NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4067 8.3044 120.3476 55.1990 32.8583 176.0555 2 K 3.7825 8.7399 115.7219 57.5971 32.0928 176.5046 3 M 3.7527 7.5183 116.6272 53.7763 32.4443 177.0400 4 L 3.6002 8.5163 122.3245 54.0181 42.6522 174.4102 5 E 3.8053 8.2540 116.1980 58.3360 26.8314 175.1995 6 Q 4.4764 8.3011 114.2998 56.3680 29.3030 177.0948 7 L 3.5357 7.4897 122.2619 58.2100 41.9142 178.5116 8 E 4.2035 7.6734 118.5438 58.1550 29.0777 178.8844 9 K 4.0723 7.4038 118.7206 58.9326 32.4245 178.6392 10 K 4.1410 7.8235 117.7556 59.0695 32.1302 178.4899 11 L 4.1750 8.3165 120.2718 55.6161 42.0385 177.7805 12 G 3.9672 8.6235 105.6780 45.6314 0.0000 172.3610 13 Y 4.7812 7.5770 119.1833 55.9693 41.8783 173.6523 14 T 4.5313 7.5082 122.9603 61.4284 70.1633 174.4172 15 F 4.1659 9.3373 126.7599 57.1654 39.0564 175.5669 16 K 3.9209 8.4647 125.7947 58.5625 32.6227 176.7919 17 D 4.6243 7.9849 122.4768 53.1925 40.9537 177.0761 18 K 4.3350 8.6036 127.7660 57.8752 32.2435 178.3136 19 S 4.2403 9.2545 115.1782 62.3676 63.1153 175.4119 20 L 3.9153 7.7089 120.4349 57.9360 41.2562 178.8801 21 L 3.3925 7.6485 118.8026 58.6409 41.4061 179.4732 22 E 3.9020 7.7215 116.8277 59.1764 28.9057 179.2415 23 K 4.0285 8.3899 119.8784 59.2833 31.9959 178.7968 24 A 4.2073 8.0329 120.5956 54.4619 18.6028 178.6613 25 L 4.4262 7.6372 115.8096 54.4280 42.1887 176.1435 26 T 4.8171 7.2332 116.9010 61.9349 69.9991 173.9983 27 H 4.5666 9.0897 127.1369 55.2396 30.7065 176.4770 28 V 4.1681 7.5458 125.2930 64.0963 31.0890 178.2845 29 S 4.2696 7.9051 113.8881 60.9424 63.1385 175.5406 30 Y 4.2317 7.9442 122.2979 58.8612 39.1517 175.2454 31 S 4.5571 8.1328 115.4876 56.2530 64.7752 174.4382 32 K 4.1465 8.7838 127.1964 58.5449 33.0207 177.8543 33 K 4.3584 7.9799 117.7105 57.3886 32.9743 176.4277 34 E 4.5673 8.0884 117.4493 54.1885 29.9734 173.5541 35 H 5.1488 7.7355 118.5323 52.6869 32.2138 174.5295 36 Y 4.5572 8.2157 118.1215 58.0496 37.2426 177.1010 37 E 4.0785 7.6624 121.2952 60.1840 29.7577 178.6787 38 T 4.1543 7.8677 114.6654 65.9223 68.7768 176.9603 39 L 4.0833 7.9892 120.7512 57.7942 41.7748 178.5801 40 E 3.9975 8.9982 119.5921 59.5600 29.1142 178.8181 41 F 4.1928 8.0298 119.9250 61.1552 39.4779 176.8330 42 L 3.9394 8.0917 119.6321 58.2757 41.9951 179.2430 43 G 4.1948 8.7037 107.0964 47.0702 0.0000 175.1910 44 D 4.3425 8.2106 120.2201 57.2658 41.2575 178.2004 45 A 3.8451 7.3148 121.0770 54.8384 18.3150 178.9834 46 L 3.3646 7.6783 118.8513 58.3889 41.9765 179.4739 47 V 2.6603 7.3302 117.7030 65.5203 31.4200 177.2808 48 N 4.2470 7.9263 116.8574 56.7795 38.6195 176.4577 49 F 4.2415 7.9958 121.6364 61.4650 39.5975 176.8250 50 F 3.8903 7.5847 117.4673 60.7865 38.5002 177.9094 51 I 3.9776 8.1193 119.5401 64.3912 37.0849 178.6524 52 V 3.6272 8.2821 119.5773 65.8551 31.0535 177.6490 53 D 4.3274 8.0921 117.4892 57.1222 41.3673 177.7241 54 L 4.1038 7.8763 120.3823 58.1027 42.2525 178.4583 55 L 4.0102 8.2726 120.7091 58.4105 41.7930 179.0427 56 V 3.7844 7.6843 116.1244 65.1534 31.5338 177.2243 57 Q 4.1433 7.8249 116.6373 57.0734 29.0805 175.8053 58 Y 4.5096 7.6524 113.8302 57.3333 39.5128 175.5824 59 S 4.4381 7.9048 115.8849 57.0093 63.0280 172.1772 60 P 4.3114 0.0000 0.0000 65.1332 31.0985 176.1026 61 N 4.8021 7.2810 115.6913 51.6532 41.6229 173.6790 62 K 4.5720 8.5333 123.3788 56.5899 32.8599 176.8097 63 R 4.5468 8.4365 119.2184 54.7470 32.5280 176.9014 64 E 4.0801 8.9201 121.3313 59.8848 29.1447 179.8508 65 G 3.5974 8.1156 105.1001 47.2344 0.0000 174.6449 66 F 4.4033 8.0588 121.9493 60.2451 39.3031 177.7021 67 L 3.9574 