NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4502 8.3044 118.1946 55.1276 32.5552 174.4470 1 V 4.2455 7.9521 119.8048 60.7249 34.4347 173.5579 2 L 4.2339 8.3153 127.5181 54.1986 43.3702 176.9932 3 S 4.5166 8.7675 117.3298 57.6641 65.2892 175.0636 4 E 4.2587 8.8760 122.8744 59.5980 29.4082 179.0546 5 G 3.7044 8.1833 105.1523 47.9465 0.0000 175.3062 6 E 3.8808 8.1895 120.8362 58.9777 29.4292 179.3305 7 W 4.4623 8.0699 118.9659 60.1640 29.0725 178.6171 8 Q 4.1949 8.6329 118.1170 58.9678 28.0178 178.8158 9 L 4.0493 7.9328 119.6978 57.5737 41.6046 179.7135 10 V 3.7350 7.9743 118.2718 66.2482 31.5425 178.2164 11 L 4.3059 8.5906 118.8740 57.8395 41.2163 179.2009 12 H 4.2217 8.4617 116.3155 58.6475 28.9405 177.7924 13 V 3.8325 7.9479 120.9736 64.4104 31.3989 178.2663 14 W 3.8689 8.5645 128.8945 60.1140 30.2758 177.5576 15 A 4.0017 8.1436 120.1918 55.2068 17.9991 179.5113 16 K 3.9482 7.8214 116.8159 59.3253 32.1993 179.3862 17 V 2.6594 7.3025 118.0029 66.0141 30.8814 177.3396 18 E 4.0259 7.6789 114.8926 57.6974 29.3639 178.4710 19 A 4.1806 7.5969 121.1406 54.3253 19.4652 177.6066 20 D 4.6576 7.7605 114.4690 52.4545 43.4456 176.0000 21 V 3.6240 7.7306 123.7751 64.1639 31.8213 178.2779 22 A 4.0229 7.9923 121.1020 54.9578 18.3241 179.5469 23 G 3.6209 8.3010 105.4943 47.8371 0.0000 175.6483 24 H 4.1810 8.1627 118.5506 58.2592 28.6003 178.2395 25 G 3.5368 8.3816 108.0252 47.6411 0.0000 175.7948 26 Q 3.8756 8.0246 120.3901 58.8539 28.7435 178.5172 27 D 4.2854 7.8352 119.6775 57.5529 40.8022 179.2343 28 I 3.6324 7.7277 119.9482 64.4193 37.0658 178.6129 29 L 3.4497 7.8303 119.8701 57.5230 41.2628 179.6628 30 I 3.6257 7.7254 120.0311 64.2188 36.9290 178.4583 31 R 3.7765 8.0152 119.7084 59.0693 29.8723 178.1867 32 L 3.8937 7.8357 120.2767 58.4494 42.2113 179.1618 33 F 4.5889 7.9096 117.6798 60.4482 38.5365 177.9452 34 K 4.0450 8.1096 117.7343 59.4980 32.0404 179.3219 35 S 4.2687 8.0807 114.5321 60.3858 64.1994 174.6113 36 H 4.6827 8.1420 118.2244 51.9591 29.6459 171.7240 37 P 4.7740 0.0000 0.0000 64.7233 31.3736 177.5312 38 E 4.0942 8.2851 116.1964 59.6355 29.4235 179.2172 39 T 3.7766 8.1442 110.9494 64.5134 68.7129 176.2792 40 L 3.7470 8.0825 123.1796 57.8092 41.7797 178.6425 41 E 4.0959 7.9204 117.4066 58.7160 29.4133 178.8290 42 K 4.4258 8.0918 117.3550 57.2999 32.9074 177.0912 43 F 4.5837 8.2193 119.0487 55.5645 38.0030 175.9198 44 D 4.4102 8.5117 126.2419 57.0720 40.9931 178.5367 45 R 3.7863 7.8987 118.2219 58.3194 30.2180 176.6647 46 F 5.0981 8.0510 113.8385 56.6653 40.7622 176.6377 47 K 4.0919 8.1578 119.3752 58.8036 32.5751 177.6373 48 H 4.3885 8.1471 114.5871 57.4331 29.0031 175.6112 49 L 4.1180 7.6183 121.6812 54.8225 41.6344 176.9225 50 K 4.3206 9.2117 123.8788 57.6252 33.3153 177.2623 51 T 4.7360 7.3130 107.5309 58.7593 73.2265 174.1087 52 E 3.9007 8.7583 121.6623 59.4528 29.7157 178.7616 53 A 3.9914 8.0014 120.2204 55.3879 18.2224 179.3434 54 E 3.9502 7.9404 115.7981 59.6964 29.9065 179.1957 55 M 4.1706 8.1095 118.7345 58.4448 31.8416 179.0234 56 K 3.9713 8.3042 117.5159 59.0248 32.2845 178.5357 57 A 4.4845 7.6553 118.4387 52.1409 19.0812 177.7602 58 S 4.3294 7.5783 112.5135 57.4035 62.7647 174.1758 59 E 4.0003 8.7573 130.4125 59.4658 29.3137 178.7874 60 D 4.4202 8.1385 117.6860 57.2844 41.3595 177.8698 61 L 3.2712 8.3335 121.2742 57.6573 41.9778 178.7855 62 K 3.8845 8.1514 122.0871 60.0350 32.1339 179.2937 63 K 3.9398 8.3009 124.1783 60.3603 31.5254 180.2516 64 H 4.6393 8.5227 119.8219 58.9553 29.7255 177.5197 65 G 3.5986 8.3210 107.8411 47.7586 0.0000 175.8316 66 V 3.5905 7.8246 120.5127 66.0020 31.5910 178.1555 67 T 3.8835 7.9010 115.5156 66.6637 68.2615 