NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.2219 8.1701 110.9370 61.8374 69.9644 172.9638 6 A 4.2039 8.3434 122.7541 51.7581 19.0952 176.1233 7 N 4.3847 8.6521 115.4268 53.9804 40.0682 173.1590 8 V 4.5822 7.8472 113.1950 59.0673 35.8550 175.8525 9 V 3.6608 8.2946 114.7906 61.5412 31.8694 176.6779 10 V 3.7012 8.3120 124.2947 62.9748 31.8170 175.0930 11 S 4.6851 8.3375 120.4455 56.8324 66.0757 173.0438 12 N 4.8416 8.3375 118.1594 50.9488 38.6554 171.8229 13 P 4.3303 0.0000 0.0000 64.6029 32.0532 177.4811 14 R 4.0622 7.8501 120.1209 54.9871 30.3861 174.1613 15 P 4.3639 0.0000 0.0000 62.4831 32.2015 175.2977 16 I 4.7913 7.6383 112.5261 59.1334 40.8437 174.6406 17 F 4.7527 9.0782 122.7137 56.0527 41.4454 174.4515 18 T 5.0721 8.4079 113.2212 59.4549 71.8144 173.6518 19 E 4.2975 8.9517 122.7694 56.6311 30.1298 177.2311 20 S 4.6611 8.4566 114.4996 58.8977 64.0970 175.4601 21 R 4.5693 7.9728 117.0262 56.0086 31.6524 175.5072 22 S 4.6779 7.6122 110.3868 56.6744 65.9741 174.1184 23 F 4.6984 8.5602 123.9891 56.9356 37.8557 174.5297 24 K 4.3433 7.5818 123.8575 54.0715 36.2120 175.8770 25 A 4.4063 8.0768 123.9718 52.2988 19.6184 178.6828 26 V 3.9092 8.2470 120.9849 61.5701 30.0045 175.6368 27 A 4.4969 7.6517 124.1191 53.2621 19.1622 177.0429 28 N 4.1672 8.6067 121.2866 54.4174 38.2517 174.3972 29 G 4.0706 7.8719 103.6361 45.2006 0.0000 173.2249 30 K 5.1794 9.1286 118.2726 54.4616 36.3445 175.9284 31 I 4.8984 8.3141 124.4272 59.7064 40.2704 174.1129 32 Y 5.1082 9.1627 124.5604 56.3108 41.2097 174.8692 33 I 5.1080 9.4612 123.4061 59.8324 41.1501 174.9439 34 G 4.7064 8.9601 113.3383 44.4806 0.0000 171.4213 35 Q 4.6228 8.7455 118.1043 55.4874 29.9455 176.9512 36 I 3.9066 8.3590 122.4517 63.3703 37.5280 175.7764 37 D 4.6553 9.2831 123.9993 55.3759 38.6095 173.4577 38 T 4.5911 7.5965 107.9460 59.4850 71.5093 173.4599 39 D 4.5686 8.3386 121.4305 52.6707 40.0736 174.6908 40 P 4.5895 0.0000 0.0000 63.9644 31.7922 177.9205 41 V 2.8301 7.7801 119.5442 65.3269 31.6615 175.6306 42 N 4.3669 7.8385 119.8387 52.6420 38.9769 173.5254 43 P 4.1891 0.0000 0.0000 65.5753 31.6412 178.5121 44 A 4.0821 7.9790 119.6981 54.5293 18.5356 177.8008 45 N 4.7278 8.2838 112.4452 53.7495 39.4066 175.4475 46 Q 4.6946 7.7493 118.1459 55.7025 29.3813 175.2384 47 I 4.6608 7.6379 113.7220 58.0302 40.6486 173.5403 48 P 4.1233 0.0000 0.0000 63.3515 31.7444 176.1995 49 V 4.6126 7.9792 116.2502 59.7384 35.4688 174.1680 50 Y 5.2141 8.5207 120.2688 56.1957 42.4788 174.7059 51 I 4.3037 8.7557 125.0134 61.2659 38.5321 174.5992 52 E 4.6836 8.7623 128.9693 54.6699 30.2753 175.6606 53 N 4.6968 9.2580 125.5658 52.4404 39.6788 176.3576 54 E 3.9592 8.7893 119.3045 59.8225 29.4414 178.6009 55 D 4.4087 7.9242 115.0915 54.2502 39.7295 176.8980 56 G 3.9335 8.0123 108.9137 44.9046 0.0000 174.0097 57 S 4.4470 8.9384 115.2375 58.4525 64.7194 172.8313 58 H 5.5078 8.6106 117.2032 53.9085 31.8482 173.5334 59 V 4.4737 8.7449 122.2332 59.6325 33.8466 174.7753 60 Q 4.4115 9.0506 127.7386 55.8627 29.5653 174.8419 61 I 4.7219 7.9089 119.0930 58.8441 40.8835 175.1899 62 T 4.1811 8.4277 112.5023 61.4541 69.6599 173.9661 63 Q 4.4848 8.1032 121.2224 53.6308 30.7226 173.9160 64 P 4.3303 0.0000 0.0000 62.2101 32.5924 175.9535 65 L 4.2035 8.4296 120.8901 54.8825 43.0666 176.0676 66 I 4.7707 8.2174 122.1449 59.6628 40.2534 174.3436 67 I 4.8042 8.2256 127.7660 59.6855 39.3797 176.1026 68 N 4.9565 9.0541 125.2109 51.5566 39.0724 175.5327 69 A 3.9340 8.4831 119.7296 54.9925 18.3938 178.3415 70 A 4.1641 8.1661 116.5654 52.5034 19.2457 178.0350 