105 F 5.0865 6.7845 114.3746 54.9768 41.0249 174.2902 106 G 3.8175 8.9371 110.2866 44.9115 0.0000 174.0993 107 G 4.6559 8.3156 123.6501 45.9193 0.0000 171.7714 108 G 4.3761 7.6682 109.7809 44.7575 0.0000 173.1765 109 L 5.2283 8.8893 124.2864 52.2549 46.3279 173.9547 110 P 4.7418 0.0000 0.0000 62.3969 32.7924 176.2304 111 V 3.7339 8.7536 123.6168 62.4524 32.0896 174.9983 112 I 4.6483 8.2237 129.9216 60.0524 38.0411 175.4370 113 F 5.0892 8.7948 127.4854 57.5990 42.3213 174.2249 114 N 4.2762 8.8813 123.4648 55.0161 35.7737 173.7835 115 E 3.8645 8.3472 109.9839 56.8659 27.7778 174.7387 116 Q 4.3788 7.8610 117.8177 54.1239 32.2101 173.8930 117 V 4.0182 8.5266 125.3771 63.3779 31.6878 175.1668 118 I 4.6341 9.0361 120.6400 59.0868 39.2492 175.4246 119 G 4.3914 7.1970 111.5414 46.6529 0.0000 170.8727 120 A 5.1035 8.0608 120.4496 50.6202 23.1122 175.7175 121 V 4.7497 8.9132 112.5843 59.4909 35.7742 175.3260 122 G 4.3528 8.7348 109.8132 44.5316 0.0000 171.4573 123 V 5.2112 8.9107 125.3479 61.1582 33.9876 174.7629 124 S 4.8675 9.6727 121.6705 56.8243 65.3903 173.1618 125 G 3.6475 9.1267 119.0057 45.6121 0.0000 173.9048 126 G 4.0111 7.9031 110.7222 44.8597 0.0000 173.3641 127 T 4.2157 8.5318 111.6259 61.2809 71.0486 175.3858 128 V 3.6973 8.1690 119.3892 66.0036 31.5255 177.3580 129 E 3.9813 8.2273 117.9359 59.7840 29.3733 179.3579 130 Q 4.0406 8.1945 117.8347 59.0643 28.8334 178.5130 131 D 4.4393 8.3010 120.0120 57.3993 40.8831 178.6161 132 Q 4.0502 8.1623 120.0304 58.6610 29.0568 177.7852 133 L 3.9143 7.9743 121.5322 58.2906 42.2890 178.9838 134 L 3.9903 8.0687 118.6194 57.8293 41.4907 179.4738 135 A 4.2080 8.1103 120.5574 54.8986 18.2555 179.5107 136 Q 3.9256 8.1401 118.4599 59.4313 29.1204 177.7687 137 C 4.0327 8.1513 119.5855 62.5447 31.5400 175.4517 138 A 4.0254 8.0177 122.1075 55.0970 17.9486 179.5687 139 L 4.1416 7.5550 116.9255 57.6366 41.6051 178.9969 140 D 4.4355 8.0981 118.2692 57.6584 41.0450 178.2082 141 C 4.1807 8.0652 118.7962 62.5265 31.2872 175.0310 142 F 4.0311 8.2999 122.3351 61.5383 38.7771 176.9310 143 S 4.2433 8.2411 110.0288 59.7023 63.1156 174.9724 144 A 4.3694 7.9550 124.1332 52.4236 19.3253 177.3051 145 L 4.1915 6.7568 116.9522 54.4959 42.5033 177.0380 146 E 4.1009 8.1267 116.7600 56.7255 29.6445 175.2496 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 4.42 0.00 3.87 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 3 L 8.47 3.87 0.00 1.68 1.58 0.92 0.64 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 4 M 9.19 4.72 0.00 2.12 1.99 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 2.45 2.51 0.00 5 N 8.53 4.78 0.00 2.72 2.90 0.00 0.00 7.00 7.61 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 6 K 8.61 4.21 0.00 1.86 1.93 0.00 1.52 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 1.39 1.42 7.81 7 S 7.65 4.75 0.00 3.93 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 8 Q 8.29 4.43 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.05 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 9 Q 8.76 4.14 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 10 V 8.17 4.48 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 0.77 0.00 0.00 0.94 0.00 0.00 11 Q 8.50 4.74 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.22 6.81 0.00 0.00 0.00 0.00 0.00 2.69 2.53 0.00 12 T 8.15 4.94 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 1.23 0.00 0.00 13 I 8.28 4.23 1.71 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.98 0.90 0.00 0.00 14 T 8.27 4.63 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 15 L 8.64 3.95 0.00 1.79 1.72 0.98 1.03 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 16 A 8.29 4.40 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 17 A 7.74 3.98 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.07 4.12 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 19 Q 8.16 4.02 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.73 0.00 0.00 0.00 0.00 0.00 2.42 2.68 0.00 20 Q 7.95 4.03 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 21 M 8.11 4.07 0.00 2.39 2.49 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 2.79 2.95 0.00 22 A 8.39 3.59 1.63 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 0.00 0.00 23 A 7.94 3.86 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 24 A 7.70 3.93 1.30 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 0.00 0.00 25 V 7.36 3.26 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 0.78 0.00 0.00 0.28 0.00 0.00 26 E 7.81 3.86 0.00 2.14 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 2.29 2.32 0.00 27 K 7.92 3.86 0.00 2.02 1.92 0.00 1.55 0.00 0.00 1.55 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.46 7.81 28 K 8.14 3.98 0.00 1.89 1.81 0.00 1.56 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.47 7.81 29 A 8.55 3.91 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 30 T 7.35 3.83 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 31 E 7.98 4.13 0.00 2.13 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 2.48 2.30 0.00 32 I 7.51 4.11 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.64 