NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 4.1169 8.0249 121.3413 61.3012 38.7947 174.3109 3 Y 4.5724 8.6559 124.8216 55.9713 40.2133 173.4207 4 Q 5.2107 8.3261 121.6730 54.8948 33.7669 173.3649 5 K 4.5623 8.8322 119.3241 56.4655 36.2476 173.8069 6 Q 5.1911 8.7155 118.6336 54.7896 30.7591 175.3101 7 R 4.3713 9.0303 120.0662 56.9480 32.2446 175.4527 *12 T 4.4120 7.6764 110.0370 61.4596 70.2739 178.4369 13 Q 4.6816 9.1712 122.0506 53.9157 32.7884 174.2472 14 L 5.1254 8.5071 124.9575 53.2419 45.4926 174.4559 15 N 5.4412 9.5110 124.8949 51.9612 42.0031 172.9425 16 I 5.4168 8.9470 126.5962 59.5897 41.5792 174.6249 17 S 5.2698 9.2663 119.9098 56.6737 66.8373 172.6647 18 I 5.3058 9.1840 121.3147 59.6493 41.7166 173.8675 19 S 5.0344 9.1925 122.0979 56.1744 66.2384 173.4627 20 D 4.8529 8.5123 125.8102 54.0278 41.0119 174.1759 21 D 4.8594 7.2961 116.5233 52.6250 42.2712 175.9516 22 Q 4.6429 8.4819 119.4731 55.9780 29.3214 175.8449 23 S 4.2510 8.0416 113.2492 57.5311 63.5276 172.3037 24 P 4.5129 0.0000 0.0000 63.2709 31.9872 175.4552 25 S 5.0095 8.5221 116.6695 56.2484 65.7652 173.2726 26 H 4.8059 9.2955 123.3603 54.5860 32.3185 172.3522 27 I 4.6149 8.3139 127.0680 59.7189 39.3486 175.3759 28 N 4.9012 8.9263 126.7657 51.9885 39.1694 174.2526 29 T 4.1213 9.3111 113.9980 61.1790 69.9887 177.1459 30 G 3.8436 8.4881 109.2634 45.4058 0.0000 173.5562 31 V 4.4010 7.8433 119.4482 60.2674 33.7654 175.7655 32 G 3.6764 8.7050 113.9196 48.1014 0.0000 174.0444 33 F 3.9686 8.0293 121.5855 60.5754 39.4810 176.4512 34 L 3.5174 7.5283 118.7278 57.7376 42.2041 178.0049 35 N 4.3691 8.2603 116.9543 56.5955 38.4888 177.7018 36 H 4.1811 7.4804 115.5806 56.9546 29.6683 176.6249 *38 L 4.3605 7.9291 121.1483 54.5670 43.8409 179.3836 39 T 3.9768 7.9283 115.5173 66.4808 68.2503 176.6888 40 L 4.1411 7.8898 121.0617 57.7250 41.6631 179.1985 41 F 4.9410 8.6009 121.7697 60.9646 39.2328 177.1004 42 T 4.0631 8.1256 110.6686 64.3608 68.3870 176.1971 43 F 3.9967 7.8951 122.5749 61.0779 39.5138 176.3963 44 H 4.2796 8.2292 114.4329 57.9916 28.7628 177.3533 45 S 4.3196 7.7981 115.1409 58.7222 63.1664 175.5589 46 G 3.7346 7.3310 109.5150 45.2467 0.0000 172.8418 47 L 4.6726 7.4540 120.4636 53.4223 43.6830 175.9455 48 S 4.7252 9.2774 120.4216 57.9570 64.4259 173.1395 49 L 5.3255 8.8055 124.4445 53.0193 44.9433 175.2445 50 N 5.2314 9.4113 120.1555 51.6245 42.4619 173.4993 51 I 5.0223 9.1769 124.3395 59.5775 41.4917 174.0921 52 E 4.8978 9.5625 126.8558 54.5425 32.1177 174.7359 53 A 5.2530 8.6966 127.0234 50.1914 21.2328 175.4878 54 Q 4.6459 9.6027 121.3336 53.0551 33.3779 175.9215 55 G 4.0167 8.5778 114.7287 46.8376 0.0000 173.7758 *60 D 4.6356 8.3499 124.8385 54.0001 42.8384 176.4168 61 D 4.4380 7.9334 118.1809 57.4962 40.6692 178.3138 62 H 3.9745 8.1419 118.2131 59.6356 29.8549 176.8801 63 H 4.2942 8.0255 117.3613 58.8241 28.5800 177.8210 64 V 3.6030 7.7419 119.7107 66.3359 31.4385 178.0649 65 T 3.9432 8.2377 115.7772 66.7463 68.2728 176.1998 66 E 3.9101 8.4579 121.3170 59.4049 29.6715 178.5561 67 D 4.3351 8.4092 119.1659 57.3815 40.7969 178.8033 68 I 3.8231 8.1083 120.5562 64.4064 37.0689 178.7076 69 G 3.1243 8.2455 106.4670 47.5876 0.0000 175.7897 70 I 3.5866 7.8702 122.3730 64.1196 37.0840 178.7655 71 V 3.7094 7.7070 119.0127 65.9570 31.2873 177.9618 72 I 3.7653 7.9984 119.9336 64.3304 36.9542 178.2848 73 G 3.6905 8.0542 106.5503 48.2274 0.0000 175.5809 74 Q 3.9960 8.2997 121.3496 58.4834 28.4986 179.0875 75 L 4.0201 7.9648 