NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4423 8.3349 115.4153 57.5733 64.2103 174.4401 3 L 3.8643 9.1468 117.1199 56.9454 41.3792 175.2124 4 L 4.7295 7.6726 118.5730 51.9871 44.4041 174.8091 5 P 4.5242 0.0000 0.0000 62.7183 32.0730 175.8755 6 V 4.6525 8.0351 118.9910 60.2118 34.2536 173.4213 7 P 4.7166 0.0000 0.0000 63.3698 32.0710 174.7470 8 Y 4.6960 9.3523 125.6642 56.2094 40.8621 174.3258 9 T 4.8333 7.4996 122.3167 61.5673 71.8966 172.9624 10 E 4.5003 8.7219 125.9923 53.9905 33.2614 174.4139 11 A 4.6124 8.6914 128.3153 52.4097 19.2705 176.2313 12 A 5.4410 8.8806 121.5325 51.7610 23.4022 175.6157 13 S 4.8007 9.0039 114.6294 56.7131 66.3241 173.9989 14 L 4.8619 8.2596 123.3905 53.2834 45.2206 175.4878 15 S 4.5266 8.3170 114.2324 57.3586 66.0510 173.9364 16 T 4.1000 8.2770 117.5257 65.3717 68.2559 174.6390 17 G 4.0649 9.0148 115.4369 45.3173 0.0000 174.2084 18 S 4.3781 8.1298 116.0859 58.9153 64.2816 173.5883 19 T 5.0541 8.1986 117.9428 61.8621 72.9278 172.7754 20 V 4.5746 8.8240 125.7457 61.4213 34.1042 174.1807 21 T 5.0919 8.7364 125.1496 61.8189 71.2850 173.3596 22 I 5.1341 9.1466 126.9661 59.3330 40.9986 174.2625 23 K 4.8740 8.9032 128.3839 54.9523 35.1735 175.3860 24 G 4.2338 7.4701 112.3887 46.2891 0.0000 171.4936 25 R 4.9102 8.1754 118.7145 54.0761 33.8478 173.9278 26 P 4.6987 0.0000 0.0000 62.8176 31.4849 176.6311 27 L 4.2717 8.8065 123.3862 57.0237 42.2845 177.2093 28 V 4.5712 7.5267 109.8285 58.8752 35.9829 174.6132 29 C 4.5460 8.3329 115.1815 58.1501 30.1795 174.8261 30 F 4.3253 9.2987 120.5450 60.6795 38.7684 177.5644 31 L 3.9737 8.1806 121.3284 58.1225 41.7711 177.1220 32 N 4.6039 8.2466 113.2823 52.4304 39.0576 174.8519 33 E 3.5623 8.1662 117.8581 56.8257 27.3815 172.4792 34 P 4.7207 0.0000 0.0000 63.0254 33.8007 176.5555 35 Y 4.8400 9.2410 117.8920 56.1147 42.0184 174.4851 36 L 4.9517 8.1500 121.8088 53.5048 45.8370 174.8388 37 Q 4.7105 8.9425 126.3801 54.1875 32.8100 173.6832 38 V 4.9776 8.9337 125.7694 61.3409 34.7535 173.6733 39 D 5.2581 9.4014 127.8649 52.5770 44.2595 175.0672 40 F 5.2319 9.1265 123.0798 56.8116 40.2614 174.9839 41 H 5.3863 9.3886 122.3981 54.8442 30.4036 176.6091 42 T 4.5628 8.4286 110.5228 62.7739 69.3364 174.1765 43 E 4.7930 7.8817 120.3919 54.4783 33.6404 175.9442 44 M 3.9300 8.5338 118.8909 56.9803 32.4491 177.0615 45 K 4.3569 7.3101 119.3345 55.1179 34.0528 177.8467 46 E 3.6935 8.4586 119.2928 58.9385 29.6427 177.5009 47 E 4.1619 7.9043 117.1311 56.7293 29.9206 176.4664 48 S 4.3349 7.5556 114.2648 57.4939 64.0667 173.5550 49 D 4.4688 8.2978 120.0017 54.6772 42.1350 175.7889 50 I 4.6322 8.1726 121.6964 59.6487 39.1534 176.7847 51 V 3.8036 8.9834 129.0095 65.5177 32.3622 176.2625 52 F 4.7491 8.1091 123.0929 57.0096 42.5429 172.4510 53 H 5.0788 8.7456 127.0865 53.5006 32.0163 172.9166 54 F 4.3861 8.4739 127.8450 56.2319 42.1850 173.0738 55 Q 4.4284 8.0858 128.1315 53.9478 31.9243 173.9298 56 V 3.7607 8.0213 126.9014 60.9835 33.8014 173.9173 57 C 3.7916 8.2316 129.3505 56.7967 32.2102 172.4297 58 F 3.4842 7.3837 124.6353 59.0247 38.6986 176.7233 59 G 4.0271 8.7230 113.5539 45.4240 0.0000 172.8463 60 R 4.3546 7.1317 115.7696 56.1604 32.9444 176.4933 61 R 4.6145 6.7736 110.8584 55.6475 33.3282 172.7353 62 V 4.4034 8.7057 118.7302 60.8361 34.7480 174.1814 63 V 4.7501 8.3414 127.0669 61.2965 34.4266 174.0883 64 M 5.4549 8.6492 126.2566 52.9607 36.3003 174.3800 65 N 4.8522 7.7628 118.0942 53.7751 43.0751 172.6139 66 S 5.1644 8.6618 111.8929 56.8021 67.2365 173.0171 67 R 4.5470 8.7835 122.0899 54.7351 32.0652 174.0050 68 E 4.7131 9.1429 127.0172 55.0839 32.4729 176.3443 69 Y 3.2027 9.4755 122.2334 59.0638 35.6091 171.8019 70 G 3.7860 8.3570 105.6338 45.3374 0.0000 173.7659 71 A 4.6996 7.6744 123.1465 49.5370 21.2893 175.8841 72 W 4.6720 8.6324 122.5502 56.8716 29.6075 176.8980 73 K 4.6788 8.9035 126.7597 56.1557 34.1339 176.3095 74 Q 4.1920 8.8058 127.7795 57.0374 29.4692 176.7645 75 Q 4.5031 8.8136 128.5634 56.0180 30.2964 174.9003 76 V 4.5341 9.0817 126.0001 61.0562 34.1883 173.6977 77 E 5.1802 8.8849 128.0033 54.4524 32.2413 174.6926 78 S 4.8559 9.1502 120.3084 56.7125 65.9359 174.3571 79 K 4.3960 8.7806 123.4218 56.0483 