NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 K 4.2041 8.3144 120.0006 57.0589 33.8469 174.1980 9 M 4.2381 8.0910 119.3709 51.8636 33.7587 173.5618 10 S 4.4508 9.1122 117.0212 57.9234 64.9289 172.6480 11 E 4.6584 8.3829 120.2984 54.3390 31.1728 176.4378 12 K 4.9980 8.5114 123.0086 55.4746 33.0389 176.1111 13 L 4.4799 8.6813 125.3461 53.6818 43.5339 176.7504 14 R 4.3410 8.3936 122.2943 55.5402 30.1165 174.8011 15 I 5.4424 8.1376 125.3058 58.6955 39.8545 175.4757 16 K 4.7558 8.4634 126.1815 53.3912 35.7424 175.5856 17 V 4.3118 8.6596 125.9865 61.4461 32.3472 175.4536 18 D 4.8790 8.3232 127.6124 53.8769 42.2709 174.0885 19 D 4.9629 8.1486 115.8830 52.2232 45.4355 174.8276 20 V 4.6378 8.3592 122.2596 61.4780 34.6974 173.4768 21 K 4.3867 8.3243 127.6857 54.9092 34.2991 175.3784 22 I 3.9902 8.2201 127.0158 61.1240 37.5643 175.6122 23 N 5.0180 8.6064 124.4896 50.2645 41.4894 174.0047 24 P 4.4636 0.0000 0.0000 64.6117 31.5083 177.4810 25 K 4.1522 7.5990 117.5734 58.1433 32.8764 175.9136 26 Y 4.4359 6.7189 113.9853 56.3175 40.6892 172.5519 27 V 4.4471 8.7763 121.2070 61.7110 32.2222 175.3014 28 L 5.0309 8.3431 128.4793 54.1817 44.2171 175.3187 29 Y 4.8445 9.3172 118.4786 56.4244 41.2858 175.5327 30 G 4.0115 9.8814 113.4619 45.4251 0.0000 171.7220 31 V 4.3805 9.0302 128.0007 61.7103 32.7688 174.9001 32 S 4.8085 8.5676 124.4272 58.5149 63.6919 172.8993 33 T 5.4157 8.3792 114.7696 60.3621 71.9024 172.3466 34 P 4.1736 0.0000 0.0000 66.1889 31.3393 178.0322 35 N 4.4352 8.4445 115.9113 53.9591 38.9265 174.9397 36 K 4.1889 6.7902 114.9038 56.9520 37.0133 172.8060 37 R 4.3773 8.3081 119.5941 55.9444 30.6783 176.2796 38 L 4.5029 8.9803 124.9215 53.0959 44.2873 175.2178 39 Y 5.7671 8.2667 121.1854 56.3553 39.0154 174.6215 40 K 4.7510 8.7935 124.4317 54.9054 36.9607 174.0756 41 R 5.1594 8.3316 120.9166 54.2895 33.0044 175.5496 42 Y 4.2704 9.1954 125.3143 61.2261 38.6774 178.6605 43 S 4.2826 8.4432 113.1359 61.1024 62.2038 175.3914 44 E 4.1177 8.6213 122.4295 58.8520 29.3884 178.4933 45 F 3.9709 8.4182 118.2436 59.9161 38.7474 177.5156 46 W 3.4204 8.0681 127.8408 60.1169 30.2863 178.0969 47 K 3.7932 7.8759 118.5187 59.3300 31.9564 178.6561 48 L 3.8171 7.3032 121.9593 58.1541 41.6533 177.5375 49 K 4.0175 7.6791 120.1017 58.6597 31.7221 178.0798 50 T 4.2051 7.0401 114.7465 64.5426 67.2523 176.2536 51 R 3.8385 7.2640 120.1059 59.4927 30.1082 178.2276 52 L 3.8147 7.8171 118.1810 58.2737 41.6136 179.6716 53 E 4.2496 7.8982 119.2725 58.7932 29.2157 179.0988 54 R 4.2249 7.4648 116.0799 57.6860 30.5511 178.0943 55 D 4.4963 8.4506 118.9175 56.4993 41.2951 177.7873 56 V 3.5333 8.3819 118.8265 63.2377 31.8249 176.8845 57 G 3.8525 8.0314 105.9204 45.6763 0.0000 172.7659 58 S 4.8102 7.3889 114.2738 56.0888 66.6465 173.1626 59 T 4.3807 8.4695 112.2800 61.2177 69.5107 173.9398 60 I 3.4678 8.2528 125.8407 59.0583 38.7975 173.0980 61 P 4.5632 0.0000 0.0000 63.2741 32.0103 174.9489 62 Y 4.8606 7.4035 116.7167 57.1655 39.5597 175.0647 63 D 4.5102 8.8507 125.4155 54.3175 41.2894 176.2162 64 F 4.4966 8.6355 126.6710 56.1154 40.2496 171.1662 65 P 4.6218 0.0000 0.0000 61.9658 31.3014 175.7960 66 E 4.4968 8.5438 122.7980 54.2525 31.4435 175.5678 67 K 4.5599 7.5466 120.1852 53.5200 34.2424 174.8984 68 P 4.3777 0.0000 0.0000 63.0527 31.9053 177.0718 69 G 4.0340 8.0398 109.0550 44.0370 0.0000 171.7699 70 V 3.8192 7.2085 122.7160 63.9117 32.5221 176.4427 71 L 4.4468 7.2701 124.4259 53.2555 42.4419 175.7825 72 D 4.5943 