NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 V 4.1325 8.0549 120.4675 61.6169 32.7665 174.6384 17 L 4.3002 8.1535 122.1179 52.5684 43.7202 174.9797 18 G 3.5008 7.9678 108.3184 47.3462 0.0000 174.8416 19 G 4.1898 8.6918 111.9111 46.3675 0.0000 173.2526 *29 G 3.7759 7.6257 105.8160 44.8751 0.0000 172.3083 30 A 4.7564 8.6000 123.2668 51.7613 19.3114 177.0251 31 I 4.9875 8.5607 114.2817 59.4169 41.7324 173.8471 32 Y 5.3502 9.2802 120.7010 56.5758 41.7409 174.7512 33 G 2.9865 9.2048 108.6739 45.4751 0.0000 173.6093 34 G 4.0116 8.2526 109.6125 46.5337 0.0000 174.7210 *39 G 4.0732 7.9299 103.3239 45.4536 0.0000 173.1423 40 S 5.0482 8.3037 116.0736 56.3423 67.0686 172.8197 41 R 4.6321 8.4075 121.9774 55.3422 31.9115 175.7149 42 C 5.3925 9.1016 124.3571 55.5697 38.8055 172.7599 43 S 5.1812 8.7127 113.8102 57.4311 67.0737 173.7875 44 A 4.2136 8.6459 124.2725 51.7176 19.7603 177.2065 45 A 3.9925 8.9183 121.4125 52.9994 19.7320 176.9135 46 F 4.8598 7.4936 111.2654 55.5974 44.0691 173.1648 47 N 5.3692 8.8521 119.9420 53.6011 39.2715 174.7169 48 V 5.0498 9.5478 115.8574 60.3443 36.9727 174.0770 48A T 5.7012 9.3472 115.0214 60.9393 71.1919 172.4413 48B K 4.7045 9.0630 124.1565 56.2833 36.0120 175.6770 48C G 4.0168 9.7378 109.3187 46.6777 0.0000 174.5912 48D G 3.7955 8.4705 104.8176 45.2352 0.0000 173.9717 49 A 4.6748 8.2541 123.0294 50.4136 21.4419 176.0380 50 R 5.2853 8.0028 117.8675 54.9621 33.1915 175.0386 51 Y 5.2945 9.5888 119.7708 56.4682 43.2982 173.8157 52 F 5.5252 8.5175 115.0787 55.4106 41.3766 174.5915 53 V 4.7211 8.6306 114.2007 61.1176 34.2959 175.1559 54 T 4.9227 8.3700 115.9037 61.3774 71.3014 172.2343 55 A 4.6575 8.4954 124.3783 51.7017 17.8259 179.0681 56 G 3.7416 8.8139 111.1803 48.7985 0.0000 175.4790 57 H 4.0245 8.2342 115.3692 57.6592 28.3412 176.9691 58 C 4.4776 6.9445 117.4613 60.2325 38.8666 175.8150 59 T 3.9059 7.7570 110.9933 64.7293 68.0667 175.7748 58 N 4.6676 7.0245 117.5613 55.1325 45.7800 176.4149 59 I 3.7259 7.6070 117.2933 64.0293 37.0667 177.4748 64 S 4.5926 7.3028 111.4277 56.8705 65.1232 173.5435 65 A 4.5295 8.6137 127.5113 53.4909 19.7819 176.6965 65A N 5.4414 7.8732 112.0843 50.9636 39.7026 174.6386 66 W 5.0356 9.0476 121.0026 55.0805 33.5171 174.4681 67 S 5.3499 9.4030 118.5285 56.8285 66.9528 174.4980 68 A 4.6283 8.6452 122.6745 52.7071 18.9873 177.1006 *78 S 4.4657 7.8500 110.7864 57.6193 64.2158 174.7368 79 S 3.6967 7.6401 115.6297 60.8615 62.2147 175.9806 80 G 4.0111 7.6222 108.3078 44.6073 0.0000 172.9626 81 G 3.9872 7.8241 109.1955 42.9486 0.0000 174.3917 82 S 4.1683 8.1157 113.1643 57.7984 63.8482 173.4201 *84 V 4.1985 7.8868 119.7668 63.3034 32.1647 175.4908 85 V 4.2610 8.7426 120.1489 63.0749 33.3885 175.8711 86 G 4.4425 7.8934 105.3854 45.5992 0.0000 172.4311 87 V 5.2279 8.2945 112.9977 58.8295 35.4255 175.6456 88 R 4.2977 9.1042 125.3961 57.1529 29.9603 176.0190 89 E 4.6001 8.5807 124.2749 56.3388 31.8370 175.9920 90 G 4.1149 7.6130 104.2196 46.2525 0.0000 172.2780 91 T 4.9766 8.0072 113.5977 61.0021 71.2904 172.6640 *93 S 4.3957 8.4929 120.1623 58.6646 62.6925 172.4040 94 F 5.3768 8.1847 125.8713 57.8897 42.4663 171.9043 *99 P 3.1681 0.0000 0.0000 63.9825 32.0540 175.4293 100 T 3.7568 8.3096 119.6563 64.8405 67.6770 171.5620 101 N 5.2932 7.4195 115.2503 51.5325 42.1119 173.3975 102 D 5.2129 9.0169 117.4214 52.8368 40.6369 173.5112 103 Y 5.2347 8.3579 119.0381 55.6773 42.2081 174.9005 104 G 4.7716 8.9605 