71 G 3.9582 8.5096 104.6431 45.4223 0.0000 173.0189 72 K 5.0505 8.1003 118.3357 54.0912 35.6441 175.7030 73 I 4.4766 8.3620 123.7371 61.5312 38.1589 175.4970 74 V 5.0796 8.5989 119.5146 59.8817 35.5949 174.7560 75 Y 4.5454 8.7898 123.0149 57.4223 41.7839 174.7159 76 N 3.7045 9.2670 125.4605 54.6372 37.4698 174.6528 77 G 3.9636 8.4292 102.0116 45.3666 0.0000 173.6619 78 Q 4.6934 7.8536 118.0368 53.2066 32.2281 175.0377 79 L 4.5120 8.4700 120.7767 55.4746 42.2507 177.0716 80 V 4.5826 8.0489 114.5388 59.4961 36.1681 175.0571 81 K 4.3810 8.6004 124.4768 55.5530 33.2764 175.0052 82 I 4.9616 8.3468 128.6008 59.9401 38.9476 175.6606 83 V 4.6119 8.7827 119.3194 60.5061 35.8638 174.9154 84 T 4.7631 7.8549 115.0591 61.8189 70.0636 172.5080 85 V 3.8655 8.4088 121.1607 62.4474 32.3483 175.8455 86 Q 4.0430 9.1270 128.6507 59.3100 28.7598 177.2670 87 G 4.0941 8.0021 106.7648 46.0755 0.0000 172.4384 88 H 5.2576 8.2942 120.9191 54.0293 31.9960 173.3157 89 S 4.9816 8.9245 115.2832 58.4308 65.2136 172.5851 90 M 5.4819 8.7954 119.9040 54.1708 35.9907 173.3714 91 A 5.3350 9.2766 126.5045 50.2617 22.9629 174.7617 92 I 5.0189 8.6023 122.1265 59.6878 40.6296 174.3587 93 Y 5.1918 9.2098 124.1805 56.1795 41.9927 175.6681 94 D 4.9277 8.9539 122.7015 52.0188 41.2682 177.1124 95 A 4.0407 8.3870 121.0428 55.0762 18.3535 178.3799 96 N 4.4530 8.2463 111.4506 54.1937 38.8668 176.1673 97 G 4.0255 8.3520 106.7015 45.4578 0.0000 173.8728 98 S 4.4388 8.2962 116.6649 57.6611 63.5769 173.4772 99 Q 3.7735 8.5649 126.0101 56.0382 29.4038 175.6135 100 V 3.9646 8.4913 126.1798 65.2915 32.4935 175.2132 101 D 4.6978 7.4492 117.0441 53.5828 44.7992 173.3865 102 Y 5.1641 8.3341 122.5648 56.0786 42.5376 173.4423 103 I 4.2888 8.2112 127.1780 59.2717 39.6273 176.3159 104 A 3.7091 8.4418 129.6618 54.0275 19.8716 176.3302 105 N 5.0371 7.9979 114.7119 52.5984 40.1223 174.7532 106 V 3.5727 8.5305 121.3797 64.3525 31.5715 179.2357 107 L 4.1023 8.2048 119.5576 57.4166 41.5170 178.5665 108 K 4.3496 8.2186 116.1227 56.8576 32.0095 177.1950 109 W 4.5330 8.1644 118.5787 56.0172 29.2555 175.8259 110 D 4.4625 7.6963 119.3146 53.0436 38.8072 174.8333 111 P 4.3478 0.0000 0.0000 64.2978 32.1152 175.9379 112 D 4.3153 7.8129 119.2007 53.2684 41.6736 176.5188 113 Q 4.2692 7.0722 124.3414 54.0608 28.6115 173.6207 114 Y 4.9788 7.5356 115.7982 57.1013 40.3477 178.0405 115 S 4.1247 8.0633 116.2174 61.7685 63.2312 176.2125 116 I 3.7913 7.7211 123.1109 62.8934 37.5345 177.3923 117 E 3.9842 8.3243 118.1177 59.5453 29.1748 179.0072 118 A 3.8548 7.6978 121.2985 54.8370 18.5071 179.3274 119 D 4.6191 8.2254 117.2746 57.3523 40.8354 178.9280 120 K 3.9605 7.9887 119.8129 59.5494 32.3637 179.1057 121 K 3.9586 7.6341 118.4574 59.2814 31.8577 179.4556 122 F 4.3214 8.2845 118.5278 60.5131 38.6091 177.5800 123 K 4.0122 8.2052 119.2515 59.4997 31.7898 178.6570 124 Q 4.2279 8.0810 121.2982 58.7164 28.9841 178.1896 125 I 3.7433 7.7115 120.5092 64.4794 37.1778 178.2473 126 E 4.0232 8.3137 119.3791 59.4572 28.9982 179.2696 127 D 4.3831 7.8099 118.9390 57.2166 40.8352 178.8490 128 K 4.0870 7.9031 118.9430 59.5372 31.9594 179.4884 129 I 3.7120 7.9980 120.1755 64.2430 36.8847 178.3813 130 E 3.9723 8.1829 119.4492 59.5443 29.3499 179.2522 131 E 3.9722 8.1050 118.3036 59.3588 29.4842 179.5228 132 I 3.6803 7.9895 120.0194 64.3675 37.1177 178.4438 133 L 3.7044 8.0660 119.9717 57.6827 41.4224 179.4255 134 S 4.1981 8.2947 113.2038 61.4274 62.2332 176.3743 135 K 3.9783 8.0650 121.0383 59.5073 31.7535 179.3408 136 I 3.6160 7.6958 119.9081 64.6850 36.9838 178.1485 