NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.5687 0.0000 0.0000 62.3773 33.0850 175.2794 3 F 4.3357 8.7470 122.8485 58.1494 40.6048 172.5916 4 I 4.7057 7.3786 126.3736 59.4858 39.8506 173.6397 5 Y 4.6833 9.0925 128.4736 55.7505 41.0943 173.9906 6 R 4.6658 7.9624 126.7520 54.4541 32.4537 174.7954 7 R 4.1048 7.8385 124.8020 54.6384 33.8948 173.2262 8 R 4.9010 7.9393 124.8915 54.1758 32.5151 175.6183 9 V 4.0397 8.6995 126.5488 63.2681 32.6615 175.3977 10 Q 4.9005 9.1801 127.0390 54.3700 30.5499 176.6494 11 F 3.8438 8.9967 122.8312 61.4739 39.4845 176.9030 12 Y 4.3908 7.9392 116.3650 59.0799 38.1227 176.4830 13 E 4.2719 7.9543 119.8174 57.2562 29.9272 176.8861 14 T 4.6387 7.3217 109.4791 60.7467 70.0948 172.9165 15 D 4.9575 8.2782 120.7870 51.0972 42.2108 176.3042 16 A 4.0834 8.4731 120.6225 54.9615 18.3042 178.7141 17 Q 4.0423 8.2044 114.0148 57.0390 28.8616 177.3515 18 G 3.9251 8.5771 106.8098 45.2099 0.0000 172.6874 19 I 4.9462 7.1944 112.0157 58.1159 41.5905 174.6581 20 V 4.1702 8.5372 123.8146 63.0143 31.8173 175.3338 21 H 4.2543 8.9628 128.7497 56.4009 30.2413 175.8131 22 H 4.0223 8.6441 121.3112 58.9536 28.0862 177.8456 23 S 4.4576 7.8168 116.0186 61.0889 62.8550 175.8255 24 N 4.3139 8.3937 120.1236 55.6679 38.0946 176.7260 25 Y 3.2685 7.5211 118.5138 60.7763 37.7998 178.6488 26 F 3.9137 7.2300 117.0952 60.3413 38.8566 177.9995 27 R 3.9372 7.5721 117.3786 59.3487 29.9131 178.3539 28 Y 4.4578 7.5222 116.5546 61.3474 37.7772 178.8078 29 F 4.3531 7.6544 118.8029 60.5033 38.8994 177.3764 30 E 3.9686 8.3209 118.9980 59.3400 29.4940 178.6336 31 E 3.8808 8.5792 118.7676 59.2706 29.4362 179.2561 32 A 3.5022 7.9366 120.6758 55.1613 18.5214 179.7744 33 R 3.7104 8.3131 117.0100 59.3907 30.0012 179.6067 34 G 3.6148 8.1531 105.4149 47.8156 0.0000 175.7408 35 E 4.0320 8.2631 121.0467 58.7940 29.5371 178.7485 36 F 2.5401 8.1560 121.2379 61.1425 39.2749 177.3775 37 L 3.7382 7.8474 118.1266 57.5233 41.3714 179.4707 38 R 3.9099 8.2297 119.2198 59.5655 29.8630 178.7875 39 S 4.1648 8.3732 112.7949 60.9413 62.9911 175.5907 40 K 4.2432 7.4438 119.0110 55.7689 32.0350 177.3372 41 G 3.9175 8.2294 107.6172 45.8589 0.0000 174.5507 42 F 5.0082 8.0097 120.8234 55.3293 39.4424 172.5437 43 P 4.5364 0.0000 0.0000 61.7528 32.6161 176.8995 44 Y 4.3198 8.8884 121.7890 61.1660 38.5677 178.7788 45 S 3.9523 8.2104 114.5293 61.5903 62.3745 176.4647 46 K 4.1828 8.0719 122.5968 59.2516 31.9177 178.5761 47 M 4.1442 8.1434 118.6564 58.7328 32.0255 178.8450 48 R 4.2873 7.6870 119.2165 58.7396 29.8949 178.8781 49 D 4.4230 7.7215 117.7400 57.3077 40.8329 178.1916 50 M 4.3295 7.5352 117.7136 56.3765 32.0163 177.3246 51 G 4.0211 7.7347 106.5542 45.0844 0.0000 172.9360 52 L 4.8092 7.9205 119.4347 53.3622 43.6798 175.3071 53 E 4.9748 9.3062 123.6711 54.4330 32.7507 174.6295 54 V 4.5755 9.1607 127.4163 61.9785 32.6354 175.0001 55 V 4.3802 8.9292 128.9176 60.9156 33.4901 174.3592 56 L 4.3448 8.5718 130.5693 55.3967 42.1449 175.9686 57 L 4.5225 9.1714 127.3414 56.6114 42.8566 176.4097 58 N 5.0613 7.7405 113.3956 52.0137 40.6898 172.9593 59 A 5.3840 8.2868 119.9286 51.0152 22.6831 175.0153 60 Y 4.9592 9.3466 121.1048 56.2210 42.7501 173.5511 61 C 4.8451 8.0511 125.3475 57.3105 35.0362 172.3802 62 E 4.3952 8.7592 124.0479 54.5591 31.8388 174.2490 63 Y 4.5123 8.5121 121.2906 56.6581 39.0057 175.0082 64 K 4.4154 8.9584 124.3433 57.4693 33.6056 177.5423 65 K 4.6217 7.6735 116.2163 53.6552 35.9974 174.1574 66 P 4.5564 0.0000 0.0000 62.6826 32.7113 175.0674 67 L 4.4279 7.8784 119.5903 52.9796 44.4704 175.9649 68 F 5.4075 8.9744 120.9146 55.2252 42.7135 174.4599 69 Y 4.3397 8.7477 120.7770 59.8855 38.6790 176.1310 70 D 