NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.1863 0.0000 0.0000 62.2977 32.6377 175.2968 3 N 4.4385 8.1298 116.3957 52.3433 39.6919 172.7144 4 Y 5.0956 8.7074 121.7007 56.1641 41.5451 174.4975 5 K 4.9690 9.1497 124.0992 54.7945 35.4526 174.3400 6 L 5.1645 9.2625 130.8858 54.1560 44.2197 175.1052 7 T 5.1992 8.5496 122.6881 62.2719 71.6755 172.7602 8 Y 4.7407 8.3818 125.9061 56.7966 43.2052 173.0372 9 F 4.7143 6.6328 120.1349 56.6661 40.1543 176.7751 10 N 4.7672 8.6233 119.6128 51.8711 36.9034 173.1227 11 M 4.7180 7.5824 117.1143 53.9887 33.8129 175.6103 12 R 4.3561 8.2872 118.7456 56.4010 31.5795 179.8598 13 G 3.9933 7.8248 109.8005 47.3255 0.0000 174.4997 14 R 4.1161 8.8435 121.3712 57.0714 30.6380 177.5012 15 A 4.0339 6.6536 119.5842 53.1640 18.7638 178.6833 16 E 3.9568 7.7080 118.2702 59.3486 29.6034 178.6388 17 I 3.6127 7.6861 118.2059 64.1753 37.9754 177.8089 18 I 3.2464 7.4017 120.0904 64.1989 36.9315 178.4466 19 R 3.5189 7.5877 118.6288 59.1830 29.6902 178.8250 20 Y 3.8167 8.1831 116.6569 60.8948 37.8228 178.3043 21 I 3.8750 7.6818 120.7170 64.5473 37.2233 178.3828 22 F 4.3414 7.9639 118.5561 60.5409 38.7820 177.6035 23 A 4.0034 7.9024 120.2227 55.4323 18.0074 179.0168 24 Y 4.0924 8.1779 116.9335 60.6764 39.0185 177.4408 25 L 4.2858 8.1529 116.6435 53.6125 42.9007 176.0011 26 D 4.3225 7.6332 117.2970 55.4997 39.8712 173.7818 27 I 4.4584 8.1587 119.1566 59.4931 39.1787 176.4439 28 Q 4.2451 8.6149 125.3679 55.9517 29.2739 174.7444 29 Y 4.8815 7.7688 119.0268 55.7288 41.6652 173.6063 30 E 4.1032 9.2240 121.8530 55.1990 30.7557 174.7699 31 D 5.0054 8.3081 128.7889 53.6048 40.2221 172.8409 32 H 4.6961 9.5125 122.2794 55.0599 31.2643 173.6662 33 R 5.0564 8.5243 125.9627 54.4192 31.4174 176.1966 34 I 4.1881 8.5759 118.9359 60.0187 39.2732 175.8705 35 E 4.2673 8.7231 123.5483 56.1679 30.3683 178.1967 36 Q 4.1533 8.9374 121.9243 59.1111 28.4468 179.1697 37 A 4.2028 7.9899 120.5907 54.6361 18.5255 178.2953 38 D 4.6497 8.2168 115.6704 54.8168 41.0528 178.3666 39 W 4.6069 7.9862 129.8791 60.1811 31.1527 175.6177 40 P 3.9288 0.0000 0.0000 65.8078 30.5140 178.2027 41 E 3.8331 7.9840 114.9733 59.5638 29.7413 179.1238 42 I 3.8160 7.2587 118.5561 63.9246 37.2264 178.0380 43 K 2.9381 7.1436 121.2384 59.3262 31.5296 178.7715 44 S 4.0931 6.9928 110.2051 60.8205 63.0012 174.9364 45 T 4.1826 7.6409 109.5646 61.9377 68.7845 174.5999 46 L 4.6362 7.5126 123.3359 52.6290 43.5010 175.6926 47 P 4.1318 0.0000 0.0000 65.7534 29.8359 177.8748 48 F 4.6550 7.9396 116.3992 56.0145 39.9596 175.3946 49 G 4.0508 7.8219 106.0120 46.5391 0.0000 174.2951 50 K 5.0371 7.7600 114.7295 54.0893 35.6632 175.7854 51 I 4.7461 7.9982 113.6245 58.1085 40.4271 173.3843 52 P 5.4519 0.0000 0.0000 62.3190 32.4829 175.1932 53 I 4.9198 8.3295 112.9470 59.0739 41.5398 173.8929 54 L 5.2425 9.0185 125.3164 53.5606 45.2130 174.8984 55 E 4.8911 9.4843 127.3625 55.5103 31.3674 175.6279 56 V 4.3620 9.1644 126.0749 60.7810 32.9705 175.0830 57 D 4.5308 8.7485 131.4623 55.4337 38.4266 174.9909 58 G 3.8816 8.0641 102.1401 45.9696 0.0000 172.1340 59 L 4.6315 7.4984 122.0195 53.4532 43.9798 175.2879 60 T 4.7343 8.5343 123.1816 62.5776 69.7561 174.0789 61 L 5.0113 9.1124 126.8210 53.1920 45.1212 175.1900 62 H 5.0897 8.2343 116.4360 54.6179 32.7083 169.3494 63 Q 3.5030 8.8341 122.7722 55.5442 25.5427 174.3483 64 S 3.9983 8.6273 119.0246 61.8190 62.7190 176.5611 65 L 3.9871 7.8049 121.5375 56.7085 41.4885 179.1395 66 A 3.9071 7.7637 120.5821 55.0768 18.3281 179.5365 67 I 3.5456 7.7230 118.0978 64.4377 37.2772 178.4480 68 A 3.3909 7.9091 121.9403 54.9329 17.8858 179.6955 69 R 3.2226 7.3356 117.0049 59.3689 29.9122 178.1086 70 Y 3.9989 7.5706 118.2599 60.7843 38.8990 177.8483 71 L 3.7730 7.7846 119.1036 57.1745 41.9424 178.7328 72 T 4.0511 7.2717 108.2881 61.2066 69.2313 174.7983 73 K 3.9799 6.7949 123.8437 57.9612 32.5253 175.9251 74 N 4.3340 8.9726 121.8236 54.0725 35.7254 173.3855 