NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 L 4.2835 8.1693 120.6338 53.5512 43.3341 176.3227 11 P 4.2257 0.0000 0.0000 61.7710 32.0198 175.4610 12 Q 4.0382 8.9199 122.1406 59.8769 29.5621 180.6848 13 S 4.2026 8.1178 114.4645 61.1093 63.0977 176.2416 14 F 4.2272 8.2745 124.5252 61.1904 39.1478 177.1181 15 L 4.0254 8.1062 118.2055 57.7401 41.4698 179.1713 16 L 3.9504 8.3330 120.6013 58.0709 42.1009 178.9564 17 K 3.9199 8.3101 119.8645 59.5554 32.0211 178.5999 18 C 3.9751 8.2740 117.4852 62.4856 28.0527 175.5956 19 L 3.4145 8.2303 124.7397 58.8371 41.5123 179.5655 20 E 3.8866 7.9064 117.9670 61.2264 29.5941 181.0045 21 Q 4.0037 7.8250 118.9533 58.7676 28.7157 178.3933 22 M 3.5505 7.4707 119.4031 58.4701 32.2635 178.5707 23 R 3.8995 7.7285 118.0582 58.6056 30.0997 179.0949 24 K 3.8535 7.5966 120.0218 59.4627 32.3896 179.0855 25 V 3.6772 7.6262 118.5175 66.0216 31.3762 178.0387 26 Q 3.9394 8.4685 118.1619 58.6971 28.5522 178.5281 27 A 3.9426 7.9083 121.7830 55.3490 17.9640 179.3007 28 D 4.4219 8.6168 117.9442 57.5779 40.7951 179.4710 29 G 3.6034 7.9116 105.8526 47.9143 0.0000 176.1110 30 T 3.8869 8.0827 117.8098 66.0222 68.3755 176.7896 31 A 3.9219 7.9134 122.8653 55.0322 18.5974 179.2146 32 L 3.8412 7.6096 118.4959 58.6053 41.9799 179.3181 33 Q 3.9821 8.1963 117.8097 59.0744 28.6554 178.6484 34 E 4.0125 8.5983 120.0384 59.8013 29.3482 179.0657 35 T 3.8602 7.9502 116.0952 66.4560 68.4837 176.4895 36 L 4.0152 8.0864 120.7733 57.6211 41.6547 179.1830 37 C 4.3613 8.2453 119.8650 58.8013 43.4967 174.9996 38 A 3.9643 7.5984 120.8077 55.8926 18.0982 179.6724 39 T 4.0614 8.0631 112.5494 66.5174 68.7500 176.2514 40 H 4.6819 8.1406 115.5880 56.1489 31.1117 174.4207 41 Q 3.7133 8.4259 116.1318 56.7294 26.6654 175.2220 42 L 4.3800 7.5235 120.1582 53.9514 39.6841 176.3841 43 C 4.8587 8.2311 115.3279 56.6616 40.2691 174.2224 44 H 4.6779 7.7962 117.5765 52.4428 29.2059 172.1265 45 P 4.4625 0.0000 0.0000 65.9659 31.0277 178.6135 46 E 4.1004 8.4435 119.7769 61.8118 29.2196 183.7026 47 E 4.5005 8.6132 117.7820 60.4281 29.9791 181.4270 48 L 4.6348 7.8247 116.3889 55.3451 41.7149 178.8533 49 V 3.6082 7.4603 119.8707 66.0237 31.4660 177.6485 50 L 3.9517 7.9009 119.5312 58.1243 42.0129 178.5563 51 L 4.1629 8.0130 120.0080 57.8951 42.0536 178.7783 52 G 3.7247 8.6006 106.2729 48.1942 0.0000 174.9014 53 H 4.0087 8.2342 119.4449 58.9546 29.9208 176.7923 54 A 4.1875 8.2156 121.6369 55.2979 18.3173 179.4068 55 L 4.1033 8.2603 116.8502 55.7841 41.9157 177.8918 56 G 3.7324 8.4058 106.6844 45.7855 0.0000 173.9545 57 I 4.0698 7.4442 121.1854 58.7460 37.0050 174.4383 58 P 4.3837 0.0000 0.0000 62.4522 31.8047 176.9039 59 Q 4.1757 7.9872 119.8569 53.4252 29.5732 171.4318 60 P 4.1793 0.0000 0.0000 62.0296 31.8154 174.6644 61 P 4.5496 0.0000 0.0000 62.7682 32.5573 176.8381 62 L 4.9949 8.2957 122.5959 54.1391 42.4388 178.3773 63 S 4.1120 8.1339 116.3508 61.7812 63.8594 176.7015 64 S 4.7178 8.5961 115.7140 59.3822 62.4910 174.5866 65 C 4.8192 7.9574 117.4275 56.5185 37.9125 173.7305 66 S 4.5705 8.5110 119.2280 57.7967 63.9970 175.6198 67 S 3.9386 8.7406 122.8858 62.5311 62.1112 175.7389 68 Q 4.2963 8.0256 116.9301 56.3934 28.0087 178.6661 69 A 4.7216 8.5299 119.2516 52.4338 20.1172 175.3323 70 L 4.4185 8.1129 121.5330 57.3407 41.6528 178.4256 71 Q 4.5492 8.9626 125.6709 54.1816 31.9918 171.6647 72 L 3.2495 8.4463 127.3928 57.5051 42.0314 178.7560 73 M 4.0578 7.9329 117.4199 58.4319 32.1876 178.2861 74 G 3.5949 7.9210 105.4952 47.6707 0.0000 176.1243 75 C 4.3595 8.6959 121.5144 59.5383 44.8928 175.6770 76 L 4.0226 8.0385 120.5057 58.0213 41.2239 179.8196 77 R 4.0576 8.2575 117.8776 58.9416 29.9046 179.2116 78 Q 4.2459 8.2587 119.5689 58.1724 28.7500 177.8575 79 L 4.0544 8.3604 121.9072 58.7503 42.0094 178.6462 80 H 4.2086 8.5400 