NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3823 8.2893 120.3493 55.5318 32.0789 174.0599 2 N 4.4857 8.0533 121.2920 50.5133 37.8683 171.2158 3 E 3.9790 9.3301 125.3755 57.0069 29.2760 178.3291 4 L 4.4215 8.1390 124.5714 53.3391 40.6555 175.9556 5 E 4.5214 8.0166 123.2668 53.5587 32.0156 175.8456 6 G 3.7886 8.1542 112.7236 45.2712 0.0000 172.1591 7 Y 4.7362 8.9123 117.2308 56.0966 40.1774 176.8350 8 V 4.0891 8.5684 123.5706 63.3388 32.5437 177.5023 9 T 4.2203 8.1583 117.3054 66.0455 68.8627 174.9418 10 K 4.4031 7.9507 120.1494 56.5886 32.5503 177.2192 11 A 4.2860 8.1674 123.7281 53.5073 19.1005 182.1299 12 Q 3.4253 7.7377 111.6206 57.9846 31.6179 180.0967 13 S 4.0991 8.0066 110.7839 59.9473 63.1684 174.2865 14 F 4.2522 8.6229 119.8916 56.4508 39.9123 174.5128 15 R 4.5712 8.3608 121.6534 54.7186 32.1834 174.3284 16 F 5.6680 8.7375 123.0694 55.7938 43.8754 173.5636 17 A 4.7211 8.5106 120.7544 50.5414 22.5367 175.2169 18 I 4.8278 8.8018 122.9488 59.4616 40.3543 174.9953 19 V 4.6107 8.6929 125.5746 61.1906 34.4255 174.6010 20 V 5.3584 8.7981 120.6271 58.3686 35.2744 174.6617 21 A 5.5779 8.4541 125.5924 50.5682 19.6722 177.8085 22 R 4.2457 8.9532 121.5600 58.8737 30.7091 176.7202 23 F 4.0735 8.2880 119.8156 59.8275 39.8114 174.1967 24 N 4.3357 8.4500 123.2246 54.4073 36.2131 176.0296 25 E 4.5041 8.0421 121.6918 59.3216 29.3812 177.6794 26 F 3.9348 8.3642 118.7298 60.9894 39.4071 176.4496 27 V 4.1036 8.4938 117.2396 65.1065 32.0101 177.5540 28 T 3.8666 8.0140 109.0837 65.1238 68.2600 175.3263 29 R 4.0540 8.4432 122.0870 59.3316 30.0160 178.1736 30 R 3.8136 7.9688 116.7946 59.3109 30.1416 178.1707 31 L 3.8288 8.2005 120.2148 58.6349 41.9729 178.6580 32 M 3.8638 8.6106 117.8587 58.8599 32.1594 177.6680 33 E 4.0873 8.7000 119.0987 59.6049 29.5561 179.9065 34 G 3.4838 8.4584 105.4678 47.6863 0.0000 175.3191 35 A 3.6563 7.8096 123.9972 54.8601 18.3598 178.8466 36 L 4.0647 8.2856 118.6978 58.6646 41.9758 178.3070 37 D 4.3896 8.5755 117.6830 58.1403 41.1195 178.7993 38 T 3.8643 8.0390 116.0193 66.9322 68.1881 176.0667 39 F 4.3254 7.5704 118.1058 60.7676 39.2880 177.4500 40 K 4.1854 8.1518 117.1891 59.6787 31.7682 179.0970 41 K 3.8500 8.5725 118.6433 59.2671 32.5499 176.8581 42 Y 4.2775 8.6794 117.5942 58.4772 38.5158 176.1175 43 S 3.8479 8.1869 111.2562 58.8537 63.5753 172.9033 44 V 3.9563 7.8882 120.4524 62.1256 31.6810 175.7818 45 N 4.7122 8.3051 120.6428 53.7132 40.5399 174.0587 46 E 4.5007 9.0473 125.9427 56.4225 30.7998 174.5993 47 D 4.2919 8.8399 114.1273 59.7228 40.1191 173.9488 48 I 3.5747 6.4936 109.2513 58.4650 39.4730 174.5242 49 D 4.6575 8.7571 124.3834 54.0374 42.2592 175.4217 50 V 4.6469 8.3555 116.2377 59.5577 33.9974 175.0242 51 V 4.2975 8.8200 126.5640 60.9275 33.4120 174.3591 52 W 5.2358 8.8607 128.0442 55.8566 30.4085 176.1628 53 V 4.7071 9.1839 117.9835 58.8871 34.8626 174.7913 54 P 4.3380 0.0000 0.0000 65.5297 31.9068 176.3772 55 G 4.5224 8.1904 108.7219 42.3509 0.0000 173.1301 56 A 3.9138 8.6775 122.9538 55.4238 18.4423 179.4258 57 Y 3.9382 8.3406 115.9808 61.1836 38.7176 178.1478 58 E 4.1365 8.6571 119.3613 59.5175 29.5388 179.3835 59 L 3.9729 7.7793 118.9390 58.6750 41.7370 179.0491 60 G 3.6605 7.8631 100.8106 49.3993 0.0000 175.5978 61 V 3.6706 7.7569 111.9587 63.9020 32.1723 178.5590 62 T 3.8328 7.7763 114.6239 66.6659 68.2849 176.2545 63 A 3.8866 8.6600 122.5686 55.6633 18.4239 179.4157 64 Q 3.8177 8.4518 118.1128 59.9799 29.2378 178.7776 65 A 4.0104 8.8023 122.1659 54.6205 18.0754 179.1213 66 L 4.1317 8.2094 117.8349 57.8218 42.3646 180.2142 67 G 3.8219 8.8735 105.5971 47.9816 0.0000 176.0474 68 K 4.1807 8.1100 120.1495 58.3093 32.3567 178.9953 69 S 4.3454 8.3952 114.2622 58.7171 62.6771 175.2666 70 G 3.9393 