NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2656 8.3144 120.1354 58.4380 33.2759 173.8207 2 E 5.3503 8.2344 127.6134 54.4119 32.0804 177.0214 3 T 4.1679 8.1540 118.6075 61.3625 72.0377 174.8020 4 A 3.9889 8.5277 123.5327 55.3238 18.4481 179.9965 5 A 4.1502 7.9988 118.6389 55.2467 18.4635 179.5448 6 A 3.9873 8.1893 119.4514 55.1667 18.4639 179.7611 7 K 3.9949 8.3653 118.3471 59.5763 32.2480 178.7067 8 F 4.0861 8.3799 120.9456 61.4050 39.2943 176.9670 9 E 4.0369 8.4127 118.1620 59.4959 29.0657 179.3762 10 R 3.9128 8.0546 117.8250 59.3767 30.2215 178.0847 11 Q 4.0145 8.2422 117.0610 57.6068 29.2124 176.0767 12 H 4.8309 8.0625 113.9128 53.9838 31.1737 173.1011 13 M 4.7769 7.8656 118.6821 53.7902 34.0391 176.6978 14 D 4.8564 8.5792 120.9074 54.1485 42.6724 175.7643 15 S 4.5309 8.3386 115.0790 59.4662 63.8739 175.9515 16 S 4.2796 7.9837 116.2459 60.8086 62.7571 174.6541 17 T 4.6437 7.5174 108.4784 59.4640 70.6804 174.6181 18 S 4.1887 8.5477 117.8287 61.0592 63.6182 174.0988 19 A 4.0070 7.0370 119.6154 50.6202 21.3141 175.6839 20 A 3.4045 8.1384 123.8011 52.0468 17.8129 177.0590 21 S 4.5095 8.1771 116.6088 58.4819 64.2717 171.0909 22 S 4.2777 8.6947 128.2997 58.2393 62.3123 170.7881 23 S 4.4030 8.7744 118.1752 59.8397 62.7211 174.2296 24 N 4.7453 7.9418 118.2055 53.1177 38.2303 175.7909 25 Y 4.0610 8.0069 120.8954 61.6177 38.6587 177.6069 26 C 4.1168 8.4191 116.9223 59.9961 38.5757 175.7364 27 N 4.4050 8.2387 117.5601 56.5547 38.0532 177.3463 28 Q 3.8593 7.7515 118.9678 59.1929 28.9242 178.4913 29 M 3.6380 7.8590 120.0046 58.4449 31.7053 178.7401 30 M 4.0002 8.0392 119.1977 58.1805 32.0227 178.8346 31 K 3.9974 7.5077 120.6684 58.9555 32.2090 178.6669 32 S 4.0808 8.0048 112.6037 61.2853 62.2224 175.4384 33 R 4.3693 7.8018 117.9773 55.0997 30.2740 175.9265 34 N 4.1989 7.9703 114.5928 54.6946 36.7509 174.8226 35 L 4.5694 8.2256 115.7671 54.9916 42.3073 178.0367 36 T 5.7804 7.4519 106.5543 60.4046 69.9033 175.8172 37 K 4.2733 8.3487 123.3942 59.5736 32.4581 177.8548 38 D 4.5843 7.9553 117.1756 56.0971 41.7634 175.8170 39 R 3.1227 7.1018 112.7121 55.8725 31.6410 173.1343 40 C 5.0070 8.5214 116.1663 55.3407 40.5360 173.6996 41 K 4.1385 8.4875 127.1573 55.8117 32.1562 174.2378 42 P 4.5027 0.0000 0.0000 65.4760 31.6506 175.9149 43 V 5.0571 7.5266 117.1976 61.3216 34.7587 173.6353 44 N 4.7382 8.8895 123.8919 52.7906 42.9224 172.9128 45 T 4.7534 7.9130 121.6240 61.6221 71.6870 172.8384 46 F 4.8845 8.7861 124.3091 55.6292 42.0928 174.6091 47 V 4.3392 8.9047 123.3740 61.1675 33.1952 175.7571 48 H 5.6769 8.7153 129.1415 53.6940 26.1263 173.5426 49 E 4.7759 7.6833 118.1054 53.3903 34.6613 176.2939 50 S 4.3896 8.3735 114.9501 58.3314 64.9664 175.0237 51 L 4.0372 8.4790 123.9668 58.2514 41.8821 179.1369 52 A 4.0095 7.9621 120.4470 55.1406 18.1708 179.1570 53 D 4.3174 7.9477 116.5966 57.5530 41.2218 178.9346 54 V 3.8011 7.8099 118.4542 66.1061 31.6339 178.1329 55 Q 3.9260 8.5281 117.9730 58.7781 28.5175 178.5235 56 A 4.0964 8.2338 121.4634 54.4711 18.3170 179.6122 57 V 3.5821 7.7057 116.9543 65.7562 31.3280 176.9842 58 C 3.8588 7.8328 115.1574 58.1571 39.8998 174.1679 59 S 4.6852 7.5157 113.9886 57.9429 63.7551 174.9079 60 Q 4.5124 7.5324 122.2973 55.7060 27.8689 176.8814 61 K 4.0757 7.2985 128.1900 57.4223 33.0118 176.1656 62 N 4.4584 8.7416 127.6297 53.6638 39.6856 174.3922 63 V 4.5743 8.5296 118.4338 59.2345 36.7607 174.7755 64 A 4.1201 8.4002 125.3780 52.3456 19.1298 178.5795 65 C 4.7178 8.8930 119.7298 56.0128 41.2446 175.3645 66 K 3.8176 8.8090 121.7350 59.4740 31.6299 