NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 4.2771 8.1693 122.4952 54.0438 43.2148 176.4000 4 P 4.5421 0.0000 0.0000 62.5446 32.5330 173.9069 5 R 4.7977 9.2120 119.6757 54.3628 33.7057 176.5629 6 V 4.7694 8.4528 122.6007 60.3631 33.8942 175.0932 7 G 4.3035 8.8318 108.2829 44.8815 0.0000 171.0417 8 L 5.3025 8.6220 121.7326 53.2812 45.5694 175.7578 9 G 4.4278 9.3525 111.9251 44.8089 0.0000 171.4401 10 T 5.3590 8.4212 112.1531 60.0117 71.8010 172.4164 11 D 4.7651 8.7692 120.9343 53.2396 45.3817 174.1712 12 V 4.8647 7.9599 122.8288 61.8366 34.5711 173.7630 13 H 5.2160 9.2793 124.5628 53.1314 33.1789 171.2623 14 P 4.8527 0.0000 0.0000 62.5417 32.8560 175.5327 15 I 4.1506 8.3902 123.8183 61.6046 37.9167 174.9821 16 E 4.6036 9.7538 129.3400 53.8948 31.4171 175.1449 17 A 4.1479 8.6241 130.6180 53.8732 18.8589 176.8671 18 G 4.0750 9.1563 112.1579 45.3671 0.0000 174.5002 19 R 4.0043 7.5780 119.1079 55.3702 30.2950 174.2008 20 P 4.3088 0.0000 0.0000 63.3263 32.6977 175.2179 21 C 4.4155 8.8553 123.8737 58.9571 31.7891 171.2822 22 R 5.0175 8.3284 125.1508 54.4711 31.6151 175.5697 23 L 4.6442 9.0223 125.9045 54.8398 45.2966 175.4653 24 L 3.8086 9.6352 125.0206 56.1724 39.1101 174.2681 25 C 4.0311 8.9717 112.3164 60.6236 26.4953 173.0735 26 L 4.7031 7.9990 118.9528 52.9251 44.1518 175.1409 27 E 5.0411 8.3956 119.5206 55.0567 30.9759 176.0076 28 F 4.5878 9.0549 125.2851 55.8829 39.5284 175.9806 29 D 4.5382 8.6215 123.6579 54.4481 41.9537 175.6203 30 D 4.4554 9.3267 116.5522 55.1046 37.8662 173.9554 31 A 4.4539 7.7010 117.2365 51.7152 21.7748 176.3745 32 D 5.1191 7.8794 119.9076 53.3735 42.5343 177.6958 33 G 4.1197 8.6615 110.7232 46.6291 0.0000 171.7962 34 C 4.7113 8.1442 122.6427 58.0195 29.8227 173.7135 35 A 4.2939 8.6399 127.0986 51.2941 18.5325 177.4612 36 G 4.1981 8.1130 111.8935 45.0236 0.0000 172.1843 37 H 4.1822 8.2134 119.5038 59.0180 29.8771 175.7303 38 S 4.6987 7.7248 113.1690 57.4429 63.8746 173.4149 39 D 4.4588 8.2825 118.9584 53.8231 39.0819 177.2968 40 G 3.9315 7.5664 106.7916 47.2743 0.0000 174.7792 41 D 4.7406 8.1129 121.4803 52.7012 40.4290 176.6132 42 V 3.8452 8.3412 128.7840 64.0107 31.4802 178.0415 43 A 3.9692 8.0081 120.6949 54.7045 18.2441 179.2898 44 A 3.9487 8.1179 118.9321 55.5560 18.3960 179.5939 45 H 4.0944 8.2690 114.4614 58.9747 28.7974 177.8062 46 A 3.9830 8.0766 122.4584 55.2134 18.2272 179.5714 47 L 3.9277 8.0612 117.3975 58.1507 41.6591 179.4920 48 C 4.1257 8.3186 116.7035 63.0997 28.1498 175.8848 49 D 4.3435 8.3393 120.1950 57.3885 40.3797 178.8710 50 A 3.8841 8.1763 121.1677 55.0596 18.2827 179.7553 51 L 3.8689 7.9547 117.4283 57.9747 41.7679 179.6659 52 L 3.9692 8.0689 119.2770 57.7953 41.6094 179.8454 53 S 4.1148 8.1726 113.9787 61.2906 62.9236 176.2222 54 A 4.0387 7.9021 123.3008 54.3089 18.1393 178.4662 55 A 3.4652 7.3894 115.9726 50.7850 19.4265 177.2271 56 G 3.7970 7.6191 105.0124 46.9130 0.0000 174.5726 57 L 4.5554 8.6416 117.1139 54.0049 42.6325 177.4328 58 G 3.9238 8.8247 104.0988 44.1957 0.0000 170.9340 59 D 4.8304 8.3947 119.3145 50.9474 42.8904 175.7898 60 L 4.2400 8.5903 117.7438 58.5675 41.5766 180.0162 61 G 3.5019 8.1720 104.8247 48.0208 0.0000 175.5341 62 T 3.8550 7.7287 116.7477 66.3236 68.5429 176.1125 63 I 3.8066 7.0304 119.6465 63.3282 37.7418 177.5809 64 F 4.2555 8.4548 115.9462 57.7274 39.8030 177.6001 65 G 3.9089 7.9890 107.1413 45.2451 0.0000 172.0655 66 T 4.4239 8.2850 115.5817 62.9571 69.8432 174.3186 67 D 4.3867 8.7416 126.9210 54.7185 38.9429 174.3117 68 R 4.1349 7.4981 117.3939 55.6246 30.7700 176.1597 69 P 4.2924 0.0000 0.0000 66.0285 31.5011 178.5693 70 Q 3.8556 8.0788 