7.9540 109.4978 46.2652 0.0000 174.7752 71 K 3.8030 7.8183 119.3184 58.1087 32.2185 176.8617 72 Y 4.7783 7.4187 114.2243 56.5247 40.4548 174.9385 73 H 4.8028 9.1357 118.4380 57.5887 30.0262 175.8438 74 A 4.9360 7.8767 118.1515 50.7344 22.7196 175.0889 75 I 4.8302 8.8440 115.9576 58.9151 40.6927 174.6946 76 V 4.6433 8.8479 125.7263 60.0915 33.8792 174.1135 77 C 5.1391 9.0912 122.9042 57.8728 30.6388 172.8375 78 L 5.5358 8.1605 123.4856 52.1504 45.0525 175.7991 79 G 4.2778 8.0525 107.3232 46.3838 0.0000 171.9120 80 A 5.3008 8.5464 121.4315 50.5653 22.1406 176.2511 81 V 4.2767 9.2359 123.1700 59.9092 33.6148 175.2442 82 V 4.3197 8.4671 119.4839 60.6297 32.6041 177.6189 83 K 3.5772 8.5591 127.2387 56.7040 29.3427 177.0403 84 G 3.7865 8.5707 113.4961 47.3746 0.0000 171.5558 85 D 4.6275 7.8112 117.0866 54.6530 43.7872 177.6758 86 T 4.2700 8.4742 115.1046 61.3354 70.7759 176.0372 87 S 5.0045 8.5399 116.8716 60.1172 62.6312 175.2200 88 H 3.8873 7.9238 122.4698 60.0720 29.4325 175.3553 89 Y 4.1726 8.1547 120.5720 61.4068 38.4804 177.6986 90 D 4.1943 8.5143 118.2268 58.0425 41.0309 178.6673 91 A 3.8356 8.2915 120.0892 55.9151 18.3173 179.4481 92 V 3.6087 8.3958 115.6632 65.9771 31.6288 178.3396 93 V 3.4868 8.0768 117.9420 66.4006 31.2161 177.8165 94 N 4.2362 8.7699 116.1599 56.3766 38.3663 177.2407 95 S 3.9468 8.1757 116.1069 62.0799 62.9833 176.3983 96 A 3.9260 8.6272 123.7989 55.3241 17.9808 179.1451 97 S 4.2654 8.7641 110.5343 61.7594 62.5019 176.5033 98 S 4.1071 8.9172 116.3790 61.6017 62.0851 176.1855 99 G 3.6443 8.5134 108.4230 48.1735 0.0000 175.3918 100 V 3.6742 7.9273 121.1733 65.9073 31.4469 177.2786 101 L 3.9425 8.2533 120.0416 57.5065 41.7544 178.7809 102 S 4.0709 8.8112 114.7509 62.0057 63.0774 176.5659 103 A 4.1300 8.6126 123.3344 55.3477 17.9843 179.5124 104 G 4.2931 8.2749 103.0592 47.8435 0.0000 175.4201 105 L 4.0273 7.8309 120.1948 57.5839 41.7988 179.0557 106 N 4.5042 8.6697 115.7297 56.4586 38.6428 177.4050 107 S 4.3821 8.7281 114.4651 58.9942 63.3630 175.3977 108 G 3.9705 8.0994 109.4771 45.6453 0.0000 172.8390 109 V 4.5324 7.7886 120.1943 59.8576 34.2530 173.2079 110 P 4.5270 0.0000 0.0000 63.3278 32.3154 174.7690 111 C 5.2177 8.5856 122.2174 57.8753 30.6827 173.8177 112 V 3.7369 8.9062 125.8585 62.5624 32.3084 175.3820 113 F 4.5069 8.9967 131.6163 56.4057 37.9069 175.5106 114 G 4.1918 8.7092 118.3533 44.0838 0.0000 170.6894 115 V 4.8503 6.3828 116.9278 59.6000 34.4844 177.3033 116 L 4.4250 8.9888 125.7459 54.1941 42.9396 177.1807 117 T 5.3727 7.9532 112.3898 60.4330 68.3364 173.2465 118 C 4.2849 8.2083 119.2492 60.5214 30.1435 174.4251 119 D 4.5147 8.9919 120.1385 56.0190 39.5564 176.7483 120 N 4.7204 9.6399 116.4532 51.9267 39.4374 175.8247 121 M 3.9786 8.8345 119.6732 59.1996 32.1230 177.8028 122 D 4.3676 8.2262 117.2776 57.7757 41.0187 178.1220 123 Q 3.9840 8.7384 116.8037 59.0253 29.0382 178.6604 124 A 4.1659 7.6939 120.3698 55.5543 18.3454 179.4335 125 I 3.7692 8.0610 118.2415 65.1758 37.1992 178.3053 126 N 4.4230 8.1755 116.8449 56.1709 38.3934 177.5189 127 R 4.0367 8.6190 119.2511 57.5596 30.8528 176.8125 128 A 4.4554 7.5629 123.6685 51.5200 18.3318 177.5589 129 G 3.9250 9.0324 106.3249 45.8527 0.0000 174.1285 130 G 4.1828 7.8372 111.1781 44.2167 0.0000 175.5040 131 K 4.1521 8.3275 120.2063 58.1560 32.6182 177.2921 132 A 4.4689 7.9843 121.5520 51.7950 20.0236 178.5444 133 G 3.7295 8.7798 105.0740 45.3386 0.0000 172.9322 134 N 5.7535 8.0579 119.2128 50.0732 41.4587 175.5642 135 K 4.1686 8.1737 131.2879 59.0203 32.3407 177.9355 136 G 3.7226 8.2420 104.8560 48.1409 0.0000 174.8057 137 A 3.7725 8.4649 123.2827 54.5856 18.1711 179.2725 138 E 3.7337 8.0170 116.7346 59.8453 29.3207 179.8561 139 S 4.0020 8.5191 114.8411 61.5069 