118.0347 59.4045 29.7673 177.4249 81 S 4.3212 8.4488 116.1890 61.2307 62.6888 176.7919 82 G 3.6206 8.7654 109.9274 47.7867 0.0000 175.7477 83 L 4.1874 8.3961 121.9951 57.4149 41.7179 179.4977 84 F 4.5900 8.4669 122.1641 60.5515 39.3086 176.8789 85 L 3.6682 7.9072 119.9904 58.5117 41.8165 178.6093 86 Y 4.0033 7.9303 116.4794 61.0845 37.5060 178.7577 87 Q 4.0975 8.2877 119.3287 58.8412 28.7195 179.1991 88 G 3.4229 7.5542 106.1283 47.6440 0.0000 175.5168 89 L 4.0424 7.8756 121.9676 57.7699 41.4881 179.8425 90 L 4.0201 8.0463 117.5538 57.7550 41.6623 179.0472 91 Q 4.0684 8.1618 119.4373 59.1108 28.7473 178.1916 92 A 4.1239 8.0624 121.2376 54.9241 18.7593 179.3257 93 L 3.6444 8.1457 117.0466 55.3577 42.4874 176.7495 94 A 3.7762 8.5771 121.1624 53.0126 16.2809 177.3119 95 G 3.9186 7.8611 110.0007 44.0381 0.0000 171.9568 96 I 3.3911 7.2118 120.5124 61.1576 36.7056 173.2761 97 S 4.7027 7.3309 112.6467 55.1481 66.4046 173.4746 98 P 4.2010 0.0000 0.0000 66.3329 30.8253 178.6395 99 E 4.0425 8.2393 115.2149 58.6697 29.5774 178.2539 100 L 4.5109 8.2605 117.7160 55.2104 42.9944 178.4572 101 A 4.2017 7.7411 121.9159 53.8326 18.2370 177.5546 102 P 4.1880 0.0000 0.0000 66.7547 31.2065 178.8245 103 T 3.9268 7.8428 114.8348 65.6290 68.2661 176.4370 104 L 3.9488 7.6269 122.3022 57.9894 42.1454 178.2141 105 D 4.3871 8.4752 119.2823 57.9496 40.7572 179.2425 106 T 3.8317 7.8499 115.7659 66.6695 68.5239 176.4509 107 L 4.2287 7.6920 122.9846 57.4924 41.9992 178.9332 108 Q 3.9261 8.2435 119.7399 59.0171 29.1848 177.8216 109 L 4.0092 8.0490 120.1402 58.2548 41.6997 179.4808 110 D 4.4625 8.5392 118.8605 57.4306 40.6832 179.0185 111 T 4.1381 8.0128 116.5599 66.8218 68.4672 177.0585 112 T 3.9985 8.1890 117.8307 66.6168 68.5208 176.2400 113 D 4.4253 8.2223 119.8977 57.2788 41.2758 178.0876 114 F 4.6348 8.3467 120.7880 61.3253 39.4037 177.0716 115 A 4.0396 8.2974 120.6143 55.0173 18.1627 179.4490 116 I 4.0569 8.1310 118.5265 64.8415 37.2424 178.0765 117 N 4.4746 8.3792 117.4212 56.8638 38.9642 176.9725 118 I 3.9845 7.9713 121.2442 64.2350 37.2006 178.3161 119 W 4.0688 8.5613 129.2491 60.2499 30.5222 177.6079 120 Q 2.8138 8.2655 119.9947 59.0915 28.4982 178.4985 121 Q 3.6825 7.9300 120.2038 59.2577 28.9722 177.9831 122 M 3.8938 7.6408 119.2298 58.3769 31.9705 178.5783 123 E 3.7747 7.7923 118.5243 59.5501 29.3947 179.0622 124 D 4.4300 7.7345 117.5476 56.7729 40.8714 178.0077 125 L 4.4190 7.2959 116.4329 53.4883 42.0137 177.3293 126 G 3.8934 8.0679 107.2221 46.2518 0.0000 174.1341 127 M 4.4619 7.6931 115.8459 54.7059 31.7260 176.3076 128 A 4.4378 7.7243 121.2613 52.1141 20.5378 177.1654 129 P 4.6637 0.0000 0.0000 62.5562 31.2892 175.8903 *137 T 4.0087 8.2333 117.7779 63.0944 68.1790 173.2218 138 M 4.5616 8.2591 127.3768 52.3449 34.2194 173.7546 139 P 3.7798 0.0000 0.0000 62.8830 31.6139 175.1460 140 A 4.3293 7.9910 122.9299 50.3863 20.2714 176.0435 141 F 4.9292 8.6666 122.4873 56.4568 40.2784 175.2073 142 T 4.3738 9.5386 117.2225 62.3707 70.2564 176.0329 143 S 4.6225 7.9994 116.7583 57.2176 65.9706 174.7005 144 A 4.0837 8.3971 123.3096 54.9137 18.1658 179.6743 145 F 4.0526 8.2347 119.1257 61.2535 39.4881 177.3103 146 Q 4.0543 8.2053 117.5343 59.2003 28.5710 178.9277 147 R 3.4953 7.7823 118.4648 59.1352 29.4648 179.4488 148 R 3.7143 7.9642 117.8123 58.8891 30.0312 178.7257 149 A 4.0428 7.7911 120.5436 54.2976 18.4831 179.8894 150 G 3.5026 8.4058 105.1875 47.8355 0.0000 176.1613 151 G 3.4728 7.9625 108.4072 47.5739 0.0000 175.9806 152 V 3.6632 7.4115 119.6070 65.3199 31.3873 178.1266 153 L 4.0049 7.8619 119.0855 57.5729 41.5128 179.1298 154 V 3.7033 8.0449 117.9103 66.4113 31.2333 177.8324 155 A 3.9758 7.9116 120.2864 55.1488 18.0212 179.3350 156 S 4.2918 7.9225 111.8560 60.2903 63.4428 176.5536 157 N 4.3703 8.4807 121.0811 56.3256 