115.1549 57.7719 28.7666 177.0149 71 W 4.8886 8.1900 116.8492 56.1412 29.6739 175.1332 72 R 3.6690 7.9018 120.0107 57.1539 29.8062 176.6545 73 G 3.8337 8.7531 111.9193 45.7010 0.0000 173.4854 74 A 4.0472 7.6039 123.8114 52.2681 18.8217 178.3026 75 S 4.8693 8.2400 119.5585 57.5123 65.1966 175.8912 76 G 3.5740 8.7908 109.0050 47.7459 0.0000 175.5507 77 A 4.0300 8.0917 122.6600 55.3614 18.3463 179.1136 78 D 4.4712 8.2615 117.0859 58.0202 40.9387 179.2756 79 M 4.0245 7.8124 119.0006 58.4424 31.9167 178.9202 80 I 3.7878 8.2643 120.3614 64.5119 37.2209 178.7700 81 R 4.0261 8.3062 119.0253 59.3848 29.9330 178.6308 82 H 4.2395 8.4448 118.1351 59.4227 29.8879 177.5931 83 V 3.5837 8.1143 120.1110 65.7330 31.2502 177.8299 84 R 3.9861 8.5690 119.2195 59.4634 29.8494 178.6998 85 G 3.6220 7.9192 105.0262 47.7814 0.0000 175.5836 86 L 3.9646 7.7796 121.3560 57.4152 41.6970 179.7237 87 V 3.6727 8.0024 118.2542 66.2674 31.5279 177.9830 88 E 4.3743 8.3541 119.6966 59.0505 29.0768 179.0240 89 N 4.3453 8.3792 115.7431 56.1751 38.7074 176.5311 90 A 4.2844 7.7804 119.2519 52.6852 18.9062 178.0011 91 G 3.7279 8.2192 106.7702 44.7572 0.0000 173.0249 92 F 5.2514 7.9126 117.7714 55.7788 41.7721 174.8085 93 V 4.3999 8.9354 122.2243 61.3716 33.4276 174.7564 94 I 4.2216 8.4708 129.2140 61.3680 37.2443 175.9097 95 G 3.9132 9.3680 116.3232 48.3905 0.0000 173.1582 96 N 5.1624 7.8082 116.3882 51.7596 40.7139 172.4058 97 A 5.2661 8.6854 120.2468 50.9192 23.4242 175.2243 98 T 5.2555 9.0719 109.0419 60.0920 72.9261 173.3496 99 V 4.9705 8.9133 122.4852 60.2232 35.2611 173.5266 100 Q 5.0898 9.1854 125.8457 54.3230 31.4322 174.1938 101 V 4.3865 8.6240 126.9701 62.0568 33.5839 174.5818 102 I 4.7891 9.3712 128.9890 60.3970 39.2347 175.1691 103 G 4.2001 8.0744 116.2486 46.6130 0.0000 172.1293 104 N 4.6422 8.7302 117.4979 55.2478 39.0671 176.2671 105 R 4.6005 7.4668 114.5619 53.3527 33.4938 173.5879 106 P 4.4870 0.0000 0.0000 61.7631 32.4673 175.6380 107 K 4.2050 8.2648 118.3863 55.9697 32.8073 177.6101 108 V 3.9573 8.6814 123.8911 65.5497 32.4019 178.1354 109 G 4.0429 8.0362 108.4162 48.3687 0.0000 173.6661 110 P 4.2799 0.0000 0.0000 64.3272 31.6141 177.6403 111 R 4.5551 8.1481 115.3005 55.9309 30.7514 177.8647 112 R 3.9196 8.0759 120.5191 59.7558 29.9907 178.5505 113 E 3.9681 8.1121 117.8720 59.2670 29.4874 178.7178 114 E 4.0375 8.1763 118.6934 59.1720 29.7203 178.3986 115 A 4.0011 8.2597 121.0269 55.5337 18.3975 179.6101 116 Q 3.9705 8.2569 116.4066 59.1017 28.8252 179.1553 117 Q 3.9587 8.0773 119.0178 58.9833 28.9567 178.9240 118 V 3.5858 7.8926 119.0700 66.2488 31.5287 178.1546 119 L 4.0848 8.1279 118.6372 57.7697 41.3494 179.6410 120 S 4.7496 8.2845 116.8051 61.1372 62.5040 176.5411 121 E 3.9750 7.9060 120.2014 59.4531 29.2818 179.0998 122 L 4.1900 7.6382 117.5476 57.5555 41.8442 179.2087 123 V 3.8812 8.0392 117.7057 63.4696 31.5097 176.9285 124 G 3.8741 9.6272 105.4199 45.3508 0.0000 172.4247 125 A 4.7898 7.4153 119.2193 49.2581 23.1581 174.6324 126 P 4.5119 0.0000 0.0000 63.2302 32.3800 175.1768 127 V 4.7920 8.2651 125.0240 61.1439 33.0736 175.1275 128 S 4.7445 8.8762 124.8008 57.9842 64.3380 173.3385 129 V 4.9575 8.7161 124.2413 61.1976 33.7037 174.6057 130 S 4.9164 9.0197 120.7527 57.1023 67.1342 172.2007 131 A 5.1738 8.2995 119.8404 51.1571 22.1311 175.3907 132 T 4.7202 8.8533 113.4816 60.9302 71.4537 173.5648 133 T 4.9997 8.4348 117.7857 60.8574 71.2068 174.2919 134 T 4.3610 8.3210 108.4381 60.7712 69.0969 174.2884 135 D 4.5202 8.5399 120.0535 55.9232 38.7562 174.7340 136 G 3.9138 8.5485 104.0651 45.6962 0.0000 173.8709 137 L 4.5896 7.5393 119.0684 53.5517 44.4112 