8.2560 118.8797 57.8666 41.5556 179.3139 68 S 4.2326 8.2194 115.4567 61.2138 62.8471 175.1805 69 P 4.2108 0.0000 0.0000 65.6608 30.9833 178.1363 70 L 3.7819 7.2025 120.1879 57.5974 41.8796 178.5663 71 K 3.7471 9.0828 120.1372 59.6618 31.8381 178.0853 72 A 3.9448 8.2176 119.6525 55.6537 18.5327 178.7531 73 Y 4.1033 7.8865 117.6378 60.6501 38.7448 177.3728 74 L 3.3534 7.7961 117.5930 55.5295 41.7257 177.4714 75 I 3.9573 6.7235 111.5771 59.9334 38.1206 176.3463 76 S 4.1468 7.2421 117.3749 57.8868 64.7564 174.5975 77 E 3.8394 8.3856 122.2139 59.4116 29.4153 178.7011 78 E 3.9566 7.9448 118.1836 59.2327 29.5832 178.9611 79 F 4.0521 7.8652 120.6200 61.4023 39.4164 177.1652 80 F 3.8523 8.1155 117.5773 60.6537 38.4523 177.5029 81 N 4.2532 8.0409 116.1436 55.8789 38.0630 177.2063 82 L 3.8158 7.2243 120.8862 58.0977 42.2945 178.7770 83 L 3.7120 7.3571 118.7693 57.3166 41.3310 179.2454 84 A 3.9678 7.7298 121.1232 54.7758 17.9604 179.3537 85 Q 3.9608 7.4094 116.1183 59.4294 28.9614 178.8741 86 K 4.0339 7.3636 116.9128 59.2203 32.3617 178.0237 87 L 4.3230 7.9918 116.9309 54.3576 42.9845 176.0891 88 E 3.9371 8.7708 116.3542 56.6089 28.5835 176.0379 89 L 4.1731 8.1869 119.8912 59.3364 42.1648 179.6189 90 H 4.3722 8.4818 112.1054 57.3530 28.5060 176.1178 91 K 3.9898 7.9983 118.9893 57.3504 32.2324 177.2435 92 F 4.7130 8.2264 115.3461 56.9413 40.4440 175.6390 93 I 4.2543 7.7261 121.7227 61.1935 38.1042 175.5629 94 R 4.4632 8.9947 125.4966 54.5933 31.7053 175.1075 95 I 4.7398 8.3018 123.1057 60.8718 41.5655 174.1230 96 K 4.0308 9.3790 127.8839 57.1665 31.7377 177.5231 97 R 3.9493 8.9007 116.8368 56.5324 31.2931 174.6217 98 G 4.5244 8.3305 116.2900 44.8932 0.0000 173.4827 99 K 4.6265 8.4216 125.2023 55.9319 33.5726 175.5012 100 I 3.7088 7.8132 123.9257 62.6942 38.8879 175.7680 101 N 4.2212 7.9668 118.1178 53.2075 37.9612 174.2999 102 E 4.1390 8.2915 116.1680 58.7546 29.9802 178.8520 103 T 4.1667 7.7448 114.2103 64.3211 67.3348 176.3180 104 I 4.1395 7.1557 123.8676 64.0575 37.1247 178.0764 105 I 3.7875 7.3999 120.3643 64.7176 36.8950 178.6686 106 G 3.7249 8.0792 105.8189 47.6931 0.0000 175.4690 107 D 4.3774 8.0680 121.2184 57.3282 40.8171 179.1263 108 V 3.2090 7.6281 118.7747 65.7409 31.0936 177.7228 109 F 4.0260 8.4669 120.6716 61.4065 39.2198 177.0242 110 E 3.9272 8.5539 118.0295 59.2804 29.2404 179.1570 111 A 4.0952 8.2965 121.3156 54.9736 18.3573 179.1389 112 L 3.7548 8.3945 119.4336 58.4251 41.9977 179.4758 113 W 4.0048 7.7396 117.8500 59.4713 28.9771 178.4494 114 A 4.1586 8.1791 120.2363 55.0806 17.7288 179.4153 115 A 4.1047 8.2536 119.5899 55.2528 18.6581 180.0262 116 V 2.9506 8.1276 117.0744 65.9323 31.5516 177.3328 117 Y 4.5369 8.1827 120.6822 60.3733 38.5682 178.5224 118 I 3.4173 7.7665 120.2614 64.3127 37.1248 177.9137 119 D 4.3916 8.1523 117.3070 56.2034 41.0664 177.2459 120 S 4.4691 7.5751 112.5052 58.5481 63.6520 174.3202 121 G 3.6682 7.7204 110.7099 46.4701 0.0000 173.4786 122 R 2.5100 7.2059 114.1744 56.3403 28.4163 177.3320 123 D 4.7184 8.2305 118.1857 52.9918 41.1604 176.3303 124 A 4.4046 8.7927 130.1908 54.9320 18.5730 178.6027 125 N 4.3968 8.3347 114.7391 56.4741 38.6882 176.8726 126 F 4.0972 8.7318 121.9197 61.9377 39.3429 177.3579 127 T 3.7605 8.0266 114.6582 66.3407 68.2304 176.6292 128 R 2.0000 8.2609 121.5352 58.8690 30.0068 178.5837 129 E 3.7671 8.1715 118.3303 58.9455 29.1637 179.2192 130 L 3.7478 7.6536 121.1326 57.8503 42.1282 178.6120 131 F 3.3818 7.8028 120.7240 61.2979 39.1085 176.7830 132 Y 4.4263 7.5887 116.4434 60.8965 37.4308 178.1038 133 K 3.9190 7.8516 119.8488 59.0432 