178.1580 67 N 4.5310 8.0140 113.4569 53.0378 37.6690 175.6809 68 G 3.9876 7.9546 108.1548 45.5660 0.0000 174.3733 69 Q 4.1925 8.7504 119.5161 56.2770 29.2112 176.6075 70 T 4.3762 8.3038 108.7823 61.7093 69.5058 174.2178 71 N 5.0109 7.7624 119.7675 53.7947 38.3132 175.0071 72 C 5.4509 7.4356 115.0461 56.7520 44.8118 173.0820 73 Y 5.1216 8.9565 118.7117 56.3785 41.8559 173.8734 74 Q 5.0967 8.9637 125.5146 54.0605 31.2798 174.8838 75 S 4.3343 8.6450 121.9448 58.6697 63.1814 174.3236 76 Y 4.3778 8.8926 121.2930 60.5893 37.9465 176.6246 77 S 4.8922 7.8674 114.0194 56.8884 65.0043 173.7353 78 T 4.2721 8.0846 112.4716 61.9861 69.8695 173.5733 79 M 5.0420 9.0671 121.6735 53.4682 37.0265 174.5526 80 S 5.0588 9.1866 116.9218 58.1462 63.6652 173.1330 81 I 5.1493 8.9094 119.9778 59.5686 41.9096 174.2480 82 T 5.0472 8.7206 118.3654 62.0788 72.1938 173.0018 83 D 4.9568 9.3905 127.2423 53.4216 43.1686 174.9469 84 C 5.5341 9.1471 120.3420 55.2609 38.2572 172.8790 85 R 5.3025 8.7095 124.3110 54.0308 32.6252 174.3203 86 E 4.0587 9.0244 128.4682 56.4125 30.4726 176.9202 87 T 4.2892 8.5030 117.4719 60.6383 70.3363 175.9530 88 G 3.6457 8.5160 110.3381 48.6163 0.0000 175.3174 89 S 4.2118 7.8952 112.4757 59.2951 63.4024 174.3113 90 S 4.0256 7.3191 115.8544 58.5533 62.6050 173.5402 91 K 4.4690 8.3768 126.1329 54.5579 35.0507 174.9830 92 Y 4.4212 8.8545 125.2156 57.7542 38.9173 174.5269 93 P 3.7382 0.0000 0.0000 63.6950 32.4534 176.6292 94 N 4.6603 7.5340 118.8689 52.3945 36.8242 174.1490 95 C 4.3442 7.9664 116.1041 56.8033 42.8820 173.4254 96 A 5.1501 8.4836 125.8167 50.3441 21.5332 174.5916 97 Y 5.1741 9.8924 119.0879 56.0299 42.4133 174.8452 98 K 4.5036 9.3525 123.8597 55.6963 34.0640 175.2431 99 T 5.0617 8.5810 124.1041 62.5822 70.2343 174.1785 100 T 4.5573 8.8626 122.9672 61.8201 71.7335 172.8514 101 Q 4.8857 8.6768 127.8094 55.2855 30.6246 174.1933 102 A 4.5068 8.4611 125.3650 51.5377 23.7021 174.8101 103 N 5.3558 8.7450 116.2289 51.8240 40.7570 174.3847 104 K 4.7062 8.7988 122.3613 54.8796 37.7752 175.3625 105 H 4.8258 9.2185 119.6178 55.8002 29.8172 175.1628 106 I 4.7759 8.5828 116.3740 59.6043 40.5247 174.5630 107 I 4.8645 8.3649 124.0795 59.7265 40.2148 175.0732 108 V 4.7630 8.6071 119.4149 59.3433 35.9702 174.3920 109 A 5.1548 8.9059 124.8923 50.9395 20.8570 175.6817 110 C 5.2500 8.5464 118.6562 55.2702 38.1539 173.0075 111 E 4.7151 8.6122 117.8432 56.6496 33.2042 175.4330 112 G 4.2168 9.4835 106.3870 45.0892 0.0000 171.8957 113 N 4.9776 8.1442 115.7770 50.5751 40.4387 172.0331 114 P 4.2896 0.0000 0.0000 62.9878 31.8084 175.7999 115 Y 4.8486 8.3011 121.4869 56.9472 38.7899 174.5311 116 V 4.4228 8.0098 119.0701 58.3079 36.5646 173.5069 117 P 4.4649 0.0000 0.0000 62.8721 31.2116 176.9843 118 V 4.5330 8.4579 114.9177 60.9852 34.1053 175.1024 119 H 4.9591 7.9254 119.3131 55.1165 33.3676 171.7779 120 F 4.6968 8.8241 128.1809 57.4194 39.5062 174.3969 121 D 4.5262 8.4321 126.9195 56.1219 42.0360 175.6069 122 A 4.6398 6.5734 117.3537 51.4903 22.6349 174.6009 123 S 5.1041 8.6990 112.5941 56.9483 66.3299 174.7756 124 V 4.1502 8.9147 114.9420 61.7806 32.7144 175.1401 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 K 8.31 4.27 0.00 1.77 1.85 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.39 7.81 2 E 8.23 5.35 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.38 0.00 3 T 8.15 4.17 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 1.22 0.00 0.00 4 A 8.53 3.99 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 5 A 8.00 4.15 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 