NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 4.2513 8.0093 121.0464 59.6174 37.7666 174.6881 3 P 4.2832 0.0000 0.0000 62.7886 32.8846 175.0676 4 L 5.3435 8.8321 120.8876 53.0064 44.9504 176.8259 5 L 4.6669 9.0807 125.3502 53.1408 45.2937 175.1319 6 A 5.8707 8.6319 127.2933 49.7125 22.3545 175.6569 7 F 4.8848 8.7907 117.4430 55.6922 41.2066 175.2288 8 A 4.5166 8.4325 126.3475 49.8588 20.7234 177.4408 9 A 4.2274 7.6422 127.1139 51.8850 23.4834 179.2197 10 W 4.4123 8.5133 116.1669 58.5035 32.2853 174.1752 11 S 4.2217 9.0089 117.1524 59.8760 62.9818 173.6246 12 G 3.7996 9.0637 113.2557 45.8131 0.0000 173.9908 13 T 4.3905 8.0286 112.0771 64.1789 73.3730 173.9962 14 G 3.8399 8.2357 110.0230 46.7376 0.0000 176.3207 15 K 3.8399 8.5010 121.1254 59.6064 32.4509 177.4789 16 T 3.9615 7.8139 115.1716 66.9117 68.3740 176.3001 17 T 3.7945 7.8940 117.0275 66.8717 68.4719 175.8983 18 L 3.8732 8.4694 122.1300 58.3798 42.1374 178.7861 19 L 3.9639 7.6804 117.4152 56.5832 41.3820 179.1656 20 K 4.0577 8.0121 118.3033 58.4131 32.0958 178.5192 21 K 4.2738 7.7550 118.0012 58.2787 32.8960 178.4595 22 L 4.0033 8.2030 120.9692 57.8402 41.8977 179.0980 23 I 3.6580 7.5710 119.6166 63.8553 37.1187 176.3340 24 P 4.1919 0.0000 0.0000 65.5772 31.3283 178.1320 25 A 3.9791 7.6870 119.2955 55.6004 18.2057 179.7215 26 L 4.0230 8.0626 116.9712 58.0997 41.5313 179.7839 27 C 4.3428 8.3395 117.9379 62.2154 27.8745 175.7080 28 A 4.0499 8.2499 121.6039 55.2748 17.9871 179.0872 29 R 4.3094 7.6782 112.9282 56.2193 30.0576 177.1962 30 G 3.8022 8.2109 107.0622 46.0336 0.0000 173.4140 31 I 4.3513 7.9340 121.4708 59.2887 39.1570 175.3086 32 R 4.4006 9.8892 128.9514 54.9127 30.9041 173.8709 33 P 5.2770 0.0000 0.0000 61.0603 33.5963 174.8795 34 G 4.1465 9.1042 110.1805 44.3325 0.0000 171.5302 35 L 5.0826 8.5359 126.7003 53.3578 44.0124 175.3206 36 I 4.4357 9.1879 128.3247 59.7102 38.8238 174.5519 37 K 5.8589 8.7445 128.0192 53.9853 34.7665 174.4645 38 H 4.9614 8.8241 125.3181 54.7207 33.0868 173.4183 39 T 4.4795 7.4772 112.5410 60.9943 70.8035 174.0807 40 H 4.2700 8.9875 123.3967 57.1666 28.8635 174.6500 41 H 4.4848 7.7719 120.4648 54.6720 29.7629 174.8396 42 D 4.3815 8.1836 127.7462 54.0645 42.6150 174.5679 *51 D 4.3451 8.2022 114.1974 54.6638 41.5490 175.1811 52 S 3.8510 7.9861 107.2339 59.9694 61.6100 172.3596 53 Y 4.3568 8.1991 120.8868 60.2084 38.5881 176.1264 54 E 3.6687 8.2065 119.0558 59.5201 29.8701 179.1025 55 L 4.1469 7.8249 116.9633 56.2903 41.6557 178.8898 56 R 4.0299 7.5372 119.2613 58.7797 30.3426 178.0469 57 K 4.1058 7.5462 114.6849 57.9608 32.1386 178.3191 58 A 4.2778 7.8269 120.9987 52.4723 18.6970 178.0670 59 G 4.2642 6.7440 116.1858 46.1480 0.0000 173.5289 60 A 4.3299 7.3901 125.6072 49.7428 17.5381 177.5820 61 A 4.0208 8.3326 125.1129 54.8589 18.7315 177.6790 62 Q 4.6235 7.7378 112.3124 54.7013 31.1629 174.5119 63 T 4.4838 8.5391 119.8986 61.5323 70.4529 174.0443 64 I 5.2061 8.1322 126.0962 58.2253 39.9960 175.1865 65 V 4.0241 8.4513 130.7486 62.0920 31.8029 175.3294 66 A 4.7289 8.4314 130.0779 51.8998 19.7968 175.8050 67 S 4.4440 8.0075 110.9075 59.0693 65.4938 174.3160 68 Q 4.5149 8.9110 114.7289 57.7108 30.3201 176.8711 69 Q 4.1674 8.1111 115.6020 58.3783 29.1410 175.5222 70 R 4.5619 7.3657 111.2804 55.3817 31.5488 173.0935 71 W 5.6313 8.2186 113.9198 54.8565 31.5147 174.0985 72 A 4.6474 8.8656 123.3322 50.2856 21.3040 175.7937 73 L 4.7026 8.4699 124.5635 53.7854 44.8423 175.3809 *75 T 4.3548 8.1520 115.8497 63.4819 69.4325 173.6450 76 E 4.6896 8.8293 125.9394 55.5702 31.1883 177.0307 77 T 4.6870 7.8284 110.9103 60.2869 68.8798 171.7436 78 P 4.6651 0.0000 0.0000 63.6740 31.3709 176.2105 79 D 4.6535 7.4429 115.7673 54.2517 43.5072 175.0216 80 E 4.5887 7.8399 120.0348 53.9835 31.5084 175.7338 81 E 4.1977 8.6030 124.6079 55.7288 