32.3000 178.2935 134 L 4.0198 7.0292 118.2913 55.7808 42.1417 177.3441 135 F 4.9936 7.5751 114.2313 56.2186 41.1169 176.7260 136 K 3.7893 8.3082 122.6122 59.6205 31.9022 177.8387 137 E 3.8876 8.2125 118.0597 60.0543 29.5277 179.1850 138 D 4.5168 8.1502 117.8047 57.4133 40.8255 178.9509 139 I 3.9700 7.9631 120.5555 64.3120 37.1262 178.3818 140 L 3.9186 8.2599 120.3090 57.5507 41.2723 179.5074 141 S 4.0561 8.0512 112.7236 61.4431 62.1842 176.1373 142 A 4.2838 7.6591 123.1259 54.7054 18.5075 179.3134 143 I 3.8159 8.0523 118.5637 64.2985 36.9201 178.4877 144 K 3.9093 8.3290 118.8252 59.9153 31.9034 179.0742 145 E 4.0645 8.5716 118.3656 58.9970 29.5008 178.4676 146 G 3.9731 7.7127 106.6806 46.4483 0.0000 173.6912 147 R 3.7280 8.4085 120.3005 56.7750 31.0574 176.6583 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 8.30 4.41 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.52 0.00 2 K 8.74 3.78 0.00 1.76 1.71 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.22 1.37 7.81 3 M 7.52 3.75 0.00 2.28 2.22 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.57 0.00 4 L 8.52 3.60 0.00 1.78 1.85 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.25 3.81 0.00 2.29 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 2.23 2.36 0.00 6 Q 8.30 4.48 0.00 2.31 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.91 0.00 0.00 0.00 0.00 0.00 2.89 2.65 0.00 7 L 7.49 3.54 0.00 0.27 1.09 0.48 0.57 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 8 E 7.67 4.20 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.18 0.00 9 K 7.40 4.07 0.00 1.75 1.98 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.53 7.81 10 K 7.82 4.14 0.00 1.86 1.88 0.00 1.99 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.71 7.81 11 L 8.32 4.17 0.00 1.62 1.84 0.54 1.28 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 12 G 8.62 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 13 Y 7.58 4.78 0.00 3.00 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 14 T 7.51 4.53 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 1.12 0.00 0.00 15 F 9.34 4.17 0.00 3.03 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 16 K 8.46 3.92 0.00 2.02 1.79 0.00 1.44 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.43 1.37 7.81 17 D 7.98 4.62 0.00 2.79 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 18 K 8.60 4.34 0.00 1.92 1.77 0.00 1.68 0.00 0.00 1.90 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.48 7.81 19 S 9.25 4.24 0.00 4.07 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.71 3.92 0.00 2.28 2.06 1.10 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.65 3.39 0.00 0.61 1.23 0.59 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 22 E 7.72 3.90 0.00 2.23 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 2.27 2.37 0.00 23 K 8.39 4.03 0.00 1.91 1.98 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.11 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.49 1.53 7.81 24 A 8.03 4.21 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 25 L 7.64 4.43 0.00 1.63 1.84 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.23 4.82 4.39 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 1.25 0.00 0.00 27 H 9.09 4.57 0.00 3.29 3.31 0.00 5.59 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 V 7.55 4.17 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 0.30 0.00 0.00 0.68 0.00 0.00 29 S 7.91 4.27 0.00 4.10 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 30 Y 7.94 4.23 0.00 3.14 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 31 S 8.13 4.56 0.00 4.08 