NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.8342 8.2300 117.5106 52.1056 39.0553 174.5132 2 L 3.6074 7.8738 119.7070 58.3322 41.6933 177.7639 3 L 4.0393 8.5039 119.5714 57.6199 41.8860 179.0942 4 Q 4.0316 7.7754 117.8805 58.8104 28.7528 178.0142 5 F 4.3296 8.4332 121.8609 61.3766 39.3437 177.0296 6 R 3.6430 7.9340 118.1572 59.6328 29.8839 178.3154 7 N 4.4600 8.1067 116.0009 56.3551 38.4996 177.3875 8 M 4.1172 8.2462 120.7564 58.3755 31.9367 178.8222 9 I 3.6302 7.5540 120.0780 64.1976 36.9985 178.6469 10 K 4.1530 7.6065 118.1941 59.1804 31.8573 178.4294 11 C 4.4474 7.9545 118.7368 59.8357 43.7443 175.3038 12 T 4.0682 7.7423 109.5942 62.7636 69.9302 174.9427 13 I 4.5616 7.8226 122.0099 58.1928 37.5899 173.0239 14 P 4.2741 0.0000 0.0000 63.6422 32.0908 177.0774 15 G 3.9659 9.3171 108.9338 45.4695 0.0000 173.3169 16 R 4.4673 7.3649 116.2999 54.1055 34.0249 174.8645 17 E 4.3796 8.2281 121.3979 53.7635 29.3574 174.3710 18 P 4.2506 0.0000 0.0000 65.7585 31.6010 178.8355 19 L 4.1188 8.2641 116.1945 56.6144 41.6435 177.5272 20 L 4.3186 8.4875 119.7828 55.2051 42.4928 176.5915 21 A 4.4925 7.3887 117.5932 51.7085 20.8637 176.5236 22 F 4.8846 7.9140 111.7512 57.4299 40.0257 177.0564 23 S 4.4017 8.2357 118.2664 61.3342 63.2213 173.7065 24 N 5.7164 8.0016 118.2817 51.3885 38.6546 171.1806 25 Y 5.1568 8.7429 121.9242 56.2575 42.5872 175.3739 26 G 3.5837 7.5285 115.2131 47.4565 0.0000 174.9918 27 C 4.9658 10.5281 120.0581 56.6040 41.9566 174.5339 28 Y 4.2461 8.9261 115.0517 57.6401 39.9896 175.0375 29 C 4.7219 8.3309 118.7049 59.7255 41.1165 172.0091 30 G 4.7422 8.1798 112.7948 45.1218 0.0000 176.2942 31 K 4.5106 10.0812 127.2043 54.9410 33.9861 174.0591 32 G 3.7747 10.0509 119.8563 44.4857 0.0000 174.7050 33 G 3.5539 7.9185 111.1169 43.5207 0.0000 171.7951 34 S 4.5061 7.9661 112.6706 58.4011 63.5081 171.1280 35 G 4.3629 8.8974 113.4616 46.5557 0.0000 171.9755 36 T 4.7493 8.1367 117.8606 60.8268 70.9979 172.5134 37 P 4.7325 0.0000 0.0000 62.9573 31.8860 177.1687 38 V 3.5906 8.4321 114.1888 62.8083 32.2705 175.4499 39 D 4.4916 7.1655 116.9676 52.1508 42.0652 175.7464 40 E 3.9162 8.7144 117.6033 59.8886 29.5623 178.5082 41 L 3.9147 8.0662 119.8935 58.5504 42.0214 178.2114 42 D 4.5151 8.6662 117.5983 57.6998 41.0167 178.3985 43 R 3.8332 7.9737 118.8614 59.4193 29.9427 177.7991 44 C 4.3094 8.5040 116.8493 60.3712 39.8951 175.5236 45 C 4.4089 8.3763 117.8191 59.8813 33.9072 175.8914 46 Q 3.6895 8.0836 121.2699 59.4890 28.5630 178.5926 47 T 3.8199 8.0635 116.9488 66.6073 68.4027 176.0048 48 H 3.9061 8.2947 120.3788 59.4567 29.8591 176.6376 49 D 4.2743 8.2181 120.7846 57.7479 40.7292 178.7944 50 N 4.3521 8.0033 116.6261 56.7540 38.9110 176.0887 51 C 4.3918 8.2076 120.0163 59.9576 39.2304 175.2126 52 Y 4.2332 8.2554 118.4418 61.2082 37.1648 178.2046 53 D 4.4540 8.1596 119.2656 57.2489 41.0526 178.6120 54 K 4.1508 8.2482 118.9642 59.1228 32.1803 179.2922 55 A 3.7889 8.1744 121.3389 55.0139 18.0931 179.4522 56 E 4.0128 7.9304 116.1929 58.5536 29.5801 178.5933 57 K 4.3329 7.3444 116.4972 55.3439 33.3490 176.6382 58 L 3.8303 6.9626 122.3639 54.3537 42.5144 175.6775 59 P 4.2414 0.0000 0.0000 65.8703 31.3890 177.7248 60 E 3.9487 8.0070 115.6018 58.6742 29.5458 177.5248 61 C 4.5444 7.7345 116.7102 56.1413 39.5512 173.1380 62 K 4.1974 7.3567 121.1886 54.8672 35.2880 174.8508 63 G 4.3248 8.0239 112.9595 43.5929 0.0000 171.3084 64 I 3.6827 7.7198 121.3348 61.8693 38.2902 175.5541 65 L 3.7395 8.5312 126.5744 56.1357 38.7590 174.7904 66 S 4.7438 7.8457 111.1356 58.1368 63.3780 174.3407 67 G 3.9516 7.8207 