32.8421 176.3711 80 N 4.4311 8.0047 119.1134 54.1255 39.1968 174.8170 81 M 4.9615 8.1883 124.2388 53.5482 32.4845 172.3957 82 P 4.4237 0.0000 0.0000 63.8892 32.3101 177.3415 83 F 4.5369 8.1816 116.9396 57.6548 39.6951 174.2524 84 Q 4.6138 8.7401 123.0121 53.6469 30.5444 174.7899 85 D 3.3700 8.0259 122.0266 55.1451 41.3799 176.4016 86 G 3.8143 8.3397 113.1363 45.9898 0.0000 172.9038 87 Q 4.6398 7.5296 117.7849 53.5902 31.0104 175.0860 88 E 4.3969 8.4981 121.5311 56.1581 30.7665 175.6241 89 F 5.2635 8.6716 120.0956 54.9864 42.2002 173.3639 90 E 5.0711 9.0032 119.9835 54.5279 32.5202 173.8807 91 L 5.3331 9.5074 130.0300 53.4798 44.8588 174.9741 92 S 5.2865 9.0900 122.3874 56.7694 66.1403 173.0709 93 I 4.9425 8.9853 125.8938 59.8307 39.5796 174.7002 94 S 5.0344 9.2792 124.4926 57.1888 65.2047 174.0445 95 V 4.3169 8.6829 124.7544 61.6801 31.9785 175.5534 96 L 4.7340 8.6541 129.2525 52.4852 43.3540 176.4922 97 P 4.2090 0.0000 0.0000 65.3857 31.4293 177.6109 98 D 4.6270 7.8081 116.3305 54.0847 40.6301 175.3162 99 K 4.1089 7.1152 117.6979 56.4317 36.6833 173.4976 100 Y 4.9130 8.3668 118.0352 56.7889 39.8617 174.8553 101 Q 5.0051 9.0410 124.7452 54.2665 32.0869 174.0526 102 V 4.8503 9.1366 126.8511 61.5999 33.8069 173.9407 103 M 5.0095 9.1953 128.3316 53.6190 34.8264 175.2356 104 V 4.5150 8.4867 123.1035 61.1527 34.0555 175.3565 105 N 4.3067 10.1360 128.0179 54.5695 36.4068 175.6940 106 G 3.8978 8.4227 103.6376 45.5380 0.0000 173.2299 107 Q 4.4906 7.6400 121.5844 53.5132 30.7276 174.7028 108 S 4.3977 8.6129 120.2042 58.8302 62.9146 173.4736 109 S 4.3349 8.8172 122.0332 59.1838 65.7338 173.8954 110 Y 5.1511 7.6047 114.8945 56.8192 42.4116 174.2491 111 T 5.2678 8.6243 110.5656 60.4252 72.6991 173.3072 112 F 4.8033 8.8799 125.0275 56.9876 42.6057 173.3247 113 D 4.7132 8.3987 126.7104 54.2846 41.4522 176.4029 114 H 4.3665 8.3827 120.5228 56.4313 29.2075 175.6247 115 R 4.4767 8.8837 122.3497 56.8760 31.5217 176.7005 116 I 4.7751 7.5350 116.1988 58.5228 41.0362 175.1847 117 K 4.0364 8.5224 122.4814 56.4431 33.1102 176.3484 118 P 4.3994 0.0000 0.0000 65.6269 31.4475 178.2438 119 E 4.2222 8.1486 116.0205 58.4186 29.5470 177.6193 120 A 4.1914 8.1693 121.8612 53.6084 18.9304 177.5938 121 V 4.0665 7.6737 116.8150 63.0048 32.0128 175.6570 122 K 4.8534 9.1277 124.6507 55.4203 34.9245 175.3641 123 M 5.2203 7.8448 118.6080 54.1807 36.0866 173.1953 124 V 5.1069 8.8619 124.0751 61.1580 35.0492 173.8100 125 Q 5.1495 9.3847 128.7006 54.2734 32.0800 173.9255 126 V 5.2036 9.1738 126.8967 61.2431 34.3215 174.4258 127 W 5.0020 9.3513 124.6821 56.4001 31.2733 173.6556 128 R 4.1565 9.0963 115.8107 56.1406 27.2778 176.4470 129 D 4.9875 8.2732 115.7612 54.4856 38.8901 175.4461 130 I 5.3403 7.4536 111.3476 59.3841 42.0410 176.1469 131 S 4.8915 8.9998 117.6833 56.5947 65.7110 172.5883 132 L 5.0517 8.4526 124.1534 53.7898 43.7084 176.3370 133 T 4.3471 8.7108 116.3980 62.3825 70.7700 174.9337 134 K 4.6594 7.6800 122.2795 54.8753 36.0124 174.6083 135 F 5.1207 8.6202 128.3163 56.7068 42.3681 172.9621 136 N 4.9754 8.4772 123.9699 52.0403 42.7909 172.8583 137 V 4.5361 8.1547 124.9007 60.8870 33.9976 174.9478 138 S 4.2103 8.7754 125.0396 58.2098 63.2744 174.0345 139 Y 4.8255 8.3539 124.7908 57.7919 38.5430 178.2698 140 L 4.1924 8.0264 121.9368 56.7636 42.4135 177.9437 141 K 4.3279 7.8873 118.8745 56.1625 33.2482 177.5750 142 R 4.2330 8.3448 117.6165 56.5845 29.4677 177.2972 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 S 8.33 4.44 0.00 3.99 3.12 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 3 L 9.15 3.86 0.00 1.86 1.79 0.98 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 4 L 7.67 4.73 0.00 1.41 1.34 0.46 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.52 0.00 2.25 2.12 0.00 3.90 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 2.23 2.06 0.00 6 V 8.04 4.65 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 1.05 0.00 0.00 1.07 0.00 0.00 7 P 0.00 4.72 0.00 1.90 1.90 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.23 0.00 8 Y 9.35 4.70 0.00 3.22 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 9 T 7.50 4.83 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 1.04 0.00 0.00 