177.8241 138 G 4.2324 8.3609 110.2283 44.1884 0.0000 173.8828 139 L 4.0800 8.5087 118.2286 58.6684 39.9255 178.1264 140 T 4.6553 7.6564 106.1512 61.1277 69.8397 174.9209 141 G 4.2283 8.7030 113.2716 48.3553 0.0000 175.3590 142 R 4.1168 7.7389 118.6925 55.5537 30.7239 177.6784 143 G 3.9306 8.3276 111.8883 45.1237 0.0000 174.9940 144 E 3.9950 8.3837 122.9909 58.7122 30.0449 175.7904 145 G 4.4343 7.3796 102.3459 45.6212 0.0000 172.2141 146 L 5.1595 9.0281 119.3441 52.6895 45.1509 176.1342 147 A 5.3298 8.7979 123.1752 50.2201 22.9186 174.8607 148 A 5.1042 8.8367 119.8921 50.2806 23.3343 175.1200 149 I 5.0422 8.8573 120.5135 59.1170 41.1933 174.1282 150 A 5.3989 9.6019 130.9528 50.3040 22.4746 174.7692 151 T 5.1887 8.6993 109.4069 60.0320 72.6402 172.7168 152 A 5.1262 8.6464 122.8355 50.4786 23.5329 174.9174 153 L 5.1005 8.8624 121.1966 53.5229 45.3787 175.9385 154 V 5.0884 8.8752 118.4051 59.7163 36.4293 174.2693 155 A 5.1143 8.9690 121.9237 50.2485 22.8078 175.7436 156 A 4.4931 8.9197 123.7416 51.9604 19.2968 177.5794 157 E 4.6923 8.3796 118.3859 55.5969 29.8469 175.2522 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 3 L 8.17 4.28 0.00 1.62 1.66 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.54 0.00 2.21 2.07 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 5 R 9.21 4.80 0.00 1.59 1.80 0.00 3.14 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 6 V 8.45 4.77 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.95 0.00 0.00 7 G 8.83 4.30 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 0.00 8 L 8.62 5.30 0.00 1.60 1.46 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 9 G 9.35 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 0.00 0.00 0.00 0.00 10 T 8.42 5.36 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 1.20 0.00 0.00 11 D 8.77 4.77 0.00 2.79 2.60 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 12 V 7.96 4.86 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 0.81 0.00 0.00 0.89 0.00 0.00 13 H 9.28 5.22 0.00 3.04 3.09 0.00 5.67 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.85 0.00 2.12 2.18 0.00 3.76 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.01 0.00 15 I 8.39 4.15 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 1.09 0.51 0.94 0.00 0.00 16 E 9.75 4.60 0.00 1.89 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.23 0.00 17 A 8.62 4.15 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 9.16 4.08 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 0.00 19 R 7.58 4.00 0.00 2.11 1.87 0.00 3.18 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 20 P 0.00 4.31 0.00 2.13 2.20 0.00 3.69 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 2.08 1.98 0.00 21 C 8.86 4.42 0.00 3.06 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 22 R 8.33 5.02 0.00 2.00 1.95 0.00 3.40 0.00 0.00 3.28 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 23 L 9.02 4.64 0.00 1.65 1.54 0.54 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 24 L 9.64 3.81 0.00 2.00 1.81 1.02 0.99 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 25 C 8.97 4.03 0.00 3.10 3.03 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 26 L 8.00 4.70 0.00 1.60 1.22 0.75 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.40 5.04 0.00 1.79 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 2.23 2.31 0.00 28 F 9.05 4.59 0.00 2.83 3.03 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 29 D 8.62 4.54 0.00 2.58 2.62 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 30 D 9.33 4.46 0.00 2.89 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 A 7.70 4.45 1.20 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 