176.6112 68 V 3.6001 8.0458 120.2345 66.2508 31.6638 178.1760 69 L 4.2360 8.2514 118.8117 58.0219 41.4125 179.7806 70 T 4.0258 8.2948 115.8571 66.4512 68.4480 176.6126 71 A 3.9954 8.1367 122.7429 55.0876 18.3802 179.4682 72 L 3.6989 8.2192 119.1474 58.0524 42.0791 179.1769 73 G 3.2897 8.5583 105.7918 47.8309 0.0000 175.4246 74 A 3.9534 7.8314 121.9868 54.7386 18.7366 179.5749 75 I 3.7647 7.5437 118.1825 64.5796 37.1707 178.6910 76 L 3.9656 7.9095 120.1715 57.6813 41.1757 179.7169 77 K 3.8962 7.8400 117.2202 58.7040 32.2416 178.9414 78 K 3.9126 7.7666 118.1361 56.3337 32.4120 176.7398 79 K 2.0000 8.2668 118.2001 56.3035 29.7594 175.7666 80 G 3.9467 7.8268 106.1428 45.7463 0.0000 173.8684 81 H 4.5542 7.3008 119.0988 55.5088 27.6155 174.9873 82 H 5.4137 7.3022 110.4518 54.3891 29.8943 176.0340 83 E 3.9232 8.5593 122.4988 60.2090 28.9925 178.5811 84 A 4.0314 7.9155 118.5967 55.3559 18.4297 179.0307 85 E 4.1060 8.1333 116.5946 59.4385 29.6088 179.3256 86 L 4.3110 8.3369 119.2107 57.2263 41.6765 179.1606 87 K 3.9078 7.9757 118.6334 59.3135 32.0571 177.4244 88 P 4.3294 0.0000 0.0000 65.6502 31.2487 178.2201 89 L 4.0171 7.5884 120.3251 57.9761 42.0145 178.7251 90 A 4.2361 8.4688 121.2093 55.2670 18.3554 179.4107 91 Q 3.8938 8.2519 118.2524 59.3362 29.1082 178.6152 92 S 4.0236 8.2471 115.3658 61.9182 62.9996 176.1784 93 H 4.1827 8.6921 119.7673 57.9750 28.2241 177.7847 94 A 2.6500 8.0627 122.5088 54.6191 18.2765 178.9136 95 T 3.9754 7.3725 111.9193 64.3157 69.5762 176.0261 96 K 4.0946 7.4452 119.8720 58.6271 32.9518 177.1186 97 H 4.2543 8.1061 116.7917 56.6274 29.5321 176.1401 98 K 3.2907 7.4778 119.0698 55.1823 28.0822 179.8234 99 I 4.3911 7.9605 121.5510 58.8065 38.2856 175.0969 100 P 4.5883 0.0000 0.0000 62.2706 32.0669 177.3811 101 I 3.6640 8.3969 120.8115 64.8341 36.8716 178.2282 102 C 4.0895 7.8751 116.0097 61.0112 29.1440 175.5780 103 Y 4.1085 7.9047 118.9520 60.6533 37.4496 178.0515 104 L 4.2111 7.9033 119.6727 57.5646 41.4269 179.1353 105 E 4.0102 8.2617 118.9590 59.3973 29.4244 179.2509 106 F 4.5266 7.9655 117.8518 60.8747 38.9207 177.6709 107 I 3.8696 8.2384 118.1421 63.9422 37.7083 178.0927 108 S 4.1917 8.2930 116.4086 61.5662 62.6189 176.1134 109 E 4.0052 8.5791 121.8349 59.3188 29.3559 178.7715 110 A 3.9988 8.1449 120.7325 55.1357 18.4169 179.6522 111 I 3.6712 8.0712 118.4849 64.6791 37.1537 178.7190 112 I 3.8196 8.0128 120.6428 64.6418 36.9545 178.0006 113 H 4.1281 8.5387 119.2433 59.3035 29.6644 177.5557 114 V 3.5454 7.9421 120.0515 65.9566 31.2996 178.0342 115 L 3.7312 7.8277 118.8433 57.8167 41.0403 178.9059 116 H 4.3390 8.0122 117.5825 59.2730 29.8534 177.0772 117 S 4.1349 7.7890 114.0328 61.4701 62.3877 175.9598 118 R 4.0384 8.0071 119.5556 57.7127 31.1382 176.5531 119 H 5.0724 8.2167 115.3865 53.9866 29.3268 173.2804 120 P 4.3543 0.0000 0.0000 65.6488 31.6088 178.3889 121 G 3.7637 8.1065 106.7855 47.7638 0.0000 173.6794 122 D 4.9400 8.2503 116.6251 53.7608 42.9893 175.4410 123 F 4.8882 8.0224 120.0448 56.6640 39.7192 174.6668 124 G 3.8843 7.7746 108.3023 44.0854 0.0000 172.2743 125 A 3.9116 8.4171 120.6341 55.3217 18.3196 179.7118 126 D 4.1742 7.9481 116.5764 57.4441 40.9099 178.7270 127 A 3.8701 7.7399 120.7349 55.0896 18.4271 179.2344 128 Q 2.8414 7.8165 118.5380 58.7915 28.9675 178.7188 129 G 3.5312 8.0471 106.5753 47.6996 0.0000 175.4920 130 A 3.8252 7.9678 123.3538 54.9945 18.3425 179.4262 131 M 3.9794 8.2397 117.0143 58.6916 32.3447 177.7503 132 N 4.2929 8.5786 117.6850 56.7008 39.0510 176.6256 133 K 3.8381 8.1564 120.6671 59.4086 32.2165 178.5601 134 A 3.8309 8.0437 121.1973 55.2494 18.2312 179.6963 135 L 4.1020 8.3943 117.8999 57.8238 