75 T 4.6956 7.5082 108.5247 59.3586 71.5801 174.1660 76 D 4.5868 8.5285 119.5133 54.7634 39.8306 177.1733 77 L 3.8430 7.8598 119.9137 56.2491 42.0382 176.8566 78 A 4.6513 7.4528 121.5333 50.7704 19.3731 177.5023 79 G 3.8636 8.4896 108.8950 46.0657 0.0000 173.8738 80 N 4.5209 9.3977 118.7634 54.8136 39.0919 175.4682 81 T 4.7469 7.3444 107.8947 59.0915 73.6450 174.2738 82 E 3.9931 8.6061 119.7146 59.5863 29.3793 179.2980 83 M 3.9881 7.9267 117.9438 58.6395 32.4466 177.9497 84 E 4.0767 8.3928 118.8552 59.5591 29.5136 179.3720 85 Q 4.1047 8.1908 118.1577 58.9252 28.6514 178.3691 86 C 4.0558 7.8610 119.4561 62.8366 31.6233 175.4038 87 H 4.2079 8.0291 117.8040 58.6557 28.2398 177.8610 88 V 3.3312 8.2598 120.3631 66.1850 31.3100 177.6930 89 D 4.2243 8.2811 118.5514 57.3172 40.6396 178.9059 90 A 3.9140 8.1273 121.1876 55.1989 18.4388 179.7721 91 I 3.4635 7.5776 118.3257 64.3116 37.0438 178.7415 92 V 3.5785 7.5576 119.0074 66.2884 31.3070 177.8663 93 D 4.3775 8.2193 118.5827 57.5296 40.6887 178.9252 94 T 3.8863 8.0515 116.3373 66.7313 68.5915 176.7169 95 L 4.1406 8.0843 120.8699 57.7119 41.4136 179.1335 96 D 4.5091 8.4072 117.5038 57.6214 41.3487 177.4872 97 D 4.5536 8.5317 118.5304 57.7809 40.8342 178.3917 98 F 4.0678 7.7862 119.6097 60.6454 40.8136 176.3287 99 M 4.3088 7.9618 120.5349 56.2993 29.3498 176.1839 *121 T 4.3417 7.7243 114.0428 62.9038 70.7014 175.1681 122 Y 4.4434 8.0805 120.9903 59.8691 38.4161 176.3827 123 N 5.1195 8.2369 115.3164 53.7640 40.9546 176.5283 124 A 3.8881 8.3793 121.8211 54.9561 18.6494 177.7266 125 P 4.2515 0.0000 0.0000 66.0450 31.2778 178.6444 126 H 4.2335 8.1979 114.6968 58.5719 28.7288 177.3212 127 L 3.9067 8.2541 122.4366 58.4146 41.8496 178.8779 128 M 3.8855 7.9756 118.5196 58.4259 31.8211 178.6060 129 Q 3.9130 8.0304 119.4946 59.1659 29.2687 177.8394 130 D 4.3448 8.3040 120.1431 57.5143 40.9224 178.8120 131 L 3.8792 8.2844 119.6323 57.7669 41.5498 179.1657 132 D 4.2145 8.1200 117.9782 57.6278 40.9513 178.5041 133 T 3.8584 7.8735 115.2871 66.6953 68.5267 175.8042 134 Y 4.0544 8.3378 120.7338 60.6281 39.1435 177.6204 135 L 3.9127 8.7984 121.8796 56.4950 42.3579 178.5722 136 G 3.8474 8.3085 106.6375 46.5122 0.0000 174.3127 137 G 3.8208 8.5467 114.7867 45.5584 0.0000 173.4004 138 R 4.0952 7.9927 119.3182 55.8237 30.8101 176.4613 139 E 3.8897 8.6103 120.3620 57.7044 30.0571 176.2189 140 W 5.0618 7.5082 115.0237 54.2519 32.6940 175.4875 141 L 4.3265 9.5100 120.5183 57.3596 41.1675 178.4446 142 I 4.5614 7.3074 117.4162 60.2067 40.7336 176.9401 143 G 3.8641 8.6693 113.6427 45.8591 0.0000 173.6670 144 N 5.0277 8.8081 121.6887 52.4241 37.7440 174.0426 145 S 4.4681 7.5239 112.0224 56.5031 66.0982 173.8970 146 V 2.8231 6.8072 120.7078 61.5463 31.5949 175.3134 147 T 4.5275 8.2974 111.8137 58.4823 71.9006 174.6633 148 W 3.8713 8.4520 118.5515 58.3390 27.8305 178.1072 149 A 3.6441 7.1296 122.7107 55.1649 17.7368 179.3229 150 D 4.5840 8.0336 117.4378 57.4936 40.8971 178.9235 151 F 4.6757 8.2575 117.9632 61.0579 39.0417 176.9454 152 Y 4.2282 8.4601 119.2754 60.2263 38.4906 177.6694 153 W 4.2514 8.5492 129.5020 60.5544 30.8741 177.5266 154 E 3.5546 8.1441 120.4373 58.5423 28.5356 178.8432 155 I 3.4693 7.6460 119.6868 64.5919 37.1929 178.2765 156 C 3.9263 7.9251 118.1018 62.6860 27.9926 176.3971 157 S 3.7121 7.6457 116.1867 61.2959 62.0284 176.5986 158 T 3.8492 7.2187 118.5570 66.8063 68.5209 176.3606 159 T 4.0789 7.4466 116.4245 66.7234 68.4828 176.7404 160 L 4.1528 7.9647 120.8727 58.1152 41.2384 179.7269 161 L 4.1751 8.1985 118.8092 57.5741 41.2195 179.7540 162 V 3.4886 7.4472 117.7747 65.9530 31.5405 177.7020 163 F 4.5751 8.1794 115.4144 58.3579 40.2866 175.8309 164 K 4.5812 8.2903 119.5274 53.5977 32.3101 174.3957 165 P 4.4946 0.0000 0.0000 63.6477 31.8914 176.9189 166 D 5.3241 7.9188 115.9560 52.0295 39.9656 177.4892 167 L 3.9064 7.7312 123.4061 58.3806 42.0627 177.9827 168 L 4.8000 7.7857 115.0168 54.4802 42.3429 