NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.8053 8.1648 122.2814 52.2449 20.1698 175.7662 2 T 4.5956 8.8704 116.7572 61.2855 72.0527 171.8443 3 K 5.3234 8.9187 124.4223 54.9643 37.2116 174.5837 4 A 5.3418 9.1109 123.5949 51.2001 23.4811 175.1242 5 V 5.0248 8.9055 117.5185 61.0515 35.4912 173.3857 6 C 4.9196 9.0640 121.7984 58.1878 35.3815 172.6065 7 V 4.5436 8.5088 126.3365 61.6474 32.9852 174.1659 8 L 4.8983 8.9493 129.3362 53.6637 43.1249 176.0962 9 K 4.9643 9.1587 122.6227 54.5555 37.0780 177.5915 10 G 4.6478 9.0881 110.1796 44.8840 0.0000 173.2417 11 D 4.8749 9.9104 119.3062 51.7972 39.8762 175.2692 12 G 3.6349 8.5218 112.2898 46.3235 0.0000 174.2903 13 P 4.2977 0.0000 0.0000 64.2402 31.6420 176.3707 14 V 4.8421 7.5405 116.7778 61.3234 33.0347 175.0409 15 Q 4.8108 8.6409 125.1906 54.8230 33.7503 174.0079 16 G 4.4620 8.6752 108.2270 45.9717 0.0000 171.9715 17 I 5.1568 8.5484 119.7872 59.5503 41.2596 174.9292 18 I 4.6960 8.8687 127.8409 59.4640 40.4297 174.3869 19 N 5.0040 8.4330 124.2569 51.4655 41.0422 173.9648 20 F 5.5114 8.9603 120.2105 55.8119 43.0053 173.8379 21 E 5.1861 9.7143 123.1627 54.7415 33.5728 173.7124 22 Q 4.8159 9.3309 127.6600 54.2037 31.1721 175.6805 23 K 4.0547 8.9077 129.1690 58.8048 32.9736 176.4301 24 E 4.8533 7.7831 116.2784 53.7860 33.5232 174.7555 25 S 4.3600 8.5934 116.0361 60.0643 63.3084 173.9968 26 N 4.1975 8.9219 119.0401 53.9521 35.8674 174.2235 27 G 4.0552 7.8148 108.0245 43.0082 0.0000 172.1161 28 P 4.5813 0.0000 0.0000 63.0005 32.1353 175.7973 29 V 4.6525 8.8275 122.1110 61.2858 33.7507 174.6916 30 K 4.8208 9.1992 128.2643 55.9697 33.7624 176.0549 31 V 4.8026 9.2159 124.8280 60.8725 34.3725 174.1928 32 W 5.9836 7.6869 123.8304 55.1905 31.7286 175.4234 33 G 3.8105 7.7418 107.0395 46.1349 0.0000 170.7771 34 S 5.1119 7.8330 114.6318 56.7850 66.8927 173.6134 35 I 5.1167 8.7906 123.1902 59.3652 40.8895 174.5927 36 K 4.8752 9.0568 124.5840 55.6428 36.2669 177.0372 37 G 4.2121 8.9621 106.8717 46.6261 0.0000 173.3996 38 L 4.5090 7.6617 119.9694 52.9456 43.3271 176.2460 39 T 4.3196 8.1099 110.6999 60.9485 69.6204 174.2052 40 E 4.1370 8.5835 124.4166 58.0227 30.5369 175.7157 41 G 3.8523 8.5963 109.5944 43.9213 0.0000 172.1886 42 L 4.8603 8.2036 119.2286 54.7468 42.9068 176.4595 43 H 5.0285 9.3163 119.7435 53.5934 33.0288 173.3900 44 G 4.0504 9.1654 110.7829 47.0332 0.0000 172.6356 45 F 5.5201 8.5087 124.3807 57.3921 42.2559 172.5992 46 H 5.3468 9.0746 123.2450 53.9439 33.3377 172.9995 47 V 4.3704 8.4540 122.2564 62.4995 32.6632 174.9782 48 H 5.0228 9.2929 125.8764 54.5417 30.4663 176.1443 49 E 3.6504 8.9816 122.6032 58.6701 29.9729 177.1104 50 F 4.9571 8.1463 118.3996 54.7556 41.6536 177.0874 51 G 4.1561 8.4713 112.8617 44.8663 0.0000 174.0012 52 D 4.7436 8.0293 118.6642 52.6242 42.5778 174.1577 53 N 5.2130 8.7193 124.6112 52.7277 39.2596 176.6072 54 T 3.9989 8.5576 109.8084 63.2136 68.9235 174.6193 55 A 4.6999 8.0827 126.0194 51.4339 20.0110 176.6853 56 G 4.1363 7.9735 110.7105 47.4701 0.0000 176.7647 57 C 4.4452 8.6240 116.4459 59.2348 40.6786 175.7930 58 T 3.8095 7.4730 110.2841 64.2017 68.2568 175.6797 59 S 4.5238 7.8791 114.6840 58.6368 63.4670 175.1446 60 A 4.4376 7.4467 126.0882 53.9692 18.3041 178.9285 61 G 4.1720 7.8080 106.4012 44.0390 0.0000 170.7578 62 P 4.7384 0.0000 0.0000 61.9641 33.9345 175.0408 63 H 4.5170 8.4554 116.5216 55.6712 29.5103 175.6870 64 F 4.2685 9.0193 125.6890 58.2951 40.2356 175.3115 65 N 5.0121 7.8552 123.5587 52.2565 39.8179 173.0600 66 P 4.2276 0.0000 0.0000 65.0628 32.0686 177.9293 67 L 4.4169 7.7191 116.5985 