NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5195 8.3049 118.1959 55.1283 32.5837 174.5419 2 R 4.5478 8.0989 118.2472 54.0319 33.9971 174.2332 3 D 4.3668 9.8442 122.8417 55.9270 42.3652 176.7625 4 M 3.5744 9.4719 123.7290 55.3381 31.0414 176.4534 5 I 4.9913 7.0970 109.0653 59.4152 40.8887 174.6684 6 H 4.6749 9.5935 121.4511 58.5311 29.4711 174.9447 7 N 4.7963 7.5700 112.7894 52.2522 40.6892 173.3438 8 I 4.8465 8.4767 119.7670 59.6687 40.9044 175.0091 9 S 5.0795 8.9359 123.8626 57.4821 64.3994 172.9425 10 Y 5.3804 8.4119 121.1132 55.6218 41.8866 173.6713 11 C 5.2359 9.2232 120.7469 58.0646 35.6064 172.6232 12 L 4.9679 9.0994 124.6142 55.1885 43.9737 173.9017 13 M 5.1098 8.6340 118.4189 53.4809 35.4888 175.6444 14 V 4.4870 8.4788 121.7511 61.4963 34.2364 175.2314 15 Y 4.4599 9.9820 126.9453 56.6354 39.0839 177.0655 16 G 3.7246 8.8680 110.1618 49.0737 0.0000 174.9557 17 T 4.2021 7.8757 107.3039 62.3643 69.5002 174.6197 18 E 4.2137 7.8704 122.3872 55.9587 30.5282 176.3156 19 D 4.6225 8.4250 121.1642 53.2151 42.0217 176.6290 20 E 3.9582 8.8670 128.6380 59.6098 29.5312 178.4417 21 E 3.9665 8.3486 118.4628 59.4278 29.4754 179.5268 22 K 4.0763 8.1799 118.0383 59.2213 32.0985 179.4202 23 V 3.5964 7.8120 118.6836 66.1469 31.3912 178.2538 24 I 3.7111 8.0529 119.7550 64.1288 36.6976 177.7966 25 E 3.9005 8.4107 119.5819 59.3150 29.6882 178.4845 26 A 4.1376 8.1725 120.6340 55.1656 18.4080 179.1294 27 L 3.8063 8.0383 118.9098 58.5106 41.9305 178.9840 28 R 4.2787 8.1231 115.1154 57.5664 30.1655 177.4937 29 N 4.7512 7.9437 115.7759 53.8080 38.9333 175.2735 30 V 4.4597 7.5449 118.6155 63.8062 33.4349 175.5007 31 I 4.5960 8.3057 123.6751 58.1988 37.9953 172.7061 32 P 4.5187 0.0000 0.0000 63.8396 31.7015 177.5736 33 G 3.9072 8.9102 109.3338 45.2178 0.0000 173.6631 34 A 4.0452 7.6579 123.3364 52.4910 18.6623 177.9013 35 T 4.5181 8.2561 112.5340 58.7588 69.1651 171.6932 36 P 4.8936 0.0000 0.0000 62.4456 32.7423 176.1107 37 E 4.3411 9.3337 121.3624 56.4326 30.9125 175.8184 38 R 5.2442 8.4011 121.1147 54.6942 32.6508 175.4731 39 E 4.7203 8.8022 119.7559 54.9297 33.3388 174.2522 40 S 4.7707 8.6928 117.5381 58.6169 63.6027 172.8145 41 A 4.6119 8.8822 126.9393 51.3656 22.7922 173.9857 42 E 4.9390 8.8023 115.5668 54.7663 32.2165 177.2543 43 G 4.2500 9.2034 114.5047 44.5912 0.0000 172.2232 44 Y 4.3533 9.1289 123.1231 59.9510 39.0772 176.9928 45 H 3.6297 9.3898 121.9947 56.7096 26.3497 175.4342 46 G 3.9452 8.3571 105.2041 45.9817 0.0000 174.1845 47 N 4.7509 8.1399 118.3127 52.1805 39.6435 172.9134 48 P 4.9359 0.0000 0.0000 62.8833 32.2809 175.4929 49 I 4.7056 8.7961 115.9320 59.4207 41.7278 173.9038 50 T 4.7423 8.2725 119.9200 62.4491 70.3352 174.0781 51 V 4.3998 9.1509 127.8265 61.8576 33.4220 174.4559 52 L 5.1761 9.1333 128.5918 53.5032 43.3198 175.7824 53 R 4.9186 8.6869 122.8624 54.6052 34.3347 174.8862 54 G 3.7847 7.2316 106.4154 45.2313 0.0000 172.1371 55 R 4.8995 8.2943 120.6700 54.1819 32.5706 174.0620 56 L 4.8389 9.2201 129.5469 53.2627 44.0947 176.1298 57 D 4.9593 8.6083 122.6768 51.9483 40.9859 176.1395 58 R 3.9769 7.9313 120.4355 56.3511 31.1139 176.7066 59 R 3.9083 8.7899 124.0201 59.8827 30.0461 178.6229 60 R 3.9318 8.0192 116.7399 59.3073 30.0816 178.8255 61 A 4.0862 7.9599 120.0383 55.1382 18.5013 179.5383 62 L 4.0077 8.1716 117.6245 57.9652 41.6795 180.0221 63 R 4.0299 8.2735 118.1812 59.1425 30.1407 178.5690 64 E 3.9860 8.2951 119.2429 59.1486 29.5271 178.6430 65 F 4.2317 8.6173 120.8044 61.7906 39.5224 177.0731 66 M 4.1314 8.4657 118.2658 58.2785 31.8184 178.5274 67 E 3.9297 8.3286 118.8410 59.4528 29.6251 179.4485 68 K 3.7619 7.7938 119.2965 59.1149 32.1283 178.4328 69 F 3.9852 8.4403 121.4442 61.7270 39.3107 177.2361 70 T 3.9204 8.4841 115.5547 66.6826 68.0255 176.4949 71 E 3.7992 7.5706 118.8228 59.2465 29.5414 179.2914 72 V 3.2649 7.2327 117.0604 65.3434 31.7553 177.2620 73 F 4.8330 7.5198 114.7874 55.5886 39.1501 175.4139 74 R 4.0581 7.2679 119.7001 58.1233 30.0093 176.2230 