0.96 0.00 0.00 33 N 8.40 4.19 0.00 2.91 2.96 0.00 0.00 6.68 7.30 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 34 V 7.26 4.42 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 0.70 0.00 0.00 0.89 0.00 0.00 35 A 8.29 4.62 1.16 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 36 V 7.96 4.70 2.27 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 0.88 0.00 0.00 0.97 0.00 0.00 37 V 8.93 4.93 2.15 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 1.00 0.00 0.00 0.98 0.00 0.00 38 F 9.35 5.47 0.00 3.13 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 39 S 8.05 5.04 0.00 3.74 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 40 V 8.49 4.70 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 1.05 0.00 0.00 0.66 0.00 0.00 41 V 8.61 4.95 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 0.74 0.00 0.00 0.98 0.00 0.00 42 D 8.54 4.87 0.00 2.89 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 8.05 3.82 0.00 1.79 2.01 0.00 3.41 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.95 0.00 44 G 8.46 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 45 G 8.00 4.02 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 0.00 46 N 7.89 4.71 0.00 3.00 2.76 0.00 0.00 7.09 7.05 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 47 T 8.30 4.27 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 1.22 0.00 0.00 48 L 8.17 4.53 0.00 1.59 1.69 0.99 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.07 4.31 0.00 1.67 1.44 0.99 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 50 I 8.62 5.02 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.76 0.91 0.00 0.00 51 Q 9.09 4.43 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 52 R 8.61 4.82 0.00 1.86 1.83 0.00 3.53 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 53 M 8.54 4.17 0.00 2.13 1.95 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 2.86 2.52 0.00 54 D 8.79 4.41 0.00 2.64 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 55 E 7.87 4.31 0.00 1.88 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 2.21 2.20 0.00 56 A 7.47 3.80 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 57 F 7.77 4.38 0.00 3.14 2.92 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 58 V 8.54 3.94 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 0.90 0.00 0.00 0.98 0.00 0.00 59 S 8.11 4.44 0.00 4.03 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 60 S 7.95 4.55 0.00 4.20 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 C 7.72 4.00 0.00 3.25 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 D 8.08 4.41 0.00 2.69 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 63 I 7.34 3.71 1.99 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.00 1.07 0.00 0.00 64 S 8.52 4.10 0.00 3.98 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 65 L 7.82 3.90 0.00 1.80 1.64 0.92 0.68 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 66 N 8.11 4.58 0.00 2.86 3.12 0.00 0.00 7.08 7.41 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 67 K 8.40 3.90 0.00 2.00 1.84 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.53 7.81 68 A 7.84 3.93 1.39 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 69 W 8.48 4.06 0.00 3.38 3.39 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 70 S 8.33 3.63 0.00 3.86 3.83 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 71 A 7.90 4.50 1.29 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 0.00 0.00 72 C 7.83 4.03 0.00 3.04 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 73 S 7.62 3.87 0.00 2.92 3.36 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 74 L 7.88 4.27 0.00 1.55 1.59 0.83 0.77 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 75 K 7.75 3.78 0.00 1.82 1.81 0.00 1.62 0.00 0.00 1.56 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.22 7.81 76 Q 7.41 4.49 0.00 2.29 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.09 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 77 G 9.09 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 78 T 8.66 3.94 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 1.20 0.00 0.00 79 H 8.20 4.41 0.00 3.41 3.74 0.00 5.45 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.78 4.08 0.00 2.05 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 2.21 1.95 0.00 81 I 7.28 4.19 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.78 0.90 0.00 0.00 82 T 7.54 4.05 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 83 S 8.02 4.04 0.00 4.04 4.02 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 84 A 8.06 4.34 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.42 4.64 2.33 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 0.94 0.00 0.00 1.09 0.00 0.00 86 Q 7.49 4.21 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.93 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 87 P 0.00 3.12 0.00 1.77 1.41 0.00 3.57 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 1.89 1.75 0.00 88 G 8.55 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 89 Q 7.64 4.48 0.00 2.35 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.62 0.00 90 S 8.54 4.39 