NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9640 8.3549 109.7483 44.5616 0.0000 173.7964 2 L 4.5609 7.6250 117.8560 50.5251 44.8114 175.0337 3 S 4.5886 8.7160 116.9995 57.6163 66.5066 174.7329 4 D 4.6199 8.6752 120.9859 57.3172 41.0050 178.0891 5 G 3.7616 8.1954 105.8782 48.1840 0.0000 175.2967 6 E 3.9637 7.9134 121.3533 58.7669 29.3894 179.5425 7 W 4.3068 8.2678 119.1665 59.5636 29.0570 178.1897 8 Q 4.0497 8.7797 120.0488 59.4044 28.3259 178.4175 9 Q 4.0019 8.0791 120.2955 59.1774 29.1112 178.2218 10 V 3.7926 7.9137 119.2674 66.2503 31.4940 178.0177 11 L 4.2547 8.3969 118.5310 57.2708 41.2365 178.9707 12 N 4.3188 8.0202 116.7497 56.7489 39.2601 176.7116 13 V 3.7234 8.0541 119.7080 65.8283 31.5455 177.7031 14 W 4.2753 8.5308 128.2408 60.3804 30.2229 177.9880 15 G 3.6540 7.8220 104.8851 47.7905 0.0000 175.4623 16 K 4.0121 7.9541 120.6270 59.1130 32.0094 179.6738 17 V 2.7579 6.9252 117.9857 65.7198 31.1726 177.7606 18 E 3.7621 7.5219 116.9531 59.1949 29.2540 178.9711 19 A 4.2148 7.2864 119.7678 54.0631 19.6661 177.6055 20 D 4.6705 7.8739 116.7986 52.1180 42.4799 175.3893 21 I 3.7777 7.8108 117.7844 63.1016 37.9755 178.2446 22 A 4.0118 7.9216 122.4488 55.0732 18.5026 179.7045 23 G 3.5495 8.2203 105.6450 47.5911 0.0000 175.7692 24 H 4.2053 8.3425 118.6833 58.5094 28.8564 178.0343 25 G 3.5838 8.2670 107.8431 47.7891 0.0000 175.5276 26 Q 3.8341 8.1817 122.1431 58.9887 29.1622 178.1251 27 E 3.8548 7.9486 119.3315 59.1783 29.3734 179.3752 28 V 3.5133 7.9900 118.5945 66.1291 31.6025 178.0441 29 L 3.4264 7.5008 117.9552 57.7157 41.3247 179.6948 30 I 3.6474 7.7459 119.9218 64.1110 36.8838 178.4749 31 R 3.7739 7.9113 119.5609 59.2382 29.8956 178.0808 32 L 3.9317 7.8083 120.0629 58.5441 41.7671 179.0959 33 F 4.5936 8.3251 118.1443 60.5505 38.5795 177.6542 34 T 4.1761 8.0725 108.9767 64.2699 69.1292 177.0485 35 G 3.7040 8.1541 107.7182 46.0768 0.0000 173.5457 36 H 4.7564 8.3693 118.1426 51.8672 29.5144 171.7634 37 P 4.5939 0.0000 0.0000 64.5446 31.2002 177.4586 38 E 4.1320 8.2681 116.0722 59.2926 29.4368 179.1219 39 T 3.8220 8.3462 111.7164 64.4368 68.6798 176.0941 40 L 3.4343 7.7644 123.0601 58.0665 41.8181 178.7642 41 E 4.0549 7.6791 115.3079 58.6011 29.4498 178.6593 42 K 4.4317 7.9644 117.2716 56.4393 32.6531 176.5128 43 F 4.6691 8.1460 119.6358 55.4856 39.7052 176.1711 44 D 4.4534 8.6117 126.7703 57.0781 40.9174 178.1798 45 E 3.9992 7.9742 117.5566 58.2393 29.7379 177.2636 46 F 5.1366 7.6143 114.7428 56.6611 40.7633 176.8157 47 K 4.0556 8.0402 120.2332 59.3994 32.5127 178.0871 48 H 4.3239 8.2728 114.9365 58.1663 28.7154 176.1899 49 L 4.0004 7.2403 119.2811 54.8986 42.0633 176.2187 50 K 4.3367 9.6755 121.0039 57.6178 34.5894 177.5044 51 T 4.5027 7.6874 108.1355 60.1580 72.1583 175.0289 52 E 3.9674 8.5165 121.0945 58.9299 29.5436 178.7446 53 A 3.9218 7.8493 120.6713 55.2480 18.4036 179.2183 54 E 3.9037 7.8710 115.6935 59.7741 29.8870 179.3074 55 M 4.1574 7.8593 118.3366 58.4171 31.8408 178.9210 56 K 3.9260 8.2505 117.4450 59.0460 32.3118 178.3467 57 A 4.4958 7.8885 118.3653 51.3318 18.7227 177.0175 58 S 4.3238 7.5144 113.9814 57.5706 62.6532 174.7143 59 E 4.1388 8.7755 128.4088 59.1142 29.2725 178.5608 60 D 4.4390 8.1207 117.9811 57.0406 41.2694 177.8287 61 L 3.4248 7.8538 120.7759 57.6670 42.0106 179.0688 62 K 3.8843 7.6836 117.4383 59.1376 31.9741 178.9248 63 K 3.8608 8.2032 119.9898 60.1166 32.0461 178.1400 64 H 4.3443 8.7954 118.6702 59.2614 29.6835 177.2392 65 G 3.6441 8.4263 107.8302 48.0953 0.0000 175.7827 66 T 3.8501 7.8893 117.9144 66.3448 68.6328 176.7328 67 V 3.5985 7.7083 120.1323 66.1135 31.4784 177.9993 68 V 3.6095 7.9825 117.9632 66.3279 31.4441 