75 G 4.0275 8.7620 112.1605 46.3735 0.0000 173.6775 76 R 4.7224 8.1180 118.4767 55.7567 31.2809 178.0370 77 M 4.1506 8.2859 120.5447 58.5215 32.5260 177.6928 78 D 5.2349 8.0005 116.3690 55.3611 39.5244 176.9296 79 E 4.2738 8.0055 117.7593 57.4078 29.9900 176.9890 80 L 4.6104 8.2494 118.3484 54.9851 44.2886 178.2964 81 E 4.2080 8.5234 118.3973 59.2300 29.4048 177.9814 82 D 4.8344 8.0877 114.7700 53.6977 40.2420 176.8011 83 R 4.4014 8.4204 119.6108 56.4193 30.5164 175.9749 84 F 4.8738 8.1700 117.5487 56.7127 39.9671 175.3071 85 D 4.9112 8.7142 124.7666 51.9159 41.0999 176.0892 86 E 4.1873 8.7089 115.2638 58.2351 29.8131 177.4660 87 N 4.9929 8.8300 116.4639 53.1521 38.9034 175.5403 88 G 4.1108 8.4665 108.7874 45.1005 0.0000 173.5863 89 N 4.8070 8.2695 117.1178 52.8176 40.4615 173.6993 90 L 4.3309 8.6497 124.6487 53.2159 44.3834 174.9289 91 F 5.0733 8.9055 126.1714 55.9397 40.4242 175.2325 92 L 4.7455 8.9803 126.1529 53.2567 45.2136 175.0495 93 R 5.0957 8.6515 124.7406 54.4285 32.9662 174.9059 94 L 5.2674 8.4558 122.9493 52.3944 45.5491 175.5142 95 D 4.5419 9.1819 123.2825 54.6238 41.7138 177.3120 96 K 3.9538 8.5997 125.9663 59.6340 32.1044 179.0920 97 Q 4.0071 8.1368 118.0054 58.6978 28.7030 178.3830 98 K 3.9502 8.8325 119.7650 59.4819 32.0416 179.0074 99 A 4.2398 8.1835 122.4731 54.6305 18.0119 179.4595 100 L 3.9511 7.7751 117.6573 57.9396 42.1995 178.0825 101 E 4.4423 7.7070 116.1694 55.9316 29.5069 176.9261 102 G 3.9245 8.2937 107.4227 45.7653 0.0000 173.3883 103 V 4.4572 8.1296 119.3288 60.5002 34.4486 174.6182 104 W 4.9653 8.8518 127.4161 55.5281 30.1730 175.4051 105 E 4.7540 8.6559 127.1516 53.2829 31.5381 173.1662 106 P 5.0168 0.0000 0.0000 63.2395 32.0681 175.9356 107 V 4.5453 8.8233 115.6161 60.1325 35.3619 175.4884 108 R 4.2789 8.6359 119.5240 57.7322 31.2920 176.1256 109 H 4.8685 7.8071 111.8226 54.3502 33.0758 171.9554 110 G 3.5941 8.6269 105.7067 44.0185 0.0000 172.2100 111 D 4.6115 8.4206 118.5645 54.1989 41.5344 175.5982 112 A 4.9202 8.4006 126.4826 50.0244 23.2674 174.9250 113 I 4.1742 8.7711 120.6272 60.9060 38.4984 175.0368 114 H 5.0700 9.5208 126.0648 54.4788 30.4583 174.2942 115 L 5.0585 9.2424 123.9504 52.7739 44.4600 175.4749 116 K 3.9925 9.1243 125.8829 54.7701 33.8619 174.8887 117 I 4.2152 8.2015 130.4901 59.3980 38.7511 175.6626 118 K 4.4242 8.5175 130.5579 55.7023 32.2917 175.7390 119 V 4.0509 7.8839 127.0065 61.9950 32.3566 175.1237 120 E 3.9603 8.5398 129.2119 56.8715 30.0652 176.3466 121 A 4.5229 8.4596 128.5787 51.4900 22.1695 174.0859 122 Y 4.6565 8.4535 123.7309 54.9864 41.5659 173.1983 123 P 3.4328 0.0000 0.0000 62.1180 32.1005 177.3056 124 A 4.4902 7.9121 123.8264 51.0720 16.3281 177.1689 125 K 4.9299 7.5076 122.6537 51.7382 37.4012 175.7131 126 R 3.9198 8.6033 123.2553 59.7647 29.8967 178.5104 127 E 3.8656 8.0733 116.6273 59.3477 29.5016 179.1025 128 V 3.4803 7.6543 118.3965 65.5738 31.7672 177.6418 129 A 3.9890 7.9181 120.4631 55.1212 18.1784 179.4925 130 V 2.5011 7.4842 117.0357 65.9310 31.4891 177.6592 131 E 3.8594 8.0957 118.7921 59.5003 29.3178 178.5796 132 N 4.3768 8.2598 116.3304 56.4609 38.5815 177.5636 133 I 3.9293 7.9648 121.2355 64.2501 37.0406 178.3656 134 R 3.9541 8.1129 119.0109 59.3388 29.9744 178.0237 135 K 4.0687 7.9754 118.2503 59.7779 32.2382 178.5097 136 I 3.9451 7.4150 118.7302 64.0413 37.4494 176.6384 137 L 4.4067 8.5909 124.6628 54.9756 41.4632 176.5690 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 4.52 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 2 R 8.10 4.55 0.00 1.86 1.97 0.00 3.23 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.73 0.00 3 D 9.84 4.37 0.00 2.94 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 4 M 9.47 3.57 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.49 0.00 5 I 7.10 4.99 1.84 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 1.41 0.62 0.82 0.00 0.00 6 H 9.59 4.67 0.00 3.00 3.35 0.00 5.69 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 7 N 7.57 4.80 0.00 