41.6153 179.5626 136 E 3.9771 8.7113 119.2213 59.2298 29.3032 179.1178 137 L 3.9605 8.1747 120.4673 58.0039 42.1138 178.5000 138 F 4.1510 8.4550 120.6754 61.7436 39.2749 177.3961 139 R 3.3938 8.2844 117.6254 58.7109 29.8023 179.0287 140 K 3.8098 8.3354 119.8621 59.7169 32.2514 178.6927 141 D 4.3356 8.2331 119.3390 57.2709 40.6880 178.8629 142 I 3.4029 7.6004 120.3307 64.1799 37.0217 178.2884 143 A 3.7023 7.9733 121.7371 54.9867 18.1808 179.5516 144 A 3.9436 7.9770 119.2577 55.2252 18.4453 180.0808 145 K 3.9968 8.0805 117.0928 59.6567 32.0457 179.0040 146 Y 4.4941 8.6780 120.0414 61.9488 37.9767 179.7672 147 K 4.0420 8.1593 124.2950 59.9173 31.6073 180.7141 148 E 4.2330 7.9853 118.8425 59.1091 29.4875 178.8521 149 L 4.3539 7.9082 116.6566 55.1791 41.9452 177.7312 150 G 3.9105 7.9786 106.8856 45.4030 0.0000 172.2380 151 Y 4.7525 8.2421 123.2598 55.7840 40.6581 177.4403 152 Q 3.6704 8.3638 125.8565 55.8826 28.6688 173.1721 153 G 3.8944 5.3800 108.1384 45.8731 0.0000 173.1469 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 0 M 8.30 4.45 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 1 V 7.95 4.25 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 0.90 0.00 0.00 0.96 0.00 0.00 2 L 8.32 4.23 0.00 0.84 0.64 0.60 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.77 4.52 0.00 4.04 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 4 E 8.88 4.26 0.00 2.20 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 2.44 2.53 0.00 5 G 8.18 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.19 3.88 0.00 1.92 1.69 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 2.20 2.25 0.00 7 W 8.07 4.46 0.00 3.58 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.63 4.19 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.68 2.62 0.00 9 L 7.93 4.05 0.00 1.85 1.72 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.97 3.73 2.49 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 1.20 0.00 0.00 0.94 0.00 0.00 11 L 8.59 4.31 0.00 1.84 1.80 0.97 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.46 4.22 0.00 3.27 3.45 0.00 5.85 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.95 3.83 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 1.11 0.00 0.00 0.92 0.00 0.00 14 W 8.56 3.87 0.00 3.70 3.21 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 15 A 8.14 4.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.82 3.95 0.00 1.47 1.59 0.00 1.69 0.00 0.00 1.52 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.55 1.48 7.81 17 V 7.30 2.66 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 0.00 0.00 0.06 0.00 0.00 0.21 0.00 0.00 18 E 7.68 4.03 0.00 2.04 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 0.00 2.29 2.21 0.00 19 A 7.60 4.18 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 20 D 7.76 4.66 0.00 2.71 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.73 3.62 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 0.84 0.00 0.00 0.87 0.00 0.00 22 A 7.99 4.02 1.31 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 0.00 0.00 0.00 23 G 8.30 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.16 4.18 0.00 3.23 3.20 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.38 3.54 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 0.00 0.00 0.00 26 Q 8.02 3.88 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.71 0.00 0.00 0.00 0.00 0.00 2.30 2.50 0.00 27 D 7.84 4.29 0.00 2.85 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 28 I 7.73 3.63 1.86 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 1.49 0.63 0.88 0.00 0.00 29 L 7.83 3.45 0.00 1.35 0.97 0.73 0.44 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 30 I 7.73 3.63 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.58 0.88 0.00 0.00 31 R 8.02 3.78 0.00 1.92 2.05 0.00 3.03 0.00 0.00 2.