178.1101 69 L 4.2571 8.2950 118.4441 57.6522 41.3906 179.7499 70 T 3.9804 8.3683 116.4576 66.5721 68.4235 176.5097 71 A 3.9996 7.9863 122.4621 54.9007 18.3235 179.4166 72 L 3.6695 8.1683 119.0694 58.1061 42.1988 179.1421 73 G 3.2363 8.1944 105.8223 47.7953 0.0000 175.5317 74 G 3.6912 7.7212 106.9582 47.5116 0.0000 175.5250 75 I 3.8275 7.4341 121.8928 64.1999 37.2121 178.4758 76 L 3.9027 7.7650 120.0121 57.7139 41.1609 179.4891 77 K 4.0164 7.6533 116.5232 58.0431 32.3258 178.5374 78 K 3.9752 8.1124 118.7248 55.6526 32.9659 176.2836 79 K 2.0000 8.0961 118.4781 56.4126 29.7031 175.5483 80 G 3.9440 7.6659 105.5660 45.7878 0.0000 173.2124 81 H 4.7276 7.4493 118.9692 55.5508 27.8238 174.9859 82 H 5.7403 7.2070 110.4293 54.7479 29.7035 176.4716 83 E 3.9514 8.5867 121.4677 60.2385 28.9783 178.8392 84 A 4.0069 7.9418 118.4172 55.4696 18.8171 179.1181 85 E 4.0882 8.1059 116.5157 59.2261 29.5630 179.1921 86 L 3.9849 8.6371 120.8867 57.7217 42.1166 178.3992 87 K 3.8297 8.1455 120.1084 59.3522 31.9602 176.6062 88 P 4.2455 0.0000 0.0000 65.7553 31.1222 177.9844 89 L 3.9696 7.9242 119.3119 57.9386 42.1619 178.6788 90 A 4.1184 8.3505 121.0895 55.2291 18.2342 179.6617 91 Q 3.8985 8.4918 117.1921 59.1674 28.7675 179.2052 92 S 4.0091 8.4422 115.6829 61.7737 63.0098 176.2372 93 H 4.1473 8.6186 119.5395 58.0386 28.4409 177.6869 94 A 2.5800 7.7892 122.8132 54.6107 18.2080 179.1196 95 T 3.9364 7.5232 109.0379 62.4975 67.7911 175.2710 96 K 4.1478 7.4350 119.9592 58.5669 33.1390 177.0418 97 H 4.2826 7.9330 114.3830 56.2273 29.4399 175.5341 98 K 3.4942 7.4144 116.8115 56.1553 28.7272 175.4377 99 I 4.4456 7.9486 118.5877 58.5309 38.5406 174.8523 100 P 4.4950 0.0000 0.0000 62.4047 31.8730 177.3674 101 I 3.6267 8.6379 120.0863 64.1113 37.6187 177.9625 102 K 3.6548 7.9066 120.1562 59.6902 31.8836 178.1029 103 Y 4.1386 7.7965 116.8362 61.0041 37.7459 178.4895 104 L 4.1888 7.8563 119.6503 57.4421 41.7626 178.8956 105 E 3.9554 8.1655 119.4592 59.2636 29.6290 178.5876 106 F 4.4953 8.2718 118.1338 61.1058 39.0395 177.6963 107 I 3.8443 8.2015 117.8470 64.0541 37.6962 178.0273 108 S 4.2274 8.3190 116.2712 61.7755 62.6347 176.4508 109 D 4.4384 8.3357 121.3083 57.3046 40.6590 178.6024 110 A 4.0354 8.2581 121.3033 55.1904 18.3124 179.6790 111 I 3.6563 8.0318 118.2935 64.7241 37.3562 178.6674 112 I 3.8463 7.6795 120.1659 64.5834 36.8603 177.7214 113 H 4.1007 8.5197 119.2010 59.4574 29.6334 177.2282 114 V 3.5463 7.7273 119.5199 66.0904 31.3509 177.8491 115 L 3.8514 7.9715 118.6148 58.2470 41.1758 179.3721 116 H 4.4120 8.1856 115.7645 58.8101 28.3692 177.9113 117 S 4.1404 7.9898 114.5575 61.2353 62.3485 175.9394 118 K 4.0905 8.2307 120.0835 57.8208 33.2990 176.8522 119 H 4.9309 8.0873 115.7439 53.5480 29.2219 172.0649 120 P 4.6034 0.0000 0.0000 64.1587 31.6688 177.3132 121 G 4.1099 9.5824 112.9043 45.0102 0.0000 172.6617 122 D 5.0250 8.1077 118.8679 53.2244 39.9560 176.2810 123 F 5.0060 8.1029 120.9566 56.0034 39.3309 174.3408 124 G 3.8451 8.0932 111.9116 44.0942 0.0000 170.7491 125 A 3.8417 8.3295 121.7742 54.8839 18.3237 179.7801 126 D 4.2224 7.9247 117.0961 56.4077 39.7066 178.5340 127 A 4.0532 7.7216 123.1628 54.3105 18.4676 178.9316 128 Q 3.5703 8.1246 118.6220 59.1673 28.9318 178.8962 129 G 3.6099 7.7839 105.8802 47.9578 0.0000 175.4941 130 A 3.8750 8.0555 123.8273 54.6976 18.3905 179.3797 131 M 4.0168 8.2665 116.8043 59.0596 32.3367 178.4566 132 T 3.9126 8.2603 116.2017 66.8295 68.6086 176.6924 133 K 4.0472 8.0108 119.9765 59.4501 32.0082 179.3325 134 A 3.8526 7.8977 121.0659 54.9740 18.2659 179.7179 135 L 4.0939 8.1475 117.6687 57.9341 41.5714 179.5975 136 E 4.0245 8.3793 118.8221 59.1003 29.4137 