6 A 8.19 3.99 1.43 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 0.00 0.00 7 K 8.37 3.99 0.00 1.96 2.05 0.00 1.66 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.45 7.81 8 F 8.38 4.09 0.00 3.21 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 9 E 8.41 4.04 0.00 2.33 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 2.50 2.67 0.00 10 R 8.05 3.91 0.00 1.80 2.09 0.00 3.25 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 8.24 4.01 0.00 1.63 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.48 0.00 0.00 0.00 0.00 0.00 2.20 2.37 0.00 12 H 8.06 4.83 0.00 1.85 2.64 0.00 5.60 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 13 M 7.87 4.78 0.00 1.97 2.17 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.66 0.00 14 D 8.58 4.86 0.00 2.83 2.60 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 15 S 8.34 4.53 0.00 3.94 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 16 S 7.98 4.28 0.00 4.08 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 17 T 7.52 4.64 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 1.21 0.00 0.00 18 S 8.55 4.19 0.00 3.97 4.01 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 0.00 0.00 0.00 19 A 7.04 4.01 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.14 3.40 0.57 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 21 S 8.18 4.51 0.00 3.77 3.71 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 22 S 8.69 4.28 0.00 4.22 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 23 S 8.77 4.40 0.00 4.01 4.01 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 0.00 0.00 0.00 24 N 7.94 4.75 0.00 2.90 3.11 0.00 0.00 5.82 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 25 Y 8.01 4.06 0.00 3.06 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 26 C 8.42 4.12 0.00 3.14 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 27 N 8.24 4.40 0.00 2.89 2.93 0.00 0.00 7.14 7.74 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 28 Q 7.75 3.86 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 29 M 7.86 3.64 0.00 0.72 1.14 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.74 0.00 30 M 8.04 4.00 0.00 1.65 1.85 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 2.39 0.00 31 K 7.51 4.00 0.00 1.94 1.90 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.31 7.81 32 S 8.00 4.08 0.00 3.89 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 33 R 7.80 4.37 0.00 1.88 2.05 0.00 3.67 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.05 0.00 34 N 7.97 4.20 0.00 2.86 2.90 0.00 0.00 6.82 7.43 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 35 L 8.23 4.57 0.00 1.78 1.63 0.79 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.45 5.78 4.44 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 1.42 0.00 0.00 37 K 8.35 4.27 0.00 1.80 1.96 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.57 7.81 38 D 7.96 4.58 0.00 2.61 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 39 R 7.10 3.12 0.00 1.60 1.65 0.00 2.86 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.46 0.00 40 C 8.52 5.01 0.00 2.98 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 41 K 8.49 4.14 0.00 1.86 1.77 0.00 1.78 0.00 0.00 1.61 0.00 0.00 3.14 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.42 7.81 42 P 0.00 4.50 0.00 2.14 2.13 0.00 3.62 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 43 V 7.53 5.06 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 0.79 0.00 0.00 0.97 0.00 0.00 44 N 8.89 4.74 0.00 2.67 2.29 0.00 0.00 6.87 6.76 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 45 