10 E 8.72 4.50 0.00 1.59 1.59 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 2.36 2.30 0.00 11 A 8.69 4.61 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 12 A 8.88 5.44 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 13 S 9.00 4.80 0.00 4.06 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 14 L 8.26 4.86 0.00 1.77 1.54 0.67 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.32 4.53 0.00 4.00 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 16 T 8.28 4.10 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 1.24 0.00 0.00 17 G 9.01 4.06 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 0.00 0.00 0.00 18 S 8.13 4.38 0.00 3.83 3.68 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 19 T 8.20 5.05 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 1.20 0.00 0.00 20 V 8.82 4.57 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 0.87 0.00 0.00 0.82 0.00 0.00 21 T 8.74 5.09 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 1.21 0.00 0.00 22 I 9.15 5.13 2.11 0.00 0.00 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 1.49 0.76 1.25 0.00 0.00 23 K 8.90 4.87 0.00 1.77 1.57 0.00 1.64 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.49 7.81 24 G 7.47 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 0.00 0.00 0.00 25 R 8.18 4.91 0.00 1.75 1.65 0.00 3.06 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.74 0.00 26 P 0.00 4.70 0.00 1.87 1.36 0.00 3.73 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.44 0.00 27 L 8.81 4.27 0.00 1.55 1.75 0.94 1.16 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 28 V 7.53 4.57 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 0.78 0.00 0.00 0.96 0.00 0.00 29 C 8.33 4.55 0.00 3.11 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 30 F 9.30 4.33 0.00 3.20 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 31 L 8.18 3.97 0.00 1.62 1.75 0.94 0.97 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 32 N 8.25 4.60 0.00 2.91 2.84 0.00 0.00 7.16 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 33 E 8.17 3.56 0.00 1.95 1.68 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 2.13 2.32 0.00 34 P 0.00 4.72 0.00 2.18 2.19 0.00 3.51 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.18 0.00 35 Y 9.24 4.84 0.00 2.73 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 36 L 8.15 4.95 0.00 1.69 0.70 1.09 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 8.94 4.71 0.00 1.46 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.52 0.00 0.00 0.00 0.00 0.00 2.39 2.17 0.00 38 V 8.93 4.98 2.09 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 1.15 0.00 0.00 1.12 0.00 0.00 39 D 9.40 5.26 0.00 2.81 2.52 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 40 F 9.13 5.23 0.00 2.96 3.01 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 41 H 9.39 5.39 0.00 3.07 3.31 0.00 5.61 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 42 T 8.43 4.56 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 43 E 7.88 4.79 0.00 1.92 1.80 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 2.25 2.21 0.00 44 M 8.53 3.93 0.00 1.95 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.44 0.00 45 K 7.31 4.36 0.00 1.87 1.85 0.00 1.27 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.41 7.81 46 E 8.46 3.69 0.00 1.85 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 2.12 2.18 0.00 47 E 7.90 4.16 0.00 1.90 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 2.24 2.28 0.00 48 S 7.56 4.33 0.00 3.96 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 49 D 8.30 4.47 0.00 2.48 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 50 I 8.17 4.63 1.68 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 0.70 0.62 0.96 0.00 0.00 51 V 8.98 3.80 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 1.06 0.00 0.00 1.06 0.00 0.00 52 F 8.11 4.75 0.00 2.84 2.27 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 53 H 8.75 5.08 0.00 3.40 3.28 0.00 5.82 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 54 F 8.47 4.39 0.00 1.88 2.39 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 55 Q 8.09 4.43 0.00 1.58 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.03 1.92 0.00 56 V 