NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.8275 8.2493 122.4696 52.7327 20.3241 175.2573 2 T 4.4607 8.3504 107.3873 60.5462 72.3354 171.1346 3 K 5.3186 8.9735 122.6044 54.9793 37.1895 176.1180 4 A 5.3212 9.0781 123.4385 50.8972 23.3923 175.1619 5 V 4.9957 8.8266 117.4454 60.9343 35.5578 173.5553 6 C 4.9127 9.0302 121.5327 58.1916 35.4287 172.5369 7 V 4.6159 8.5246 126.0772 61.4171 33.2641 173.9694 8 L 4.9823 8.9098 128.9551 53.4716 43.4603 175.9879 9 K 5.0017 9.0779 121.9701 55.6789 37.0821 175.9903 10 G 4.3645 7.9628 108.6297 46.0346 0.0000 172.5719 11 D 4.5768 8.8368 118.8663 55.1621 41.8732 176.3736 12 G 4.3973 7.5902 108.8946 43.7964 0.0000 171.3799 13 P 4.4894 0.0000 0.0000 63.1360 32.0238 176.1487 14 V 4.3389 7.4099 120.2553 62.8779 32.0232 175.1159 15 Q 4.8086 8.5322 125.4397 54.7888 33.5905 173.8329 16 G 4.4676 8.6897 108.3168 45.7992 0.0000 171.8940 17 I 5.1527 8.4563 119.9452 59.4477 41.0636 174.9431 18 I 4.6780 8.7722 127.7179 59.4470 40.3269 174.3794 19 N 5.0047 8.3091 124.2456 51.3792 41.1292 173.9535 20 F 5.3758 8.8443 119.9726 55.8233 43.2037 173.7258 21 E 5.2314 9.6718 122.8070 54.7599 33.7452 173.8250 22 Q 4.7976 9.2895 127.1369 54.3704 31.3356 175.8742 23 K 4.1229 9.0364 127.2681 58.6884 32.7049 177.5501 24 E 4.7833 7.7678 116.2548 53.8613 33.2674 175.0936 25 S 4.2153 8.6791 117.5028 60.5247 63.2397 174.2599 26 N 4.1435 8.9152 119.8744 53.9295 36.0044 174.3303 27 G 4.0144 7.9022 108.1780 43.3541 0.0000 172.0726 28 P 4.6207 0.0000 0.0000 62.6754 32.2281 176.4117 29 V 4.6518 8.8348 122.9408 61.1649 33.9527 174.7524 30 K 4.8482 9.1966 128.2341 56.0611 33.7709 176.0929 31 V 4.8248 9.1799 124.7838 60.8343 34.4249 174.1923 32 W 5.5788 8.3111 124.3304 54.3676 31.5985 175.2277 33 G 4.1355 8.0079 108.7639 46.2933 0.0000 171.2636 34 S 5.0551 7.9469 116.4431 57.1266 66.5740 173.8251 35 I 5.1406 8.6196 126.0866 59.3536 41.1485 174.5958 36 K 4.8575 9.1699 124.9699 55.5810 36.2021 177.0004 37 G 3.9027 8.9765 107.2110 45.4124 0.0000 173.5869 38 L 4.3567 7.5969 120.0209 53.3764 42.7897 176.6302 39 T 4.3029 8.1215 111.0045 61.1390 69.7457 174.2813 40 E 4.1808 8.6341 122.8205 58.0881 30.4360 175.6236 41 G 4.1239 8.5317 107.7277 43.8542 0.0000 172.0355 42 L 4.6706 8.2868 119.6137 54.9257 42.6568 176.5271 43 H 4.9887 9.3634 120.5227 53.5484 32.6350 173.4210 44 G 4.0088 9.1392 111.1832 46.7117 0.0000 172.3817 45 F 5.5930 9.0536 124.4966 56.9622 42.5406 173.0499 46 H 5.3916 9.1471 122.7189 54.0927 33.6820 172.7977 47 V 4.4876 8.6538 122.1062 62.2591 32.7692 174.9432 48 H 5.0034 9.3259 125.9051 54.7231 30.2605 176.1366 49 E 3.7142 8.8824 122.8933 58.8541 29.8392 177.1111 50 F 4.9728 8.2179 118.5154 54.8722 41.3669 177.1106 51 G 4.2804 8.3202 113.3217 44.3170 0.0000 174.3927 52 D 4.7187 7.8503 117.0986 52.7413 42.7274 174.0028 53 N 5.1814 8.8117 123.9786 52.6954 39.1580 175.7173 54 T 3.9635 8.5167 109.7543 63.4237 68.7255 174.5140 55 A 4.7179 8.0053 125.6328 51.4622 20.0664 176.4222 56 G 4.0516 7.9152 111.4142 47.9249 0.0000 176.8564 57 C 4.4591 8.5933 116.6065 59.1436 39.2420 175.8448 58 T 3.7805 7.6721 116.4380 66.4233 68.0798 175.8416 59 S 4.5158 7.9867 112.7485 58.6322 63.3171 174.5281 60 A 4.4053 7.4580 123.6509 52.3431 18.5869 179.2669 61 G 4.0004 7.5098 104.9182 43.8946 0.0000 170.6135 62 P 4.7474 0.0000 0.0000 61.9827 34.1256 174.9503 63 H 4.3878 8.4609 116.4441 55.7614 29.4822 175.6039 64 F 4.3062 9.1104 125.9566 57.9124 40.2460 175.2547 65 N 4.9619 7.8071 125.4363 51.8088 39.0007 173.0768 66 P 4.1623 0.0000 0.0000 65.0847 32.1435 177.9017 67 L 4.1817 7.5823 116.6267 54.0084 42.3438 176.1479 68 