T 7.91 4.75 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 0.84 0.00 0.00 46 F 8.79 4.88 0.00 3.00 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 47 V 8.90 4.34 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 1.06 0.00 0.00 1.03 0.00 0.00 48 H 8.72 5.68 0.00 3.12 3.44 0.00 5.64 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.68 4.78 0.00 1.95 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 2.26 2.28 0.00 50 S 8.37 4.39 0.00 4.07 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 51 L 8.48 4.04 0.00 1.83 1.74 1.01 1.16 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 52 A 7.96 4.01 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 53 D 7.95 4.32 0.00 2.87 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.81 3.80 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1.06 0.00 0.00 55 Q 8.53 3.93 0.00 2.29 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 56 A 8.23 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 57 V 7.71 3.58 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.98 0.00 0.00 58 C 7.83 3.86 0.00 2.90 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 59 S 7.52 4.69 0.00 3.97 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Q 7.53 4.51 0.00 1.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.00 0.00 0.00 0.00 0.00 0.00 2.48 2.43 0.00 61 K 7.30 4.08 0.00 1.64 1.66 0.00 1.71 0.00 0.00 1.55 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.44 7.81 62 N 8.74 4.46 0.00 2.81 2.66 0.00 0.00 7.00 7.71 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 63 V 8.53 4.57 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 0.66 0.00 0.00 0.82 0.00 0.00 64 A 8.40 4.12 1.19 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 0.00 0.00 0.00 0.00 0.00 65 C 8.89 4.72 0.00 3.12 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 66 K 8.81 3.82 0.00 1.75 1.88 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.54 7.81 67 N 8.01 4.53 0.00 2.79 2.91 0.00 0.00 6.31 7.00 0.00 0.00 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 G 7.95 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 0.00 0.00 0.00 69 Q 8.75 4.19 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 70 T 8.30 4.38 4.19 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 0.00 0.00 1.19 0.00 0.00 71 N 7.76 5.01 0.00 3.15 3.19 0.00 0.00 6.06 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 72 C 7.44 5.45 0.00 3.00 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 73 Y 8.96 5.12 0.00 2.79 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 74 Q 8.96 5.10 0.00 1.96 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.18 2.22 0.00 75 S 8.64 4.33 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 76 Y 8.89 4.38 0.00 3.07 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 77 S 7.87 4.89 0.00 3.92 3.83 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 78 T 8.08 4.27 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 1.00 0.00 0.00 79 M 9.07 5.04 0.00 1.94 2.00 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 2.54 2.49 0.00 80 S 9.19 5.06 0.00 3.93 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.91 5.15 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.67 0.98 0.00 0.00 82 T 8.72 5.05 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 1.30 0.00 0.00 83 D 9.39 4.96 0.00 2.57 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 84 C 9.15 5.53 0.00 2.89 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 85 R 8.71 5.30 0.00 1.96 1.81 0.00 3.12 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 