62.8149 176.5022 140 A 3.4393 7.5558 123.0869 54.8858 17.9269 179.0421 141 L 3.3572 7.4415 118.5580 58.6660 42.0182 179.4187 142 T 3.6786 7.9877 115.3312 66.4530 68.2913 176.0794 143 A 3.9029 8.0797 122.9473 55.9042 18.2489 179.0959 144 I 3.6493 7.6309 117.7520 64.6256 37.1238 177.7364 145 E 3.8390 8.4365 119.4103 59.9613 29.4543 179.4511 146 M 3.8351 8.4368 118.2517 58.3795 31.7962 178.1694 147 A 3.8517 7.8358 119.5800 55.3536 18.7992 178.9219 148 S 4.2355 7.9985 111.0811 61.6175 62.3743 176.1722 149 L 4.0186 8.4006 122.9314 58.6671 41.7802 179.0488 150 F 4.4741 8.8317 117.4972 59.2550 39.8742 174.8379 151 E 5.1777 7.8925 118.2567 52.8981 28.6512 173.7044 152 H 4.8097 7.8115 128.5773 56.7451 32.6397 174.5590 153 H 4.4891 9.0044 113.6690 57.1875 29.1120 175.1797 154 L 3.4479 6.9369 121.7582 54.2858 42.5337 174.1427 155 K 4.1232 7.5285 120.6090 56.8034 32.7073 175.9194 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 M 8.29 4.38 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 N 8.05 4.49 0.00 2.91 2.79 0.00 0.00 6.33 6.77 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 3 E 9.33 3.98 0.00 1.97 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 2.31 2.33 0.00 4 L 8.14 4.42 0.00 1.69 1.83 0.96 0.93 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 5 E 8.02 4.52 0.00 1.79 1.58 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 2.03 2.17 0.00 6 G 8.15 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 7 Y 8.91 4.74 0.00 2.99 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 8 V 8.57 4.09 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 0.96 0.00 0.00 0.89 0.00 0.00 9 T 8.16 4.22 4.31 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 1.25 0.00 0.00 10 K 7.95 4.40 0.00 1.95 1.88 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.35 0.00 0.00 3.58 0.00 0.00 0.00 0.00 1.60 1.83 7.81 11 A 8.17 4.29 1.56 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 0.00 0.00 12 Q 7.74 3.43 0.00 2.32 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 13 S 8.01 4.10 0.00 3.62 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 14 F 8.62 4.25 0.00 2.62 2.29 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 15 R 8.36 4.57 0.00 1.83 1.64 0.00 3.11 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.76 0.00 16 F 8.74 5.67 0.00 2.47 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.51 4.72 0.16 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 18 I 8.80 4.83 1.74 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.82 0.74 0.00 0.00 19 V 8.69 4.61 1.98 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 0.92 0.00 0.00 0.86 0.00 0.00 20 V 8.80 5.36 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 0.41 0.00 0.00 -0.62 0.00 0.00 21 A 8.45 5.58 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 22 R 8.95 4.25 0.00 1.98 2.13 0.00 3.13 0.00 0.00 3.10 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.36 0.00 23 F 8.29 4.07 0.00 3.32 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 24 N 8.45 4.34 0.00 3.25 3.07 0.00 0.00 6.72 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 25 E 8.04 4.50 0.00 2.32 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 2.36 2.28 0.00 26 F 8.36 3.93 0.00 3.10 3.15 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 27 V 8.49 4.10 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 1.09 0.00 0.00 1.15 0.00 0.00 28 T 8.01 3.87 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 1.35 0.00 0.00 29 R 8.44 4.05 0.00 2.18 1.99 0.00 3.36 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.92 0.00 30 R 7.97 3.81 0.00 2.07 1.93 0.00 3.25 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.50 0.00 31 L 8.20 3.83 0.00 1.88 1.72 0.89 0.79 