177.7310 169 D 4.3805 8.1182 121.8761 56.9542 40.8256 177.8178 170 N 4.9692 8.0869 113.4096 53.1669 39.6925 174.8368 171 H 5.0040 8.0804 114.9544 52.7287 29.2524 172.4066 172 P 4.2938 0.0000 0.0000 66.3281 31.3197 178.7115 173 R 3.9609 7.9847 117.0365 59.1493 30.0890 178.8122 174 L 3.9998 8.0082 118.8127 57.4723 41.5740 179.6398 175 V 3.7237 7.8537 117.8934 66.2597 31.4860 177.8269 176 T 3.8574 8.3953 115.9024 66.8012 68.3642 176.1753 177 L 3.9424 7.9127 121.8009 58.1387 41.9812 179.1867 178 R 4.0989 8.2522 117.5495 59.2911 30.1283 179.0189 179 K 3.9697 8.3068 118.2656 59.4862 31.8595 179.3806 180 K 3.9805 8.1007 117.4891 59.5763 32.3959 179.1909 181 V 4.1572 8.1438 118.3059 66.4234 31.3708 178.0556 182 Q 4.1627 8.4498 115.8250 57.9593 28.6292 177.4803 183 A 4.5410 7.7022 120.0179 51.4574 19.4810 177.2999 184 I 3.9201 7.4764 119.7859 60.6359 37.7819 174.8273 185 P 4.2462 0.0000 0.0000 66.0045 31.2504 178.4059 186 A 4.0159 8.0564 118.6276 55.0083 18.2134 179.8070 187 V 3.2832 7.7572 116.0703 66.0206 31.7997 177.7926 188 A 3.9819 8.4047 120.9347 55.5441 18.1877 179.4303 189 N 4.3497 8.4685 114.9356 55.9673 38.4620 177.6180 190 W 4.2559 8.0117 129.4678 60.6084 30.6563 178.0746 191 I 3.3750 7.7516 118.8763 64.3743 36.5311 178.2132 192 K 4.0346 7.5520 118.0333 59.0442 31.9783 179.0219 193 R 3.9368 7.2979 118.1715 57.8507 30.4483 177.3057 194 R 3.4168 6.4892 114.3544 54.6643 29.8866 174.6646 195 P 4.1460 0.0000 0.0000 62.7851 31.8244 175.9572 196 Q 4.1043 8.5200 124.3560 55.9690 29.2976 175.0664 197 T 4.7499 8.0166 114.2800 59.5665 72.2656 174.0023 198 K 4.0047 8.7766 123.4605 58.9020 32.7625 176.8316 199 L 4.3997 7.8065 122.7442 54.8055 41.9971 176.1239 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 P 0.00 4.19 0.00 1.64 2.06 0.00 3.73 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.89 0.00 3 N 8.13 4.44 0.00 2.59 2.74 0.00 0.00 7.27 6.60 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 4 Y 8.71 5.10 0.00 2.71 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 5 K 9.15 4.97 0.00 1.86 1.71 0.00 1.72 0.00 0.00 1.79 0.00 0.00 2.80 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.43 7.81 6 L 9.26 5.16 0.00 2.09 1.87 0.99 1.03 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 7 T 8.55 5.20 4.35 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 1.30 0.00 0.00 8 Y 8.38 4.74 0.00 2.97 2.81 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 9 F 6.63 4.71 0.00 2.60 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 10 N 8.62 4.77 0.00 2.73 2.80 0.00 0.00 6.76 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 11 M 7.58 4.72 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.66 0.00 12 R 8.29 4.36 0.00 1.95 2.02 0.00 3.39 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.63 0.00 13 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 14 R 8.84 4.12 0.00 1.81 1.97 0.00 3.25 0.00 0.00 3.33 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 15 A 6.65 4.03 0.78 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 16 E 7.71 3.96 0.00 2.13 1.88 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 2.35 2.27 0.00 17 I 7.69 3.61 2.13 0.00 0.00 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 1.81 1.07 0.85 0.00 0.00 18 I 7.40 3.25 1.71 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.27 0.08 0.00 0.00 19 R 7.59 3.52 0.00 1.92 1.17 0.00 3.72 0.00 0.00 3.48 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 20 Y 8.18 3.82 0.00 3.01 2.61 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 21 I 7.68 3.87 1.61 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.79 0.65 0.00 0.00 22 F 7.96 4.34 0.00 2.48 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 23 A 7.90 4.00 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 24 Y 8.18 4.09 0.00 3.22 3.37 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 0.00 25 L 8.15 4.29 0.00 1.82 1.74 0.92 1.09 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 