53.6072 42.0642 176.2156 68 S 3.6312 7.6137 113.4605 59.6212 60.6566 172.3259 69 R 4.3835 8.1313 117.9060 55.0246 31.2318 176.9849 70 K 4.3445 8.6386 118.5587 56.1387 33.4376 176.5743 71 H 4.0270 8.8351 123.7135 56.7536 30.5111 174.5858 72 G 4.0682 8.0714 110.4958 44.9974 0.0000 172.1880 73 G 4.0115 9.1292 109.0840 44.0204 0.0000 173.3032 74 P 4.3470 0.0000 0.0000 65.3011 31.2854 177.4626 75 K 4.3066 7.8858 115.5312 56.5359 32.4611 176.3829 76 D 4.6517 7.7420 119.9481 53.6033 41.5935 176.5972 77 E 3.9243 8.7964 122.7922 59.0044 29.6564 176.8027 78 E 4.3041 7.9210 120.6626 54.7839 28.7529 174.7202 79 R 4.8600 7.6815 120.3462 53.9096 32.9507 174.7338 80 H 4.4410 8.9456 116.0999 55.4429 29.3489 176.8893 81 V 3.4218 8.1936 122.2594 66.2043 31.6934 177.0883 82 G 3.8155 8.3973 105.3066 47.1938 0.0000 173.6542 83 D 5.2123 7.9733 122.1092 53.3358 39.2373 176.2865 84 L 4.5248 8.1500 121.7349 53.1573 43.3963 176.5981 85 R 4.0203 8.6625 120.6954 56.5685 30.5410 176.0120 86 N 4.6516 8.7358 121.3372 54.3135 39.2999 174.7224 87 V 4.1858 8.5646 115.0929 60.4485 34.3904 175.0556 88 T 5.0029 8.2257 119.0659 61.8608 71.0705 173.0582 89 A 4.7699 8.9654 129.6300 50.8291 20.9786 177.3042 90 D 5.0502 8.9135 122.3739 52.0382 41.3727 177.0990 91 K 4.0397 8.5559 117.1757 59.5163 32.5197 177.1114 92 D 4.6176 8.6310 118.4608 53.9967 41.2269 177.0384 93 G 4.2856 8.5485 108.3123 44.3542 0.0000 172.6187 94 V 4.8444 7.8614 119.3434 60.7730 33.9722 174.0442 95 A 5.2214 8.8982 130.0966 49.8193 21.0264 175.3778 96 D 5.0104 8.6325 123.6482 52.9798 41.3262 176.0629 97 V 3.7997 8.6232 124.9436 62.5026 33.0617 175.3157 98 S 4.7717 8.4155 122.5925 57.8301 63.9283 172.8715 99 I 4.8251 9.2255 128.1164 59.2843 41.5578 174.1140 100 E 5.1862 8.8832 125.6472 54.4931 32.1025 174.3952 101 D 4.8723 9.2756 126.0829 52.7328 44.4810 175.7413 102 S 4.6811 8.9670 120.2163 58.5370 63.6288 174.6039 103 V 4.1112 8.0039 120.7888 64.4368 32.2488 176.4138 104 I 4.0272 7.9526 111.6367 61.2407 38.1262 174.5227 105 S 4.6507 8.4664 114.5077 57.5860 65.4620 174.1213 106 L 4.4380 8.8364 122.2123 54.2175 41.5225 176.1792 107 S 4.4549 7.8717 112.9197 58.1034 66.4475 174.6855 108 G 3.8858 8.5248 108.2178 44.9558 0.0000 173.6475 109 D 4.4513 8.7456 117.2900 57.3249 41.0316 176.8968 110 H 4.9852 8.1246 114.7494 55.4754 28.9583 173.9572 111 C 4.4379 8.0635 121.2980 59.8809 31.7241 173.5193 112 I 3.9206 8.2017 119.2018 60.4580 38.1390 175.6852 113 I 3.7268 7.2986 123.0576 62.8347 37.5224 176.3151 114 G 3.8092 9.3933 113.1862 45.4426 0.0000 173.0603 115 R 4.8653 7.4448 119.4049 54.7816 33.6252 174.5319 116 T 4.9689 8.0285 115.2640 62.1014 71.4315 173.5905 117 L 4.7335 8.6466 128.7369 54.1687 44.0210 175.4293 118 V 4.9994 8.7695 125.4275 61.0518 35.1664 174.1826 119 V 5.1167 8.6773 126.8615 60.4742 33.8405 174.5710 120 H 5.3589 8.7687 120.2949 53.8540 31.2032 174.1725 121 E 4.2129 9.1462 121.4758 58.9425 30.0540 176.5545 122 K 4.8134 8.4326 116.7801 53.7102 36.8239 175.6019 123 A 4.3843 8.4355 122.8963 52.0540 18.9947 177.0383 124 D 4.6776 9.1627 122.7342 54.1555 41.4865 175.8620 125 D 4.5980 9.3929 124.9681 53.2416 39.6515 177.1248 126 L 3.5936 9.4488 118.3553 55.8644 39.4828 175.3613 127 G 4.3034 8.5972 105.1951 45.9512 0.0000 174.6393 128 K 4.5448 7.9768 117.1412 56.0126 32.3817 177.3819 129 G 3.7717 7.8925 107.7366 45.0024 0.0000 174.9577 130 G 3.8540 8.8571 107.5746 45.9768 0.0000 172.7823 131 N 5.0375 7.7568 114.5805 49.8971 40.5271 174.6780 132 E 4.1059 8.7311 117.8483 59.5763 29.4208 179.4695 133 E 3.9827 8.1379 118.2414 59.0946 29.6652 178.8370 