NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1539 8.3044 120.3487 53.8860 34.1049 172.2255 2 H 3.6942 8.3468 122.0426 55.3663 27.6023 171.6764 3 L 4.7118 7.6658 125.6267 52.1644 46.0758 177.0078 4 T 4.1524 8.0551 111.4360 60.7648 70.9701 173.9380 5 P 4.2225 0.0000 0.0000 65.7828 31.2726 178.8028 6 E 3.9444 8.0530 116.7802 59.5988 29.4930 179.1440 7 E 3.9436 7.8798 118.6592 59.0124 29.3791 179.2668 8 K 3.7836 8.0280 119.7012 59.7790 32.2143 179.0711 9 S 4.0793 8.1468 115.0662 61.5092 62.2384 176.5959 10 A 4.0090 8.0078 123.5878 54.9111 18.0873 179.9862 11 V 3.4935 7.6544 116.8914 66.4448 31.4981 178.4906 12 T 3.9433 8.1408 115.5039 66.4245 68.0301 176.5328 13 A 4.0548 8.1482 122.0291 55.2250 18.7138 179.1000 14 L 3.8987 7.6698 117.6386 58.0647 42.1745 178.9818 15 W 4.2947 8.6097 128.2857 60.2119 30.3964 177.9227 16 G 3.8014 7.9651 104.7714 46.5404 0.0000 174.6653 17 K 4.4318 7.9059 119.1160 55.3337 32.9379 176.3472 18 V 3.7796 6.9899 120.2679 61.8487 32.2886 175.7182 19 N 4.5462 8.2739 125.1684 52.2762 39.0848 175.4290 20 V 3.5305 8.2221 128.6159 66.1372 31.6140 177.1774 21 D 4.2980 8.0780 117.0575 57.2748 41.2330 177.7151 22 E 3.8734 8.2764 119.6604 59.3904 29.7021 178.9488 23 V 3.5847 8.0485 118.7521 65.6082 31.5070 178.2214 24 G 3.8032 8.5803 106.1529 47.8421 0.0000 175.8003 25 G 3.6947 8.0932 108.9130 47.4847 0.0000 175.3310 26 E 3.9474 8.3876 121.6261 58.8373 29.6505 178.7899 27 A 3.9150 8.2213 121.0603 54.8926 18.4160 179.4341 28 L 4.2007 8.1714 119.1446 58.1384 42.2184 179.2982 29 G 3.6424 8.2095 105.7449 48.0810 0.0000 175.9122 30 R 3.9245 8.1696 120.7630 58.5144 30.0120 178.8451 31 L 4.0275 8.0073 120.2931 58.3831 42.2903 179.1752 32 L 4.1804 7.9562 119.7862 56.5475 41.2588 179.6759 33 V 3.5690 7.4136 117.9401 65.8257 31.6859 177.9133 34 V 3.5492 7.8952 116.9063 64.1864 32.7898 175.6302 35 Y 3.9663 7.1864 116.3599 54.5785 37.6239 174.3076 36 P 4.8585 0.0000 0.0000 64.1133 31.9723 178.3231 37 W 4.3466 8.0207 116.7922 59.2464 27.9129 177.4829 38 T 4.2925 7.7638 110.3438 63.5028 68.2363 175.8862 39 Q 4.2323 8.2764 121.7483 57.9192 28.5270 177.9570 40 R 3.7412 7.5617 116.0117 58.3028 29.3904 177.4839 41 F 4.3075 6.9621 115.3280 57.7508 39.5530 175.8796 42 F 4.4628 7.7033 120.7700 56.8771 39.4786 176.9519 43 E 4.1642 8.3433 121.3192 58.5883 29.5069 178.1422 44 S 4.6002 7.9691 111.6529 58.8010 63.6622 174.5833 45 F 4.6914 8.3410 119.5854 58.0096 39.9704 177.0372 46 G 4.0043 8.0292 107.5559 45.0537 0.0000 174.7563 47 D 4.4779 8.6795 126.0503 54.3595 41.1460 175.5651 48 L 4.8777 8.3745 125.8371 54.4175 42.9290 177.8205 49 S 4.2903 8.5219 117.0216 60.8787 63.1964 174.7802 50 T 4.7476 7.4325 109.3808 58.0471 73.0882 172.6375 51 P 4.2272 0.0000 0.0000 66.1424 31.3297 178.7306 52 D 4.3531 8.0704 116.7481 57.2079 40.5715 178.4866 53 A 4.0123 7.7351 120.3309 54.9677 18.7760 179.5940 54 V 3.6956 8.2342 117.1241 66.6535 31.4933 178.3662 55 M 4.2563 8.3835 117.2624 57.4562 31.8502 177.9661 56 G 4.0215 7.7741 103.4324 43.3206 0.0000 173.2298 57 N 4.4662 7.5720 121.6275 52.6359 39.4692 174.0181 58 P 4.2545 0.0000 0.0000 65.7621 31.5004 178.7832 59 K 3.6692 7.9589 118.0498 58.9033 31.8442 179.1673 60 V 3.6810 8.1741 118.6408 66.0264 31.4599 178.2141 61 K 3.9230 8.1846 117.9169 59.4735 31.9016 179.1737 62 A 3.9874 8.2995 121.4037 55.4565 18.1894 179.2225 63 H 4.3411 8.4641 116.9262 59.2147 29.9120 177.5566 64 G 3.7466 8.4156 107.9489 47.9371 0.0000 175.5535 65 K 4.0452 8.1692 122.0958 58.8819 32.2127 178.8931 66 K 3.9526 7.9509 119.6854 59.3865 32.1708 179.0021 67 V 3.4768 7.9668 118.7159 66.0774 31.5226 177.8931 68 L 4.5476 8.4273 120.0739 57.8957 41.9085 179.0748 69 G 3.8232 8.5656 106.2422 47.6271 0.0000 175.6777 70 A 4.1141 7.8611 121.9699 54.7434 18.7375 179.0283 71 F 4.3835 8.4916 119.3065 61.7033 39.6142 177.0240 72 S 3.9140 8.8539 112.9468 61.8852 62.0966 176.1403 73 D 4.4970 8.3392 121.0863 56.9507 40.4779 178.9459 74 G 3.5124 8.0219 106.4244 47.3081 0.0000 175.5987 75 L 3.9543 7.1591 119.4517 56.5672 41.5715 178.1515 76 A 4.3311 7.1900 119.0804 52.2409 19.3748 176.5952 77 H 4.9701 8.2824 115.9559 55.1549 29.9010 175.7047 