179.0089 137 L 3.9521 8.2629 120.7435 58.1121 42.2961 178.4726 138 F 4.1772 8.2889 120.5542 61.6826 39.1914 177.0119 139 R 3.5503 8.1682 117.9333 59.3886 29.8092 178.0047 140 N 4.2459 8.4094 117.0746 56.7614 38.7497 176.7278 141 D 4.3539 8.1557 120.3493 57.1261 40.7618 178.8832 142 I 3.4618 7.3643 119.9436 64.2121 37.0936 178.0718 143 A 3.7892 7.9586 121.6908 55.1085 18.2109 179.3309 144 A 3.9543 8.0294 119.0249 55.6011 18.5672 180.1725 145 K 4.0657 7.8113 116.5958 59.6162 32.0681 179.3526 146 Y 4.2764 8.4181 117.6671 60.8538 37.6931 178.2731 147 K 3.9524 8.3147 120.5814 59.7960 32.1115 178.6899 148 E 3.9807 7.9660 117.0832 59.0775 29.4602 178.5437 149 L 4.3766 7.7243 116.0942 54.1354 42.0200 177.1488 150 G 3.9080 7.9708 107.0670 46.5987 0.0000 175.0394 151 F 4.4669 7.9731 123.3911 55.6077 37.7698 174.4200 152 Q 4.0313 8.0913 125.6971 58.2273 29.2769 177.0722 153 G 3.3971 6.9426 108.9321 45.6318 0.0000 172.0303 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 G 8.35 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 2 L 7.63 4.56 0.00 0.77 0.69 0.52 -0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.72 4.59 0.00 4.08 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.68 4.62 0.00 2.91 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 5 G 8.20 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 6 E 7.91 3.96 0.00 1.93 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 2.24 2.28 0.00 7 W 8.27 4.31 0.00 3.52 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 8 Q 8.78 4.05 0.00 2.37 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 9 Q 8.08 4.00 0.00 2.34 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 10 V 7.91 3.79 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 1.14 0.00 0.00 0.85 0.00 0.00 11 L 8.40 4.25 0.00 1.84 1.79 0.93 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.02 4.32 0.00 2.77 3.06 0.00 0.00 7.14 7.58 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 13 V 8.05 3.72 2.33 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 0.81 0.00 0.00 1.23 0.00 0.00 14 W 8.53 4.28 0.00 3.61 3.22 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 15 G 7.82 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.95 4.01 0.00 1.64 1.55 0.00 1.46 0.00 0.00 1.16 0.00 0.00 3.05 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.34 1.33 7.81 17 V 6.93 2.76 1.18 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 0.06 0.00 0.00 0.31 0.00 0.00 18 E 7.52 3.76 0.00 1.95 1.92 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 2.16 2.07 0.00 19 A 7.29 4.21 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 20 D 7.87 4.67 0.00 2.66 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.81 3.78 1.80 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 0.61 0.86 0.00 0.00 22 A 7.92 4.01 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 8.22 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 4.21 0.00 3.17 3.22 0.00 5.83 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 8.27 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 0.00 0.00 0.00 26 Q 8.18 3.83 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 27 E 7.95 3.85 0.00 2.07 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 2.26 2.36 0.00 28 V 7.99 3.51 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 1.01 0.00 0.00 0.99 0.00 0.00 29 L 7.50 3.43 0.00 1.50 0.79 0.77 0.51 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 30 I 7.75 3.65 1.78 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 1.32 0.71 0.87 0.00 0.00 31 R 7.91 3.77 0.00 1.94 2.12 0.00 3.05 0.00 0.00 2.99 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 32 L 7.81 3.93 