4.3051 8.4353 124.7742 54.1152 40.8212 173.4895 71 D 4.5574 7.8377 118.5008 54.9381 41.9912 175.3741 72 V 4.4898 8.3159 123.1173 61.8508 32.7680 174.7959 73 F 5.2817 8.6415 122.0927 55.2994 42.2570 173.1194 74 E 5.0709 9.4425 118.0119 54.6313 33.6812 175.1533 75 V 4.8846 9.0757 124.5354 62.0736 33.3757 174.2298 76 H 5.3917 9.6046 127.0956 54.5492 30.4790 173.9327 77 L 4.9312 9.2433 126.7351 53.4582 44.3689 174.6841 78 N 5.2507 8.8079 123.6030 51.5527 42.7427 172.8344 79 L 4.2911 8.6728 128.0540 55.3064 42.1141 175.8765 80 E 4.4654 9.3530 126.6240 57.8210 31.2301 176.2517 81 E 4.6865 7.6341 118.0816 54.9474 33.3827 174.1766 82 L 5.0390 8.4691 128.0231 54.0880 44.6279 174.7708 83 S 4.8761 8.8401 122.1604 55.8754 66.1116 173.6562 84 R 3.8550 8.6444 118.9859 59.0983 29.8039 177.8901 85 F 4.9946 8.2007 114.6209 57.6355 41.1210 174.8238 86 T 5.2279 7.8979 109.3530 59.9562 72.5778 172.8768 87 F 5.3844 8.3669 115.6653 55.8631 41.9622 173.3213 88 T 4.9763 8.7352 116.3562 61.9843 71.9434 173.0345 89 F 5.3155 9.1058 125.4611 55.9041 41.5629 175.0878 90 S 5.2303 8.8944 116.7742 56.9381 66.1429 172.5588 91 Y 5.1841 8.8567 118.2291 56.4553 42.3158 174.1987 92 I 4.7225 8.9025 123.9677 59.4387 40.8205 174.5795 93 V 4.7056 8.7149 127.7447 61.7913 32.8561 174.4002 94 F 5.3489 9.5611 127.5162 55.7284 41.7276 174.8898 95 K 4.7374 9.1230 123.9311 54.4999 34.8340 175.4534 96 E 3.5119 9.2135 127.8529 58.1286 28.2996 176.4828 97 D 4.5698 8.9149 126.5733 56.2801 41.2897 175.6190 98 I 4.4542 7.8374 121.5473 58.9276 39.0768 174.7117 99 A 4.0557 8.7441 128.5715 52.3436 18.3257 176.7594 100 V 4.2107 8.7335 123.2908 64.2335 33.6402 175.2255 101 A 4.8046 7.3179 119.4492 50.9791 22.5554 175.1843 102 K 5.0316 8.5840 117.6458 54.9629 36.8207 175.5026 103 A 5.1057 8.8198 123.8183 51.4995 23.4497 174.4324 104 N 5.6525 9.0881 114.9469 52.4439 41.1106 173.9109 105 T 5.2164 9.1701 110.1049 60.1016 72.6843 172.3869 106 K 4.8972 8.8402 125.4068 55.0113 35.3080 174.4110 107 H 5.3802 8.8000 122.9953 54.2242 33.5632 171.9632 108 C 5.2314 8.8207 114.5068 56.0946 33.8313 172.2223 109 M 5.4801 8.6223 116.2188 53.7570 36.0680 175.0369 110 V 4.9895 8.9071 121.0303 61.1931 35.5290 174.1989 111 K 4.9162 9.0639 127.8574 55.4404 35.9091 175.6604 112 N 4.2639 9.7113 123.7307 54.6103 36.0205 175.0086 113 G 3.9630 8.2829 101.8687 45.8733 0.0000 173.3971 114 K 4.6752 7.6178 118.7371 53.8446 35.0504 175.7226 115 I 4.2386 8.3213 122.8244 61.7816 37.4520 175.9810 116 V 4.8513 8.2769 118.9598 59.1789 34.1546 176.0897 117 S 3.9990 8.6411 117.6506 58.0557 63.9132 173.8892 118 I 3.9219 8.4326 123.6023 60.6634 37.3053 174.6368 119 P 4.3528 0.0000 0.0000 62.6652 32.1072 177.5410 120 K 3.9410 8.8016 121.3774 59.5516 32.0677 179.2935 121 E 4.1815 8.2984 117.5089 59.6635 29.2592 179.3870 122 V 3.7135 7.7318 118.4806 65.4718 31.6548 177.5843 123 L 3.8945 8.0905 118.9581 57.9349 41.2438 179.2196 124 E 3.9612 8.0732 117.1603 59.8726 29.5774 179.7608 125 V 3.7747 7.2530 109.2956 64.0121 31.6643 178.5244 126 L 4.3180 7.9075 118.1754 57.8013 41.6312 177.8809 127 K 4.2072 8.0402 121.5277 57.0015 32.2805 176.3187 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 4.57 0.00 1.87 1.91 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.60 0.00 3 F 8.75 4.34 0.00 3.52 3.13 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 4 I 7.38 4.71 1.55 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.51 0.73 0.00 0.00 5 Y 9.09 4.68 0.00 3.19 2.94 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 6 R 7.96 4.67 0.00 1.60 1.48 0.00 3.42 0.00 0.00 2.97 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.45 0.00 7 R 7.84 4.10 0.00 0.93 0.66 0.00 2.98 