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 32 M 8.61 3.86 0.00 2.13 1.82 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.60 0.00 33 E 8.70 4.09 0.00 2.16 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 2.36 2.59 0.00 34 G 8.46 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.81 3.66 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 36 L 8.29 4.06 0.00 1.98 1.71 1.02 1.18 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 37 D 8.58 4.39 0.00 2.79 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 38 T 8.04 3.86 4.04 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 0.79 0.00 0.00 39 F 7.57 4.33 0.00 3.34 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 40 K 8.15 4.19 0.00 1.97 1.94 0.00 1.79 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.58 1.67 7.81 41 K 8.57 3.85 0.00 2.05 2.29 0.00 1.96 0.00 0.00 1.79 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.50 7.81 42 Y 8.68 4.28 0.00 3.33 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 43 S 8.19 3.85 0.00 4.14 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 44 V 7.89 3.96 2.41 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 0.89 0.00 0.00 1.30 0.00 0.00 45 N 8.31 4.71 0.00 2.76 2.75 0.00 0.00 6.94 7.53 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 46 E 9.05 4.50 0.00 1.93 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 2.14 2.24 0.00 47 D 8.84 4.29 0.00 2.78 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 48 I 6.49 3.57 1.72 0.00 0.00 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 1.41 1.56 0.55 0.00 0.00 49 D 8.76 4.66 0.00 2.63 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 50 V 8.36 4.65 1.77 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 0.61 0.00 0.00 0.91 0.00 0.00 51 V 8.82 4.30 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 1.06 0.00 0.00 0.86 0.00 0.00 52 W 8.86 5.24 0.00 3.24 3.10 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 0.00 0.00 0.00 53 V 9.18 4.71 2.17 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 0.77 0.00 0.00 1.03 0.00 0.00 54 P 0.00 4.34 0.00 2.21 2.38 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.05 0.00 55 G 8.19 4.52 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 0.00 56 A 8.68 3.91 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 57 Y 8.34 3.94 0.00 3.00 2.98 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 58 E 8.66 4.14 0.00 2.41 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 2.42 2.50 0.00 59 L 7.78 3.97 0.00 1.76 1.69 0.79 0.67 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 60 G 7.86 3.66 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 0.00 0.00 0.00 61 V 7.76 3.67 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 0.82 0.00 0.00 1.03 0.00 0.00 62 T 7.78 3.83 4.38 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 1.21 0.00 0.00 63 A 8.66 3.89 1.33 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 0.00 0.00 64 Q 8.45 3.82 0.00 2.20 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 65 A 8.80 4.01 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 66 L 8.21 4.13 0.00 1.73 1.67 0.70 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.87 3.82 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 0.00 0.00 0.00 68 K 8.11 4.18 0.00 1.97 1.92 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.48 7.81 69 S 8.40 4.35 0.00 4.08 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 0.00 70 G 7.95 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 0.00 0.00 0.00 71 K 7.82 3.80 0.00 0.79 1.19 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.25 1.39 7.81 72 Y 7.42 4.78 0.00 2.94 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 73 H 9.14 4.80 0.00 2.83 3.45 0.00 5.89 