119.1787 57.6534 41.6982 179.1875 76 L 4.0089 8.0257 118.6863 57.5867 41.7411 178.9186 77 L 4.0710 7.9324 120.3629 57.9595 41.9641 179.1731 78 E 4.1402 7.6837 114.5405 57.3551 28.6055 178.6756 *80 I 3.8031 7.6624 121.9686 61.2914 39.0580 178.1677 81 K 4.0203 8.0439 118.4482 59.5363 32.0452 178.2420 82 D 4.5514 7.8289 117.6048 56.8093 41.0211 177.4159 83 K 4.1941 7.5283 117.6477 56.1648 31.9195 175.8849 84 K 4.0701 8.0123 124.0960 56.4979 33.1499 175.2621 85 H 4.8764 7.8297 115.1823 54.0545 30.9491 173.4659 86 F 5.3613 7.5880 117.4206 54.7636 40.8211 174.8312 87 V 3.5997 8.8429 120.4618 65.0497 31.3614 176.3899 88 R 4.6074 9.1930 123.6942 56.0466 30.3963 174.8424 89 Y 5.1310 7.6674 113.4410 56.2598 39.8266 175.7012 90 G 4.3094 9.3614 110.7269 45.0751 0.0000 171.5315 91 T 5.5805 8.1424 118.2826 60.6774 73.2840 172.4935 *93 Y 4.5357 8.2582 118.6310 58.2648 39.3233 175.2674 94 I 4.6624 8.6968 124.0334 59.2833 40.7859 173.4745 95 P 5.6213 0.0000 0.0000 60.4702 34.0260 175.2248 *97 D 4.7597 8.6473 120.3991 54.2337 41.7585 178.8042 98 E 4.2196 9.3480 127.5552 60.2094 29.6664 177.2918 99 T 4.5725 7.3946 116.9305 63.0096 70.2151 173.8203 100 L 5.0624 9.0563 126.4143 53.3572 45.4516 174.9229 101 A 5.1654 9.0373 127.4099 50.0293 22.5866 174.5396 102 R 4.3110 8.8326 120.8034 54.1824 33.3646 174.5330 103 V 4.7751 8.0874 124.7874 60.9999 35.1075 173.8334 104 V 4.8258 8.7992 127.6474 61.2156 33.9079 174.4770 105 V 4.9805 9.2339 121.2935 59.5697 35.2075 174.3266 106 D 4.9650 9.1517 123.8111 52.5173 43.9937 175.1678 107 I 4.5649 8.6016 128.9041 61.1251 34.3327 175.6329 108 S 4.4591 8.5360 119.5212 57.2049 64.8454 176.5341 109 G 3.8416 8.2229 108.2927 45.3113 0.0000 173.4730 110 R 4.4988 7.6990 119.0252 53.6768 30.7755 174.0906 111 P 4.6431 0.0000 0.0000 62.7314 32.1080 175.8387 112 Y 4.3981 8.9702 124.8851 56.5097 42.8601 172.5956 113 L 5.0974 8.1128 128.8273 53.3238 44.6588 175.1883 114 S 4.6108 9.2830 122.2846 56.8168 63.9187 172.3056 115 F 4.8152 8.7585 130.4307 56.5748 40.6596 175.3268 116 N 5.0266 8.3063 123.9317 50.4227 39.1678 172.1947 117 A 4.4584 7.6921 119.9113 51.1381 21.7967 176.6493 118 S 4.5191 8.6333 119.6742 57.7750 62.9986 174.5556 119 L 4.5827 8.2960 125.8556 54.2260 42.2950 178.0155 120 S 4.3371 9.1644 118.9053 60.7366 63.0803 174.8413 121 K 4.7547 7.4202 116.3683 54.3759 35.9047 176.3796 122 E 4.1832 8.6493 120.0862 58.4364 29.9030 177.1847 123 K 5.0085 7.6634 116.0105 54.4718 36.2323 175.8071 124 V 4.2304 8.3254 115.6284 60.2658 34.0145 176.3671 125 G 3.7313 8.2117 115.7428 47.3190 0.0000 174.4319 126 T 4.2882 8.6639 114.5634 60.9471 69.4270 173.9049 127 F 4.3356 8.2176 126.8467 57.2198 39.9936 174.2547 128 D 4.6629 7.9648 128.4998 54.4901 41.1314 177.5544 129 T 4.0637 8.6063 122.5364 66.1376 67.9535 176.3434 130 E 4.1282 8.0491 118.7727 58.5206 29.4844 178.6318 131 L 3.6563 7.7215 120.2871 56.9743 41.5939 179.2814 132 V 3.8606 7.8224 118.7433 66.1160 31.5018 177.4733 133 E 2.9247 7.9826 118.4695 59.0711 29.3717 178.4518 134 E 3.8033 7.5776 118.2177 59.0996 29.4591 179.0143 135 F 3.9304 8.4633 121.0321 61.4876 39.4099 177.3083 136 F 3.6708 7.9338 117.2325 60.1055 38.5916 177.6855 137 R 3.7406 8.1470 118.5244 59.2071 29.9022 178.3708 138 A 3.7762 7.5619 120.2689 55.0915 18.3119 179.5990 139 V 3.3345 7.0908 116.4689 66.1586 31.5526 178.4446 140 V 3.6230 7.8709 118.1100 66.0553 31.3431 178.0971 141 I 3.7033 7.6307 119.5760 64.5345 36.7471 178.1801 142 N 4.4310 7.7978 115.2262 55.5104 