38.4208 176.6142 158 L 3.2630 8.0705 122.0423 58.2562 41.9687 179.1041 159 Q 3.9767 7.7043 117.3206 59.2375 28.7911 179.1058 160 S 4.1660 7.8798 116.1129 61.4024 62.8700 176.2529 161 F 4.2269 8.5468 123.6741 61.5154 39.0279 177.2697 162 L 3.9982 8.1920 118.1121 58.1121 41.3158 179.2230 163 E 4.0180 8.2307 118.3896 59.3689 29.4035 179.5784 164 L 3.9713 7.8119 119.9420 58.1713 42.2775 178.6645 165 A 3.9820 7.8094 120.6639 55.3387 18.1033 179.0432 166 Y 4.2604 8.4332 120.6389 61.5690 38.6780 178.7986 167 R 3.7145 7.5293 119.0570 60.9846 29.6418 180.3913 168 A 3.9912 7.7754 120.5954 55.1103 18.4089 179.6000 169 L 4.2552 8.2267 117.7033 58.3392 41.5775 180.0797 170 R 3.8388 7.8394 119.2332 59.9769 29.9879 178.8118 *171 H 4.4006 7.5857 116.2667 57.4367 29.2301 178.8221 172 F 5.0640 7.7142 119.9594 56.2195 38.1282 175.7931 173 A 4.1523 7.5404 127.1521 53.1703 18.8478 176.6224 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 10 L 8.17 4.28 0.00 1.79 1.81 0.62 0.79 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 11 P 0.00 4.23 0.00 2.35 2.20 0.00 3.74 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 2.12 1.99 0.00 12 Q 8.92 4.04 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.96 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 13 S 8.12 4.20 0.00 4.14 4.15 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 14 F 8.27 4.23 0.00 3.14 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 15 L 8.11 4.03 0.00 1.97 1.80 1.03 0.76 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 16 L 8.33 3.95 0.00 2.04 1.67 0.94 0.27 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 17 K 8.31 3.92 0.00 2.00 1.83 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.47 7.81 18 C 8.27 3.98 0.00 2.99 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 19 L 8.23 3.41 0.00 1.73 1.76 0.49 0.90 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 20 E 7.91 3.89 0.00 2.04 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 2.24 2.23 0.00 21 Q 7.83 4.00 0.00 1.80 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.95 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 22 M 7.47 3.55 0.00 1.65 1.49 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 23 R 7.73 3.90 0.00 1.76 1.84 0.00 3.22 0.00 0.00 2.93 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 24 K 7.60 3.85 0.00 1.83 1.71 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.38 7.81 25 V 7.63 3.68 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 0.96 0.00 0.00 1.00 0.00 0.00 26 Q 8.47 3.94 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.50 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 27 A 7.91 3.94 1.36 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 28 D 8.62 4.42 0.00 2.80 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 29 G 7.91 3.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 T 8.08 3.89 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 1.19 0.00 0.00 31 A 7.91 3.92 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 32 L 7.61 3.84 0.00 1.80 1.80 0.89 1.09 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 33 Q 8.20 3.98 0.00 2.31 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.68 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 34 E 8.60 4.01 0.00 1.96 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 2.31 2.43 0.00 35 T 7.95 3.86 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 1.21 0.00 0.00 36 L 8.09 4.02 0.00 1.69 1.70 0.93 0.58 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 37 C 8.25 4.36 0.00 3.08 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 A 7.60 3.