110.1884 44.4550 0.0000 173.1740 68 P 3.9636 0.0000 0.0000 65.6713 31.6705 178.2694 69 Y 3.6593 8.1202 118.3818 59.8306 38.8132 177.1175 70 F 4.7316 7.9909 115.3219 57.6310 40.9883 174.9763 71 N 4.3412 8.6633 119.5149 53.7730 38.4545 174.3690 72 T 4.0983 8.4614 124.0104 63.0307 68.8347 174.1514 73 Y 4.7330 7.7361 125.6137 55.3323 40.6600 174.2339 74 S 5.0516 9.4751 115.0351 56.9260 64.2143 172.6620 75 Y 5.3949 8.4572 123.9130 55.9715 41.4856 173.3707 76 D 4.5201 9.5650 118.7142 52.5093 45.1072 173.2591 77 C 5.3769 8.8201 124.9622 55.3046 40.2592 173.2279 78 T 4.4610 8.7772 124.0786 62.5235 70.8486 174.4530 79 D 4.4860 9.6443 128.4855 55.5227 38.0905 174.8667 80 G 3.9075 8.2510 103.3137 45.5913 0.0000 172.7406 81 K 4.6407 7.7149 121.0514 54.3334 34.8580 174.6212 82 L 5.4347 8.5206 126.3144 53.4303 44.0108 175.8771 83 T 4.6673 9.0191 119.7828 61.9418 72.3576 172.2255 84 C 4.9816 8.8696 123.6421 56.3692 40.8454 173.2794 85 N 4.5744 9.2269 121.3389 53.4217 39.3285 175.6814 86 D 4.5556 8.2137 119.2349 54.7252 41.5673 175.8934 87 Q 4.4597 8.5406 119.8135 57.4188 31.7794 176.7781 88 N 4.3490 8.3904 113.9048 55.5303 39.0926 175.0385 89 D 4.7397 7.7795 119.7171 52.4852 42.0298 176.5834 90 K 4.1786 8.4274 127.4412 58.7231 32.1602 179.6765 91 C 4.3230 8.5797 119.6034 59.5300 44.2320 175.5929 92 K 4.0247 8.2639 119.6722 59.3292 31.7095 178.9781 93 L 3.9288 7.9221 120.7067 57.8827 42.0020 178.8664 94 F 3.9687 8.2352 120.7445 61.2960 39.3957 177.1908 95 I 3.7282 8.0394 119.5230 64.5465 36.9064 177.5259 96 C 2.7564 8.0960 119.3565 59.3789 43.5937 175.4881 97 N 4.1153 7.7981 117.8519 56.1193 38.0070 176.8956 98 C 4.0864 7.7809 118.1009 60.0140 39.2397 175.8684 99 D 3.8786 7.8764 120.4381 57.0555 40.4038 178.6733 100 R 3.7390 8.1002 119.8146 59.7772 30.1373 178.7801 101 T 3.7692 7.8056 109.1216 64.4247 68.5406 176.3480 102 A 3.5522 7.5685 123.0652 54.8237 18.2339 179.3898 103 A 3.3958 7.9457 119.6370 55.4885 18.1712 179.8359 104 M 3.9774 7.7461 116.2178 58.3596 32.2663 177.9049 105 C 4.4080 8.0514 118.9262 59.5912 38.3277 175.4909 106 F 4.3046 8.3517 119.6416 60.7104 38.2630 177.4842 107 A 4.1735 7.7649 118.9881 54.1343 18.2511 178.7330 108 K 4.2783 7.6862 114.3442 55.5538 33.0760 176.1277 109 A 4.7798 7.1033 122.4822 49.3411 20.8402 175.1007 110 P 4.3407 0.0000 0.0000 62.6557 31.7627 175.3447 111 Y 4.4087 8.6011 123.5793 55.9369 39.7953 173.6912 112 N 4.6312 8.3039 126.9953 51.4330 39.8776 175.2058 113 E 3.7384 8.3721 127.0152 58.8095 30.0359 178.4038 114 A 4.0287 7.4760 120.3231 54.5958 18.7163 177.4299 115 Y 4.4470 7.2275 112.3908 58.3960 38.2741 175.4718 116 N 4.7047 7.6983 118.4369 54.7948 39.4002 174.2902 117 H 4.8383 9.5581 121.2525 55.9166 28.9513 174.8538 118 F 4.3121 7.9262 119.2904 57.9859 40.2880 174.5875 119 N 4.2784 7.4954 125.2954 52.8966 37.2746 175.5113 120 R 3.9793 8.1327 124.1096 57.9962 30.4305 178.7177 121 Q 4.1100 7.7808 115.9502 57.6644 28.8426 176.7969 122 L 4.2260 7.6560 116.7278 55.6054 42.8173 176.5331 123 C 4.8023 7.8140 119.6620 55.7877 39.3723 174.0516 124 K 4.1976 7.4739 122.6149 56.7622 32.7849 176.9990 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 1 N 8.23 4.83 0.00 2.92 3.13 0.00 0.00 5.71 5.79 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 2 L 7.87 3.61 0.00 0.91 1.21 0.79 0.06 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 3 L 8.50 4.04 0.00 1.69 1.70 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 7.78 4.03 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.89 0.00 0.00 0.00 0.00 0.00 2.50 2.39 0.00 5 F 8.43 4.33 0.00 3.33 