105.9536 45.8887 0.0000 171.8993 105 I 4.9915 8.2578 119.5555 58.9116 41.8725 173.8742 106 V 4.3785 8.0726 128.2339 60.7827 34.3178 174.1613 107 R 4.1497 8.6731 129.0781 55.5783 31.2457 175.0930 108 Y 4.8351 8.0745 124.7120 58.3785 38.2581 176.0239 109 T 4.5510 9.2190 112.4582 61.3178 69.9531 173.9100 110 D 4.6341 8.3868 120.9902 53.1730 39.6245 177.3031 111 G 3.8802 8.2248 106.7309 46.0225 0.0000 174.2763 112 S 4.3599 7.8516 113.9206 57.8761 63.8320 174.5428 113 S 4.3607 7.8743 115.3401 55.3743 62.2145 171.6008 114 P 4.3746 0.0000 0.0000 61.5227 32.1618 177.0487 115 A 4.2553 8.2740 122.5706 52.2199 19.6151 178.6431 116 G 3.8544 8.5175 110.0885 44.2071 0.0000 171.9232 117 T 4.9900 7.1564 109.8444 59.9259 73.7487 174.3047 118 V 4.5189 8.2196 121.6530 60.6654 33.9460 174.1519 119 D 4.4065 8.7391 128.7890 54.2521 41.2992 175.7867 120 L 4.5462 8.4016 125.0505 54.0333 41.9069 175.8996 120A Y 3.6850 8.1142 116.3740 58.6871 35.9632 171.7837 120B N 4.9163 8.2078 111.4166 53.0578 38.4310 175.0688 120C G 3.9618 8.8019 108.8743 45.4221 0.0000 173.3817 120D S 5.0004 8.5809 115.1678 56.7726 66.9358 172.8202 121 T 4.9457 8.1608 109.6072 60.2382 72.2118 172.8312 122 Q 4.4933 8.6294 124.2174 54.3699 30.9747 174.2224 123 D 4.6983 8.7012 126.7829 54.3901 42.6132 174.5025 124 I 4.9664 7.9773 126.4545 59.7751 38.9315 175.6957 125 S 4.7951 9.3129 118.5551 57.8714 65.0377 172.9973 126 S 4.6829 7.6794 114.3340 57.8164 66.3932 172.4770 127 A 5.1147 8.2279 119.9655 50.5928 21.8761 174.9559 128 A 4.5361 8.6221 120.8710 51.2526 23.5739 175.0789 129 N 4.6650 8.5523 116.2971 51.9908 39.8216 175.8444 130 A 4.4852 8.4196 124.8240 52.2335 19.6453 177.0569 131 V 4.5444 8.4988 112.1958 58.8485 35.2519 176.0284 132 V 3.8723 8.2056 121.9082 64.7561 31.6820 176.5927 133 G 3.9775 8.9204 115.6753 45.0791 0.0000 173.4042 134 Q 4.2137 7.8018 121.7234 55.7311 30.3155 174.8536 135 A 4.6293 8.5525 128.4249 51.8651 19.2625 176.3064 136 I 4.5740 8.9327 122.6517 59.0829 42.2864 174.0351 137 K 5.0868 8.4600 123.6161 54.1652 36.3537 175.6014 138 K 5.1938 8.6448 120.9357 55.1788 35.8113 174.8635 139 S 5.2701 9.3595 117.0857 56.7474 65.3358 173.0488 140 G 4.2859 8.7787 113.0466 44.7799 0.0000 173.1540 141 S 4.5367 8.9137 113.3322 59.1610 63.8764 175.6574 142 T 4.1304 8.0624 118.2907 65.8058 68.9404 176.1950 143 T 4.3710 7.9372 107.6986 61.8270 70.4149 174.8957 *156 K 4.0522 7.2092 121.5087 56.6532 35.9737 177.1887 157 V 4.9094 8.5643 130.2047 62.8771 32.4807 174.0247 158 T 4.9369 8.7181 117.2865 59.8725 72.4301 172.5001 159 S 5.0007 8.1191 114.8585 57.1851 67.2005 173.2782 160 G 4.1916 8.1413 105.8840 46.5016 0.0000 171.8714 161 T 5.2323 8.3767 115.9551 61.3520 72.1963 174.2145 162 V 4.2710 8.6858 126.3787 63.4305 31.9371 176.3378 163 T 4.4593 8.7588 117.8590 62.4137 70.5232 174.4991 164 A 4.6450 7.5999 121.6224 50.9860 22.4179 175.5068 165 V 4.5573 8.1455 112.8902 59.5243 35.3855 174.8164 166 N 4.1451 8.4749 116.2750 54.5592 35.7846 174.5855 167 V 4.3011 7.9650 117.7590 61.9157 33.8827 174.8445 168 T 4.8851 8.4165 123.7925 62.1807 70.2628 174.0573 169 V 4.1372 8.3650 125.9857 61.0232 34.2390 173.8782 170 N 4.8798 8.5430 125.4463 52.1863 39.4009 174.5253 171 Y 4.8244 8.2927 122.5776 56.0734 40.0338 176.4030 172 G 3.8185 8.7560 109.3674 49.0746 0.0000 174.9362 173 D 4.3006 8.2175 119.0672 56.2387 41.3835 176.0807 *175 G 4.3822 7.9925 107.1860 44.2309 0.0000 169.7834 176 P 4.6586 0.0000 0.0000 62.4795 