137 Y 4.4084 7.7842 117.6461 61.2323 37.6050 178.0458 138 H 4.1370 8.4921 119.2260 59.3768 29.9567 177.2546 139 I 3.6755 7.9979 121.5968 64.5145 36.9168 177.9973 140 E 3.9852 8.5804 119.6958 59.7976 29.3271 179.3772 141 N 4.3374 8.3973 116.2495 56.2566 38.5193 177.2474 142 E 3.9185 8.2513 120.0350 59.5392 29.4836 179.4930 143 I 3.6639 7.9474 119.5099 64.2791 37.1497 178.2064 144 A 3.9714 8.1660 121.6766 55.1629 18.1623 179.6414 145 R 3.7841 7.9563 117.0128 59.6168 30.2057 178.5671 146 I 3.6820 7.8601 119.6457 64.5649 36.9363 178.3815 147 K 3.9130 8.0428 117.8840 59.3413 32.2859 179.0167 148 K 4.0646 8.0578 119.6583 59.4650 31.9673 178.4552 149 L 3.9878 7.7174 118.1404 58.0240 41.8039 179.2602 150 I 4.1846 7.7857 109.2253 61.6383 38.0112 175.9816 151 G 3.7175 7.6937 114.7847 45.8184 0.0000 172.8841 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 5 T 8.17 4.22 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 1.20 0.00 0.00 6 A 8.34 4.20 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 7 N 8.65 4.38 0.00 2.73 2.79 0.00 0.00 6.68 6.98 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 8 V 7.85 4.58 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 0.82 0.00 0.00 0.94 0.00 0.00 9 V 8.29 3.66 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 0.67 0.00 0.00 0.95 0.00 0.00 10 V 8.31 3.70 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 0.82 0.00 0.00 0.93 0.00 0.00 11 S 8.34 4.69 0.00 3.96 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 12 N 8.34 4.84 0.00 2.63 2.73 0.00 0.00 6.92 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 13 P 0.00 4.33 0.00 2.22 2.17 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 14 R 7.85 4.06 0.00 1.80 1.89 0.00 3.25 0.00 0.00 3.31 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 15 P 0.00 4.36 0.00 1.68 1.87 0.00 3.80 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.04 0.00 16 I 7.64 4.79 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.61 0.88 0.00 0.00 17 F 9.08 4.75 0.00 2.92 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.41 5.07 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 1.11 0.00 0.00 19 E 8.95 4.30 0.00 2.14 1.95 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 2.35 2.55 0.00 20 S 8.46 4.66 0.00 3.85 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 21 R 7.97 4.57 0.00 1.79 1.97 0.00 3.36 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 22 S 7.61 4.68 0.00 3.97 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 23 F 8.56 4.70 0.00 2.91 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 24 K 7.58 4.34 0.00 1.76 1.56 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.43 7.81 25 A 8.08 4.41 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 26 V 8.25 3.91 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 0.95 0.00 0.00 1.02 0.00 0.00 27 A 7.65 4.50 1.24 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 28 N 8.61 4.17 0.00 2.84 2.86 0.00 0.00 7.23 7.96 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 29 G 7.87 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 0.00 0.00 0.00 30 K 9.13 5.18 0.00 1.71 1.35 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.24 1.36 7.81 31 I 8.31 4.90 1.60 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.41 0.77 0.00 0.00 32 Y 9.16 5.11 0.00 3.04 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 33 I 9.46 5.11 1.86 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.27 0.86 0.00 0.00 34 G 8.96 4.71 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 0.00 0.00 0.00 35 Q 8.75 