0.00 0.00 32 D 7.88 5.12 0.00 2.66 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 33 G 8.66 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 0.00 0.00 0.00 34 C 8.14 4.71 0.00 3.15 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.64 4.29 1.27 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 0.00 0.00 36 G 8.11 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 0.00 0.00 0.00 0.00 37 H 8.21 4.18 0.00 3.34 3.34 0.00 5.87 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 38 S 7.72 4.70 0.00 3.87 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 D 8.28 4.46 0.00 2.86 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 G 7.57 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 41 D 8.11 4.74 0.00 2.84 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.34 3.85 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 0.93 0.00 0.00 1.06 0.00 0.00 43 A 8.01 3.97 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.12 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 45 H 8.27 4.09 0.00 3.43 3.33 0.00 5.65 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 46 A 8.08 3.98 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 47 L 8.06 3.93 0.00 1.96 1.75 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 48 C 8.32 4.13 0.00 3.15 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 49 D 8.34 4.34 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 50 A 8.18 3.88 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 51 L 7.95 3.87 0.00 1.85 1.70 0.97 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.07 3.97 0.00 1.66 1.83 0.91 0.66 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 53 S 8.17 4.11 0.00 4.03 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 7.90 4.04 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 55 A 7.39 3.47 0.99 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 0.00 0.00 56 G 7.62 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 L 8.64 4.56 0.00 1.54 1.64 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 58 G 8.82 3.92 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 0.00 0.00 0.00 59 D 8.39 4.83 0.00 3.00 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.59 4.24 0.00 1.74 1.84 0.84 1.38 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 61 G 8.17 3.50 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 0.00 62 T 7.73 3.86 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 63 I 7.03 3.81 1.29 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 1.24 0.16 -0.47 0.00 0.00 64 F 8.45 4.26 0.00 2.76 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 65 G 7.99 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 66 T 8.29 4.42 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 67 D 8.74 4.39 0.00 2.70 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 68 R 7.50 4.13 0.00 2.17 2.20 0.00 3.63 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 69 P 0.00 4.29 0.00 2.09 2.14 0.00 3.91 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00 70 Q 8.08 3.86 0.00 1.47 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.30 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 71 W 8.19 4.89 0.00 3.45 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 7.90 3.67 0.00 1.72 1.80 0.00 3.39 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.42 0.00 73 G 8.75 3.83 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 0.00 0.00 0.00 74 A 7.60 4.05 1.52 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 75 S 8.24 4.87 0.00 4.12 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.79 3.57 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 0.00 77 A 8.09 4.