S 3.5895 7.5416 114.2821 59.8661 60.5827 171.1440 69 R 4.5557 8.0884 117.9104 53.8838 32.8235 176.5349 70 K 4.3439 8.0255 117.9532 56.7195 34.2605 175.8685 71 H 3.9983 8.7525 121.8141 56.3273 30.1163 175.2503 72 G 3.5223 7.2472 112.2060 46.9621 0.0000 171.6086 73 G 4.0843 8.5791 114.9262 46.0273 0.0000 172.6414 74 P 4.3266 0.0000 0.0000 63.5833 32.1789 176.6351 75 K 4.5188 7.7682 119.0615 54.2704 33.4516 176.6296 76 D 4.3456 8.8856 124.4644 57.2923 40.8588 177.3711 77 E 4.3335 8.0260 115.3320 56.8855 30.6218 175.9680 78 E 4.6861 7.7672 118.5934 53.1628 29.6453 174.0278 79 R 4.5276 6.8862 113.6887 56.4094 32.4626 174.7923 80 H 4.4876 8.7276 116.2040 55.1205 29.4425 176.9525 81 V 3.4760 8.4257 122.9078 66.5077 31.3238 177.2102 82 G 3.8925 8.3442 104.3662 47.1700 0.0000 173.1617 83 D 5.0578 8.1362 121.4753 53.3826 40.8744 176.1462 84 L 4.7612 8.2901 124.9317 53.2016 42.7234 179.0398 85 R 3.9124 8.4974 122.0705 57.7484 28.2024 177.6048 86 N 5.6516 8.7248 122.1471 52.6205 42.1210 173.0847 87 V 4.1980 8.5155 114.9848 60.4238 34.5185 175.1859 88 T 5.0231 8.1313 118.0352 61.8984 71.4540 173.5100 89 A 4.7386 8.9625 129.2915 49.8831 21.1983 179.3415 90 D 4.9519 9.0349 125.1873 52.3769 38.5520 179.4451 91 K 4.8501 9.0533 115.3015 59.2012 32.2757 176.9490 92 D 4.6072 8.4653 116.9082 53.4130 40.9749 176.5318 93 G 4.2161 8.0189 106.8720 46.2991 0.0000 173.0053 94 V 4.7599 7.8513 119.1338 60.7102 33.9259 173.9280 95 A 5.1449 8.8648 130.1215 49.5900 21.1138 174.9286 96 D 4.6814 8.6718 123.3258 53.1244 42.2178 175.5611 97 V 4.1181 8.5588 127.6410 61.7296 33.2809 175.1079 98 S 5.1629 8.5111 123.1912 57.7675 63.7618 172.5571 99 I 4.8711 9.3128 120.7156 59.1687 41.8453 173.4124 100 E 5.1887 8.7554 122.3977 54.4496 32.1870 174.0779 101 D 5.0097 9.3599 126.2116 52.7282 44.3731 176.0071 102 S 4.6789 8.9647 119.7733 58.4847 63.7715 174.5254 103 V 4.1857 8.1576 120.8509 64.0726 32.5957 176.4367 104 I 4.0386 7.8472 111.0701 61.1744 38.2113 174.4567 105 S 4.6596 8.2441 114.1614 57.4469 65.3609 173.8994 106 L 4.4206 8.8148 122.4188 54.1109 41.5600 176.2462 107 S 4.4504 7.8794 112.8836 58.2517 66.3854 175.2686 108 G 3.8645 8.4639 108.7483 45.0634 0.0000 173.4845 109 D 4.6605 8.6893 117.1921 54.9758 39.9921 176.3246 110 H 4.9177 8.0763 116.2831 55.7201 28.9757 174.3139 111 C 4.4914 8.0563 121.3651 59.5839 31.8434 173.4752 112 I 3.8856 8.1371 119.1778 60.5868 38.2013 175.7496 113 I 3.6833 7.3035 123.0400 62.8063 37.4655 176.3071 114 G 3.8084 9.3749 113.2126 45.4344 0.0000 172.7940 115 R 4.9479 7.4638 118.8840 54.6969 33.9479 174.5298 116 T 4.9708 8.0693 115.6437 62.0145 70.9613 173.8204 117 L 4.8172 8.6381 128.9789 54.0310 43.9836 175.3600 118 V 5.0429 8.9218 126.0064 60.9887 35.1359 174.2027 119 V 5.1277 8.6709 126.7053 60.4611 33.7490 174.6389 120 H 5.2726 8.8771 121.1844 54.0065 30.7575 174.5941 121 E 4.2043 9.1395 121.8007 58.8354 30.0472 176.6188 122 K 4.7861 8.2922 116.8507 53.7054 36.1683 175.8243 123 A 4.3973 8.3050 123.7417 52.1041 18.9093 176.4752 124 D 4.9064 9.2898 122.8309 54.0886 41.7271 176.0867 125 D 4.5359 9.2169 125.4898 53.3544 39.9457 177.1235 126 L 3.6079 9.8663 119.6047 55.8478 39.6407 175.9499 127 G 4.1217 8.7938 106.0779 45.5115 0.0000 174.5674 128 K 4.5415 8.1830 118.1627 56.0485 32.4573 178.0909 129 G 3.3994 7.7606 108.3274 45.9342 0.0000 175.3331 130 G 3.8941 8.3023 106.9428 45.6017 0.0000 172.6827 131 N 5.0964 7.6587 114.6044 49.6783 40.6591 174.7081 132 E 4.0790 8.7764 118.0452 59.6244 29.3990 179.2866 133 E 3.9248 8.2125 118.7246 58.9818 29.4672 178.4863 134 S 4.1377 8.3369 113.8808 61.2933 62.3627 175.3483 135 