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 32 L 7.84 3.89 0.00 1.72 1.39 1.07 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.91 4.59 0.00 3.15 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 34 K 8.11 4.05 0.00 1.75 1.83 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.57 7.81 35 S 8.08 4.27 0.00 3.76 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 H 8.14 4.68 0.00 2.90 2.72 0.00 5.64 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 37 P 0.00 4.77 0.00 2.15 2.11 0.00 3.83 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 38 E 8.29 4.09 0.00 2.31 2.30 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 2.24 2.57 0.00 39 T 8.14 3.78 4.43 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 0.88 0.00 0.00 40 L 8.08 3.75 0.00 1.30 1.73 0.06 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.92 4.10 0.00 2.20 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 2.39 2.55 0.00 42 K 8.09 4.43 0.00 1.96 1.77 0.00 1.97 0.00 0.00 1.77 0.00 0.00 3.17 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.77 2.00 7.81 43 F 8.22 4.58 0.00 3.35 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.51 4.41 0.00 2.61 2.71 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 45 R 7.90 3.79 0.00 1.42 1.09 0.00 2.96 0.00 0.00 2.84 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.21 0.00 46 F 8.05 5.10 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 47 K 8.16 4.09 0.00 1.87 2.25 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.46 7.81 48 H 8.15 4.39 0.00 3.31 3.47 0.00 5.53 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.62 4.12 0.00 1.58 1.58 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.21 4.32 0.00 1.82 1.84 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.51 7.81 51 T 7.31 4.74 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 52 E 8.76 3.90 0.00 2.04 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 2.36 2.37 0.00 53 A 8.00 3.99 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 54 E 7.94 3.95 0.00 2.11 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 2.35 2.34 0.00 55 M 8.11 4.17 0.00 2.07 2.25 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 2.74 2.59 0.00 56 K 8.30 3.97 0.00 1.82 1.85 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.57 7.81 57 A 7.66 4.48 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 58 S 7.58 4.33 0.00 3.96 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 59 E 8.76 4.00 0.00 2.05 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 2.42 2.33 0.00 60 D 8.14 4.42 0.00 2.93 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 61 L 8.33 3.27 0.00 1.31 1.59 -0.12 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.15 3.88 0.00 1.85 1.95 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.42 7.81 63 K 8.30 3.94 0.00 1.79 1.82 0.00 1.86 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.33 7.81 64 H 8.52 4.64 0.00 3.58 3.53 0.00 5.76 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.32 3.60 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 0.00 0.00 0.00 66 V 7.82 3.59 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 1.04 0.00 0.00 0.96 0.00 0.00 67 T 7.90 3.88 4.45 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 1.29 0.00 0.00 68 V 8.05 3.60 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 1.16 0.00 0.00 0.93 0.00 0.00 69 L 8.25 4.24 0.00 1.79 1.91 0.87 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.29 4.03 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 1.26 0.00 