8.3178 118.2310 53.3211 39.3802 175.7580 73 R 4.3298 8.6105 123.9175 57.8992 31.0287 178.3596 74 R 4.0883 8.1207 115.8613 58.1706 30.3916 176.8639 75 W 4.7130 8.1137 115.7614 56.5024 29.4483 176.4672 76 Q 4.3300 8.0966 117.1518 56.2214 28.7552 176.0695 77 R 4.6282 8.1378 114.8432 54.4244 32.7943 174.7421 78 R 4.3983 8.2981 119.9580 54.6725 30.3916 176.5754 79 Y 4.3208 8.8185 125.1166 59.4226 38.0195 176.8723 80 D 4.4841 6.9179 118.9774 53.0875 40.2651 175.8299 81 D 4.6011 7.8353 120.1793 53.5013 42.3784 174.0184 82 P 4.3016 0.0000 0.0000 65.8644 29.8959 178.2642 83 E 3.9032 8.1221 116.7574 59.7862 29.4713 178.9117 84 M 4.3312 7.9227 117.3847 58.2766 32.5428 178.1572 85 I 4.4308 8.1480 122.0254 63.6659 37.0206 177.5065 86 D 4.3835 8.4482 118.5836 57.7702 40.7733 178.2580 87 E 4.0327 7.6003 118.4677 59.3021 29.2971 179.1344 88 R 3.3991 7.6919 117.6191 59.0786 28.6224 178.2278 89 R 3.8719 7.8254 118.6822 58.4657 30.1188 176.8732 90 I 4.2757 6.0804 109.3893 60.4825 38.3522 175.1231 91 G 3.9332 8.6793 108.4079 45.9483 0.0000 176.1003 92 L 3.1366 7.0893 117.9332 57.3356 41.2668 178.8787 93 E 3.9739 8.0353 117.0325 59.7941 29.1434 179.3073 94 R 3.8906 7.7740 118.3575 58.8358 29.8483 178.6003 95 F 3.1822 7.7446 119.6945 60.1796 39.0649 177.0018 96 L 3.4607 7.3750 118.9503 57.3016 41.6964 178.1679 97 N 4.4517 7.7706 116.2024 56.7130 38.3572 176.7745 98 E 3.9031 7.5684 118.7285 59.3033 29.8012 178.4818 99 L 4.1856 6.7984 119.8058 58.0571 42.3709 178.4858 100 Y 4.5159 8.5933 116.1278 60.1387 39.1006 177.1385 101 N 4.7761 8.2879 120.7611 51.5152 36.2263 174.6875 102 D 4.7096 7.2812 119.6328 53.5917 40.8187 175.6243 103 R 4.4983 8.0401 118.6352 57.0995 32.7000 176.2183 104 F 4.7966 7.3847 110.8246 57.0474 39.8031 175.4358 105 D 4.6565 6.8574 119.7623 52.7792 43.5056 175.0363 106 S 4.7577 8.4327 119.0201 58.3168 63.4818 176.1292 107 R 3.4363 7.8695 122.9266 59.2632 29.2710 178.7545 108 W 4.3456 7.7563 117.6632 59.5488 29.2559 177.9094 109 R 4.3993 7.9200 113.6044 58.1177 29.6543 177.6864 110 D 4.4000 8.7139 119.3091 56.3368 41.5320 176.6400 111 T 4.0331 6.9998 115.7379 63.6591 69.3283 175.2270 112 K 4.0920 8.5661 123.1193 59.2993 32.0443 179.8697 113 I 3.7820 7.7385 113.1646 63.8296 37.3794 178.1111 114 A 4.0362 7.8901 121.2162 55.1680 18.7120 179.2742 115 Q 4.0899 8.0230 116.4792 58.7338 28.7541 178.0691 116 D 4.7768 8.2491 119.0414 55.2808 40.9406 178.2695 117 F 4.1646 8.0537 121.8430 60.9943 39.3037 176.1901 118 L 4.4684 7.9236 116.5813 54.0360 42.1528 176.2861 119 Q 3.5172 7.6307 114.9403 57.2597 26.2776 173.5567 120 L 4.5415 8.2769 111.0313 55.1598 42.6815 178.4353 121 S 4.3753 7.8261 116.1227 58.1115 64.4020 174.2039 122 K 4.4005 8.2082 121.4277 54.3617 31.6395 174.2219 123 P 4.4845 0.0000 0.0000 62.4364 32.1750 176.6462 124 N 4.5529 8.3825 116.7005 53.2350 37.4121 174.0709 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 8 K 8.31 4.20 0.00 1.88 1.92 0.00 1.43 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.52 7.81 9 M 8.09 4.24 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.62 0.00 10 S 9.11 4.45 0.00 4.05 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 11 E 8.38 4.66 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 12 K 8.51 5.00 0.00 1.77 1.88 0.00 1.80 0.00 0.00 2.30 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.40 7.81 13 L 8.68 4.48 0.00 1.72 1.67 1.03 1.42 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 14 R 8.39 4.34 0.00 1.95 2.12 