T 4.3284 7.7077 110.2697 62.1156 68.6338 175.4666 136 K 4.2009 7.6719 121.3906 58.1675 33.6397 176.5023 137 T 4.0717 8.1218 105.8268 60.2158 70.5247 175.0743 138 G 3.8366 7.7427 109.9121 44.5465 0.0000 173.0153 139 N 4.2756 7.5277 114.9558 54.4108 36.5866 174.6234 140 A 4.5281 7.4788 117.7375 50.9857 19.6190 179.7857 141 G 4.1106 7.9159 105.6200 45.2424 0.0000 173.7744 142 S 4.4029 8.7373 114.4441 58.4654 64.7729 174.2410 143 R 4.3309 8.3592 120.1800 55.3436 29.5998 176.3858 144 L 4.3270 8.8516 125.8619 57.2333 43.0690 177.2207 145 A 5.0003 7.7229 118.0851 51.1882 22.9726 173.9141 146 C 5.5908 8.4689 113.3976 55.9490 47.0153 172.6811 147 G 4.6681 8.0502 103.6792 46.2018 0.0000 172.7034 148 V 4.4599 8.3343 121.1583 62.3436 32.8196 175.4341 149 I 4.2167 8.7879 129.2926 60.7828 38.1768 175.3248 150 G 4.4203 8.9216 114.4235 43.9246 0.0000 172.3449 151 I 4.2843 8.3059 121.4936 61.1363 37.6278 175.4780 152 A 4.8335 8.3655 127.7403 49.5565 22.2653 176.1040 153 Q 4.0704 8.5341 118.6923 56.4652 29.1945 176.0553 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 A 8.25 4.83 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 2 T 8.35 4.46 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 3 K 8.97 5.32 0.00 1.73 1.76 0.00 1.79 0.00 0.00 1.93 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.50 7.81 4 A 9.08 5.32 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.83 5.00 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 0.81 0.00 0.00 0.97 0.00 0.00 6 C 9.03 4.91 0.00 3.15 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 7 V 8.52 4.62 2.08 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 8.91 4.98 0.00 1.71 1.59 1.04 0.48 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 9 K 9.08 5.00 0.00 1.65 1.63 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.39 7.81 10 G 7.96 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 0.00 0.00 0.00 0.00 11 D 8.84 4.58 0.00 2.68 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 12 G 7.59 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.49 0.00 2.18 2.16 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 14 V 7.41 4.34 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 1.20 0.00 0.00 0.93 0.00 0.00 15 Q 8.53 4.81 0.00 1.97 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.41 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 16 G 8.69 4.47 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 0.00 17 I 8.46 5.15 1.82 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 1.20 1.06 0.83 0.00 0.00 18 I 8.77 4.68 1.81 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.39 0.40 0.00 0.00 19 N 8.31 5.00 0.00 1.44 1.42 0.00 0.00 6.39 8.17 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 20 F 8.84 5.38 0.00 2.87 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 21 E 9.67 5.23 0.00 2.44 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 2.32 2.39 0.00 22 Q 9.29 4.80 0.00 2.19 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.53 0.00 23 K 9.04 4.12 0.00 1.81 1.87 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.42 7.81 24 E 7.77 4.78 0.00 1.98 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 0.00 2.29 2.31 0.00 25 S 8.68 4.22 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 26 N 8.92 4.14 0.00 2.87 2.90 0.00 0.00 6.96 7.65 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 27 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 28 P 0.00 4.62 0.00 2.11 2.04 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 29 V 8.83 4.65 2.22 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 1.33 0.00 0.00 1.09 