30.6595 176.2379 82 E 4.2079 8.6918 121.5928 56.6837 29.6858 176.5053 83 L 4.9491 8.4941 121.9581 53.7447 43.7220 176.6756 84 D 4.6988 8.9187 120.5116 52.8421 41.2257 176.5972 85 L 3.8198 8.3173 128.2655 57.9161 41.5267 179.0115 86 Q 3.9300 8.1979 117.7195 59.3596 29.2154 178.0327 87 F 4.4774 8.4224 123.0579 60.6258 39.3540 177.0080 88 L 3.8474 8.0915 118.1010 57.8742 41.5577 179.4386 89 A 4.1199 8.2515 121.1148 54.8868 18.3675 179.3336 90 S 4.2715 7.7554 110.7114 59.7797 62.9903 174.5811 91 R 4.4304 7.0298 121.8708 55.8503 32.1166 176.7280 *93 D 4.3849 7.9051 118.8031 54.6419 41.2498 173.0934 94 T 4.5341 7.9288 115.9587 59.3911 67.4786 175.6031 95 S 4.5660 7.7543 116.9302 60.0631 65.9160 176.4516 96 K 4.6190 7.8892 118.6771 56.6553 33.5921 175.2892 97 L 4.9890 7.7655 115.4783 53.0552 45.3425 175.6202 98 D 4.9894 8.9384 120.7873 54.3185 43.6154 176.2089 99 L 4.7981 7.7787 119.3854 53.4282 46.1925 174.5723 100 I 5.0115 8.6682 125.9693 59.5490 40.2036 174.4933 101 L 4.9217 9.3779 128.4493 53.9521 43.4304 175.9273 102 V 4.7270 8.9876 124.2323 61.1360 33.8621 173.9782 103 E 4.9750 9.5219 128.5264 56.0750 33.0541 176.0667 104 G 3.9613 9.6256 114.2820 45.1527 0.0000 173.2955 105 F 4.3781 8.0045 118.2439 55.4284 38.6241 175.7695 106 K 4.0453 8.3784 125.2636 57.5398 32.4559 176.7589 107 H 3.9601 8.6918 116.9554 56.5589 25.2612 173.2327 108 E 4.7573 7.9679 121.7954 55.0173 33.3849 175.1180 109 E 4.5445 8.2951 118.3741 54.4398 29.8975 173.6886 110 I 4.5155 7.0878 112.7837 57.9765 41.4219 175.4735 111 A 4.1114 8.3700 120.8018 53.0633 19.0817 176.7838 112 K 4.7081 8.8014 121.8552 54.9372 36.5942 174.6569 113 I 4.6720 8.1375 127.4158 59.4170 39.9535 175.1484 114 V 4.2386 8.2701 126.9341 61.9915 33.2300 174.5917 115 L 5.3639 7.6403 123.3083 53.4143 44.6447 175.6649 116 F 4.8411 8.6777 120.8517 57.7289 43.8776 173.6413 117 R 4.7770 6.8323 123.3983 54.8896 33.7232 174.0036 118 D 4.4551 8.4820 124.3305 56.2033 41.5565 177.1431 119 G 3.8963 8.9370 113.2905 45.4167 0.0000 172.9263 120 A 4.1946 7.2934 121.7096 52.6564 18.7099 178.6929 121 G 3.7656 8.3576 106.5858 47.3661 0.0000 174.0708 122 H 4.6345 7.3221 115.0281 53.7457 32.5725 173.1426 123 R 4.6775 8.7350 122.4924 54.1030 31.7369 175.8470 124 P 4.0027 0.0000 0.0000 65.9315 31.2101 178.2470 125 E 4.0645 8.3317 117.1918 59.4593 29.3639 177.9014 126 E 4.3669 8.0488 114.2748 57.0668 29.2612 176.5429 127 L 4.5008 8.1365 120.2110 53.5114 42.8931 176.1864 128 V 4.2979 8.0907 121.5442 61.3400 33.1890 176.1398 129 I 4.1944 8.0099 129.5471 59.7359 36.1267 175.0108 130 D 4.6433 7.8934 124.3722 52.0786 40.6506 178.5171 131 R 3.9993 8.2727 118.9016 59.3828 30.2801 177.1812 132 H 4.6606 9.0466 113.4870 55.3482 29.1709 174.2075 133 V 4.4045 8.2037 121.9579 62.6082 31.0174 175.8033 134 I 4.2966 8.9174 122.7232 61.2087 38.6818 175.8062 135 A 4.4275 7.0700 124.0704 51.6372 21.9387 175.0507 136 V 4.5844 7.7054 120.1419 61.0472 34.4955 174.7252 137 A 5.0106 9.0705 129.4753 50.5580 20.3153 175.4125 138 S 5.5932 8.9087 116.3744 56.9143 65.5361 173.7528 139 D 5.0672 8.5267 118.1820 52.7505 39.8483 176.1635 140 V 4.4278 7.7102 116.2328 61.4073 34.7920 171.5733 141 P 4.4628 0.0000 0.0000 62.8204 31.8391 175.9816 142 L 4.6608 7.9438 119.9134 53.3254 45.3784 176.9579 143 N 4.6947 8.5455 121.3505 51.8509 37.2251 174.0291 144 L 4.6667 7.5610 120.5565 54.2534 43.6863 177.0872 145 D 4.6611 8.2648 121.6801 51.7039 39.3681 175.4352 146 V 4.0205 7.8299 116.0227 60.4688 34.1004 172.8972 147 A 3.8324 7.6860 125.5236 50.1380 18.4778 175.6897 148 L 4.6526 8.3287 124.5327 54.6124 43.2918 175.6709 149 L 4.7264 8.3692 126.2417 52.7632 45.5469 175.2169 150 D 4.9274 8.3667 120.9737 53.5486 41.6535 177.1221 151 I 3.8158 9.8333 127.5832 63.3729 38.1682 175.9918 152 N 4.7394 7.6448 115.5069 53.5385 38.9943 175.7915 