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 32 K 8.78 4.15 0.00 1.88 1.89 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.46 7.81 33 K 7.98 4.36 0.00 1.78 1.91 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.38 1.45 7.81 34 E 8.09 4.57 0.00 1.97 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 2.25 2.39 0.00 35 H 7.74 5.15 0.00 3.20 3.46 0.00 5.65 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 Y 8.22 4.56 0.00 3.25 3.46 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 37 E 7.66 4.08 0.00 2.12 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 2.34 2.43 0.00 38 T 7.87 4.15 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 1.25 0.00 0.00 39 L 7.99 4.08 0.00 1.97 1.98 1.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 40 E 9.00 4.00 0.00 2.33 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.61 0.00 41 F 8.03 4.19 0.00 3.32 3.23 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 42 L 8.09 3.94 0.00 2.06 1.84 1.18 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.70 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 44 D 8.21 4.34 0.00 2.97 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 A 7.31 3.85 1.08 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 0.00 0.00 46 L 7.68 3.36 0.00 1.61 1.24 0.72 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.33 2.66 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 0.96 0.00 0.00 0.57 0.00 0.00 48 N 7.93 4.25 0.00 2.99 3.00 0.00 0.00 6.86 7.76 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 49 F 8.00 4.24 0.00 2.95 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 50 F 7.58 3.89 0.00 2.33 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 I 8.12 3.98 2.08 0.00 0.00 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 1.71 1.00 0.98 0.00 0.00 52 V 8.28 3.63 2.23 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 1.06 0.00 0.00 1.02 0.00 0.00 53 D 8.09 4.33 0.00 2.47 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 54 L 7.88 4.10 0.00 1.97 1.80 0.21 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.27 4.01 0.00 1.97 1.85 0.97 0.98 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 56 V 7.68 3.78 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 0.90 0.00 0.00 0.97 0.00 0.00 57 Q 7.82 4.14 0.00 2.13 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.48 0.00 0.00 0.00 0.00 0.00 2.24 2.47 0.00 58 Y 7.65 4.51 0.00 2.95 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 59 S 7.90 4.44 0.00 4.07 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 60 P 0.00 4.31 0.00 1.97 2.11 0.00 3.93 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.99 0.00 61 N 7.28 4.80 0.00 2.28 2.03 0.00 0.00 7.16 6.53 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 62 K 8.53 4.57 0.00 1.73 1.79 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.34 1.49 7.81 63 R 8.44 4.55 0.00 2.04 1.87 0.00 3.24 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 64 E 8.92 4.08 0.00 2.25 2.25 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 2.38 2.48 0.00 65 G 8.12 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 F 8.06 4.40 0.00 3.14 3.23 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 67 L 8.26 3.96 0.00 1.78 1.74 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.22 4.23 0.00 3.94 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 69 P 0.00 4.21 0.00 2.12 2.23 0.00 3.54 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 2.00 1.98 0.00 70 L 7.20 3.78 0.00 1.62 1.65 0.77 0.51 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 71 K 9.08 