0.00 71 A 8.14 4.00 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 72 L 8.22 3.70 0.00 1.59 1.75 0.23 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.56 3.29 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 74 A 7.83 3.95 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 75 I 7.54 3.76 1.85 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 1.54 1.04 0.89 0.00 0.00 76 L 7.91 3.97 0.00 1.33 1.56 -0.13 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.84 3.90 0.00 1.75 1.79 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.49 7.81 78 K 7.77 3.91 0.00 1.87 1.78 0.00 1.75 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.58 1.76 7.81 79 K 8.27 2.00 0.00 1.16 0.74 0.00 1.40 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.59 1.06 7.81 80 G 7.83 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 7.30 4.55 0.00 3.18 3.22 0.00 5.80 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 82 H 7.30 5.41 0.00 3.28 3.44 0.00 5.66 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.56 3.92 0.00 2.12 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 2.40 2.48 0.00 84 A 7.92 4.03 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 85 E 8.13 4.11 0.00 2.25 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 2.40 2.47 0.00 86 L 8.34 4.31 0.00 1.91 1.72 1.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.98 3.91 0.00 1.86 1.90 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.65 7.81 88 P 0.00 4.33 0.00 2.31 2.34 0.00 3.96 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 2.25 2.05 0.00 89 L 7.59 4.02 0.00 2.00 1.91 0.99 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.47 4.24 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.25 3.89 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 92 S 8.25 4.02 0.00 4.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.69 4.18 0.00 3.60 3.63 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.06 2.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.37 3.98 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 1.10 0.00 0.00 96 K 7.45 4.09 0.00 1.53 1.62 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.19 1.33 7.81 97 H 8.11 4.25 0.00 3.01 3.13 0.00 5.86 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.48 3.29 0.00 1.92 1.70 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.26 1.01 7.81 99 I 7.96 4.39 2.12 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 1.41 1.45 1.17 0.00 0.00 100 P 0.00 4.59 0.00 1.96 1.98 0.00 3.15 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 0.77 1.19 0.00 101 I 8.40 3.66 1.79 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.71 0.80 0.00 0.00 102 C 7.88 4.09 0.00 2.76 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 0.00 103 Y 7.90 4.11 0.00 3.22 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 0.00 104 L 7.90 4.21 0.00 1.84 1.82 0.71 1.18 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 0.00 105 E 8.26 4.01 0.00 2.03 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 2.32 2.44 0.00 106 F 7.97 4.53 0.00 3.18 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 0.00 107 I 8.24 3.87 2.03 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 1.09 0.00 0.00 108 S 8.29 4.19 0.00 4.21 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 0.00 109 E 8.58 4.01 0.00 2.17 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 0.00 2.38 2.42 0.00 110 A 8.14 4.00 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 0.00 111 I 8.07 3.67 2.12 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 1.63 0.75 1.07 0.00 0.00 112 I 8.01 3.82 2.13 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.96 