0.00 2.97 0.00 0.00 3.36 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 15 I 8.14 5.44 1.89 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 1.45 0.33 1.02 0.00 0.00 16 K 8.46 4.76 0.00 1.64 1.69 0.00 1.96 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.20 7.81 17 V 8.66 4.31 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 1.08 0.00 0.00 1.02 0.00 0.00 18 D 8.32 4.88 0.00 2.47 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 19 D 8.15 4.96 0.00 2.87 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 20 V 8.36 4.64 1.93 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 0.41 0.00 0.00 0.80 0.00 0.00 21 K 8.32 4.39 0.00 1.68 1.76 0.00 0.81 0.00 0.00 1.29 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 1.20 7.81 22 I 8.22 3.99 1.80 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.72 0.83 0.00 0.00 23 N 8.61 5.02 0.00 2.46 2.40 0.00 0.00 5.96 9.15 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 24 P 0.00 4.46 0.00 2.17 2.21 0.00 3.26 0.00 0.00 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 25 K 7.60 4.15 0.00 1.13 1.85 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.44 7.81 26 Y 6.72 4.44 0.00 3.12 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 27 V 8.78 4.45 2.29 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 0.73 0.00 0.00 1.16 0.00 0.00 28 L 8.34 5.03 0.00 1.58 1.70 1.03 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 29 Y 9.32 4.84 0.00 3.16 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 30 G 9.88 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 31 V 9.03 4.38 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 1.00 0.00 0.00 1.17 0.00 0.00 32 S 8.57 4.81 0.00 3.91 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 33 T 8.38 5.42 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 34 P 0.00 4.17 0.00 1.98 2.22 0.00 3.74 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 35 N 8.44 4.44 0.00 2.72 2.86 0.00 0.00 6.81 7.60 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 36 K 6.79 4.19 0.00 1.80 1.97 0.00 1.28 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.16 1.12 7.81 37 R 8.31 4.38 0.00 1.59 1.60 0.00 3.11 0.00 0.00 3.38 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 38 L 8.98 4.50 0.00 1.49 1.49 0.96 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 8.27 5.77 0.00 2.93 2.89 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 40 K 8.79 4.75 0.00 1.68 1.65 0.00 0.97 0.00 0.00 0.61 0.00 0.00 2.57 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.06 1.24 7.81 41 R 8.33 5.16 0.00 1.94 1.78 0.00 3.19 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.93 0.00 42 Y 9.20 4.27 0.00 3.10 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 43 S 8.44 4.28 0.00 4.05 3.93 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 44 E 8.62 4.12 0.00 2.12 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 2.13 2.57 0.00 45 F 8.42 3.97 0.00 3.22 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 46 W 8.07 3.42 0.00 2.92 2.89 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 47 K 7.88 3.79 0.00 1.98 2.08 0.00 1.50 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.54 1.65 7.81 48 L 7.30 3.82 0.00 1.56 1.40 0.79 -1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 49 K 7.68 4.02 0.00 1.60 1.09 0.00 1.76 0.00 0.00 1.91 0.00 0.00 2.88 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.80 1.66 7.81 50 T 7.04 4.21 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 