2.89 2.85 0.00 0.00 5.99 7.83 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 8 I 8.48 4.85 1.68 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.41 0.64 0.00 0.00 9 S 8.94 5.08 0.00 3.64 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 10 Y 8.41 5.38 0.00 2.96 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 11 C 9.22 5.24 0.00 2.95 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 12 L 9.10 4.97 0.00 1.78 1.78 0.94 0.80 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 13 M 8.63 5.11 0.00 1.67 1.90 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 14 V 8.48 4.49 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 1.00 0.00 0.00 0.93 0.00 0.00 15 Y 9.98 4.46 0.00 3.15 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.87 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 17 T 7.88 4.20 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 18 E 7.87 4.21 0.00 2.23 1.97 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 2.39 2.35 0.00 19 D 8.42 4.62 0.00 2.72 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 20 E 8.87 3.96 0.00 2.08 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 2.40 2.43 0.00 21 E 8.35 3.97 0.00 2.32 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 2.34 2.36 0.00 22 K 8.18 4.08 0.00 1.94 1.87 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.50 7.81 23 V 7.81 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 1.13 0.00 0.00 1.02 0.00 0.00 24 I 8.05 3.71 2.06 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.55 0.92 0.00 0.00 25 E 8.41 3.90 0.00 2.03 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 0.00 2.34 2.36 0.00 26 A 8.17 4.14 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 27 L 8.04 3.81 0.00 1.69 1.81 0.43 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.12 4.28 0.00 1.87 1.97 0.00 3.21 0.00 0.00 3.23 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.74 0.00 29 N 7.94 4.75 0.00 3.04 3.01 0.00 0.00 6.70 7.84 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 30 V 7.54 4.46 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 0.47 0.00 0.00 0.59 0.00 0.00 31 I 8.31 4.60 1.63 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.71 0.87 0.00 0.00 32 P 0.00 4.52 0.00 2.09 2.03 0.00 3.85 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 33 G 8.91 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 34 A 7.66 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 T 8.26 4.52 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 1.27 0.00 0.00 36 P 0.00 4.89 0.00 2.21 2.47 0.00 3.43 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.95 0.00 37 E 9.33 4.34 0.00 1.96 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 2.30 2.28 0.00 38 R 8.40 5.24 0.00 1.66 1.81 0.00 3.21 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 39 E 8.80 4.72 0.00 1.97 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 2.16 2.23 0.00 40 S 8.69 4.77 0.00 3.89 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 41 A 8.88 4.61 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.80 4.94 0.00 1.82 1.85 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 2.19 2.26 0.00 43 G 9.20 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 0.00 0.00 0.00 44 Y 9.13 4.35 0.00 3.07 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 45 H 9.39 3.63 0.00 3.40 3.26 0.00 5.86 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.36 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.14 4.75 0.00 3.24 3.00 0.00 0.00 6.77 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 48 P 0.00 4.94 0.00 2.06 2.05 0.00 3.77 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 2.01 1.98 0.00 49 I 8.80 4.71 1.53 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.15 -0.04 0.00 0.00 50 T 8.27 4.74 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 1.19 0.00 0.00 51 V 9.15 4.40 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 0.91 0.00 0.00 0.88 0.00 0.00 52 L 9.13 5.18 0.00 1.66 1.68 