0.00 0.00 2.87 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.98 0.00 8 R 7.94 4.90 0.00 1.67 1.65 0.00 3.23 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.61 0.00 9 V 8.70 4.04 2.31 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 0.96 0.00 0.00 1.03 0.00 0.00 10 Q 9.18 4.90 0.00 1.46 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 11 F 9.00 3.84 0.00 2.69 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.94 4.39 0.00 3.13 3.17 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 13 E 7.95 4.27 0.00 2.10 1.92 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 2.20 1.47 0.00 14 T 7.32 4.64 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 15 D 8.28 4.96 0.00 2.89 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.47 4.08 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 17 Q 8.20 4.04 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.99 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 18 G 8.58 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 7.19 4.95 1.87 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 1.25 0.88 1.06 0.00 0.00 20 V 8.54 4.17 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 0.43 0.00 0.00 0.86 0.00 0.00 21 H 8.96 4.25 0.00 3.28 3.26 0.00 5.85 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 H 8.64 4.02 0.00 2.61 2.74 0.00 5.51 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 23 S 7.82 4.46 0.00 4.13 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 24 N 8.39 4.31 0.00 2.55 2.20 0.00 0.00 6.84 7.01 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 25 Y 7.52 3.27 0.00 2.49 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 0.00 0.00 0.00 26 F 7.23 3.91 0.00 3.27 3.17 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 27 R 7.57 3.94 0.00 1.81 1.97 0.00 3.08 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 28 Y 7.52 4.46 0.00 2.73 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 29 F 7.65 4.35 0.00 2.93 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 0.00 0.00 0.00 0.00 30 E 8.32 3.97 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 31 E 8.58 3.88 0.00 2.10 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 2.42 2.71 0.00 32 A 7.94 3.50 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.31 3.71 0.00 1.93 1.88 0.00 3.21 0.00 0.00 3.44 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.95 0.00 34 G 8.15 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.26 4.03 0.00 2.17 2.37 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 2.48 2.85 0.00 36 F 8.16 2.54 0.00 2.38 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.85 3.74 0.00 1.75 1.93 0.96 0.86 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 38 R 8.23 3.91 0.00 2.00 2.10 0.00 3.34 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 39 S 8.37 4.16 0.00 4.14 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 0.00 40 K 7.44 4.24 0.00 1.49 1.69 0.00 1.57 0.00 0.00 1.37 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.95 0.62 7.81 41 G 8.23 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 42 F 8.01 5.01 0.00 2.86 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 43 P 0.00 4.54 0.00 2.30 2.02 0.00 3.84 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.13 0.00 44 Y 8.89 4.32 0.00 3.02 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.21 3.95 0.00 4.07 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 0.00 46 K 8.07 4.18 0.00 2.02 2.27 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.59 7.81 47 M 8.14 4.14 0.00 2.08 2.19 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 2.05 2.07 0.00 48 R 7.69 4.29 0.00 1.80 1.82 0.00 2.65 0.00 0.00 2.99 