0.00 0.00 30 K 9.20 4.85 0.00 1.97 1.85 0.00 1.55 0.00 0.00 1.44 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.49 1.45 7.81 31 V 9.18 4.82 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 1.14 0.00 0.00 32 W 8.31 5.58 0.00 3.49 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 33 G 8.01 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.95 5.06 0.00 3.90 3.63 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 35 I 8.62 5.14 1.77 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 1.26 0.54 0.90 0.00 0.00 36 K 9.17 4.86 0.00 1.75 1.86 0.00 1.31 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.33 7.81 37 G 8.98 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 0.00 0.00 0.00 38 L 7.60 4.36 0.00 1.78 1.34 0.77 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.12 4.30 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 1.24 0.00 0.00 40 E 8.63 4.18 0.00 2.06 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 2.40 2.34 0.00 41 G 8.53 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.29 4.67 0.00 1.51 1.60 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.36 4.99 0.00 2.97 3.30 0.00 5.63 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 44 G 9.14 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 45 F 9.05 5.59 0.00 2.93 3.07 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 0.00 0.00 0.00 46 H 9.15 5.39 0.00 3.17 2.92 0.00 5.67 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.65 4.49 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 0.89 0.00 0.00 0.86 0.00 0.00 48 H 9.33 5.00 0.00 3.04 3.39 0.00 5.68 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 49 E 8.88 3.71 0.00 1.65 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 1.50 2.13 0.00 50 F 8.22 4.97 0.00 3.01 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 51 G 8.32 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 52 D 7.85 4.72 0.00 2.61 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 N 8.81 5.18 0.00 2.70 2.75 0.00 0.00 7.37 7.70 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 54 T 8.52 3.96 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 55 A 8.01 4.72 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 56 G 7.92 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 0.00 0.00 0.00 57 C 8.59 4.46 0.00 2.98 3.09 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 58 T 7.67 3.78 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 59 S 7.99 4.52 0.00 4.09 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 60 A 7.46 4.41 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 61 G 7.51 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.75 0.00 2.04 2.21 0.00 3.46 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 2.01 1.96 0.00 63 H 8.46 4.39 0.00 2.79 3.16 0.00 5.72 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 64 F 9.11 4.31 0.00 2.88 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 65 N 7.81 4.96 0.00 2.58 2.43 0.00 0.00 6.95 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 66 P 0.00 4.16 0.00 2.02 1.90 0.00 2.98 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 1.49 1.24 0.00 67 L 7.58 4.18 0.00 1.54 1.67 0.84 0.88 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 68 S 7.54 3.59 0.00 3.97 3.86 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 R 8.09 4.56 0.00 1.86 1.81 0.00 3.11 0.00 0.00 3.40 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 70 K 8.03 4.34 0.00 1.80 1.91 0.00 1.48 0.00 0.00 1.72 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.44 1.37 7.81 71 H 8.75 4.00 0.00 3.19 3.21 0.00 5.99 