26 D 7.63 4.32 0.00 2.75 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 27 I 8.16 4.46 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.02 0.87 0.00 0.00 28 Q 8.61 4.25 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.29 0.00 29 Y 7.77 4.88 0.00 2.76 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 0.00 0.00 0.00 30 E 9.22 4.10 0.00 2.05 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 0.00 2.29 2.24 0.00 31 D 8.31 5.01 0.00 2.40 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 H 9.51 4.70 0.00 3.49 3.44 0.00 5.80 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.52 5.06 0.00 1.77 1.91 0.00 3.36 0.00 0.00 3.62 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.72 0.00 34 I 8.58 4.19 1.97 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 1.11 0.61 0.90 0.00 0.00 35 E 8.72 4.27 0.00 2.28 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 36 Q 8.94 4.15 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 1.99 2.34 0.00 37 A 7.99 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 D 8.22 4.65 0.00 2.98 2.81 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 39 W 7.99 4.61 0.00 3.77 3.37 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 0.00 40 P 0.00 3.93 0.00 2.15 2.06 0.00 3.85 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 41 E 7.98 3.83 0.00 2.09 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 2.30 2.39 0.00 42 I 7.26 3.82 2.07 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 1.48 0.91 1.08 0.00 0.00 43 K 7.14 2.94 0.00 0.79 1.26 0.00 1.39 0.00 0.00 1.46 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.19 1.37 7.81 44 S 6.99 4.09 0.00 3.98 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 45 T 7.64 4.18 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 1.22 0.00 0.00 46 L 7.51 4.64 0.00 1.93 1.72 1.33 1.01 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 47 P 0.00 4.13 0.00 2.30 2.20 0.00 3.78 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 48 F 7.94 4.65 0.00 3.09 3.06 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 49 G 7.82 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 50 K 7.76 5.04 0.00 1.84 1.83 0.00 1.82 0.00 0.00 2.01 0.00 0.00 3.23 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.80 1.62 7.81 51 I 8.00 4.75 1.97 0.00 0.00 -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 0.52 0.05 0.93 0.00 0.00 52 P 0.00 5.45 0.00 2.07 1.98 0.00 3.34 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.70 0.00 53 I 8.33 4.92 1.96 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.99 1.03 0.00 0.00 54 L 9.02 5.24 0.00 1.73 1.58 1.23 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 55 E 9.48 4.89 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 56 V 9.16 4.36 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 1.24 0.00 0.00 57 D 8.75 4.53 0.00 2.78 2.67 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 58 G 8.06 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 0.00 0.00 0.00 59 L 7.50 4.63 0.00 1.80 1.76 0.91 0.58 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 60 T 8.53 4.73 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 61 L 9.11 5.01 0.00 1.64 1.48 0.75 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 62 H 8.23 5.09 0.00 3.18 3.32 0.00 5.62 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 63 Q 8.83 3.50 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.85 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 64 S 8.63 4.00 0.00 3.98 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 65 L 7.80 3.99 0.00 1.68 1.80 0.94 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 66 A 7.76 3.91 1.20 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 0.00 0.00 0.00 67 I 7.72 3.55 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.78 0.73 0.00 0.00 68 A 7.91 3.39 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.34 3.22 0.00 1.85 1.96 0.00 