153 D 4.7587 7.5972 119.6963 51.9299 39.8131 176.2347 154 V 3.5998 7.8748 123.5769 65.8366 32.0399 176.8040 155 E 3.8219 8.3721 117.7182 59.4237 29.1102 179.6294 156 G 4.1674 8.4635 107.2260 47.1340 0.0000 175.4189 157 L 4.0129 8.2844 123.0638 57.8835 42.1358 178.5410 158 A 4.1044 8.8546 121.5116 55.6576 18.1797 179.1818 159 D 4.3630 8.0995 116.8059 57.5406 40.9377 178.8127 160 F 4.1227 8.0803 121.0435 61.5923 39.1825 176.7935 161 V 3.6550 7.8849 116.1093 66.2951 31.3315 177.3813 162 V 3.7856 7.9532 117.2918 66.3867 31.6378 177.8007 163 E 4.1029 8.4461 118.0407 59.0322 29.4228 179.7294 164 W 3.7410 8.1276 127.2164 58.2785 31.1658 177.4016 *166 Q 4.2009 8.0750 117.8332 55.4001 29.9889 177.5956 167 K 4.0212 7.6615 115.2756 58.2846 32.1219 177.6966 168 Q 4.0897 6.9408 115.7391 56.0966 29.6389 175.4435 169 N 4.4304 7.3820 119.6491 53.1836 38.6931 174.6388 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 8.01 4.25 1.86 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 1.40 1.35 0.91 0.00 0.00 3 P 0.00 4.28 0.00 2.46 2.09 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.03 0.00 4 L 8.83 5.34 0.00 1.56 1.61 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 5 L 9.08 4.67 0.00 1.63 1.48 0.75 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 6 A 8.63 5.87 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 7 F 8.79 4.88 0.00 2.82 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 8 A 8.43 4.52 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.64 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 W 8.51 4.41 0.00 3.36 2.93 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 11 S 9.01 4.22 0.00 3.91 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 12 G 9.06 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 13 T 8.03 4.39 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 1.24 0.00 0.00 14 G 8.24 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 15 K 8.50 3.84 0.00 1.79 1.87 0.00 2.07 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.59 7.81 16 T 7.81 3.96 4.22 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 1.18 0.00 0.00 17 T 7.89 3.79 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 1.19 0.00 0.00 18 L 8.47 3.87 0.00 1.75 1.75 1.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.68 3.96 0.00 1.72 1.53 0.74 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.01 4.06 0.00 1.82 1.84 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.64 7.81 21 K 7.76 4.27 0.00 1.91 1.82 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.45 7.81 22 L 8.20 4.00 0.00 1.84 1.54 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.57 3.66 1.84 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 1.76 0.57 0.89 0.00 0.00 24 P 0.00 4.19 0.00 2.15 2.10 0.00 3.76 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 2.20 2.15 0.00 25 A 7.69 3.98 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 26 L 8.06 4.02 0.00 1.89 1.77 0.99 0.90 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 27 C 8.34 4.34 0.00 3.20 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 28 A 8.25 4.05 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 29 R 7.68 4.31 0.00 1.97 1.99 0.00 3.40 0.00 0.00 3.28 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 30 G 8.21 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 31 I 7.93 4.35 1.97 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 1.33 1.53 0.95 0.00 0.00 32 R 9.89 4.40 0.00 1.91 1.96 0.00 3.10 0.00 0.00 3.