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 72 G 7.25 3.52 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 0.00 73 G 8.58 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 0.00 0.00 0.00 74 P 0.00 4.33 0.00 2.19 2.20 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 75 K 7.77 4.52 0.00 1.81 1.75 0.00 1.80 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.42 7.81 76 D 8.89 4.35 0.00 2.65 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 77 E 8.03 4.33 0.00 1.94 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 2.27 2.26 0.00 78 E 7.77 4.69 0.00 1.95 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 2.19 2.18 0.00 79 R 6.89 4.53 0.00 1.91 1.79 0.00 2.62 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.48 0.00 80 H 8.73 4.49 0.00 3.47 3.37 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.43 3.48 1.55 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 0.90 0.00 0.00 0.56 0.00 0.00 82 G 8.34 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 D 8.14 5.06 0.00 2.65 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 84 L 8.29 4.76 0.00 1.77 1.85 0.77 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.50 3.91 0.00 2.13 1.37 0.00 3.10 0.00 0.00 3.53 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 86 N 8.72 5.65 0.00 2.57 2.67 0.00 0.00 6.71 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 87 V 8.52 4.20 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 -0.29 0.00 0.00 0.77 0.00 0.00 88 T 8.13 5.02 4.22 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 1.20 0.00 0.00 89 A 8.96 4.74 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 90 D 9.03 4.95 0.00 2.89 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 91 K 9.05 4.85 0.00 1.94 1.99 0.00 1.16 0.00 0.00 2.36 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.43 7.81 92 D 8.47 4.61 0.00 2.82 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 93 G 8.02 4.22 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 94 V 7.85 4.76 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 1.05 0.00 0.00 0.92 0.00 0.00 95 A 8.86 5.14 1.13 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 0.00 0.00 96 D 8.67 4.68 0.00 2.69 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 97 V 8.56 4.12 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 0.84 0.00 0.00 0.67 0.00 0.00 98 S 8.51 5.16 0.00 3.92 3.75 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 99 I 9.31 4.87 1.94 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.12 0.96 0.00 0.00 100 E 8.76 5.19 0.00 1.98 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 2.22 2.32 0.00 101 D 9.36 5.01 0.00 2.87 2.54 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 0.00 102 S 8.96 4.68 0.00 4.08 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 0.00 103 V 8.16 4.19 2.22 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 0.83 0.00 0.00 1.01 0.00 0.00 104 I 7.85 4.04 1.92 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.81 1.04 0.00 0.00 105 S 8.24 4.66 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 0.00 106 L 8.81 4.42 0.00 1.78 1.62 1.03 0.85 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 0.00 107 S 7.88 4.45 0.00 3.90 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.46 3.86 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 0.00 0.00 0.00 109 D 8.69 4.66 0.00 2.84 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 0.00 110 H 8.08 4.92 0.00 3.14 3.50 0.00 5.72 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 0.00 111 C 8.06 4.49 0.00 3.16 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 0.00 112 I 8.14 3.89 1.61 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.12 0.91 0.00 0.00 113 I 7.30 3.68 1.77 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 1.20 0.37 0.88 0.00 0.00 114 G 9.37 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 0.00 115 R 7.46 4.95 0.00 1.58 1.82 0.00 2.21 0.00 0.00 2.