0.00 3.99 4.01 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 91 L 8.24 4.78 0.00 1.89 1.66 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 92 Y 7.37 4.83 0.00 3.09 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 93 G 9.07 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 94 L 8.01 3.96 0.00 1.82 1.75 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 95 Q 8.05 4.01 0.00 2.26 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 96 L 7.43 4.23 0.00 1.67 1.72 0.80 0.81 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 97 T 7.96 4.10 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 1.21 0.00 0.00 98 N 9.39 4.27 0.00 3.01 2.91 0.00 0.00 6.89 7.31 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 99 Q 8.79 3.61 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.92 0.00 0.00 0.00 0.00 0.00 2.20 2.36 0.00 100 Q 8.05 3.79 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.54 6.83 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 101 R 7.57 4.12 0.00 1.18 1.45 0.00 2.70 0.00 0.00 2.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.54 0.00 102 I 7.75 4.23 1.94 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 1.75 0.70 0.92 0.00 0.00 103 I 8.05 3.97 1.65 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 1.38 0.61 0.02 0.00 0.00 104 I 7.97 4.38 1.92 0.00 0.00 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 1.55 0.80 0.97 0.00 0.00 105 F 6.78 5.09 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 0.00 106 G 8.94 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 0.00 107 G 8.32 4.66 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 0.00 0.00 0.00 108 G 7.67 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 L 8.89 5.23 0.00 1.56 1.52 0.99 1.21 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 0.00 110 P 0.00 4.74 0.00 2.02 2.17 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 111 V 8.75 3.73 1.79 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 0.18 0.00 0.00 0.66 0.00 0.00 112 I 8.22 4.65 1.91 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 1.30 0.69 0.96 0.00 0.00 113 F 8.79 5.09 0.00 3.08 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 N 8.88 4.28 0.00 2.66 2.68 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 0.00 115 E 8.35 3.86 0.00 2.05 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 0.00 2.20 2.23 0.00 116 Q 7.86 4.38 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.98 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 117 V 8.53 4.02 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 0.81 0.00 0.00 0.89 0.00 0.00 118 I 9.04 4.63 2.01 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.98 1.14 0.00 0.00 119 G 7.20 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 0.00 120 A 8.06 5.10 1.16 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 0.00 121 V 8.91 4.75 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 0.78 0.00 0.00 1.05 0.00 0.00 122 G 8.73 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.91 5.21 2.42 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 0.94 0.00 0.00 1.23 0.00 0.00 124 S 9.67 4.87 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 0.00 125 G 9.13 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 0.00 0.00 0.00 126 G 7.90 4.01 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 0.00 0.00 0.00 127 T 8.53 4.22 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 128 V 8.17 3.70 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 1.26 0.00 0.00 0.88 0.00 0.00 129 E 8.23 3.98 0.00 2.11 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 2.42 2.49 0.00 130 Q 8.19 4.04 0.00 2.37 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 131 D 8.30 4.44 0.00 2.96 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 0.00 132 Q 8.16 4.05 0.00 2.42 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 133 L 7.97 3.91 0.00 1.96 1.75 nan 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.07 3.99 0.00 1.78 1.69 0.98 0.85 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 0.00 135 A 8.11 4.21 1.51 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 0.00 0.00 136 Q 8.14 3.93 0.00 2.33 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 137 C 8.15 4.03 0.00 3.14 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 0.00 138 A 8.02 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 139 L 7.55 4.14 0.00 1.98 1.78 1.00 1.00 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 0.00 140 D 8.10 4.44 0.00 2.84 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 0.00 141 C 8.07 4.18 0.00 3.01 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 0.00 142 F 8.30 4.03 0.00 3.22 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 0.00 143 S 8.24 4.24 0.00 4.20 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 0.00 144 A 7.96 4.37 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 0.00 145 L 6.76 4.19 0.00 1.32 1.46 0.82 0.67 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 0.00 146 E 8.13 4.10 0.00 1.96 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 2.12 2.20 0.00