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 6 R 7.93 3.64 0.00 1.90 2.08 0.00 3.14 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 7 N 8.11 4.46 0.00 3.07 2.98 0.00 0.00 7.06 7.66 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 8 M 8.25 4.12 0.00 1.94 2.20 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.20 0.00 9 I 7.55 3.63 1.89 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.15 0.94 0.00 0.00 10 K 7.61 4.15 0.00 1.87 1.88 0.00 1.70 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.72 7.81 11 C 7.95 4.45 0.00 3.16 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.74 4.07 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 1.23 0.00 0.00 13 I 7.82 4.56 2.03 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 1.34 0.71 0.93 0.00 0.00 14 P 0.00 4.27 0.00 2.03 1.98 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 15 G 9.32 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 0.00 0.00 0.00 16 R 7.36 4.47 0.00 1.67 1.63 0.00 2.77 0.00 0.00 2.44 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.42 0.00 17 E 8.23 4.38 0.00 1.99 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 2.27 2.42 0.00 18 P 0.00 4.25 0.00 2.22 2.23 0.00 3.64 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 19 L 8.26 4.12 0.00 1.73 1.76 0.94 0.89 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 20 L 8.49 4.32 0.00 1.47 1.76 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.39 4.49 0.24 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 22 F 7.91 4.88 0.00 3.07 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 23 S 8.24 4.40 0.00 3.96 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 24 N 8.00 5.72 0.00 2.80 2.79 0.00 0.00 6.50 7.56 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 25 Y 8.74 5.16 0.00 3.31 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.53 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 C 10.53 4.97 0.00 2.99 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 28 Y 8.93 4.25 0.00 3.19 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 29 C 8.33 4.72 0.00 3.36 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 G 8.18 4.74 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 0.00 0.00 0.00 31 K 10.08 4.51 0.00 1.77 1.78 0.00 1.88 0.00 0.00 1.79 0.00 0.00 3.22 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.45 1.51 7.81 32 G 10.05 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 33 G 7.92 3.55 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 0.00 34 S 7.97 4.51 0.00 3.81 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 35 G 8.90 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 0.00 0.00 0.00 0.00 36 T 8.14 4.75 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 1.23 0.00 0.00 37 P 0.00 4.73 0.00 2.03 1.97 0.00 3.66 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 2.00 1.87 0.00 38 V 8.43 3.59 0.99 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 -0.13 0.00 0.00 0.35 0.00 0.00 39 D 7.17 4.49 0.00 2.96 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 40 E 8.71 3.92 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 41 L 8.07 3.91 0.00 1.71 1.60 0.40 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.67 4.52 0.00 3.17 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 43 R 7.97 3.83 0.00 1.92 2.18 0.00 3.13 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 44 C 8.50 4.31 0.00 3.55 3.39 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 0.00 45 C 8.38 4.41 0.00 3.37 3.49 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 46 Q 8.08 3.69 