3.75 0.00 1.94 1.98 0.00 1.72 0.00 0.00 1.65 0.00 0.00 3.16 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.47 7.81 72 A 8.22 3.94 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 73 Y 7.89 4.10 0.00 2.98 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 74 L 7.80 3.35 0.00 1.63 1.53 0.86 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 75 I 6.72 3.96 1.75 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 1.45 0.49 0.93 0.00 0.00 76 S 7.24 4.15 0.00 4.08 4.05 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 77 E 8.39 3.84 0.00 2.02 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 2.37 2.42 0.00 78 E 7.94 3.96 0.00 2.15 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 2.45 2.44 0.00 79 F 7.87 4.05 0.00 2.23 2.61 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 80 F 8.12 3.85 0.00 2.89 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 81 N 8.04 4.25 0.00 2.94 2.78 0.00 0.00 6.56 6.05 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 82 L 7.22 3.82 0.00 1.73 1.47 0.85 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 83 L 7.36 3.71 0.00 0.64 0.30 0.35 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 84 A 7.73 3.97 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 85 Q 7.41 3.96 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.60 0.00 86 K 7.36 4.03 0.00 2.06 2.01 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.23 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.68 1.73 7.81 87 L 7.99 4.32 0.00 1.88 1.74 1.29 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.77 3.94 0.00 2.50 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 2.43 2.55 0.00 89 L 8.19 4.17 0.00 1.83 1.90 1.10 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 90 H 8.48 4.37 0.00 3.29 3.44 0.00 5.52 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 91 K 8.00 3.99 0.00 1.71 0.89 0.00 1.49 0.00 0.00 1.57 0.00 0.00 2.68 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.09 1.16 7.81 92 F 8.23 4.71 0.00 2.86 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 93 I 7.73 4.25 1.93 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 1.40 0.52 1.03 0.00 0.00 94 R 8.99 4.46 0.00 0.82 0.85 0.00 2.43 0.00 0.00 2.88 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.30 0.00 95 I 8.30 4.74 1.96 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 1.28 0.96 0.96 0.00 0.00 96 K 9.38 4.03 0.00 1.83 1.60 0.00 1.91 0.00 0.00 1.69 0.00 0.00 2.73 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.37 7.81 97 R 8.90 3.95 0.00 1.98 1.88 0.00 3.29 0.00 0.00 3.36 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 98 G 8.33 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 99 K 8.42 4.63 0.00 1.70 1.83 0.00 1.83 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.50 7.81 100 I 7.81 3.71 1.90 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 1.45 1.49 0.93 0.00 0.00 101 N 7.97 4.22 0.00 2.98 2.80 0.00 0.00 7.08 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 0.00 102 E 8.29 4.14 0.00 2.20 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 2.34 2.35 0.00 103 T 7.74 4.17 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 104 I 7.16 4.14 2.30 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.58 1.02 0.00 0.00 105 I 7.40 3.79 2.15 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 0.83 0.93 0.00 0.00 106 G 8.08 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 0.00 107 D 8.07 4.38 0.00 2.60 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 0.00 0.00 0.00 108 V 7.63 3.21 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 