134 S 4.0823 8.6733 114.0986 61.7033 62.4434 175.9622 135 T 4.2307 7.8234 110.3631 62.8549 68.5073 175.6808 136 K 4.2692 7.6964 119.9087 57.7607 34.0014 176.7448 137 T 4.0650 8.1825 104.9308 60.0070 70.2613 174.9857 138 G 3.8207 8.0394 110.1744 44.8931 0.0000 173.0220 139 N 4.2106 7.7320 114.9389 54.3066 36.7092 174.5345 140 A 4.5061 7.9836 117.6312 51.6596 19.6781 179.6914 141 G 4.1637 7.9171 105.8930 45.6648 0.0000 173.8611 142 S 4.4015 8.7223 114.7748 58.4425 64.8047 174.3895 143 R 4.3337 8.3671 120.2208 55.3065 29.4302 176.3921 144 L 4.2953 8.9420 126.1164 57.4649 43.0567 177.1974 145 A 4.8488 7.7589 117.5266 51.5149 22.6606 174.0643 146 C 5.5342 8.5271 113.9084 55.9128 47.0478 172.6269 147 G 4.6763 8.1019 104.3104 46.2426 0.0000 172.4559 148 V 4.4855 8.2599 120.5952 62.2185 32.8748 175.4424 149 I 4.1830 8.7125 129.2396 60.8128 38.0182 175.2238 150 G 4.3930 8.9631 115.0369 43.9661 0.0000 172.4059 151 I 4.2933 8.3206 122.2922 61.1543 37.5879 175.4012 152 A 4.8360 8.4024 127.9686 49.6208 22.2035 176.0430 153 Q 4.0691 8.5397 118.8607 56.4353 29.2070 176.0535 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 8.16 4.81 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 8.87 4.60 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 1.22 0.00 0.00 3 K 8.92 5.32 0.00 1.87 1.71 0.00 1.80 0.00 0.00 1.92 0.00 0.00 3.10 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.49 7.81 4 A 9.11 5.34 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 5 V 8.91 5.02 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 0.80 0.00 0.00 0.97 0.00 0.00 6 C 9.06 4.92 0.00 3.15 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.51 4.54 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 0.93 0.00 0.00 0.92 0.00 0.00 8 L 8.95 4.90 0.00 1.71 1.60 1.04 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.16 4.96 0.00 1.64 1.62 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 G 9.09 4.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 9.91 4.87 0.00 2.75 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 12 G 8.52 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 0.00 0.00 0.00 13 P 0.00 4.30 0.00 2.18 2.10 0.00 3.65 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 14 V 7.54 4.84 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 0.83 0.00 0.00 0.91 0.00 0.00 15 Q 8.64 4.81 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.33 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 16 G 8.68 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.55 5.16 1.81 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 1.21 0.82 0.00 0.00 18 I 8.87 4.70 1.84 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 1.25 1.23 0.51 0.00 0.00 19 N 8.43 5.00 0.00 1.44 1.52 0.00 0.00 6.40 8.00 0.00 0.00 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 8.96 5.51 0.00 2.90 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 21 E 9.71 5.19 0.00 2.39 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 2.31 2.39 0.00 22 Q 9.33 4.82 0.00 2.19 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.58 0.00 0.00 0.00 0.00 0.00 2.45 2.60 0.00 23 K 8.91 4.05 0.00 1.85 1.81 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.52 1.48 7.81 24 E 7.78 4.85 0.00 2.02 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 25 S 8.59 4.36 0.00 3.98 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 26 N 8.92 4.20 0.00 2.91 2.98 0.00 0.00 6.92 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 7.81 4.06 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 0.00 28 P 0.00 4.58 0.00 2.13 