38.5517 176.6256 143 A 4.2679 8.1808 120.3347 51.6273 19.4556 177.0178 144 R 3.7913 7.6768 115.7002 57.1915 28.4202 175.6970 145 L 5.0206 7.8882 116.2629 53.6491 44.8716 176.3333 146 T 5.1522 8.6526 116.6899 61.0300 69.0802 173.3250 147 T 5.3334 9.2985 123.3322 60.6992 71.5085 171.8856 148 H 5.3969 9.2469 124.4717 54.1355 31.8974 172.7967 149 I 4.6535 8.8969 124.6849 59.5419 39.6863 174.4578 150 D 5.0148 8.8802 126.6157 52.3716 44.5192 174.6342 151 L 4.5405 8.4547 127.0598 54.0295 41.5932 176.3116 152 I 4.1128 8.6349 129.1090 64.0659 37.6233 176.9604 153 R 4.6594 7.8316 116.2188 55.2439 32.6834 174.7783 154 G 4.3344 8.8430 108.8543 46.5216 0.0000 172.6665 155 G 4.8602 8.1436 117.9896 46.0024 0.0000 172.2741 156 N 4.8730 7.9175 119.5253 51.4923 41.1500 175.8180 157 T 4.1489 8.4350 124.5869 66.8206 68.7089 176.2690 158 H 4.2000 8.3129 119.8027 59.7739 29.9204 176.8911 159 H 4.4044 8.6359 117.9473 58.8628 28.6309 177.6631 160 E 4.0334 8.5279 120.8406 59.4568 29.3505 179.2850 161 I 4.2298 8.0828 112.5549 63.1764 37.9655 177.7412 162 E 3.9777 8.5885 121.3965 59.1780 29.4231 178.4663 163 A 4.0603 8.3479 120.9485 55.2853 18.3576 179.6508 164 I 3.5832 7.7737 117.7791 64.5698 37.2279 178.6473 165 F 4.3136 8.6903 118.6355 60.5827 38.8011 177.7862 166 K 3.9648 8.6709 118.1818 59.5800 31.8758 179.2816 167 A 4.0052 8.3223 121.0899 55.0631 18.2271 179.4105 168 F 4.0427 8.5412 119.4516 61.5621 39.4859 177.5480 169 S 4.2652 8.4900 114.7487 61.7681 62.5975 177.0071 170 R 4.0073 8.2206 120.5176 59.1160 29.7947 178.8647 171 A 3.9154 8.0464 120.6807 54.9579 18.2567 179.4333 172 L 3.7228 7.9000 119.1694 58.2236 41.9641 179.1357 173 G 3.6848 7.6979 104.1720 48.0703 0.0000 175.2535 174 I 3.8404 8.0111 121.9882 64.1516 37.1319 178.4689 175 A 4.0820 8.1106 121.6023 54.9768 17.9779 179.0961 176 L 4.0160 7.9927 115.7509 55.3387 42.1712 177.5048 177 T 4.0250 7.4109 116.9845 63.5355 69.2358 173.8037 178 A 4.7793 8.8311 128.8314 52.2873 19.4574 177.2083 179 T 4.2427 8.7809 110.7968 61.7894 68.5741 174.1285 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 2 I 8.02 4.12 1.77 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 1.32 1.00 0.90 0.00 0.00 3 Y 8.66 4.57 0.00 3.00 2.88 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 4 Q 8.33 5.21 0.00 1.90 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 5 K 8.83 4.56 0.00 1.79 1.88 0.00 1.26 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.34 7.81 6 Q 8.72 5.19 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.91 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00 7 R 9.03 4.37 0.00 1.81 1.87 0.00 3.12 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 *12 T 7.68 4.41 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 13 Q 9.17 4.68 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.73 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 14 L 8.51 5.13 0.00 1.71 1.67 0.94 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 15 N 9.51 5.44 0.00 2.81 2.63 0.00 0.00 6.53 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 8.95 5.42 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.59 0.97 0.00 0.00 17 S 9.27 5.27 0.00 3.95 3.94 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 18 I 9.18 5.31 2.00 0.00 0.00 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 1.24 1.78 1.04 0.00 0.00 19 S 9.19 5.03 0.00 3.92 3.65 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 20 D 8.51 4.85 0.00 2.70 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 