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 D 8.26 4.47 0.00 3.04 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 M 7.81 4.02 0.00 1.66 2.09 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 1.15 0.00 80 I 8.26 3.79 1.91 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 1.55 0.73 0.95 0.00 0.00 81 R 8.31 4.03 0.00 1.96 2.06 0.00 3.18 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.85 0.00 82 H 8.44 4.24 0.00 3.68 3.70 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 83 V 8.11 3.58 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 1.03 0.00 0.00 1.11 0.00 0.00 84 R 8.57 3.99 0.00 1.91 2.11 0.00 3.38 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 85 G 7.92 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 86 L 7.78 3.96 0.00 1.84 1.69 0.75 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 87 V 8.00 3.67 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 1.09 0.00 0.00 0.98 0.00 0.00 88 E 8.35 4.37 0.00 2.07 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 2.54 2.45 0.00 89 N 8.38 4.35 0.00 2.85 2.89 0.00 0.00 7.04 7.17 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 90 A 7.78 4.28 1.52 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 91 G 8.22 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 F 7.91 5.25 0.00 3.14 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 93 V 8.94 4.40 2.24 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 0.99 0.00 0.00 0.96 0.00 0.00 94 I 8.47 4.22 1.89 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 1.30 0.69 0.92 0.00 0.00 95 G 9.37 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 96 N 7.81 5.16 0.00 2.90 2.89 0.00 0.00 5.77 7.05 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 97 A 8.69 5.27 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 9.07 5.26 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 1.21 0.00 0.00 99 V 8.91 4.97 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 0.80 0.00 0.00 0.93 0.00 0.00 100 Q 9.19 5.09 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.94 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 101 V 8.62 4.39 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 0.89 0.00 0.00 0.90 0.00 0.00 102 I 9.37 4.79 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.83 0.89 0.00 0.00 103 G 8.07 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 0.00 0.00 0.00 0.00 104 N 8.73 4.64 0.00 2.70 2.85 0.00 0.00 6.70 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 0.00 105 R 7.47 4.60 0.00 1.69 1.74 0.00 3.34 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 106 P 0.00 4.49 0.00 1.89 1.90 0.00 3.46 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.01 0.00 107 K 8.26 4.20 0.00 1.81 1.82 0.00 1.75 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.37 7.81 108 V 8.68 3.96 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 1.05 0.00 0.00 0.84 0.00 0.00 109 G 8.04 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.28 0.00 2.10 2.16 0.00 3.85 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 2.08 2.15 0.00 111 R 8.15 4.56 0.00 1.85 1.74 0.00 2.93 0.00 0.00 2.51 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 112 R 8.08 3.92 0.00 2.16 1.95 0.00 3.32 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 113 E 8.11 3.97 0.00 2.05 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 2.40 2.37 0.00 114 E 8.18 4.04 0.00 2.00 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 2.33 2.34 0.00 115 A 8.26 4.00 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 0.00 116 Q 8.26 3.97 