2.11 0.00 3.76 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 2.01 1.99 0.00 29 V 8.83 4.65 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 1.35 0.00 0.00 1.07 0.00 0.00 30 K 9.20 4.82 0.00 1.92 1.80 0.00 1.60 0.00 0.00 1.37 0.00 0.00 2.80 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.57 1.42 7.81 31 V 9.22 4.80 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 0.87 0.00 0.00 1.08 0.00 0.00 32 W 7.69 5.98 0.00 3.56 3.19 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 0.00 0.00 0.00 0.00 33 G 7.74 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 34 S 7.83 5.11 0.00 3.86 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 35 I 8.79 5.12 1.78 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 0.60 0.87 0.00 0.00 36 K 9.06 4.88 0.00 1.76 1.85 0.00 1.31 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.34 7.81 37 G 8.96 4.21 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 0.00 38 L 7.66 4.51 0.00 1.78 1.36 0.78 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.11 4.32 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 8.58 4.14 0.00 1.95 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 2.49 2.27 0.00 41 G 8.60 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 42 L 8.20 4.86 0.00 1.51 1.59 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.32 5.03 0.00 2.98 3.31 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 9.17 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 45 F 8.51 5.52 0.00 2.99 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 46 H 9.07 5.35 0.00 3.15 2.92 0.00 5.68 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.45 4.37 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 0.98 0.00 0.00 0.89 0.00 0.00 48 H 9.29 5.02 0.00 3.04 3.39 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.98 3.65 0.00 1.70 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 1.47 1.97 0.00 50 F 8.15 4.96 0.00 3.11 2.86 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 51 G 8.47 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.03 4.74 0.00 2.62 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 53 N 8.72 5.21 0.00 2.81 2.71 0.00 0.00 7.44 7.22 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 54 T 8.56 4.00 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 1.23 0.00 0.00 55 A 8.08 4.70 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 7.97 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 57 C 8.62 4.45 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 7.47 3.81 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 1.22 0.00 0.00 59 S 7.88 4.52 0.00 4.16 4.13 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 60 A 7.45 4.44 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 61 G 7.81 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.74 0.00 2.06 2.22 0.00 3.65 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 2.08 2.01 0.00 63 H 8.46 4.52 0.00 2.78 3.16 0.00 5.73 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 9.02 4.27 0.00 2.85 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 65 N 7.86 5.01 0.00 2.61 2.49 0.00 0.00 6.94 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 4.23 0.00 2.13 2.11 0.00 3.10 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.47 0.00 67 L 7.72 4.42 0.00 1.59 1.68 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.61 3.63 0.00 3.99 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 69 R 8.13 4.38 0.00 1.78 1.95 0.00 3.13 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 70 K 8.64 4.34 0.00 1.69 1.69 