21 D 7.30 4.86 0.00 2.83 2.62 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 22 Q 8.48 4.64 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.96 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 23 S 8.04 4.25 0.00 4.01 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 24 P 0.00 4.51 0.00 1.98 2.06 0.00 3.64 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 25 S 8.52 5.01 0.00 3.77 3.94 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 26 H 9.30 4.81 0.00 3.19 3.32 0.00 5.53 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 I 8.31 4.61 1.83 0.00 0.00 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 1.25 0.80 0.92 0.00 0.00 28 N 8.93 4.90 0.00 2.69 2.75 0.00 0.00 6.50 7.25 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 29 T 9.31 4.12 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 30 G 8.49 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 31 V 7.84 4.40 2.12 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 1.43 0.00 0.00 1.00 0.00 0.00 32 G 8.71 3.68 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 33 F 8.03 3.97 0.00 2.82 2.50 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 34 L 7.53 3.52 0.00 1.54 1.73 0.41 0.94 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 35 N 8.26 4.37 0.00 2.85 2.78 0.00 0.00 6.64 7.72 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 36 H 7.48 4.18 0.00 3.06 2.95 0.00 5.81 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *38 L 7.93 4.36 0.00 1.72 1.76 0.83 0.57 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 39 T 7.93 3.98 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 1.22 0.00 0.00 40 L 7.89 4.14 0.00 1.70 1.87 0.84 1.05 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 41 F 8.60 4.94 0.00 3.46 3.43 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 42 T 8.13 4.06 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 1.44 0.00 0.00 43 F 7.90 4.00 0.00 3.04 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 44 H 8.23 4.28 0.00 3.35 3.37 0.00 5.70 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 7.80 4.32 0.00 3.66 3.38 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 46 G 7.33 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 0.00 0.00 0.00 47 L 7.45 4.67 0.00 1.45 1.60 0.98 0.65 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 48 S 9.28 4.73 0.00 3.76 3.87 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 0.00 0.00 0.00 49 L 8.81 5.33 0.00 1.74 1.64 1.11 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 50 N 9.41 5.23 0.00 2.61 2.73 0.00 0.00 6.55 6.81 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 51 I 9.18 5.02 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.79 0.93 0.00 0.00 52 E 9.56 4.90 0.00 1.84 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 2.28 2.40 0.00 53 A 8.70 5.25 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 54 Q 9.60 4.65 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.64 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 55 G 8.58 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 *60 D 8.35 4.64 0.00 2.78 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.14 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 0.00 139 V 7.09 3.33 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 -0.19 0.00 0.00 140 V 7.87 3.62 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 1.10 0.00 0.00 1.06 0.00 0.00 141 I 7.63 3.70 1.88 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.37 