32.8206 175.6473 177 V 4.4176 8.3305 115.3274 59.7827 34.7043 174.6052 178 Y 4.8611 8.6570 122.4279 56.0486 40.5943 174.4544 179 N 4.1132 8.6233 115.7848 55.1387 37.4849 173.6500 180 M 4.6435 8.1634 116.2767 54.1621 35.1062 175.8943 181 V 4.6833 8.2703 119.2978 61.3328 34.4702 174.3428 182 R 4.9383 8.9127 127.3515 55.1715 32.1903 175.5509 183 T 5.2885 8.7849 112.5452 60.2649 73.1690 173.9046 184 T 5.1802 8.7355 108.6479 61.1936 70.2296 173.8857 *190 A 4.6911 7.6649 123.5825 52.2401 20.1207 177.3984 191 C 4.8653 8.8120 119.7556 57.3425 41.2345 173.0357 192 S 4.4856 8.2927 114.9970 58.2035 65.4616 172.6191 192A A 4.4672 8.7819 121.9364 50.7869 22.0684 175.9752 192B G 3.9330 8.4776 108.7284 47.6167 0.0000 174.0104 193 G 4.1705 8.7957 110.5177 46.0116 0.0000 174.4242 194 D 4.4402 8.0373 119.0410 56.3968 41.3554 176.9288 195 S 4.5734 7.9198 115.9377 60.0081 63.2556 175.2238 196 G 4.2118 8.4516 112.9494 46.2700 0.0000 174.0528 197 G 3.8343 8.0632 107.0868 45.8529 0.0000 172.7762 198 A 4.3781 8.2852 122.6447 51.8320 19.6253 176.2888 199 H 5.3802 9.4422 121.3435 54.4826 30.7387 174.4869 200 F 5.4623 9.0046 117.2082 55.8256 42.0816 173.1686 201 A 4.4701 8.7956 121.1630 50.0820 21.5380 175.9840 202 G 3.5293 8.9857 113.3546 47.5700 0.0000 174.0566 *207 S 5.0845 8.4071 118.9501 57.7779 65.7893 172.4824 208 V 4.7102 7.9023 121.4675 61.4263 33.2044 174.7485 209 A 4.3403 8.8276 131.2668 52.0612 18.7386 177.4214 210 L 4.6048 8.4510 122.2360 55.1710 45.0690 176.5439 211 G 4.3367 7.8985 103.2685 45.7539 0.0000 172.0867 212 I 5.0615 8.4919 120.9472 59.2070 39.8261 175.2545 213 H 4.5401 9.4776 128.5691 57.0485 30.2251 174.7499 214 S 4.3581 8.6453 120.5248 59.1077 63.9392 173.6475 215 G 4.1670 7.2401 103.5112 48.2116 0.0000 171.2273 216 S 5.0362 8.4951 114.1276 58.5876 65.3535 175.1196 217 S 4.5452 8.6856 112.8837 58.2704 62.7586 173.8247 *219 G 4.3608 7.7307 108.4489 46.5734 0.0000 172.8746 220 C 5.0425 8.1562 117.1157 55.2263 46.3110 172.9408 221 S 4.6665 8.5954 120.2620 57.5275 66.1122 173.2861 221A G 3.8365 8.4032 116.7462 47.5238 0.0000 175.9400 222 T 4.1965 8.7235 121.3803 63.2503 69.2938 174.6746 223 A 4.2101 8.0553 125.8630 51.4297 17.3665 176.6816 224 G 4.4299 8.6483 111.0259 45.2532 0.0000 172.4924 225 S 5.4297 8.5398 113.6263 57.4995 64.0024 174.1671 226 A 4.4066 8.5357 123.3424 53.4745 19.2513 177.3718 227 I 5.0220 8.9238 124.0648 59.8794 39.7579 174.6676 228 H 5.3786 8.8549 121.0386 53.6153 32.3859 172.1572 229 Q 4.6375 9.1841 122.2329 54.8864 30.4352 173.2947 230 P 4.7724 0.0000 0.0000 63.5343 31.9601 177.8856 231 V 3.8469 8.9992 125.3967 64.8161 31.4127 178.6861 232 T 3.8013 7.9272 110.1255 64.8261 68.2995 176.0635 233 E 3.9305 8.1099 121.1160 58.3795 29.5292 179.0472 234 A 2.7105 7.5485 120.4654 54.4857 18.5577 179.4912 235 L 3.9336 7.9109 117.8759 57.8639 41.6336 179.9317 235A S 4.0344 8.1841 114.2099 61.2609 62.8377 176.1589 236 A 3.8587 7.5579 123.6293 54.2747 17.9924 178.1957 237 Y 4.7344 7.1278 111.0651 56.5115 39.0225 175.7962 238 G 3.9307 7.8442 107.3448 47.0926 0.0000 174.0085 239 V 4.8339 7.6817 110.7046 59.2723 35.2509 176.0216 240 T 4.7706 8.5347 112.0053 59.7693 72.0551 174.0226 241 V 4.5449 8.3359 116.4592 61.6859 33.1905 175.9368 242 Y 4.3834 7.7719 118.6586 57.5680 37.8019 174.8240 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 16 V 8.05 4.13 2.01 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 0.45 0.00 0.00 0.85 0.00 0.00 17 L 8.15 