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.06 4.06 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 40 H 8.14 4.68 0.00 3.28 3.24 0.00 5.95 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 8.43 3.71 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.11 7.39 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 42 L 7.52 4.38 0.00 1.96 1.58 0.93 0.77 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 43 C 8.23 4.86 0.00 3.01 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 44 H 7.80 4.68 0.00 3.22 3.23 0.00 5.82 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.46 0.00 2.27 2.30 0.00 3.67 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 46 E 8.44 4.10 0.00 2.09 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 2.24 1.96 0.00 47 E 8.61 4.50 0.00 1.93 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 2.23 2.21 0.00 48 L 7.82 4.63 0.00 1.94 1.73 0.94 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.46 3.61 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.04 0.00 0.00 50 L 7.90 3.95 0.00 1.74 1.68 0.93 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.01 4.16 0.00 1.88 1.90 1.04 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.60 3.72 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 0.00 0.00 0.00 53 H 8.23 4.01 0.00 3.25 3.54 0.00 5.96 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.22 4.19 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.26 4.10 0.00 1.83 1.72 1.07 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.41 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 57 I 7.44 4.07 1.90 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 1.56 0.67 0.94 0.00 0.00 58 P 0.00 4.38 0.00 1.88 1.91 0.00 3.50 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 1.89 1.97 0.00 59 Q 7.99 4.18 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 60 P 0.00 4.18 0.00 1.87 2.03 0.00 3.34 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.85 0.00 61 P 0.00 4.55 0.00 2.25 2.12 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.03 0.00 62 L 8.30 4.99 0.00 1.74 1.64 0.63 0.86 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 63 S 8.13 4.11 0.00 4.03 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 64 S 8.60 4.72 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.96 4.82 0.00 3.09 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 66 S 8.51 4.57 0.00 3.95 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 67 S 8.74 3.94 0.00 3.67 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 68 Q 8.03 4.30 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.34 0.00 0.00 0.00 0.00 0.00 2.28 1.93 0.00 69 A 8.53 4.72 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 70 L 8.11 4.42 0.00 1.80 1.79 0.73 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.96 4.55 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.74 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 72 L 8.45 3.25 0.00 1.05 1.38 -0.08 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 73 M 7.93 4.06 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.58 0.00 74 G 7.92 3.59 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 0.00 0.00 0.00 75 C 8.70 4.36 0.00 3.42 3.44 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 76 L 8.04 4.02 0.00 1.78 1.71 0.79 0.95 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 77 R 8.26 4.06 0.00 2.00 2.02 0.00 3.13 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 78 Q 8.26 4.25 0.00 2.40 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.80 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 79 L 8.36 4.05 0.00 1.86 2.03 0.83 0.93 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 80 H 8.54 4.21 0.00 3.30 3.38 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.45 4.32 0.00 4.20 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 0.00 82 G 8.77 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 0.00 0.00 0.00 83 L 8.40 4.19 0.00 2.15 1.83 1.17 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 84 F 8.47 4.59 0.00 3.01 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 85 L 7.91 3.67 0.00 1.81 1.50 0.80 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 7.93 4.00 0.00 3.11 2.87 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 87 Q 8.29 4.10 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.88 0.00 0.00 0.00 0.00 0.00 2.43 2.69 0.00 88 G 7.55 3.