78 L 3.9108 8.0941 120.2756 57.3785 41.7510 178.0914 79 D 4.7259 7.8899 116.4189 54.1916 41.6964 176.6313 80 N 4.9739 8.1039 118.4116 51.4066 39.8644 175.6265 81 L 4.1156 7.9172 121.8747 57.8196 41.7187 179.4513 82 K 4.1153 8.0741 118.1755 59.5727 31.8972 179.5480 83 G 3.6183 8.0802 104.0612 47.9983 0.0000 175.4019 84 T 3.8317 7.6986 117.2307 65.4571 68.5555 175.1441 85 F 4.7422 7.7841 116.2799 57.0479 40.0586 177.0466 86 A 4.0692 7.8629 124.0614 55.9141 18.1393 180.4833 87 T 3.8942 7.8492 113.5218 66.7238 68.6085 176.9914 88 L 4.1272 7.9669 120.4975 57.5238 41.7456 179.3429 89 S 4.3032 8.3925 113.6800 61.5784 62.3485 176.0672 90 E 3.9155 8.2087 121.3080 59.1179 29.1239 179.1314 91 L 3.8857 7.9875 120.3511 58.6713 42.2689 178.9368 92 H 4.2275 8.4466 115.8824 58.5051 28.1772 177.2857 93 C 3.5366 7.6054 120.6884 62.2654 31.1910 175.3596 94 D 4.1388 8.2117 120.0009 56.3044 40.5227 177.4067 95 K 4.3017 7.7382 116.6056 57.1850 33.9815 177.0574 96 L 4.2013 7.6490 116.6190 54.5082 42.5831 176.0269 97 H 4.0044 7.0676 114.4713 56.6736 26.4499 175.7255 98 V 4.0012 7.8329 118.5995 60.8853 32.1319 174.7324 99 D 4.3349 8.9265 127.2707 54.2468 41.4505 175.4800 100 P 3.4495 0.0000 0.0000 64.4268 31.8820 177.9585 101 E 3.9141 8.3478 119.3644 59.3236 29.2507 178.3842 102 N 4.3454 8.0663 116.5337 56.2895 38.5073 177.3176 103 F 4.5494 7.3887 119.1769 60.5103 38.9368 178.0162 104 R 4.0568 7.9998 117.4352 59.0996 30.0457 178.6438 105 L 3.8375 7.8168 118.7554 57.6087 41.5529 179.2867 106 W 4.2992 8.6903 128.6293 60.5840 30.6039 178.1726 107 G 3.4473 8.5199 105.5215 47.9167 0.0000 175.4810 108 N 4.3881 8.2778 118.9625 55.9613 38.5553 177.7878 109 V 3.5717 7.8750 119.8259 65.6792 31.5744 177.8782 110 L 3.5830 7.5508 120.4637 57.8431 41.7847 179.1532 111 V 3.4892 7.5729 118.2758 66.0671 31.4190 177.8389 112 C 4.0861 7.9448 116.5264 62.6967 27.8535 176.2500 113 V 3.5074 7.6865 119.8540 65.9120 30.9932 178.1476 114 L 3.8403 7.7470 118.5613 57.5473 41.3205 179.3367 115 A 3.6804 7.2033 120.6789 55.1927 18.0468 179.2263 116 H 4.1443 8.0178 116.0210 59.6586 30.0076 177.0140 117 H 3.8797 8.1547 117.2415 58.0551 28.9672 176.9154 118 F 4.6693 8.5117 117.6240 55.5724 40.0478 177.4623 119 G 3.9128 8.8395 108.9281 46.1245 0.0000 177.8061 120 K 4.0719 8.8846 123.2909 59.0739 32.4094 177.7161 121 E 4.0730 8.0907 119.7972 58.4790 29.8498 177.0358 122 F 4.5577 8.1446 123.1781 57.1294 37.8590 175.4855 123 T 4.2408 7.3890 115.6179 59.8863 71.3883 173.6168 124 P 4.1399 0.0000 0.0000 65.6596 31.2917 177.2669 125 P 4.1990 0.0000 0.0000 65.3935 31.2471 178.9057 126 V 3.5657 7.4320 117.0510 65.6680 31.3397 177.8486 127 Q 3.4823 8.2636 119.5865 59.0137 29.0178 177.9985 128 A 4.0097 8.2272 121.8431 55.2848 18.3861 179.5464 129 A 3.9140 7.8322 118.7908 55.6065 18.4129 179.5702 130 Y 3.9486 8.2635 115.2277 61.1280 37.9096 178.7109 131 Q 4.1033 8.6403 119.7247 58.9258 28.7081 178.9302 132 K 4.0360 8.0456 119.2149 59.2659 32.0375 179.6873 133 V 3.5516 7.5928 118.0669 66.2200 31.4604 178.6539 134 V 4.0103 8.3147 112.2120 64.1910 31.2631 178.4453 135 A 4.1319 8.3344 120.8920 55.1806 18.2818 179.8963 136 G 3.5719 8.4421 104.5889 47.9588 0.0000 176.1217 137 V 3.4434 8.4058 120.9087 65.4544 31.6138 178.0136 138 A 3.9069 8.2688 120.7163 55.3328 17.7729 179.2733 139 N 4.2809 8.5440 115.1750 56.5643 38.3731 177.5502 140 A 4.0795 7.8229 121.1653 55.0094 18.5406 179.3835 141 L 3.9347 7.6784 116.3214 56.8714 42.0351 178.4616 142 A 4.3266 7.7484 119.3468 53.0335 18.8716 178.4666 143 H 4.2609 7.7801 115.9102 58.4428 29.9287 175.7947 144 K 4.4755 8.1783 117.8428 56.1510 32.1950 176.1411 145 Y 4.2528 7.9619 117.4024 58.3794 38.4326 175.6298 146 H 4.4754 8.4043 117.5381 56.1441 28.3696 173.2435 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.15 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.56 0.00 2 H 8.35 3.69 0.00 3.39 3.33 0.00 5.72 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 3 L 7.67 4.71 0.00 1.53 1.42 0.81 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.06 4.15 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 1.17 0.00 0.00 5 P 0.00 4.22 0.00 2.15 2.13 