4.30 0.00 1.47 1.48 0.79 0.53 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 18 G 7.97 3.50 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 0.00 19 G 8.69 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 0.00 0.00 0.00 0.00 *29 G 7.63 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 30 A 8.60 4.76 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 31 I 8.56 4.99 2.14 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.05 0.56 0.00 0.00 32 Y 9.28 5.35 0.00 2.92 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 9.20 2.99 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 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.25 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 *39 G 7.93 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 40 S 8.30 5.05 0.00 3.78 3.76 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 0.00 0.00 0.00 0.00 41 R 8.41 4.63 0.00 1.67 1.68 0.00 2.93 0.00 0.00 2.99 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.16 0.00 42 C 9.10 5.39 0.00 2.84 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 43 S 8.71 5.18 0.00 3.71 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.65 4.21 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.92 3.99 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 46 F 7.49 4.86 0.00 2.96 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.85 5.37 0.00 2.45 2.92 0.00 0.00 6.74 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 48 V 9.55 5.05 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 0.86 0.00 0.00 1.11 0.00 0.00 48A T 9.35 5.70 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 1.33 0.00 0.00 48B K 9.06 4.70 0.00 1.83 1.93 0.00 1.67 0.00 0.00 1.95 0.00 0.00 2.14 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.12 1.53 7.81 48C G 9.74 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 48D G 8.47 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 49 A 8.25 4.67 1.23 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 0.00 0.00 0.00 50 R 8.00 5.29 0.00 1.82 2.05 0.00 3.05 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.50 0.00 51 Y 9.59 5.29 0.00 2.86 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 52 F 8.52 5.53 0.00 3.13 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 53 V 8.63 4.72 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 0.76 0.00 0.00 1.20 0.00 0.00 54 T 8.37 4.92 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 0.95 0.00 0.00 55 A 8.50 4.66 1.09 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 0.00 0.00 56 G 8.81 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.23 4.02 0.00 2.37 1.31 0.00 5.56 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 6.94 4.48 0.00 2.92 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.76 3.91 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 0.90 0.00 0.00 58 N 7.02 4.67 0.00 2.82 2.82 0.00 0.00 6.99 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 7.61 3.73 1.90 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.83 0.60 0.00 0.00 64 S 7.30 4.59 0.00 3.47 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 65 A 8.61 4.53 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 65A N 7.87 5.44 0.00 2.65 2.76 0.00 0.00 5.80 8.88 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 66 W 9.05 5.04 0.00 3.44 3.35 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 67 S 9.40 5.35 0.00 3.91 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.65 