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.69 4.92 0.00 1.61 1.57 0.00 3.08 0.00 0.00 3.09 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.47 0.00 54 G 7.23 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 55 R 8.29 4.90 0.00 1.66 1.71 0.00 3.14 0.00 0.00 3.10 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.49 0.00 56 L 9.22 4.84 0.00 1.87 1.67 0.96 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 57 D 8.61 4.96 0.00 2.75 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 R 7.93 3.98 0.00 1.90 1.93 0.00 3.17 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 59 R 8.79 3.91 0.00 1.88 1.96 0.00 3.20 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 60 R 8.02 3.93 0.00 1.92 1.99 0.00 3.20 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 61 A 7.96 4.09 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 62 L 8.17 4.01 0.00 1.88 1.76 0.96 0.73 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 63 R 8.27 4.03 0.00 1.96 2.01 0.00 3.15 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.82 0.00 64 E 8.30 3.99 0.00 2.16 2.17 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 2.39 2.35 0.00 65 F 8.62 4.23 0.00 3.40 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 66 M 8.47 4.13 0.00 2.19 2.31 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 3.02 0.00 67 E 8.33 3.93 0.00 2.24 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 2.34 2.51 0.00 68 K 7.79 3.76 0.00 1.60 1.55 0.00 0.84 0.00 0.00 1.11 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.43 0.21 7.81 69 F 8.44 3.99 0.00 2.77 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 70 T 8.48 3.92 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 1.28 0.00 0.00 71 E 7.57 3.80 0.00 1.79 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 0.00 2.22 2.38 0.00 72 V 7.23 3.26 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 -0.47 0.00 0.00 0.02 0.00 0.00 73 F 7.52 4.83 0.00 2.63 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 74 R 7.27 4.06 0.00 1.94 1.82 0.00 3.42 0.00 0.00 3.47 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 75 G 8.76 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 0.00 0.00 0.00 76 R 8.12 4.72 0.00 2.18 2.05 0.00 3.12 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 77 M 8.29 4.15 0.00 2.14 2.12 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 2.73 2.64 0.00 78 D 8.00 5.23 0.00 2.85 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 79 E 8.01 4.27 0.00 2.23 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 2.38 2.33 0.00 80 L 8.25 4.61 0.00 1.83 1.67 0.56 0.23 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 81 E 8.52 4.21 0.00 2.09 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 0.00 2.44 2.59 0.00 82 D 8.09 4.83 0.00 2.80 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 83 R 8.42 4.40 0.00 1.86 2.21 0.00 3.03 0.00 0.00 3.21 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 84 F 8.17 4.87 0.00 3.05 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.71 4.91 0.00 2.88 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 86 E 8.71 4.19 0.00 2.19 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 2.39 2.37 0.00 87 N 8.83 4.99 0.00 2.89 2.88 0.00 0.00 7.25 7.17 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 88 G 8.47 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 89 N 8.27 4.81 0.00 3.04 2.25 0.00 0.00 6.60 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.65 4.33 0.00 0.87 1.15 0.15 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 91 F 8.91 5.07 0.00 3.01 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 92 L 8.98 4.75 0.00 1.69 1.49 0.88 1.26 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 93 R 8.65 5.10 0.00 1.96 1.69 0.00 3.19 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 94 L 8.46 5.27 0.00 1.42 1.41 0.15 0.89 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 95 D 9.18 4.54 0.00 2.76 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 