0.00 1.21 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 1.95 1.17 0.00 47 T 8.06 3.82 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 1.15 0.00 0.00 48 H 8.29 3.91 0.00 3.16 3.36 0.00 5.63 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 49 D 8.22 4.27 0.00 3.06 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 50 N 8.00 4.35 0.00 2.80 2.93 0.00 0.00 6.90 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 C 8.21 4.39 0.00 3.11 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 52 Y 8.26 4.23 0.00 3.11 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 53 D 8.16 4.45 0.00 2.93 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 54 K 8.25 4.15 0.00 2.29 1.90 0.00 1.86 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.51 1.76 7.81 55 A 8.17 3.79 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 E 7.93 4.01 0.00 1.91 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 2.35 2.63 0.00 57 K 7.34 4.33 0.00 1.74 1.80 0.00 1.70 0.00 0.00 1.62 0.00 0.00 3.14 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.57 7.81 58 L 6.96 3.83 0.00 1.57 1.42 0.47 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.24 0.00 2.03 2.08 0.00 3.62 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 1.98 2.07 0.00 60 E 8.01 3.95 0.00 1.90 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 0.00 2.31 2.38 0.00 61 C 7.73 4.54 0.00 3.14 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 62 K 7.36 4.20 0.00 1.83 1.73 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.20 1.23 7.81 63 G 8.02 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 0.00 0.00 0.00 0.00 64 I 7.72 3.68 1.85 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 1.36 0.80 0.89 0.00 0.00 65 L 8.53 3.74 0.00 1.81 1.76 0.65 0.37 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 66 S 7.85 4.74 0.00 3.96 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 67 G 7.82 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 0.00 0.00 0.00 68 P 0.00 3.96 0.00 1.36 0.49 0.00 3.47 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 69 Y 8.12 3.66 0.00 2.95 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 70 F 7.99 4.73 0.00 3.15 3.08 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 0.00 0.00 0.00 0.00 71 N 8.66 4.34 0.00 2.85 2.80 0.00 0.00 7.20 7.57 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 72 T 8.46 4.10 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 1.21 0.00 0.00 73 Y 7.74 4.73 0.00 3.24 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 74 S 9.48 5.05 0.00 3.97 3.85 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 75 Y 8.46 5.39 0.00 3.12 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 76 D 9.57 4.52 0.00 2.65 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.82 5.38 0.00 3.17 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 78 T 8.78 4.46 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 1.21 0.00 0.00 79 D 9.64 4.49 0.00 2.81 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 80 G 8.25 3.91 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 0.00 0.00 0.00 81 K 7.71 4.64 0.00 1.86 1.81 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.37 7.81 82 L 8.52 5.43 0.00 1.54 1.60 0.94 1.03 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 83 T 9.02 4.67 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 84 C 8.87 4.98 0.00 2.79 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 85 N 9.23 4.57 0.00 2.60 2.87 0.00 0.00 7.10 7.66 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 86 D 8.21 4.56 0.00 2.71 