1.15 0.00 0.00 113 H 8.54 4.13 0.00 3.34 3.46 0.00 5.78 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.94 3.55 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 0.96 0.00 0.00 0.94 0.00 0.00 115 L 7.83 3.73 0.00 0.44 0.37 0.83 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.01 4.34 0.00 3.43 3.62 0.00 5.95 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.79 4.13 0.00 3.86 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 0.00 118 R 8.01 4.04 0.00 1.61 1.53 0.00 2.95 0.00 0.00 2.92 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.58 0.00 119 H 8.22 5.07 0.00 3.23 3.23 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.35 0.00 2.17 2.16 0.00 3.84 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 121 G 8.11 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.25 4.94 0.00 2.72 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 0.00 123 F 8.02 4.89 0.00 2.98 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 0.00 124 G 7.77 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 0.00 0.00 0.00 125 A 8.42 3.91 1.28 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 0.00 126 D 7.95 4.17 0.00 2.64 2.66 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 0.00 127 A 7.74 3.87 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 0.00 128 Q 7.82 2.84 0.00 1.29 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 129 G 8.05 3.53 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 0.00 0.00 0.00 130 A 7.97 3.83 1.28 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 0.00 131 M 8.24 3.98 0.00 2.48 2.40 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.96 0.00 132 N 8.58 4.29 0.00 2.85 2.94 0.00 0.00 6.87 6.62 0.00 0.00 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 K 8.16 3.84 0.00 1.93 1.67 0.00 1.59 0.00 0.00 1.51 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.37 7.81 134 A 8.04 3.83 1.28 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 0.00 135 L 8.39 4.10 0.00 1.75 1.84 1.02 0.72 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 0.00 136 E 8.71 3.98 0.00 2.18 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 0.00 2.35 2.68 0.00 137 L 8.17 3.96 0.00 1.87 1.98 1.08 1.01 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 0.00 138 F 8.45 4.15 0.00 3.14 3.34 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 0.00 139 R 8.28 3.39 0.00 1.94 1.82 0.00 3.17 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.99 0.00 140 K 8.34 3.81 0.00 1.82 1.97 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.45 7.81 141 D 8.23 4.34 0.00 2.76 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 I 7.60 3.40 1.22 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 -0.36 0.11 0.00 0.00 143 A 7.97 3.70 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 A 7.98 3.94 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 0.00 145 K 8.08 4.00 0.00 1.97 1.95 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.63 7.81 146 Y 8.68 4.49 0.00 3.03 3.24 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 0.00 147 K 8.16 4.04 0.00 1.79 1.82 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.35 7.81 148 E 7.99 4.23 0.00 2.17 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 2.36 2.53 0.00 149 L 7.91 4.35 0.00 1.85 1.71 1.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.98 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.24 4.75 0.00 2.71 2.66 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 0.00 152 Q 8.36 3.67 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.61 0.00 0.00 0.00 0.00 0.00 2.28 1.93 0.00 153 G 5.38 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 0.00 0.00 0.00