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 7.88 4.04 0.00 1.92 1.80 0.83 0.17 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 90 L 8.05 4.02 0.00 1.75 1.73 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.16 4.07 0.00 2.26 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 92 A 8.06 4.12 1.57 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 93 L 8.15 3.64 0.00 1.76 1.53 0.74 -0.19 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 94 A 8.58 3.78 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 95 G 7.86 3.92 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 0.00 0.00 0.00 96 I 7.21 3.39 1.79 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.33 0.80 0.00 0.00 97 S 7.33 4.70 0.00 4.17 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 98 P 0.00 4.20 0.00 2.17 2.18 0.00 3.60 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 2.12 2.21 0.00 99 E 8.24 4.04 0.00 1.92 2.02 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 2.33 2.47 0.00 100 L 8.26 4.51 0.00 1.74 1.64 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 101 A 7.74 4.20 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 0.00 102 P 0.00 4.19 0.00 2.26 2.33 0.00 3.86 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 2.06 0.00 103 T 7.84 3.93 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 0.00 104 L 7.63 3.95 0.00 1.89 1.62 0.88 1.59 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 0.00 105 D 8.48 4.39 0.00 2.92 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 0.00 106 T 7.85 3.83 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 1.30 0.00 0.00 107 L 7.69 4.23 0.00 1.93 1.81 0.89 0.49 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 0.00 108 Q 8.24 3.93 0.00 2.21 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.55 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 109 L 8.05 4.01 0.00 1.96 1.73 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 110 D 8.54 4.46 0.00 2.82 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 0.00 111 T 8.01 4.14 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 112 T 8.19 4.00 4.47 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 1.27 0.00 0.00 113 D 8.22 4.43 0.00 3.06 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 F 8.35 4.63 0.00 3.19 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 0.00 115 A 8.30 4.04 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.13 4.06 2.21 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.99 1.26 0.00 0.00 117 N 8.38 4.47 0.00 3.11 3.24 0.00 0.00 7.56 7.84 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 0.00 118 I 7.97 3.98 2.10 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 1.34 0.75 1.01 0.00 0.00 119 W 8.56 4.07 0.00 3.22 3.59 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 0.00 120 Q 8.27 2.81 0.00 2.29 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.57 0.00 0.00 0.00 0.00 0.00 2.19 1.91 0.00 121 Q 7.93 3.68 0.00 1.91 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.33 0.00 0.00 0.00 0.00 0.00 1.16 1.92 0.00 122 M 7.64 3.89 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.52 0.00 123 E 7.79 3.77 0.00 1.72 1.74 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 2.14 1.82 0.00 124 D 7.73 4.43 0.00 2.64 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 0.00 125 L 7.30 4.42 0.00 1.63 1.56 0.70 0.62 