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.60 0.00 49 D 7.72 4.42 0.00 2.89 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 50 M 7.54 4.33 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.79 0.00 51 G 7.73 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 52 L 7.92 4.81 0.00 1.77 1.66 0.98 0.85 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 53 E 9.31 4.97 0.00 2.05 1.84 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 2.32 2.36 0.00 54 V 9.16 4.58 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 0.84 0.00 0.00 1.16 0.00 0.00 55 V 8.93 4.38 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 0.96 0.00 0.00 1.01 0.00 0.00 56 L 8.57 4.34 0.00 1.69 1.54 0.90 1.01 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 57 L 9.17 4.52 0.00 1.58 1.63 0.85 0.94 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 58 N 7.74 5.06 0.00 2.80 2.84 0.00 0.00 5.84 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.29 5.38 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 60 Y 9.35 4.96 0.00 3.10 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 61 C 8.05 4.85 0.00 2.55 2.23 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 62 E 8.76 4.40 0.00 1.93 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.16 0.00 63 Y 8.51 4.51 0.00 2.66 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.96 4.42 0.00 1.64 1.81 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.31 7.81 65 K 7.67 4.62 0.00 1.63 1.60 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.34 7.81 66 P 0.00 4.56 0.00 1.69 1.97 0.00 3.66 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 1.53 2.03 0.00 67 L 7.88 4.43 0.00 1.37 1.36 -0.05 0.97 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 68 F 8.97 5.41 0.00 3.06 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 69 Y 8.75 4.34 0.00 2.85 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 70 D 8.44 4.31 0.00 1.58 2.40 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 71 D 7.84 4.56 0.00 2.83 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 72 V 8.32 4.49 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 0.64 0.00 0.00 0.84 0.00 0.00 73 F 8.64 5.28 0.00 3.23 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 74 E 9.44 5.07 0.00 2.10 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 2.11 2.21 0.00 75 V 9.08 4.88 2.51 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 1.47 0.00 0.00 1.40 0.00 0.00 76 H 9.60 5.39 0.00 3.39 3.39 0.00 5.84 0.00 0.00 0.00 0.00 6.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 9.24 4.93 0.00 1.77 1.78 0.41 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.81 5.25 0.00 2.83 2.55 0.00 0.00 6.69 7.50 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 79 L 8.67 4.29 0.00 1.66 1.56 0.53 0.93 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 80 E 9.35 4.47 0.00 1.95 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 2.34 0.00 81 E 7.63 4.69 0.00 1.94 1.69 0.00 0.00 0.00 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 2.23 0.00 82 L 8.47 5.04 0.00 1.57 1.47 0.85 0.83 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 83 S 8.84 4.88 0.00 3.99 4.11 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 0.00 0.00 0.00 0.00 84 R 8.64 3.85 0.00 1.74 1.72 0.00 3.00 0.00 0.00 3.00 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.39 0.00 85 F 8.20 4.99 0.00 3.13 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 86 T 7.90 5.23 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 1.26 0.00 0.00 87 F 8.37 5.38 0.00 2.92 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 88 T 8.74 4.98 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 