8.02 3.76 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 0.00 0.00 -0.47 0.00 0.00 0.04 0.00 0.00 57 C 8.23 3.79 0.00 2.38 2.36 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 58 F 7.38 3.48 0.00 2.25 1.45 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 0.00 0.00 0.00 0.00 59 G 8.72 4.03 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 0.00 0.00 0.00 60 R 7.13 4.35 0.00 1.64 1.70 0.00 3.20 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.48 0.00 61 R 6.77 4.61 0.00 1.89 1.92 0.00 2.92 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.44 0.00 62 V 8.71 4.40 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 0.09 0.00 0.00 0.55 0.00 0.00 63 V 8.34 4.75 1.82 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 0.87 0.00 0.00 0.78 0.00 0.00 64 M 8.65 5.45 0.00 1.66 2.02 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.26 0.00 65 N 7.76 4.85 0.00 2.79 2.91 0.00 0.00 6.56 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.66 5.16 0.00 4.14 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.78 4.55 0.00 0.67 1.21 0.00 2.37 0.00 0.00 2.25 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.68 0.00 68 E 9.14 4.71 0.00 1.96 1.91 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 2.25 2.29 0.00 69 Y 9.48 3.20 0.00 3.17 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 70 G 8.36 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 0.00 0.00 0.00 71 A 7.67 4.70 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 72 W 8.63 4.67 0.00 3.21 3.12 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 73 K 8.90 4.68 0.00 1.92 1.78 0.00 1.86 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.68 1.77 7.81 74 Q 8.81 4.19 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.44 6.96 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 75 Q 8.81 4.50 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.46 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 76 V 9.08 4.53 2.34 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 1.08 0.00 0.00 1.15 0.00 0.00 77 E 8.88 5.18 0.00 1.95 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 2.13 2.19 0.00 78 S 9.15 4.86 0.00 4.04 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 79 K 8.78 4.40 0.00 1.80 1.84 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.35 7.81 80 N 8.00 4.43 0.00 2.71 2.81 0.00 0.00 6.79 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 81 M 8.19 4.96 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.73 0.00 82 P 0.00 4.42 0.00 1.77 2.12 0.00 3.68 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 1.73 1.90 0.00 83 F 8.18 4.54 0.00 3.42 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 84 Q 8.74 4.61 0.00 2.11 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.05 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 85 D 8.03 3.37 0.00 1.85 2.18 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.34 3.81 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 0.00 0.00 0.00 87 Q 7.53 4.64 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.83 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 88 E 8.50 4.40 0.00 1.92 1.81 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 2.19 2.33 0.00 89 F 8.67 5.26 0.00 3.41 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 90 E 9.00 5.07 0.00 2.09 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 2.31 0.00 91 L 9.51 5.33 0.00 2.14 1.91 1.15 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 92 S 9.09 5.29 0.00 3.80 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 8.99 4.94 2.08 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 1.14 0.83 1.03 0.00 0.00 94 S 9.28 5.03 0.00 3.76 3.78 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 95 V 8.68 4.32 2.24 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 0.96 0.00 0.00 1.17 0.00 0.00 96 L 8.65 4.73 0.00 1.81 1.54 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.21 0.00 2.02 2.10 0.00 3.64 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 98 D 7.81 4.63 0.00 2.77 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 99 K 7.12 4.11 0.00 1.63 1.97 0.00 1.28 0.00 0.00 1.60 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.20 