0.00 1.73 1.51 1.08 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.33 4.59 0.00 2.96 2.94 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 34 T 8.07 4.18 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 1.26 0.00 0.00 35 G 8.15 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 36 H 8.37 4.76 0.00 3.03 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.85 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 4.59 0.00 2.16 2.12 0.00 3.85 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 2.11 2.01 0.00 38 E 8.27 4.13 0.00 2.30 2.32 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 2.38 2.62 0.00 39 T 8.35 3.82 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 40 L 7.76 3.43 0.00 1.48 1.76 -0.08 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.68 4.05 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 42 K 7.96 4.43 0.00 1.85 1.72 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.21 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.69 1.96 7.81 43 F 8.15 4.67 0.00 3.12 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.61 4.45 0.00 2.63 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 E 7.97 4.00 0.00 1.18 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 2.12 2.14 0.00 46 F 7.61 5.14 0.00 2.75 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 47 K 8.04 4.06 0.00 1.90 2.13 0.00 1.86 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.47 1.40 7.81 48 H 8.27 4.32 0.00 3.32 3.51 0.00 5.54 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.24 4.00 0.00 1.61 1.56 0.82 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.68 4.34 0.00 1.76 1.78 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.28 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.47 7.81 51 T 7.69 4.50 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 8.52 3.97 0.00 2.04 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 2.35 2.35 0.00 53 A 7.85 3.92 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 54 E 7.87 3.90 0.00 2.09 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 2.35 0.00 55 M 7.86 4.16 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.56 0.00 56 K 8.25 3.93 0.00 1.84 1.85 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.58 7.81 57 A 7.89 4.50 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 58 S 7.51 4.32 0.00 3.92 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 59 E 8.78 4.14 0.00 2.04 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 2.40 2.31 0.00 60 D 8.12 4.44 0.00 2.87 2.95 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 61 L 7.85 3.42 0.00 1.20 1.59 0.45 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.68 3.88 0.00 2.04 1.82 0.00 1.70 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.39 7.81 63 K 8.20 3.86 0.00 1.99 2.16 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.52 7.81 64 H 8.80 4.34 0.00 3.70 3.52 0.00 5.85 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 8.43 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 66 T 7.89 3.85 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 1.23 0.00 0.00 67 V 7.71 3.60 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 1.06 0.00 0.00 1.00 0.00 0.00 68 V 7.98 3.61 2.21 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 1.05 0.00 0.00 1.02 0.00 0.00 69 L 8.30 4.26 0.00 1.77 1.84 0.82 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.37 3.98 4.46 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 1.26 0.00 0.00 71 A 7.99 4.00 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 72 L 8.17 3.67 0.00 1.61 1.64 0.06 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.19 