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 33 P 0.00 5.28 0.00 2.06 2.04 0.00 3.71 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.95 0.00 34 G 9.10 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 0.00 0.00 0.00 35 L 8.54 5.08 0.00 1.62 1.54 0.91 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 36 I 9.19 4.44 1.82 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 1.10 0.57 0.87 0.00 0.00 37 K 8.74 5.86 0.00 1.89 1.69 0.00 1.55 0.00 0.00 2.30 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.27 7.81 38 H 8.82 4.96 0.00 1.40 2.42 0.00 5.80 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 T 7.48 4.48 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 1.20 0.00 0.00 40 H 8.99 4.27 0.00 3.16 3.44 0.00 5.88 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 41 H 7.77 4.48 0.00 3.06 3.23 0.00 5.95 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.18 4.38 0.00 2.64 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *51 D 8.20 4.35 0.00 2.71 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 52 S 7.99 3.85 0.00 4.08 3.98 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 53 Y 8.20 4.36 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 54 E 8.21 3.67 0.00 1.99 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 2.46 2.38 0.00 55 L 7.82 4.15 0.00 1.72 1.69 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 56 R 7.54 4.03 0.00 2.07 1.92 0.00 3.41 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 57 K 7.55 4.11 0.00 1.34 1.67 0.00 1.87 0.00 0.00 1.81 0.00 0.00 3.12 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.01 1.02 7.81 58 A 7.83 4.28 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 59 G 6.74 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 0.00 0.00 0.00 0.00 60 A 7.39 4.33 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 61 A 8.33 4.02 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 62 Q 7.74 4.62 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.54 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 63 T 8.54 4.48 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 64 I 8.13 5.21 2.04 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.85 0.94 0.00 0.00 65 V 8.45 4.02 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 0.95 0.00 0.00 0.99 0.00 0.00 66 A 8.43 4.73 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 67 S 8.01 4.44 0.00 3.85 3.95 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 68 Q 8.91 4.51 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.87 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 69 Q 8.11 4.17 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 70 R 7.37 4.56 0.00 1.77 1.83 0.00 3.07 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.58 0.00 71 W 8.22 5.63 0.00 3.40 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 72 A 8.87 4.65 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.47 4.70 0.00 2.13 1.75 1.07 1.09 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 *75 T 8.15 4.35 4.32 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 1.34 0.00 0.00 76 E 8.83 4.69 0.00 1.96 1.89 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 2.32 2.39 0.00 77 T 7.83 4.69 4.49 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 1.25 0.00 0.00 78 P 0.00 4.67 0.00 2.07 2.10 0.00 3.62 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 79 D 7.44 4.65 0.00 2.57 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.84 4.59 0.00 1.85 1.79 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 2.14 2.30 0.00 81 E 8.60 4.20 0.00 2.13 1.94 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 2.29 2.36 0.00 82 E 8.69 4.21 0.00 2.09 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 0.00 2.34 2.54 0.00 83 L 8.49 4.95 0.00 1.66 1.75 0.99 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 84 D 8.92 4.70 0.00 2.75 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 85 L 8.32 3.82 0.00 1.62 1.53 0.67 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 8.20 3.93 0.00 2.06 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.08 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 