0.00 3.57 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 6 E 8.05 3.94 0.00 2.02 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 2.38 2.45 0.00 7 E 7.88 3.94 0.00 2.02 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 2.29 2.27 0.00 8 K 8.03 3.78 0.00 1.91 1.87 0.00 1.56 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.39 7.81 9 S 8.15 4.08 0.00 4.12 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 10 A 8.01 4.01 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 11 V 7.65 3.49 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 0.61 0.00 0.00 0.37 0.00 0.00 12 T 8.14 3.94 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 1.24 0.00 0.00 13 A 8.15 4.05 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 14 L 7.67 3.90 0.00 1.85 1.89 0.06 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.61 4.29 0.00 3.80 3.20 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 0.00 16 G 7.97 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 0.00 0.00 0.00 17 K 7.91 4.43 0.00 1.99 2.08 0.00 1.74 0.00 0.00 1.61 0.00 0.00 3.27 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.47 7.81 18 V 6.99 3.78 1.19 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 0.09 0.00 0.00 0.57 0.00 0.00 19 N 8.27 4.55 0.00 2.73 2.63 0.00 0.00 6.82 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 20 V 8.22 3.53 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 1.22 0.00 0.00 1.02 0.00 0.00 21 D 8.08 4.30 0.00 2.76 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 22 E 8.28 3.87 0.00 2.08 1.88 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 2.25 2.29 0.00 23 V 8.05 3.58 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 0.83 0.00 0.00 0.60 0.00 0.00 24 G 8.58 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 0.00 0.00 0.00 25 G 8.09 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.39 3.95 0.00 2.04 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 0.00 2.26 2.29 0.00 27 A 8.22 3.91 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 28 L 8.17 4.20 0.00 1.93 1.71 1.04 1.01 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 29 G 8.21 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.17 3.92 0.00 1.90 1.92 0.00 3.06 0.00 0.00 3.01 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 31 L 8.01 4.03 0.00 1.96 1.99 1.06 0.71 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 32 L 7.96 4.18 0.00 1.88 1.72 0.78 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.41 3.57 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.95 0.00 0.00 34 V 7.90 3.55 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 -0.12 0.00 0.00 0.76 0.00 0.00 35 Y 7.19 3.97 0.00 2.58 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.86 0.00 2.33 2.31 0.00 3.83 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.94 0.00 37 W 8.02 4.35 0.00 3.55 3.49 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 38 T 7.76 4.29 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 39 Q 8.28 4.23 0.00 2.26 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 40 R 7.56 3.74 0.00 1.65 1.98 0.00 2.92 0.00 0.00 2.60 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 6.96 4.31 0.00 1.59 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 0.00 0.00 0.00 0.00 42 F 7.70 4.46 0.00 2.80 2.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.34 4.16 0.00 1.95 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 0.00 2.25 2.20 0.00 44 S 7.97 4.60 0.00 4.11 4.07 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 45 F 8.34 4.69 0.00 3.22 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 46 G 8.03 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 47 D 8.68 4.48 0.00 2.66 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 48 L 8.37 4.88 0.00 1.67 1.64 1.02 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.52 4.29 0.00 4.01 4.29 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 50 T 7.43 4.75 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 1.21 0.00 0.00 51 P 0.00 4.23 0.00 2.15 2.12 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 52 D 8.07 4.35 0.00 2.68 2.70 