1.32 7.81 100 Y 8.37 4.91 0.00 2.52 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Q 9.04 5.01 0.00 2.11 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 102 V 9.14 4.85 2.43 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 0.92 0.00 0.00 0.95 0.00 0.00 103 M 9.20 5.01 0.00 1.91 1.94 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.61 0.00 104 V 8.49 4.51 1.80 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 0.36 0.00 0.00 0.70 0.00 0.00 105 N 10.14 4.31 0.00 2.83 2.88 0.00 0.00 7.12 7.60 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 0.00 106 G 8.42 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 0.00 107 Q 7.64 4.49 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.93 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 108 S 8.61 4.40 0.00 3.84 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.82 4.33 0.00 3.13 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 0.00 110 Y 7.60 5.15 0.00 3.02 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 0.00 111 T 8.62 5.27 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 0.00 112 F 8.88 4.80 0.00 3.33 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 0.00 113 D 8.40 4.71 0.00 2.36 2.45 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 0.00 0.00 0.00 0.00 114 H 8.38 4.37 0.00 3.12 3.35 0.00 5.63 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 8.88 4.48 0.00 2.00 2.08 0.00 3.51 0.00 0.00 3.38 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 116 I 7.54 4.78 2.01 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.72 0.98 0.00 0.00 117 K 8.52 4.04 0.00 2.14 1.95 0.00 1.52 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.50 7.81 118 P 0.00 4.40 0.00 2.17 2.19 0.00 3.48 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.62 0.00 119 E 8.15 4.22 0.00 1.95 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 2.32 2.38 0.00 120 A 8.17 4.19 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.67 4.07 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 0.75 0.00 0.00 1.16 0.00 0.00 122 K 9.13 4.85 0.00 1.70 1.78 0.00 1.97 0.00 0.00 1.67 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.28 7.81 123 M 7.84 5.22 0.00 2.18 1.82 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 124 V 8.86 5.11 2.35 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 1.40 0.00 0.00 0.75 0.00 0.00 125 Q 9.38 5.15 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.52 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 126 V 9.17 5.20 2.35 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 1.15 0.00 0.00 1.29 0.00 0.00 127 W 9.35 5.00 0.00 3.54 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 0.00 128 R 9.10 4.16 0.00 1.89 2.10 0.00 2.78 0.00 0.00 2.31 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.92 0.00 129 D 8.27 4.99 0.00 2.72 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 0.00 130 I 7.45 5.34 2.15 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.80 1.26 0.00 0.00 131 S 9.00 4.89 0.00 3.96 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 0.00 132 L 8.45 5.05 0.00 1.80 1.52 1.09 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 133 T 8.71 4.35 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 1.16 0.00 0.00 134 K 7.68 4.66 0.00 1.76 1.61 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.77 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.38 7.81 135 F 8.62 5.12 0.00 2.80 2.73 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 0.00 136 N 8.48 4.98 0.00 2.73 2.45 0.00 0.00 6.18 7.27 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 0.00 137 V 8.15 4.54 1.75 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 0.24 0.00 0.00 0.86 0.00 0.00 138 S 8.78 4.21 0.00 3.74 3.74 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 0.00 139 Y 8.35 4.83 0.00 3.03 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 0.00 140 L 8.03 4.19 0.00 1.63 1.74 0.96 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 141 K 7.89 4.33 0.00 1.75 1.74 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.43 7.81 142 R 8.34 4.23 0.00 1.83 1.69 0.00 3.30 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.18 0.00