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 7.88 4.94 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 75 I 8.84 4.83 1.78 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.30 0.76 0.00 0.00 76 V 8.85 4.64 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 1.02 0.00 0.00 0.83 0.00 0.00 77 C 9.09 5.14 0.00 2.69 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 78 L 8.16 5.54 0.00 1.40 1.40 0.79 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 79 G 8.05 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 0.00 0.00 0.00 0.00 80 A 8.55 5.30 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 81 V 9.24 4.28 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 0.80 0.00 0.00 0.88 0.00 0.00 82 V 8.47 4.32 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 0.76 0.00 0.00 1.06 0.00 0.00 83 K 8.56 3.58 0.00 0.79 1.44 0.00 0.87 0.00 0.00 1.53 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.08 0.63 7.81 84 G 8.57 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 85 D 7.81 4.63 0.00 2.63 2.41 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 86 T 8.47 4.27 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 1.24 0.00 0.00 87 S 8.54 5.00 0.00 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 0.00 88 H 7.92 3.89 0.00 3.28 3.43 0.00 5.62 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 89 Y 8.15 4.17 0.00 3.11 3.10 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 0.00 0.00 0.00 90 D 8.51 4.19 0.00 2.91 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 91 A 8.29 3.84 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 92 V 8.40 3.61 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 0.94 0.00 0.00 1.00 0.00 0.00 93 V 8.08 3.49 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 0.89 0.00 0.00 0.07 0.00 0.00 94 N 8.77 4.24 0.00 2.84 2.79 0.00 0.00 7.06 7.98 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 95 S 8.18 3.95 0.00 3.72 3.05 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 96 A 8.63 3.93 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 97 S 8.76 4.27 0.00 3.73 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 98 S 8.92 4.11 0.00 3.80 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 99 G 8.51 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.93 3.67 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 1.10 0.00 0.00 1.01 0.00 0.00 101 L 8.25 3.94 0.00 1.83 1.71 0.88 0.80 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 0.00 102 S 8.81 4.07 0.00 3.98 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 0.00 103 A 8.61 4.13 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 0.00 0.00 0.00 0.00 0.00 104 G 8.27 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 0.00 0.00 0.00 0.00 105 L 7.83 4.03 0.00 1.81 1.76 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 106 N 8.67 4.50 0.00 2.71 2.90 0.00 0.00 7.20 8.11 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 0.00 107 S 8.73 4.38 0.00 4.02 4.04 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 0.00 108 G 8.10 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 0.00 109 V 7.79 4.53 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 1.09 0.00 0.00 1.11 0.00 0.00 110 P 0.00 4.53 0.00 1.95 1.74 0.00 3.70 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 1.32 1.38 0.00 111 C 8.59 5.22 0.00 2.95 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 0.00 112 V 8.91 3.74 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 0.88 0.00 0.00 0.92 0.00 0.00 113 F 9.00 4.51 0.00 3.05 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 0.00 114 G 8.71 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 0.00 0.00 0.00 0.00 115 V 6.38 4.85 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 -0.76 0.00 0.00 0.71 0.00 0.00 116 L 8.99 4.43 0.00 1.61 1.66 0.94 0.42 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 0.00 117 T 7.95 5.37 4.31 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 1.27 0.00 0.00 118 C 8.21 4.28 0.00 2.97 3.10 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 0.00 0.00 0.00 119 D 8.99 4.51 0.00 2.69 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 0.00 120 N 9.64 4.72 0.00 2.89 2.91 0.00 0.00 6.77 8.18 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 0.00 121 M 8.83 3.98 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 122 D 8.23 4.37 0.00 2.82 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 0.00 123 Q 8.74 3.98 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.65 0.00 124 A 7.69 4.17 1.46 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 0.00 0.00 125 I 8.06 3.77 2.05 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.42 1.02 0.00 0.00 126 N 8.18 4.42 0.00 3.01 2.88 0.00 0.00 7.03 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 0.00 127 R 8.62 4.04 0.00 1.92 1.98 0.00 3.28 0.00 0.00 3.18 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.81 0.00 128 A 7.56 4.46 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 0.00 129 G 9.03 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 0.00 130 G 7.84 4.18 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 0.00 0.00 0.00 131 K 8.33 4.15 0.00 1.85 1.95 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.65 1.39 7.81 132 A 7.98 4.47 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 0.00 133 G 8.78 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 0.00 0.00 0.00 134 N 8.06 5.75 0.00 2.75 2.60 0.00 0.00 6.78 6.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 K 8.17 4.17 0.00 1.83 1.75 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.20 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.36 7.81 136 G 8.24 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 0.00 0.00 0.00 137 A 8.46 3.77 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 0.00 138 E 8.02 3.73 0.00 2.11 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 2.26 2.43 0.00 139 S 8.52 4.00 0.00 3.84 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 0.00 140 A 7.56 3.44 0.25 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 0.00 141 L 7.44 3.36 0.00 1.43 1.64 0.71 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 142 T 7.99 3.68 4.31 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 1.13 0.00 0.00 143 A 8.08 3.90 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 0.00 144 I 7.63 3.65 1.95 0.00 0.00 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 1.33 0.58 0.93 0.00 0.00 145 E 8.44 3.84 0.00 1.93 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 2.25 2.31 0.00 146 M 8.44 3.84 0.00 1.65 2.06 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.70 0.00 147 A 7.84 3.85 1.12 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 0.00 0.00 148 S 8.00 4.24 0.00 3.83 4.04 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 0.00 149 L 8.40 4.02 0.00 1.85 2.04 0.96 1.15 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 0.00 150 F 8.83 4.47 0.00 3.39 3.15 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 0.00 151 E 7.89 5.18 0.00 2.24 2.04 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 2.40 2.37 0.00 152 H 7.81 4.81 0.00 3.36 3.67 0.00 5.71 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 9.00 4.49 0.00 3.33 3.72 0.00 5.96 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 L 6.94 3.45 0.00 1.77 1.63 0.85 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 155 K 7.53 4.12 0.00 1.82 1.69 0.00 1.53 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.27 1.52 7.81