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 0.00 126 G 8.07 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 0.00 127 M 7.69 4.46 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 128 A 7.72 4.44 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 0.00 129 P 0.00 4.66 0.00 2.06 1.89 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 *137 T 8.23 4.01 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 1.15 0.00 0.00 138 M 8.26 4.56 0.00 1.93 1.87 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 139 P 0.00 3.78 0.00 1.04 1.72 0.00 3.59 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.89 0.00 140 A 7.99 4.33 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 0.00 141 F 8.67 4.93 0.00 2.93 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 0.00 142 T 9.54 4.37 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 0.00 143 S 8.00 4.62 0.00 4.15 4.10 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 0.00 144 A 8.40 4.08 1.36 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 0.00 145 F 8.23 4.05 0.00 3.13 3.05 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 0.00 146 Q 8.21 4.05 0.00 2.52 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.67 0.00 0.00 0.00 0.00 0.00 2.56 2.60 0.00 147 R 7.78 3.50 0.00 1.75 1.76 0.00 3.08 0.00 0.00 3.32 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.82 0.00 148 R 7.96 3.71 0.00 1.67 1.73 0.00 2.92 0.00 0.00 2.73 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.75 0.00 149 A 7.79 4.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.41 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 0.00 151 G 7.96 3.47 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 0.00 152 V 7.41 3.66 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 0.99 0.00 0.00 0.89 0.00 0.00 153 L 7.86 4.00 0.00 2.05 1.73 1.03 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 154 V 8.04 3.70 2.15 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 1.21 0.00 0.00 1.05 0.00 0.00 155 A 7.91 3.98 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 0.00 156 S 7.92 4.29 0.00 4.02 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 0.00 157 N 8.48 4.37 0.00 3.15 3.16 0.00 0.00 6.49 6.75 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 0.00 158 L 8.07 3.26 0.00 1.36 1.63 0.21 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 159 Q 7.70 3.98 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.50 0.00 0.00 0.00 0.00 0.00 2.35 2.62 0.00 160 S 7.88 4.17 0.00 3.91 3.97 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 0.00 161 F 8.55 4.23 0.00 3.20 3.24 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 0.00 162 L 8.19 4.00 0.00 2.16 1.73 1.34 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 163 E 8.23 4.02 0.00 2.17 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 0.00 2.64 2.50 0.00 164 L 7.81 3.97 0.00 1.99 1.65 0.93 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 165 A 7.81 3.98 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 0.00 166 Y 8.43 4.26 0.00 3.05 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 0.00 167 R 7.53 3.71 0.00 2.00 1.83 0.00 3.33 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 168 A 7.78 3.99 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 0.00 169 L 8.23 4.26 0.00 1.99 1.87 1.28 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 170 R 7.84 3.84 0.00 1.44 1.75 0.00 2.84 0.00 0.00 2.85 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.70 0.00 *171 H 7.59 4.40 0.00 2.98 2.97 0.00 7.19 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 F 7.71 5.06 0.00 3.24 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 0.00 173 A 7.54 4.15 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 * Residues marked with a * may have inaccurate shift predictions.