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 87 Q 8.54 4.46 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.08 0.00 0.00 0.00 0.00 0.00 2.25 2.50 0.00 88 N 8.39 4.35 0.00 2.73 2.89 0.00 0.00 6.71 8.06 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 89 D 7.78 4.74 0.00 2.75 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 90 K 8.43 4.18 0.00 1.85 1.88 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.51 7.81 91 C 8.58 4.32 0.00 3.11 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 92 K 8.26 4.02 0.00 2.09 2.14 0.00 1.79 0.00 0.00 1.96 0.00 0.00 3.16 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.63 1.79 7.81 93 L 7.92 3.93 0.00 1.83 1.88 0.95 0.86 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 94 F 8.24 3.97 0.00 3.34 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 95 I 8.04 3.73 2.19 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 1.84 0.77 1.05 0.00 0.00 96 C 8.10 2.76 0.00 2.25 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 97 N 7.80 4.12 0.00 2.72 2.55 0.00 0.00 7.06 7.68 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 98 C 7.78 4.09 0.00 3.20 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 99 D 7.88 3.88 0.00 2.78 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 0.00 100 R 8.10 3.74 0.00 1.70 1.79 0.00 3.03 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 101 T 7.81 3.77 4.12 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 1.16 0.00 0.00 102 A 7.57 3.55 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.95 3.40 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 0.00 104 M 7.75 3.98 0.00 1.95 2.11 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 2.56 2.49 0.00 105 C 8.05 4.41 0.00 3.09 3.16 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 0.00 106 F 8.35 4.30 0.00 3.00 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 0.00 107 A 7.76 4.17 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 0.00 108 K 7.69 4.28 0.00 1.91 1.88 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.44 7.81 109 A 7.10 4.78 1.37 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 0.00 0.00 110 P 0.00 4.34 0.00 2.10 2.03 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 111 Y 8.60 4.41 0.00 3.01 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 0.00 112 N 8.30 4.63 0.00 2.36 1.65 0.00 0.00 6.41 7.45 0.00 0.00 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 E 8.37 3.74 0.00 2.03 1.85 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 2.38 2.39 0.00 114 A 7.48 4.03 1.11 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 0.00 0.00 115 Y 7.23 4.45 0.00 1.94 1.87 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 0.00 116 N 7.70 4.70 0.00 3.01 2.82 0.00 0.00 7.03 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 0.00 117 H 9.56 4.84 0.00 3.08 3.34 0.00 5.80 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 7.93 4.31 0.00 3.04 3.08 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 0.00 0.00 0.00 0.00 119 N 7.50 4.28 0.00 2.56 2.17 0.00 0.00 7.14 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 0.00 120 R 8.13 3.98 0.00 1.83 1.91 0.00 3.15 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.80 0.00 121 Q 7.78 4.11 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.33 2.24 0.00 122 L 7.66 4.23 0.00 1.46 1.71 0.56 0.86 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 0.00 123 C 7.81 4.80 0.00 3.11 3.20 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 0.00 124 K 7.47 4.20 0.00 1.67 1.63 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.40 7.81