4.63 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *78 S 7.85 4.47 0.00 3.81 3.96 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 79 S 7.64 3.70 0.00 3.84 3.76 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 0.00 0.00 0.00 0.00 80 G 7.62 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 81 G 7.82 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 82 S 8.12 4.17 0.00 4.05 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 *84 V 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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 1.26 0.00 0.00 164 A 7.60 4.64 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 0.00 165 V 8.15 4.56 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 0.80 0.00 0.00 0.93 0.00 0.00 166 N 8.47 4.15 0.00 2.86 2.91 0.00 0.00 6.81 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 0.00 167 V 7.96 4.30 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 1.00 0.00 0.00 0.92 0.00 0.00 168 T 8.42 4.89 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 1.15 0.00 0.00 169 V 8.37 4.14 1.66 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 0.25 0.00 0.00 0.79 0.00 0.00 170 N 8.54 4.88 0.00 2.54 2.69 0.00 0.00 7.07 7.46 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 0.00 171 Y 8.29 4.82 0.00 3.18 2.85 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 0.00 172 G 8.76 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 0.00 173 D 8.22 4.30 0.00 2.99 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 *175 G 7.99 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 P 0.00 4.66 0.00 1.46 1.96 0.00 3.51 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.93 0.00 177 V 8.33 4.42 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 0.78 0.00 0.00 0.68 0.00 0.00 178 Y 8.66 4.86 0.00 2.84 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.62 4.11 0.00 2.87 2.93 0.00 0.00 6.98 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 0.00 180 M 8.16 4.64 0.00 1.94 2.02 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.62 0.00 181 V 8.27 4.68 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.89 0.00 0.00 182 R 8.91 4.94 0.00 1.78 1.81 0.00 3.11 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 183 T 8.78 5.29 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 1.34 0.00 0.00 184 T 8.74 5.18 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 1.22 0.00 0.00 *190 A 7.66 4.69 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 0.00 191 C 8.81 4.87 0.00 2.86 3.02 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 0.00 192 S 8.29 4.49 0.00 3.94 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 192A A 8.78 4.47 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 192B G 8.48 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 0.00 193 G 8.80 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 0.00 194 D 8.04 4.44 0.00 2.80 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 0.00 195 S 7.92 4.57 0.00 3.88 3.67 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 0.00 196 G 8.45 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 0.00 197 G 8.06 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 A 8.29 4.38 0.91 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 0.00 199 H 9.44 5.38 0.00 3.14 3.24 0.00 5.64 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 0.00 200 F 9.00 5.46 0.00 3.27 3.31 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 