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.75 0.00 0.00 0.00 0.00 0.00 2.48 2.67 0.00 117 Q 8.08 3.96 0.00 2.35 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 118 V 7.89 3.59 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 1.04 0.00 0.00 0.97 0.00 0.00 119 L 8.13 4.08 0.00 1.81 1.71 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 120 S 8.28 4.75 0.00 3.86 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 0.00 121 E 7.91 3.97 0.00 2.17 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 2.35 2.57 0.00 122 L 7.64 4.19 0.00 1.68 1.75 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.04 3.88 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 0.82 0.00 0.00 0.99 0.00 0.00 124 G 9.63 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 7.42 4.79 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 0.00 126 P 0.00 4.51 0.00 2.13 2.22 0.00 3.81 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 2.08 1.98 0.00 127 V 8.27 4.79 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 0.80 0.00 0.00 1.04 0.00 0.00 128 S 8.88 4.74 0.00 3.83 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 0.00 129 V 8.72 4.96 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 0.83 0.00 0.00 0.95 0.00 0.00 130 S 9.02 4.92 0.00 3.88 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 0.00 131 A 8.30 5.17 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 0.00 0.00 0.00 0.00 0.00 0.00 132 T 8.85 4.72 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 0.00 133 T 8.43 5.00 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 134 T 8.32 4.36 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 1.19 0.00 0.00 135 D 8.54 4.52 0.00 2.83 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 0.00 136 G 8.55 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 0.00 137 L 7.54 4.59 0.00 1.72 1.54 0.91 1.35 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 0.00 138 G 8.36 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 0.00 0.00 0.00 0.00 139 L 8.51 4.08 0.00 1.75 1.85 0.90 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 140 T 7.66 4.66 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 1.19 0.00 0.00 141 G 8.70 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 0.00 0.00 0.00 0.00 142 R 7.74 4.12 0.00 1.77 1.89 0.00 3.40 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 143 G 8.33 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 0.00 144 E 8.38 3.99 0.00 2.05 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 2.37 2.36 0.00 145 G 7.38 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 0.00 0.00 0.00 0.00 146 L 9.03 5.16 0.00 1.54 1.48 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 147 A 8.80 5.33 1.17 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 0.00 0.00 148 A 8.84 5.10 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 0.00 149 I 8.86 5.04 1.86 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 1.15 1.75 0.90 0.00 0.00 150 A 9.60 5.40 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 0.00 151 T 8.70 5.19 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 0.00 152 A 8.65 5.13 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 0.00 153 L 8.86 5.10 0.00 1.64 1.57 0.93 0.83 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 0.00 154 V 8.88 5.09 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 0.61 0.00 0.00 0.49 0.00 0.00 155 A 8.97 5.11 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 A 8.92 4.49 1.15 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 0.00 0.00 157 E 8.38 4.69 0.00 1.96 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00