1.21 0.00 0.00 89 F 9.11 5.32 0.00 2.77 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 0.00 0.00 0.00 90 S 8.89 5.23 0.00 3.78 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 91 Y 8.86 5.18 0.00 2.26 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 92 I 8.90 4.72 1.80 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 1.02 0.84 0.06 0.00 0.00 93 V 8.71 4.71 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 1.00 0.00 0.00 1.26 0.00 0.00 94 F 9.56 5.35 0.00 2.96 2.90 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 95 K 9.12 4.74 0.00 1.80 1.66 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.37 1.44 7.81 96 E 9.21 3.51 0.00 2.18 1.39 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 2.24 2.33 0.00 97 D 8.91 4.57 0.00 2.70 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 98 I 7.84 4.45 2.02 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 1.29 0.95 0.94 0.00 0.00 99 A 8.74 4.06 0.98 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 0.00 0.00 100 V 8.73 4.21 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 1.07 0.00 0.00 0.90 0.00 0.00 101 A 7.32 4.80 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 0.00 102 K 8.58 5.03 0.00 1.76 1.62 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.22 1.25 7.81 103 A 8.82 5.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 N 9.09 5.65 0.00 2.99 2.94 0.00 0.00 6.91 6.74 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 0.00 105 T 9.17 5.22 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 1.49 0.00 0.00 106 K 8.84 4.90 0.00 1.77 1.57 0.00 1.52 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.18 1.26 7.81 107 H 8.80 5.38 0.00 1.40 2.61 0.00 5.81 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 C 8.82 5.23 0.00 3.07 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 M 8.62 5.48 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.71 0.00 110 V 8.91 4.99 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 1.02 0.00 0.00 0.97 0.00 0.00 111 K 9.06 4.92 0.00 1.86 1.61 0.00 1.88 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.64 7.81 112 N 9.71 4.26 0.00 2.89 2.85 0.00 0.00 7.00 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 0.00 113 G 8.28 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 0.00 114 K 7.62 4.68 0.00 2.00 1.71 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.42 7.81 115 I 8.32 4.24 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 1.42 0.46 0.92 0.00 0.00 116 V 8.28 4.85 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 0.81 0.00 0.00 1.02 0.00 0.00 117 S 8.64 4.00 0.00 3.48 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 8.43 3.92 1.86 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.72 0.89 0.00 0.00 119 P 0.00 4.35 0.00 2.25 2.04 0.00 3.64 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.17 0.00 120 K 8.80 3.94 0.00 1.80 1.87 0.00 1.67 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.49 7.81 121 E 8.30 4.18 0.00 2.33 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 0.00 2.47 2.65 0.00 122 V 7.73 3.71 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 0.85 0.00 0.00 0.84 0.00 0.00 123 L 8.09 3.89 0.00 1.90 1.70 0.94 0.89 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 0.00 124 E 8.07 3.96 0.00 2.19 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 0.00 2.36 2.37 0.00 125 V 7.25 3.77 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 0.93 0.00 0.00 1.02 0.00 0.00 126 L 7.91 4.32 0.00 1.62 1.56 -0.06 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 127 K 8.04 4.21 0.00 1.94 1.79 0.00 1.72 0.00 0.00 1.88 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.49 7.81