86 E 9.02 4.06 0.00 1.55 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 2.19 2.09 0.00 87 T 8.50 4.29 4.21 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 1.20 0.00 0.00 88 G 8.52 3.65 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 0.00 0.00 0.00 89 S 7.90 4.21 0.00 3.97 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 90 S 7.32 4.03 0.00 3.86 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.38 4.47 0.00 1.75 1.66 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.62 1.35 7.81 92 Y 8.85 4.42 0.00 2.84 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 93 P 0.00 3.74 0.00 1.87 1.25 0.00 3.62 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 94 N 7.53 4.66 0.00 2.84 2.81 0.00 0.00 6.97 7.61 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 95 C 7.97 4.34 0.00 3.17 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.48 5.15 1.15 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 97 Y 9.89 5.17 0.00 2.79 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 98 K 9.35 4.50 0.00 1.83 1.85 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.45 7.81 99 T 8.58 5.06 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 1.33 0.00 0.00 100 T 8.86 4.56 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 0.00 101 Q 8.68 4.89 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.79 0.00 0.00 0.00 0.00 0.00 2.23 2.39 0.00 102 A 8.46 4.51 1.23 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 0.00 0.00 103 N 8.74 5.36 0.00 2.57 2.74 0.00 0.00 6.68 7.61 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 0.00 104 K 8.80 4.71 0.00 1.72 1.92 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.44 7.81 105 H 9.22 4.83 0.00 3.17 3.20 0.00 5.60 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.58 4.78 1.87 0.00 0.00 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 1.28 0.64 1.12 0.00 0.00 107 I 8.36 4.86 1.81 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.66 0.81 0.00 0.00 108 V 8.61 4.76 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 0.69 0.00 0.00 0.87 0.00 0.00 109 A 8.91 5.15 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 0.00 110 C 8.55 5.25 0.00 1.71 1.83 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 0.00 111 E 8.61 4.72 0.00 2.06 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 2.09 2.19 0.00 112 G 9.48 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 0.00 0.00 0.00 0.00 113 N 8.14 4.98 0.00 2.63 2.70 0.00 0.00 6.93 7.69 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 0.00 114 P 0.00 4.29 0.00 2.22 2.06 0.00 3.82 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 1.99 1.97 0.00 115 Y 8.30 4.85 0.00 2.81 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 0.00 116 V 8.01 4.42 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 0.73 0.00 0.00 0.89 0.00 0.00 117 P 0.00 4.46 0.00 0.49 0.92 0.00 3.30 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 118 V 8.46 4.53 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 0.63 0.00 0.00 0.89 0.00 0.00 119 H 7.93 4.96 0.00 3.28 3.13 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.82 4.70 0.00 2.59 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 0.00 121 D 8.43 4.53 0.00 2.56 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 0.00 122 A 6.57 4.64 1.17 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 0.00 123 S 8.70 5.10 0.00 3.95 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 0.00 124 V 8.91 4.15 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 0.70 0.00 0.00 0.99 0.00 0.00