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.54 7.81 71 H 8.84 4.03 0.00 3.17 3.26 0.00 5.94 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 8.07 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 0.00 0.00 0.00 73 G 9.13 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 74 P 0.00 4.35 0.00 2.22 2.36 0.00 3.78 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 75 K 7.89 4.31 0.00 1.77 1.89 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.46 7.81 76 D 7.74 4.65 0.00 2.77 2.63 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 77 E 8.80 3.92 0.00 1.94 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 2.31 2.23 0.00 78 E 7.92 4.30 0.00 1.90 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 2.19 2.25 0.00 79 R 7.68 4.86 0.00 1.95 1.87 0.00 2.91 0.00 0.00 3.38 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 80 H 8.95 4.44 0.00 3.51 3.38 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.19 3.42 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.31 0.00 0.00 82 G 8.40 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 83 D 7.97 5.21 0.00 2.67 2.71 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 84 L 8.15 4.52 0.00 1.98 1.80 0.74 0.94 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 85 R 8.66 4.02 0.00 1.84 1.93 0.00 3.28 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 86 N 8.74 4.65 0.00 2.67 2.77 0.00 0.00 6.95 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 8.56 4.19 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 -0.19 0.00 0.00 0.79 0.00 0.00 88 T 8.23 5.00 4.21 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 1.20 0.00 0.00 89 A 8.97 4.77 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 90 D 8.91 5.05 0.00 2.86 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 91 K 8.56 4.04 0.00 1.88 1.99 0.00 1.55 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.46 7.81 92 D 8.63 4.62 0.00 2.79 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 8.55 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 0.00 0.00 0.00 94 V 7.86 4.84 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 0.91 0.00 0.00 0.92 0.00 0.00 95 A 8.90 5.22 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.63 5.01 0.00 2.56 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 97 V 8.62 3.80 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 0.75 0.00 0.00 0.63 0.00 0.00 98 S 8.42 4.77 0.00 3.91 3.73 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 99 I 9.23 4.83 1.99 0.00 0.00 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 1.18 0.58 1.02 0.00 0.00 100 E 8.88 5.19 0.00 1.96 1.82 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 2.20 2.31 0.00 101 D 9.28 4.87 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 8.97 4.68 0.00 3.92 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 0.00 103 V 8.00 4.11 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 0.82 0.00 0.00 0.95 0.00 0.00 104 I 7.95 4.03 1.95 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.82 1.02 0.00 0.00 105 S 8.47 4.65 0.00 3.83 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 0.00 106 L 8.84 4.44 0.00 1.77 1.63 1.