1.01 0.00 0.00 0.65 0.00 0.00 109 F 8.47 4.03 0.00 3.21 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.55 3.93 0.00 2.30 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 2.50 2.61 0.00 111 A 8.30 4.10 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 0.00 112 L 8.39 3.75 0.00 1.65 1.50 0.70 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 113 W 7.74 4.00 0.00 3.32 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 0.00 114 A 8.18 4.16 1.50 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 0.00 0.00 115 A 8.25 4.10 1.62 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 0.00 116 V 8.13 2.95 2.12 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 0.42 0.00 0.00 0.61 0.00 0.00 117 Y 8.18 4.54 0.00 3.24 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 0.00 118 I 7.77 3.42 1.89 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 1.37 0.82 0.86 0.00 0.00 119 D 8.15 4.39 0.00 2.66 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 S 7.58 4.47 0.00 4.00 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 0.00 121 G 7.72 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 R 7.21 2.51 0.00 1.72 1.66 0.00 3.02 0.00 0.00 3.01 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.20 0.00 123 D 8.23 4.72 0.00 2.67 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 0.00 124 A 8.79 4.40 1.54 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 0.00 125 N 8.33 4.40 0.00 2.95 2.93 0.00 0.00 6.77 8.13 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 0.00 126 F 8.73 4.10 0.00 3.18 3.17 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 0.00 127 T 8.03 3.76 4.56 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 1.64 0.00 0.00 128 R 8.26 2.00 0.00 1.12 1.61 0.00 3.00 0.00 0.00 2.91 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 129 E 8.17 3.77 0.00 1.94 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 130 L 7.65 3.75 0.00 1.29 1.65 0.85 0.62 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 0.00 131 F 7.80 3.38 0.00 2.14 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 Y 7.59 4.43 0.00 3.03 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 0.00 133 K 7.85 3.92 0.00 1.71 1.95 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.41 7.81 134 L 7.03 4.02 0.00 0.27 0.46 0.91 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 135 F 7.58 4.99 0.00 2.57 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 0.00 136 K 8.31 3.79 0.00 1.80 1.73 0.00 1.25 0.00 0.00 1.45 0.00 0.00 2.69 0.00 0.00 2.27 0.00 0.00 0.00 0.00 1.12 1.08 7.81 137 E 8.21 3.89 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 2.37 2.39 0.00 138 D 8.15 4.52 0.00 2.92 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 0.00 139 I 7.96 3.97 2.04 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.14 0.96 0.00 0.00 140 L 8.26 3.92 0.00 1.69 1.59 0.37 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 141 S 8.05 4.06 0.00 3.95 4.16 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 0.00 142 A 7.66 4.28 1.35 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 0.00 0.00 0.00 143 I 8.05 3.82 2.01 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 1.54 1.28 1.02 0.00 0.00 144 K 8.33 3.91 0.00 1.87 1.88 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.65 7.81 145 E 8.57 4.06 0.00 2.06 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 2.32 2.57 0.00 146 G 7.71 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 0.00 147 R 8.41 3.73 0.00 1.73 1.74 0.00 3.16 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.47 0.00