0.58 0.00 0.00 51 R 7.26 3.84 0.00 1.93 2.02 0.00 3.18 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.82 0.00 52 L 7.82 3.81 0.00 2.20 2.25 1.18 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 53 E 7.90 4.25 0.00 2.20 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 54 R 7.46 4.22 0.00 1.72 1.95 0.00 3.30 0.00 0.00 3.20 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 55 D 8.45 4.50 0.00 2.70 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 56 V 8.38 3.53 1.64 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 -0.08 0.00 0.00 0.77 0.00 0.00 57 G 8.03 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.39 4.81 0.00 3.59 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.47 4.38 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 1.25 0.00 0.00 60 I 8.25 3.47 1.59 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 -0.18 0.91 0.00 0.00 61 P 0.00 4.56 0.00 1.94 1.92 0.00 2.54 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.60 0.00 62 Y 7.40 4.86 0.00 3.19 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 63 D 8.85 4.51 0.00 2.73 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 64 F 8.64 4.50 0.00 3.20 3.22 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 65 P 0.00 4.62 0.00 2.25 2.12 0.00 3.74 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 66 E 8.54 4.50 0.00 1.40 1.40 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 1.47 1.47 0.00 67 K 7.55 4.56 0.00 1.73 1.66 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.46 7.81 68 P 0.00 4.38 0.00 2.11 2.00 0.00 3.64 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 1.90 1.89 0.00 69 G 8.04 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 70 V 7.21 3.82 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 0.75 0.00 0.00 0.92 0.00 0.00 71 L 7.27 4.45 0.00 1.61 1.58 0.95 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.32 4.59 0.00 3.06 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 73 R 8.61 4.33 0.00 1.87 2.05 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 1.63 1.68 0.00 74 R 8.12 4.09 0.00 1.58 1.78 0.00 3.21 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 75 W 8.11 4.71 0.00 3.43 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 8.10 4.33 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.84 0.00 0.00 0.00 0.00 0.00 2.63 2.52 0.00 77 R 8.14 4.63 0.00 1.89 1.90 0.00 3.06 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 78 R 8.30 4.40 0.00 1.85 1.76 0.00 3.17 0.00 0.00 3.36 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.55 0.00 79 Y 8.82 4.32 0.00 3.25 3.26 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 80 D 6.92 4.48 0.00 2.55 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 0.00 0.00 0.00 0.00 81 D 7.84 4.60 0.00 2.96 2.53 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 82 P 0.00 4.30 0.00 2.17 2.08 0.00 3.61 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 83 E 8.12 3.90 0.00 2.23 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 2.39 2.36 0.00 84 M 7.92 4.33 0.00 2.08 2.03 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 2.61 2.53 0.00 85 I 8.15 4.43 2.