0.00 201 A 8.80 4.47 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 0.00 202 G 8.99 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 0.00 0.00 0.00 *207 S 8.41 5.08 0.00 3.95 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 0.00 208 V 7.90 4.71 2.24 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 0.92 0.00 0.00 0.94 0.00 0.00 209 A 8.83 4.34 0.23 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 0.00 0.00 0.00 210 L 8.45 4.60 0.00 1.73 1.71 0.96 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 211 G 7.90 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.49 5.06 2.01 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.88 1.06 0.00 0.00 213 H 9.48 4.54 0.00 3.47 3.42 0.00 5.74 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 S 8.65 4.36 0.00 3.99 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 0.00 215 G 7.24 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 0.00 216 S 8.50 5.04 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 0.00 217 S 8.69 4.55 0.00 4.00 4.09 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 *219 G 7.73 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.16 5.04 0.00 2.90 2.91 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 0.00 221 S 8.60 4.67 0.00 3.84 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 221A G 8.40 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 T 8.72 4.20 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 0.00 223 A 8.06 4.21 1.33 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 0.00 0.00 0.00 224 G 8.65 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 0.00 0.00 0.00 0.00 225 S 8.54 5.43 0.00 3.85 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 0.00 226 A 8.54 4.41 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 0.00 227 I 8.92 5.02 2.02 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 1.29 1.04 0.96 0.00 0.00 228 H 8.85 5.38 0.00 3.08 2.90 0.00 5.26 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 Q 9.18 4.64 0.00 2.31 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.93 0.00 0.00 0.00 0.00 0.00 2.81 2.59 0.00 230 P 0.00 4.77 0.00 2.17 2.05 0.00 3.75 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.19 0.00 231 V 9.00 3.85 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.98 0.00 0.00 232 T 7.93 3.80 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 0.00 233 E 8.11 3.93 0.00 2.23 1.95 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 2.34 2.20 0.00 234 A 7.55 2.71 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 0.00 0.00 0.00 0.00 0.00 235 L 7.91 3.93 0.00 1.75 1.90 0.83 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 235A S 8.18 4.03 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 0.00 236 A 7.56 3.86 0.57 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 0.00 237 Y 7.13 4.73 0.00 2.84 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 0.00 238 G 7.84 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 0.00 239 V 7.68 4.83 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 0.50 0.00 0.00 0.94 0.00 0.00 240 T 8.53 4.77 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 1.22 0.00 0.00 241 V 8.34 4.54 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 0.51 0.00 0.00 0.91 0.00 0.00 242 Y 7.77 4.38 0.00 3.06 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 * Residues marked with a * may have inaccurate shift predictions.