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 53 A 7.74 4.01 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.23 3.70 2.21 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 1.08 0.00 0.00 0.98 0.00 0.00 55 M 8.38 4.26 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.89 0.00 56 G 7.77 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 57 N 7.57 4.47 0.00 3.03 2.86 0.00 0.00 6.90 7.09 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 58 P 0.00 4.25 0.00 2.25 2.26 0.00 3.73 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 59 K 7.96 3.67 0.00 1.55 0.74 0.00 1.60 0.00 0.00 1.35 0.00 0.00 2.73 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.34 7.81 60 V 8.17 3.68 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 1.11 0.00 0.00 1.04 0.00 0.00 61 K 8.18 3.92 0.00 1.97 1.83 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.52 7.81 62 A 8.30 3.99 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 63 H 8.46 4.34 0.00 3.56 3.45 0.00 5.80 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 64 G 8.42 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 0.00 0.00 0.00 65 K 8.17 4.05 0.00 1.89 1.97 0.00 1.81 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.50 7.81 66 K 7.95 3.95 0.00 2.02 1.95 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.49 7.81 67 V 7.97 3.48 2.19 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 0.43 0.00 0.00 0.74 0.00 0.00 68 L 8.43 4.55 0.00 2.18 1.89 1.40 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.57 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 70 A 7.86 4.11 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 71 F 8.49 4.38 0.00 3.29 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 72 S 8.85 3.91 0.00 4.55 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 73 D 8.34 4.50 0.00 2.73 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 74 G 8.02 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.16 3.95 0.00 1.44 1.37 -0.54 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.19 4.33 1.04 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 77 H 8.28 4.97 0.00 3.09 3.12 0.00 5.65 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.09 3.91 0.00 1.52 1.66 0.76 0.94 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 79 D 7.89 4.73 0.00 2.64 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 80 N 8.10 4.97 0.00 2.70 2.59 0.00 0.00 7.20 7.49 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 81 L 7.92 4.12 0.00 1.78 1.86 0.93 0.81 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 82 K 8.07 4.12 0.00 1.75 1.78 0.00 1.53 0.00 0.00 1.34 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.46 7.81 83 G 8.08 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 0.00 0.00 0.00 84 T 7.70 3.83 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 0.59 0.00 0.00 85 F 7.78 4.74 0.00 3.18 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 86 A 7.86 4.07 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 87 T 7.85 3.89 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 1.21 0.00 0.00 88 L 7.97 4.13 0.00 1.98 1.82 1.10 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.39 4.30 0.00 4.16 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 90 E 8.21 3.92 0.00 2.17 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 2.32 2.57 0.00 91 L 7.99 3.89 0.00 1.84 1.85 0.89 0.81 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 92 H 8.45 4.23 0.00 3.48 3.66 0.00 5.86 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 93 C 7.61 3.54 0.00 1.23 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.21 4.14 0.00 2.67 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 95 K 7.74 4.30 0.00 1.77 1.77 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.29 1.33 7.81 96 L 7.65 4.20 0.00 1.71 1.60 0.65 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.07 4.00 0.00 3.41 3.41 0.00 5.64 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.83 4.00 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 0.15 0.00 0.00 0.45 0.00 0.00 99 D 8.93 4.33 0.00 2.79 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 3.45 0.00 1.99 1.87 0.00 