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.31 0.00 116 T 8.07 4.97 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 117 L 8.64 4.82 0.00 1.79 1.54 0.48 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.92 5.04 2.13 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 0.78 0.00 0.00 0.83 0.00 0.00 119 V 8.67 5.13 2.26 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 0.81 0.00 0.00 0.94 0.00 0.00 120 H 8.88 5.27 0.00 3.30 3.54 0.00 5.66 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.14 4.20 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 122 K 8.29 4.79 0.00 1.74 1.66 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.37 7.81 123 A 8.30 4.40 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 9.29 4.91 0.00 2.68 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 9.22 4.54 0.00 2.94 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 0.00 126 L 9.87 3.61 0.00 1.87 1.81 0.94 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.79 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 8.18 4.54 0.00 1.94 1.78 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.34 7.81 129 G 7.76 3.40 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 0.00 130 G 8.30 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 N 7.66 5.10 0.00 2.75 2.75 0.00 0.00 6.24 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 0.00 132 E 8.78 4.08 0.00 1.99 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 2.40 2.31 0.00 133 E 8.21 3.92 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 134 S 8.34 4.14 0.00 4.10 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 0.00 135 T 7.71 4.33 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 136 K 7.67 4.20 0.00 1.73 2.02 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.27 1.44 7.81 137 T 8.12 4.07 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 1.20 0.00 0.00 138 G 7.74 3.84 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 0.00 0.00 0.00 139 N 7.53 4.28 0.00 2.96 2.92 0.00 0.00 6.85 7.37 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 0.00 140 A 7.48 4.53 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 G 7.92 4.11 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 0.00 0.00 0.00 142 S 8.74 4.40 0.00 3.92 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 0.00 143 R 8.36 4.33 0.00 1.67 1.85 0.00 3.23 0.00 0.00 3.10 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.65 0.00 144 L 8.85 4.33 0.00 1.70 1.70 0.99 0.32 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 0.00 145 A 7.72 5.00 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 0.00 146 C 8.47 5.59 0.00 3.04 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 0.00 147 G 8.05 4.67 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 0.00 0.00 0.00 148 V 8.33 4.46 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 0.77 0.00 0.00 0.92 0.00 0.00 149 I 8.79 4.22 1.81 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.37 0.51 0.00 0.00 150 G 8.92 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.31 4.28 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 1.25 0.54 0.91 0.00 0.00 152 A 8.37 4.83 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 0.00 153 Q 8.53 4.07 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00