87 F 8.42 4.48 0.00 3.26 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 88 L 8.09 3.85 0.00 1.68 1.75 1.15 0.95 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 89 A 8.25 4.12 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 S 7.76 4.27 0.00 4.03 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 91 R 7.03 4.43 0.00 1.85 1.85 0.00 3.06 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.36 0.00 *93 D 7.91 4.38 0.00 2.80 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 94 T 7.93 4.53 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 1.20 0.00 0.00 95 S 7.75 4.57 0.00 3.96 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 96 K 7.89 4.62 0.00 1.81 1.75 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.56 7.81 97 L 7.77 4.99 0.00 1.60 1.48 0.90 1.00 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 98 D 8.94 4.99 0.00 2.52 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 99 L 7.78 4.80 0.00 1.70 1.49 1.02 1.21 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 0.00 100 I 8.67 5.01 1.89 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 1.23 0.58 0.94 0.00 0.00 101 L 9.38 4.92 0.00 1.58 1.62 0.84 1.02 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 0.00 102 V 8.99 4.73 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 0.71 0.00 0.00 0.87 0.00 0.00 103 E 9.52 4.98 0.00 2.08 1.76 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 2.27 2.30 0.00 104 G 9.63 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 0.00 0.00 0.00 105 F 8.00 4.38 0.00 2.95 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.38 4.05 0.00 1.76 1.77 0.00 1.90 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.46 7.81 107 H 8.69 3.96 0.00 3.28 3.31 0.00 5.70 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 E 7.97 4.76 0.00 1.91 1.78 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 2.12 2.36 0.00 109 E 8.30 4.54 0.00 1.87 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 0.00 2.23 2.28 0.00 110 I 7.09 4.52 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.60 0.87 0.00 0.00 111 A 8.37 4.11 1.25 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 0.00 0.00 0.00 112 K 8.80 4.71 0.00 1.90 1.64 0.00 1.46 0.00 0.00 1.54 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.16 1.31 7.81 113 I 8.14 4.67 0.91 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.47 0.69 0.00 0.00 114 V 8.27 4.24 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 0.84 0.00 0.00 0.79 0.00 0.00 115 L 7.64 5.36 0.00 1.63 1.60 1.03 0.86 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 0.00 116 F 8.68 4.84 0.00 3.20 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 6.83 4.78 0.00 1.56 1.66 0.00 3.35 0.00 0.00 3.21 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 118 D 8.48 4.46 0.00 2.76 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 0.00 119 G 8.94 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.29 4.19 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 0.00 121 G 8.36 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 H 7.32 4.63 0.00 2.33 2.17 0.00 5.69 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 0.00 123 R 8.74 4.68 0.00 1.90 2.03 0.00 3.14 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 124 P 0.00 4.00 0.00 1.94 1.58 0.00 3.77 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.88 0.00 125 E 8.33 4.06 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 126 E 8.05 4.37 0.00 2.26 2.21 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 2.40 2.40 0.00 127 L 8.14 4.50 0.00 1.64 1.54 0.76 0.79 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 0.00 128 V 8.09 4.30 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 0.82 0.00 0.00 0.94 0.00 0.00 129 I 8.01 4.19 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.54 