0.87 0.00 0.00 142 N 7.80 4.43 0.00 2.76 2.82 0.00 0.00 7.06 7.79 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 0.00 143 A 8.18 4.27 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 7.68 3.79 0.00 2.02 2.02 0.00 3.11 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 145 L 7.89 5.02 0.00 1.71 1.64 1.10 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 146 T 8.65 5.15 4.40 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 0.00 0.00 1.39 0.00 0.00 147 T 9.30 5.33 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 148 H 9.25 5.40 0.00 3.10 3.17 0.00 5.65 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 I 8.90 4.65 1.51 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.79 0.38 0.00 0.00 150 D 8.88 5.01 0.00 2.40 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 0.00 0.00 0.00 0.00 151 L 8.45 4.54 0.00 1.69 1.55 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 152 I 8.63 4.11 2.07 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.65 0.97 0.00 0.00 153 R 7.83 4.66 0.00 1.85 1.99 0.00 2.94 0.00 0.00 3.37 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 154 G 8.84 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 0.00 0.00 0.00 0.00 155 G 8.14 4.86 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 0.00 0.00 0.00 156 N 7.92 4.87 0.00 2.72 2.76 0.00 0.00 7.36 6.71 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 0.00 157 T 8.44 4.15 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 158 H 8.31 4.20 0.00 3.31 3.48 0.00 5.87 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 0.00 159 H 8.64 4.40 0.00 3.59 3.38 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 E 8.53 4.03 0.00 2.27 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 2.56 0.00 161 I 8.08 4.23 2.27 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.84 1.20 0.00 0.00 162 E 8.59 3.98 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 163 A 8.35 4.06 1.44 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 0.00 0.00 164 I 7.77 3.58 2.11 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 1.37 0.74 0.50 0.00 0.00 165 F 8.69 4.31 0.00 3.28 3.27 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 0.00 166 K 8.67 3.96 0.00 2.03 1.82 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.65 7.81 167 A 8.32 4.01 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 0.00 168 F 8.54 4.04 0.00 2.96 3.23 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 0.00 169 S 8.49 4.27 0.00 4.28 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 0.00 170 R 8.22 4.01 0.00 1.87 1.97 0.00 3.19 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.91 0.00 171 A 8.05 3.92 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 7.90 3.72 0.00 1.12 1.54 0.81 1.12 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 0.00 173 G 7.70 3.68 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 0.00 174 I 8.01 3.84 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.02 0.93 0.00 0.00 175 A 8.11 4.08 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 0.00 176 L 7.99 4.02 0.00 1.66 1.61 0.83 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 177 T 7.41 4.03 4.37 0.00 0.00 0.00 0.00 0.00 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 0.00 178 A 8.83 4.78 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 0.00 179 T 8.78 4.24 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 1.23 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.