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.87 4.45 0.00 3.89 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 0.00 108 G 8.52 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 0.00 109 D 8.75 4.45 0.00 2.67 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 0.00 110 H 8.12 4.99 0.00 3.23 3.41 0.00 5.64 0.00 0.00 0.00 0.00 6.58 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 4.44 0.00 2.97 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 0.00 112 I 8.20 3.92 1.63 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.18 0.94 0.00 0.00 113 I 7.30 3.73 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 0.89 0.00 0.00 114 G 9.39 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 7.44 4.87 0.00 1.63 1.84 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.22 0.00 116 T 8.03 4.97 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 1.23 0.00 0.00 117 L 8.65 4.73 0.00 1.79 1.53 0.40 0.65 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 0.00 118 V 8.77 5.00 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 0.81 0.00 0.00 0.80 0.00 0.00 119 V 8.68 5.12 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.02 0.00 0.00 120 H 8.77 5.36 0.00 3.30 3.53 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.15 4.21 0.00 2.03 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 0.00 2.36 2.34 0.00 122 K 8.43 4.81 0.00 1.72 1.66 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.44 4.38 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 0.00 124 D 9.16 4.68 0.00 2.81 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 9.39 4.60 0.00 2.91 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 0.00 126 L 9.45 3.59 0.00 1.80 1.84 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.60 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 7.98 4.54 0.00 1.86 1.79 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.49 7.81 129 G 7.89 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 G 8.86 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 0.00 131 N 7.76 5.04 0.00 2.76 2.76 0.00 0.00 6.28 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 8.73 4.11 0.00 2.07 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 2.40 2.46 0.00 133 E 8.14 3.98 0.00 2.04 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 2.39 2.31 0.00 134 S 8.67 4.08 0.00 3.96 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 0.00 135 T 7.82 4.23 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 1.28 0.00 0.00 136 K 7.70 4.27 0.00 1.81 1.81 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.58 7.81 137 T 8.18 4.06 4.19 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 0.00 0.00 0.00 1.14 0.00 0.00 138 G 8.04 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 0.00 139 N 7.73 4.21 0.00 3.03 2.89 0.00 0.00 6.84 7.36 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 0.00 140 A 7.98 4.51 1.22 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 0.00 141 G 7.92 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.72 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 8.37 4.33 0.00 1.68 1.86 0.00 3.24 0.00 0.00 3.10 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.65 0.00 144 L 8.94 4.30 0.00 1.71 1.70 0.97 0.38 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 7.76 4.85 1.24 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 0.00 0.00 146 C 8.53 5.53 0.00 3.03 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 0.00 147 G 8.10 4.68 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 0.00 0.00 0.00 148 V 8.26 4.49 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 0.82 0.00 0.00 0.94 0.00 0.00 149 I 8.71 4.18 1.80 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.37 0.41 0.00 0.00 150 G 8.96 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.32 4.29 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 8.40 4.84 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 0.00 153 Q 8.54 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00