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 0.00 0.00 0.00 74 G 7.72 3.69 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 0.00 0.00 0.00 75 I 7.43 3.83 1.87 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.66 0.90 0.00 0.00 76 L 7.77 3.90 0.00 1.24 1.50 0.08 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.65 4.02 0.00 1.62 1.77 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.41 1.42 7.81 78 K 8.11 3.98 0.00 1.74 1.80 0.00 1.77 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.60 1.72 7.81 79 K 8.10 2.00 0.00 1.23 0.74 0.00 1.52 0.00 0.00 1.41 0.00 0.00 2.78 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.71 0.84 7.81 80 G 7.67 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 81 H 7.45 4.73 0.00 3.19 3.22 0.00 5.81 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.21 5.74 0.00 3.27 3.44 0.00 5.66 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.59 3.95 0.00 2.09 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 2.42 2.47 0.00 84 A 7.94 4.01 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 85 E 8.11 4.09 0.00 2.09 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 2.39 2.42 0.00 86 L 8.64 3.98 0.00 1.73 1.77 0.86 0.40 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 87 K 8.15 3.83 0.00 2.05 1.84 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.63 1.50 7.81 88 P 0.00 4.25 0.00 2.33 2.31 0.00 3.69 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 2.23 2.05 0.00 89 L 7.92 3.97 0.00 1.83 2.04 0.87 1.11 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 90 A 8.35 4.12 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 91 Q 8.49 3.90 0.00 2.22 2.13 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 2.37 2.56 0.00 92 S 8.44 4.01 0.00 3.93 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 8.62 4.15 0.00 3.52 3.60 0.00 5.80 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 7.79 2.58 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.52 3.94 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 1.19 0.00 0.00 96 K 7.44 4.15 0.00 1.58 1.58 0.00 1.75 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.19 1.33 7.81 97 H 7.93 4.28 0.00 2.99 3.18 0.00 5.86 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 98 K 7.41 3.49 0.00 1.89 1.95 0.00 1.88 0.00 0.00 2.12 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.32 7.81 99 I 7.95 4.45 2.11 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.97 1.22 0.00 0.00 100 P 0.00 4.50 0.00 1.82 1.88 0.00 3.17 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 0.49 1.38 0.00 101 I 8.64 3.63 1.85 0.00 0.00 0.47 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 1.13 0.86 0.00 0.00 102 K 7.91 3.65 0.00 1.65 1.48 0.00 1.70 0.00 0.00 1.84 0.00 0.00 3.11 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.30 1.15 7.81 103 Y 7.80 4.14 0.00 3.25 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 0.00 104 L 7.86 4.19 0.00 1.79 1.71 0.77 0.98 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 8.17 3.96 0.00 2.01 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 0.00 2.42 2.40 0.00 106 F 8.27 4.50 0.00 3.32 2.94 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 0.00 107 I 8.20 3.84 2.04 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 1.12 0.00 0.00 108 S 8.32 4.23 0.00 4.23 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 0.00 109 D 8.34 4.44 0.00 3.00 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 0.00 110 A 8.26 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.03 3.66 2.13 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.78 0.98 0.00 0.00 112 I 7.68 3.85 2.14 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.24 