4.62 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.89 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 36 I 8.36 3.91 1.91 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 1.54 0.60 0.95 0.00 0.00 37 D 9.28 4.66 0.00 2.86 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.60 4.59 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 1.33 0.00 0.00 39 D 8.34 4.57 0.00 2.62 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 40 P 0.00 4.59 0.00 2.38 2.38 0.00 4.03 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.17 0.00 41 V 7.78 2.83 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 0.20 0.00 0.00 0.38 0.00 0.00 42 N 7.84 4.37 0.00 2.66 2.81 0.00 0.00 7.11 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 43 P 0.00 4.19 0.00 2.21 2.11 0.00 3.63 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 44 A 7.98 4.08 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 45 N 8.28 4.73 0.00 3.02 2.89 0.00 0.00 6.85 8.49 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 46 Q 7.75 4.69 0.00 2.21 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.70 0.00 0.00 0.00 0.00 0.00 2.54 2.53 0.00 47 I 7.64 4.66 1.89 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 1.24 0.66 0.94 0.00 0.00 48 P 0.00 4.12 0.00 1.97 1.77 0.00 3.63 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 49 V 7.98 4.61 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 0.74 0.00 0.00 0.83 0.00 0.00 50 Y 8.52 5.21 0.00 2.85 2.77 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 51 I 8.76 4.30 1.79 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.40 0.88 0.00 0.00 52 E 8.76 4.68 0.00 2.01 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.00 0.00 53 N 9.26 4.70 0.00 2.94 2.71 0.00 0.00 6.61 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 8.79 3.96 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 55 D 7.92 4.41 0.00 2.75 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 56 G 8.01 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 57 S 8.94 4.45 0.00 3.85 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 58 H 8.61 5.51 0.00 2.83 3.05 0.00 5.83 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 V 8.74 4.47 2.08 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 0.73 0.00 0.00 0.92 0.00 0.00 60 Q 9.05 4.41 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.84 0.00 0.00 0.00 0.00 0.00 2.08 1.80 0.00 61 I 7.91 4.72 1.67 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.70 0.21 0.00 0.00 62 T 8.43 4.18 4.24 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 1.22 0.00 0.00 63 Q 8.10 4.48 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.09 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 64 P 0.00 4.33 0.00 1.56 0.66 0.00 3.70 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.79 0.00 65 L 8.43 4.20 0.00 1.42 1.50 0.82 1.04 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 66 I 8.22 4.77 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.91 0.87 0.00 0.00 67 I 8.23 4.80 1.96 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.79 1.00 0.00 0.00 68 N 9.05 4.96 0.00 2.83 2.98 0.00 0.00 6.48 6.58 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 69 A 8.48 3.93 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 70 A 8.17 4.16 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 71 G 8.51 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 8.10 5.05 0.00 1.75 1.75 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.41 7.81 73 I 8.36 4.48 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.07 