3.12 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 70 Y 7.57 4.00 0.00 2.89 3.03 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 71 L 7.78 3.77 0.00 1.23 1.36 0.07 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 72 T 7.27 4.05 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 0.83 0.00 0.00 73 K 6.79 3.98 0.00 1.73 1.59 0.00 1.87 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.38 7.81 74 N 8.97 4.33 0.00 2.86 2.91 0.00 0.00 6.84 7.54 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 75 T 7.51 4.70 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 1.24 0.00 0.00 76 D 8.53 4.59 0.00 2.79 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 77 L 7.86 3.84 0.00 1.66 1.60 0.82 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 78 A 7.45 4.65 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 79 G 8.49 3.86 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 80 N 9.40 4.52 0.00 2.76 2.88 0.00 0.00 6.70 7.54 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 81 T 7.34 4.75 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 82 E 8.61 3.99 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 2.39 2.42 0.00 83 M 7.93 3.99 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.70 0.00 84 E 8.39 4.08 0.00 2.28 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 2.38 2.38 0.00 85 Q 8.19 4.10 0.00 2.27 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 86 C 7.86 4.06 0.00 2.97 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 87 H 8.03 4.21 0.00 3.39 3.32 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.26 3.33 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 3.46 3.40 0.00 5.82 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 L 8.25 3.91 0.00 1.64 1.58 0.86 0.83 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 0.00 128 M 7.98 3.89 0.00 1.82 2.16 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.88 0.00 129 Q 8.03 3.91 0.00 2.20 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 130 D 8.30 4.34 0.00 2.82 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 0.00 131 L 8.28 3.88 0.00 1.54 1.30 0.60 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 132 D 8.12 4.21 0.00 2.75 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 0.00 133 T 7.87 3.86 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 1.20 0.00 0.00 134 Y 8.34 4.05 0.00 2.89 3.11 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 1.43 0.55 0.99 0.00 0.00 143 G 8.67 3.86 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 0.00 144 N 8.81 5.03 0.00 2.90 2.94 0.00 0.00 5.64 7.64 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 0.00 145 S 7.52 4.47 0.00 3.75 3.79 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 0.00 146 V 6.81 2.82 0.67 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 0.23 0.00 0.00 0.36 0.00 0.00 147 T 8.30 4.53 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 1.07 0.00 0.00 148 W 8.45 3.87 0.00 3.58 3.06 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 0.00 149 A 7.13 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 D 8.03 4.58 0.00 2.97 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 F 8.26 4.68 0.00 3.27 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 0.00 152 Y 8.46 4.23 0.00 3.19 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 0.00 153 W 8.55 4.25 0.00 3.45 3.30 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 0.00 154 E 8.14 3.55 0.00 2.31 2.20 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 2.31 2.50 0.00 155 I 7.65 3.47 1.69 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.29 0.69 0.00 0.00 156 C 7.93 3.93 0.00 2.64 2.74 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 0.00 157 S 7.65 3.71 0.00 3.22 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 0.00 158 T 7.22 3.85 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 1.19 0.00 0.00 159 T 7.45 4.08 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 1.42 0.00 0.00 160 L 7.96 4.15 0.00 1.77 1.76 0.71 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 161 L 8.20 4.18 0.00 1.86 1.70 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 162 V 7.45 3.49 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.94 0.00 0.00 163 F 8.18 4.58 0.00 3.07 3.12 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 0.00 164 K 8.29 4.58 0.00 1.81 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.44 7.81 165 P 0.00 4.49 0.00 2.08 2.10 0.00 3.