1.13 0.00 0.00 113 H 8.52 4.10 0.00 3.31 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 0.00 114 V 7.73 3.55 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 0.97 0.00 0.00 0.95 0.00 0.00 115 L 7.97 3.85 0.00 1.30 0.55 0.43 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.19 4.41 0.00 3.40 3.38 0.00 5.62 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.99 4.14 0.00 3.83 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 0.00 118 K 8.23 4.09 0.00 1.71 1.44 0.00 1.70 0.00 0.00 1.40 0.00 0.00 2.67 0.00 0.00 2.22 0.00 0.00 0.00 0.00 1.27 1.32 7.81 119 H 8.09 4.93 0.00 3.21 3.52 0.00 5.62 0.00 0.00 0.00 0.00 6.77 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 4.60 0.00 2.19 2.10 0.00 3.42 0.00 0.00 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.92 0.00 121 G 9.58 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.11 5.03 0.00 2.77 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 0.00 123 F 8.10 5.01 0.00 2.78 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 0.00 124 G 8.09 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 0.00 0.00 0.00 125 A 8.33 3.84 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 0.00 126 D 7.92 4.22 0.00 2.89 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 0.00 127 A 7.72 4.05 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 8.12 3.57 0.00 1.39 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 129 G 7.78 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.06 3.87 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 0.00 131 M 8.27 4.02 0.00 2.41 2.38 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.79 0.00 132 T 8.26 3.91 4.41 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 1.23 0.00 0.00 133 K 8.01 4.05 0.00 1.83 1.69 0.00 1.58 0.00 0.00 1.52 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.51 7.81 134 A 7.90 3.85 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 0.00 135 L 8.15 4.09 0.00 1.92 1.84 1.04 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 0.00 136 E 8.38 4.02 0.00 2.25 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 2.42 0.00 137 L 8.26 3.95 0.00 1.84 1.94 0.99 1.33 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 8.29 4.18 0.00 3.02 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 0.00 139 R 8.17 3.55 0.00 2.14 1.99 0.00 3.11 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.49 0.00 140 N 8.41 4.25 0.00 2.93 2.88 0.00 0.00 7.23 9.23 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 0.00 141 D 8.16 4.35 0.00 2.85 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 0.00 142 I 7.36 3.46 1.46 0.00 0.00 -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 1.05 0.27 0.05 0.00 0.00 143 A 7.96 3.79 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 0.00 144 A 8.03 3.95 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 K 7.81 4.07 0.00 1.95 1.93 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.69 1.63 7.81 146 Y 8.42 4.28 0.00 3.10 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 0.00 147 K 8.31 3.95 0.00 2.02 2.02 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.51 7.81 148 E 7.97 3.98 0.00 2.14 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 2.60 0.00 149 L 7.72 4.38 0.00 1.74 1.68 0.89 0.89 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 0.00 150 G 7.97 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 F 7.97 4.47 0.00 2.75 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 8.09 4.03 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.60 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 153 G 6.94 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00