0.94 0.00 0.00 74 V 8.60 5.08 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 0.66 0.00 0.00 0.96 0.00 0.00 75 Y 8.79 4.55 0.00 2.94 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 76 N 9.27 3.70 0.00 2.47 2.78 0.00 0.00 7.23 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 77 G 8.43 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 7.85 4.69 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 79 L 8.47 4.51 0.00 1.65 1.64 0.94 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 80 V 8.05 4.58 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 0.77 0.00 0.00 0.97 0.00 0.00 81 K 8.60 4.38 0.00 1.85 1.70 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.48 7.81 82 I 8.35 4.96 1.88 0.00 0.00 nan 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 0.97 0.94 0.00 0.00 83 V 8.78 4.61 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 0.81 0.00 0.00 1.14 0.00 0.00 84 T 7.85 4.76 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 1.01 0.00 0.00 85 V 8.41 3.87 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 0.88 0.00 0.00 0.98 0.00 0.00 86 Q 9.13 4.04 0.00 2.08 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 87 G 8.00 4.09 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 0.00 0.00 0.00 88 H 8.29 5.26 0.00 3.36 3.39 0.00 5.45 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 89 S 8.92 4.98 0.00 4.04 4.27 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 90 M 8.80 5.48 0.00 1.98 1.91 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 2.51 2.50 0.00 91 A 9.28 5.34 1.57 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 92 I 8.60 5.02 1.84 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.65 0.90 0.00 0.00 93 Y 9.21 5.19 0.00 3.03 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.95 4.93 0.00 2.92 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 95 A 8.39 4.04 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 96 N 8.25 4.45 0.00 2.97 2.91 0.00 0.00 7.02 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 97 G 8.35 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 98 S 8.30 4.44 0.00 4.31 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 99 Q 8.56 3.77 0.00 1.83 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.98 0.00 0.00 0.00 0.00 0.00 2.15 1.53 0.00 100 V 8.49 3.96 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 0.77 0.00 0.00 0.92 0.00 0.00 101 D 7.45 4.70 0.00 2.69 2.38 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 0.00 102 Y 8.33 5.16 0.00 3.14 2.77 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 0.00 103 I 8.21 4.29 1.56 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.51 0.60 0.00 0.00 104 A 8.44 3.71 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 0.00 105 N 8.00 5.04 0.00 2.71 2.71 0.00 0.00 7.21 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 0.00 106 V 8.53 3.57 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 0.50 0.00 0.00 0.61 0.00 0.00 107 L 8.20 4.10 0.00 1.89 1.75 0.97 0.89 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 0.00 108 K 8.22 4.35 0.00 1.95 1.80 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.44 7.81 109 W 8.16 4.53 0.00 3.37 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 0.00 110 D 7.70 4.46 0.00 2.95 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 0.00 111 P 0.00 4.35 0.00 2.18 2.22 0.00 3.77 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 112 D 7.81 4.32 0.00 2.62 2.42 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 0.00 113 Q 7.07 4.27 0.00 1.78 