0.87 0.00 0.00 130 D 7.89 4.64 0.00 2.89 2.78 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 0.00 131 R 8.27 4.00 0.00 1.53 1.96 0.00 3.14 0.00 0.00 3.18 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 132 H 9.05 4.66 0.00 3.26 3.47 0.00 5.61 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 V 8.20 4.40 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 0.69 0.00 0.00 0.93 0.00 0.00 134 I 8.92 4.30 1.85 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 0.98 0.67 0.80 0.00 0.00 135 A 7.07 4.43 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 V 7.71 4.58 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.85 0.00 0.00 137 A 9.07 5.01 1.25 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 0.00 0.00 0.00 138 S 8.91 5.59 0.00 4.03 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 0.00 139 D 8.53 5.07 0.00 2.72 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 0.00 140 V 7.71 4.43 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 0.75 0.00 0.00 0.99 0.00 0.00 141 P 0.00 4.46 0.00 2.08 1.96 0.00 3.70 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 2.03 2.11 0.00 142 L 7.94 4.66 0.00 1.47 1.38 0.65 0.74 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 0.00 143 N 8.55 4.69 0.00 2.68 2.76 0.00 0.00 6.80 7.85 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 0.00 144 L 7.56 4.67 0.00 1.63 1.53 0.86 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 145 D 8.26 4.66 0.00 2.68 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 0.00 146 V 7.83 4.02 2.05 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 0.56 0.00 0.00 0.91 0.00 0.00 147 A 7.69 3.83 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 0.00 148 L 8.33 4.65 0.00 1.73 1.54 0.92 0.98 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 0.00 149 L 8.37 4.73 0.00 1.46 1.40 0.22 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 150 D 8.37 4.93 0.00 2.80 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 9.83 3.82 1.99 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 1.33 0.97 0.98 0.00 0.00 152 N 7.64 4.74 0.00 2.58 2.83 0.00 0.00 6.78 7.94 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 0.00 153 D 7.60 4.76 0.00 2.87 2.55 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 0.00 0.00 0.00 0.00 154 V 7.87 3.60 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.94 0.00 0.00 155 E 8.37 3.82 0.00 2.04 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 2.42 2.35 0.00 156 G 8.46 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 0.00 157 L 8.28 4.01 0.00 1.98 1.88 1.05 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 158 A 8.85 4.10 1.42 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 0.00 159 D 8.10 4.36 0.00 3.00 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 0.00 160 F 8.08 4.12 0.00 3.12 3.33 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 0.00 161 V 7.88 3.65 2.42 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 1.04 0.00 0.00 1.14 0.00 0.00 162 V 7.95 3.79 2.28 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 0.91 0.00 0.00 1.06 0.00 0.00 163 E 8.45 4.10 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.57 0.00 164 W 8.13 3.74 0.00 2.84 3.29 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 *166 Q 8.08 4.20 0.00 2.26 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.58 6.70 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 167 K 7.66 4.02 0.00 1.66 1.73 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.44 7.81 168 Q 6.94 4.09 0.00 1.48 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.78 0.00 0.00 0.00 0.00 0.00 1.74 1.16 0.00 169 N 7.38 4.43 0.00 2.53 2.63 0.00 0.00 6.82 8.51 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 * Residues marked with a * may have inaccurate shift predictions.