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 166 D 7.92 5.32 0.00 2.96 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 0.00 167 L 7.73 3.91 0.00 1.84 1.81 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 168 L 7.79 4.80 0.00 1.79 1.74 1.05 1.34 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 0.00 169 D 8.12 4.38 0.00 2.73 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 0.00 170 N 8.09 4.97 0.00 2.53 2.67 0.00 0.00 6.68 8.16 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 0.00 171 H 8.08 5.00 0.00 3.18 3.18 0.00 5.64 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 P 0.00 4.29 0.00 2.25 2.33 0.00 3.79 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.07 0.00 173 R 7.98 3.96 0.00 1.84 1.96 0.00 3.36 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 174 L 8.01 4.00 0.00 2.00 2.00 0.77 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 175 V 7.85 3.72 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 1.19 0.00 0.00 1.00 0.00 0.00 176 T 8.40 3.86 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 1.14 0.00 0.00 177 L 7.91 3.94 0.00 1.76 1.93 1.18 0.89 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 0.00 178 R 8.25 4.10 0.00 2.23 2.02 0.00 2.90 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 2.10 0.00 179 K 8.31 3.97 0.00 1.99 1.90 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.75 7.81 180 K 8.10 3.98 0.00 1.84 1.72 0.00 1.60 0.00 0.00 1.44 0.00 0.00 2.21 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.48 1.30 7.81 181 V 8.14 4.16 2.48 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 1.33 0.00 0.00 1.52 0.00 0.00 182 Q 8.45 4.16 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.62 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 183 A 7.70 4.54 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 0.00 184 I 7.48 3.92 2.16 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.00 1.24 0.00 0.00 185 P 0.00 4.25 0.00 2.18 2.16 0.00 3.69 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.23 0.00 186 A 8.06 4.02 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 0.00 187 V 7.76 3.28 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 0.75 0.00 0.00 0.58 0.00 0.00 188 A 8.40 3.98 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 0.00 189 N 8.47 4.35 0.00 2.86 2.93 0.00 0.00 6.69 7.70 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 0.00 190 W 8.01 4.26 0.00 3.42 3.07 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 0.00 191 I 7.75 3.38 1.91 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 1.50 0.65 0.85 0.00 0.00 192 K 7.55 4.03 0.00 1.81 1.80 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.60 7.81 193 R 7.30 3.94 0.00 1.82 1.98 0.00 3.39 0.00 0.00 3.35 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 194 R 6.49 3.42 0.00 1.36 0.66 0.00 3.19 0.00 0.00 2.86 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.34 0.00 195 P 0.00 4.15 0.00 2.15 2.04 0.00 3.65 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 196 Q 8.52 4.10 0.00 1.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 197 T 8.02 4.75 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 1.32 0.00 0.00 198 K 8.78 4.00 0.00 1.67 1.82 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.33 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.27 1.29 7.81 199 L 7.81 4.40 0.00 1.78 1.61 1.04 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.