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.81 0.00 0.00 0.00 0.00 0.00 2.16 2.28 0.00 114 Y 7.54 4.98 0.00 3.05 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.06 4.12 0.00 4.09 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 I 7.72 3.79 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.34 0.98 0.00 0.00 117 E 8.32 3.98 0.00 2.27 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 2.58 2.41 0.00 118 A 7.70 3.85 1.48 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 0.00 119 D 8.23 4.62 0.00 3.06 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 0.00 120 K 7.99 3.96 0.00 1.84 1.97 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.49 7.81 121 K 7.63 3.96 0.00 1.69 1.59 0.00 1.70 0.00 0.00 1.49 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.48 7.81 122 F 8.28 4.32 0.00 3.25 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 0.00 123 K 8.21 4.01 0.00 1.94 2.04 0.00 1.67 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.63 7.81 124 Q 8.08 4.23 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 125 I 7.71 3.74 2.08 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 1.53 0.52 0.96 0.00 0.00 126 E 8.31 4.02 0.00 2.22 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 2.57 2.55 0.00 127 D 7.81 4.38 0.00 2.84 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 0.00 128 K 7.90 4.09 0.00 1.91 1.86 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.68 7.81 129 I 8.00 3.71 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.75 0.92 0.00 0.00 130 E 8.18 3.97 0.00 2.24 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 131 E 8.10 3.97 0.00 2.18 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 0.00 2.33 2.36 0.00 132 I 7.99 3.68 2.03 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 1.50 0.91 0.86 0.00 0.00 133 L 8.07 3.70 0.00 1.87 1.61 0.94 0.69 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 0.00 134 S 8.29 4.20 0.00 3.94 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 0.00 135 K 8.06 3.98 0.00 2.00 1.83 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.65 7.81 136 I 7.70 3.62 1.65 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.61 0.69 0.00 0.00 137 Y 7.78 4.41 0.00 3.02 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 0.00 138 H 8.49 4.14 0.00 3.30 3.51 0.00 5.79 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 0.00 139 I 8.00 3.68 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.59 0.91 0.00 0.00 140 E 8.58 3.99 0.00 2.28 2.08 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 2.38 2.62 0.00 141 N 8.40 4.34 0.00 2.84 2.85 0.00 0.00 7.06 7.18 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 0.00 142 E 8.25 3.92 0.00 2.12 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 0.00 2.23 2.37 0.00 143 I 7.95 3.66 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.83 0.91 0.00 0.00 144 A 8.17 3.97 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 0.00 145 R 7.96 3.78 0.00 2.07 2.07 0.00 3.11 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 146 I 7.86 3.68 2.02 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.64 0.91 0.00 0.00 147 K 8.04 3.91 0.00 1.88 1.89 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.57 7.81 148 K 8.06 4.06 0.00 1.99 1.91 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.48 7.81 149 L 7.72 3.99 0.00 1.84 1.74 0.96 0.75 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 0.00 150 I 7.79 4.18 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.53 0.94 0.00 0.00 151 G 7.69 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