96 K 8.60 3.95 0.00 1.92 1.79 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.49 7.81 97 Q 8.14 4.01 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 98 K 8.83 3.95 0.00 1.89 2.00 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.63 1.63 7.81 99 A 8.18 4.24 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 0.00 100 L 7.78 3.95 0.00 1.67 1.92 1.01 1.05 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 0.00 101 E 7.71 4.44 0.00 2.05 1.97 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 2.53 2.47 0.00 102 G 8.29 3.92 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 0.00 103 V 8.13 4.46 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 0.99 0.00 0.00 0.94 0.00 0.00 104 W 8.85 4.97 0.00 2.95 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 0.00 105 E 8.66 4.75 0.00 2.10 1.83 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 2.28 2.36 0.00 106 P 0.00 5.02 0.00 2.19 2.22 0.00 3.88 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.32 0.00 107 V 8.82 4.55 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 0.77 0.00 0.00 0.94 0.00 0.00 108 R 8.64 4.28 0.00 1.68 1.75 0.00 3.28 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 109 H 7.81 4.87 0.00 3.09 3.15 0.00 5.66 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 G 8.63 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 0.00 111 D 8.42 4.61 0.00 2.68 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 0.00 112 A 8.40 4.92 1.10 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 0.00 0.00 113 I 8.77 4.17 1.79 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 1.23 0.72 0.86 0.00 0.00 114 H 9.52 5.07 0.00 3.12 3.31 0.00 5.77 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 9.24 5.06 0.00 1.53 1.43 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 116 K 9.12 3.99 0.00 1.57 1.50 0.00 1.58 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.92 0.21 7.81 117 I 8.20 4.22 1.72 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.22 0.69 0.00 0.00 118 K 8.52 4.42 0.00 1.79 1.71 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.74 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.39 7.81 119 V 7.88 4.05 2.43 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 0.89 0.00 0.00 1.05 0.00 0.00 120 E 8.54 3.96 0.00 1.84 1.91 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 2.35 2.25 0.00 121 A 8.46 4.52 1.31 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 0.00 0.00 0.00 122 Y 8.45 4.66 0.00 2.91 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 0.00 123 P 0.00 3.43 0.00 1.86 1.57 0.00 3.60 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.63 0.00 124 A 7.91 4.49 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 0.00 125 K 7.51 4.93 0.00 1.70 1.54 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.30 7.81 126 R 8.60 3.92 0.00 2.08 1.92 0.00 3.25 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.87 0.00 127 E 8.07 3.87 0.00 2.17 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 2.32 2.32 0.00 128 V 7.65 3.48 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 1.07 0.00 0.00 0.92 0.00 0.00 129 A 7.92 3.99 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 0.00 130 V 7.48 2.50 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 0.86 0.00 0.00 0.09 0.00 0.00 131 E 8.10 3.86 0.00 2.12 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 0.00 2.30 2.40 0.00 132 N 8.26 4.38 0.00 2.97 2.89 0.00 0.00 7.08 6.94 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 0.00 133 I 7.96 3.93 2.20 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.36 1.31 0.00 0.00 134 R 8.11 3.95 0.00 1.91 2.11 0.00 3.28 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 135 K 7.98 4.07 0.00 1.90 2.05 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.56 7.81 136 I 7.41 3.95 2.15 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.81 1.06 0.00 0.00 137 L 8.59 4.41 0.00 1.74 1.63 1.02 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00