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.86 0.94 0.00 0.00 86 D 8.45 4.38 0.00 2.84 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 87 E 7.60 4.03 0.00 2.10 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 2.27 2.30 0.00 88 R 7.69 3.40 0.00 1.89 1.70 0.00 3.15 0.00 0.00 2.80 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.50 0.00 89 R 7.83 3.87 0.00 2.32 2.09 0.00 3.38 0.00 0.00 3.65 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 90 I 6.08 4.28 1.80 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.31 0.92 0.00 0.00 91 G 8.68 3.93 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 0.00 0.00 0.00 92 L 7.09 3.14 0.00 1.43 1.04 0.77 -0.45 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 93 E 8.04 3.97 0.00 2.31 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 0.00 2.30 2.38 0.00 94 R 7.77 3.89 0.00 1.79 1.95 0.00 3.09 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 95 F 7.74 3.18 0.00 2.86 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 96 L 7.38 3.46 0.00 1.70 1.01 1.11 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 97 N 7.77 4.45 0.00 2.68 2.87 0.00 0.00 6.89 7.76 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 98 E 7.57 3.90 0.00 1.96 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 0.00 2.45 2.35 0.00 99 L 6.80 4.19 0.00 1.29 1.64 0.90 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 8.59 4.52 0.00 2.89 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 0.00 101 N 8.29 4.78 0.00 3.11 2.81 0.00 0.00 6.61 8.63 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 0.00 102 D 7.28 4.71 0.00 2.74 2.69 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 0.00 103 R 8.04 4.50 0.00 1.87 2.06 0.00 3.24 0.00 0.00 3.42 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 104 F 7.38 4.80 0.00 3.15 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 0.00 105 D 6.86 4.66 0.00 2.31 2.44 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 0.00 106 S 8.43 4.76 0.00 3.82 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 0.00 107 R 7.87 3.44 0.00 1.25 1.65 0.00 2.86 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 108 W 7.76 4.35 0.00 3.26 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 0.00 109 R 7.92 4.40 0.00 2.02 2.23 0.00 3.29 0.00 0.00 3.31 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 110 D 8.71 4.40 0.00 2.72 2.69 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 0.00 111 T 7.00 4.03 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 1.19 0.00 0.00 112 K 8.57 4.09 0.00 1.80 1.86 0.00 1.66 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.48 7.81 113 I 7.74 3.78 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.67 0.91 0.00 0.00 114 A 7.89 4.04 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 Q 8.02 4.09 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.59 0.00 0.00 0.00 0.00 0.00 2.64 2.54 0.00 116 D 8.25 4.78 0.00 3.00 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 0.00 117 F 8.05 4.16 0.00 3.11 3.26 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 0.00 118 L 7.92 4.47 0.00 1.71 1.65 1.21 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 119 Q 7.63 3.52 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.09 7.55 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 120 L 8.28 4.54 0.00 1.61 1.63 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 121 S 7.83 4.38 0.00 3.85 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 0.00 122 K 8.21 4.40 0.00 1.71 1.75 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.32 7.81 123 P 0.00 4.48 0.00 2.17 2.05 0.00 3.70 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 1.98 1.95 0.00 124 N 8.38 4.55 0.00 2.78 2.75 0.00 0.00 5.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00