3.44 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.59 0.00 101 E 8.35 3.91 0.00 2.13 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 2.33 2.43 0.00 102 N 8.07 4.35 0.00 2.45 2.77 0.00 0.00 6.95 7.75 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 0.00 103 F 7.39 4.55 0.00 3.16 2.95 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 0.00 104 R 8.00 4.06 0.00 1.98 2.01 0.00 3.15 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.91 0.00 105 L 7.82 3.84 0.00 1.81 1.41 0.80 0.23 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 0.00 106 W 8.69 4.30 0.00 3.49 3.49 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 0.00 107 G 8.52 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.28 4.39 0.00 2.91 2.91 0.00 0.00 6.68 6.97 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 0.00 109 V 7.88 3.57 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 0.96 0.00 0.00 1.12 0.00 0.00 110 L 7.55 3.58 0.00 0.54 1.05 0.73 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.57 3.49 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 1.27 0.00 0.00 1.09 0.00 0.00 112 C 7.94 4.09 0.00 3.10 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 0.00 113 V 7.69 3.51 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 0.97 0.00 0.00 0.83 0.00 0.00 114 L 7.75 3.84 0.00 0.93 1.01 0.56 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.20 3.68 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 0.00 116 H 8.02 4.14 0.00 3.15 3.41 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 0.00 117 H 8.15 3.88 0.00 2.97 2.36 0.00 5.87 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 0.00 118 F 8.51 4.67 0.00 3.19 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 0.00 119 G 8.84 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 0.00 0.00 0.00 120 K 8.88 4.07 0.00 1.91 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.48 7.81 121 E 8.09 4.07 0.00 2.17 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 0.00 2.35 2.30 0.00 122 F 8.14 4.56 0.00 3.01 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.39 4.24 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 1.28 0.00 0.00 124 P 0.00 4.14 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.20 0.00 2.11 2.06 0.00 3.47 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 2.08 2.11 0.00 126 V 7.43 3.57 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 0.93 0.00 0.00 0.89 0.00 0.00 127 Q 8.26 3.48 0.00 1.68 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 128 A 8.23 4.01 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 0.00 129 A 7.83 3.91 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 0.00 130 Y 8.26 3.95 0.00 3.22 3.24 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 0.00 131 Q 8.64 4.10 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 132 K 8.05 4.04 0.00 1.96 1.85 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.60 7.81 133 V 7.59 3.55 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 0.95 0.00 0.00 0.79 0.00 0.00 134 V 8.31 4.01 2.20 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 0.88 0.00 0.00 1.11 0.00 0.00 135 A 8.33 4.13 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.44 3.57 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 0.00 0.00 0.00 137 V 8.41 3.44 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.04 0.00 0.00 138 A 8.27 3.91 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 0.00 139 N 8.54 4.28 0.00 2.86 2.90 0.00 0.00 6.97 7.13 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 0.00 140 A 7.82 4.08 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.68 3.93 0.00 1.06 0.78 -0.25 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.75 4.33 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 0.00 143 H 7.78 4.26 0.00 3.36 3.51 0.00 5.76 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.18 4.48 0.00 1.82 1.83 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.68 7.81 145 Y 7.96 4.25 0.00 3.09 2.96 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 0.00 146 H 8.40 4.48 0.00 3.21 3.22 0.00 5.75 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