NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.5428 8.3044 120.3513 55.2153 33.4646 173.6764 1 K 2.9189 7.7982 120.1995 52.8301 34.3811 173.2964 2 P 4.2166 0.0000 0.0000 61.4867 32.8751 175.1958 3 P 4.1271 0.0000 0.0000 65.7466 31.1495 177.3614 4 Q 3.9836 7.7824 114.3225 56.7926 28.9495 175.4800 5 F 5.0051 7.4603 117.4262 55.9418 41.6054 175.9148 6 T 4.3506 8.5461 114.8180 60.5267 71.4289 176.1661 7 W 4.3850 8.6824 120.5715 59.9252 29.0324 178.6368 8 A 4.8635 8.2124 121.7144 55.0091 17.9729 179.5819 9 Q 4.1182 8.4299 116.6949 58.8412 28.7876 178.6813 10 W 4.1130 8.6120 129.5608 60.0416 30.6622 178.0133 11 F 3.9513 8.6118 121.0892 61.0670 38.8543 176.7655 12 E 4.0824 8.6702 119.0388 59.7369 29.2618 178.9710 13 T 3.8790 7.6420 114.6460 66.4169 68.4721 176.2190 14 Q 3.5241 7.2188 118.8397 57.4164 29.2645 176.9135 15 H 4.6885 7.7064 115.7069 54.1657 29.8666 175.0276 16 I 4.1844 7.3896 119.5133 62.7496 39.4170 176.2866 17 N 4.5374 8.2051 119.3893 52.1114 36.8611 173.1194 18 M 3.4800 7.7051 119.3091 54.2182 31.5878 176.8047 19 T 3.8797 7.9836 117.0585 63.5387 69.2776 174.4787 20 S 4.5096 6.9673 115.1802 56.8964 65.4368 173.8288 21 Q 4.0449 8.5522 124.1294 57.0877 28.9554 175.8752 22 Q 4.6252 7.9395 119.2072 54.3968 30.4147 175.9601 23 C 4.1883 9.4347 121.5063 60.3587 40.0240 176.3352 24 T 3.9977 7.9194 115.7175 66.9412 68.2341 175.8800 25 N 4.6051 8.0545 117.4101 56.1434 38.3683 177.1664 26 A 3.8425 7.9759 122.2441 55.5382 18.3816 179.6369 27 M 3.9858 8.4795 116.9303 58.0049 31.7941 178.8994 28 Q 4.0308 7.7038 118.8235 58.7060 28.6833 178.8324 29 V 3.4538 7.4535 118.7832 66.0835 31.6074 178.1141 30 I 3.8346 7.7049 118.8443 64.6989 36.9481 178.1526 31 N 4.8027 8.5102 118.9634 55.9424 38.1379 177.3182 32 N 4.4546 8.5179 117.4729 56.0310 38.6107 176.7836 33 Y 4.7124 7.6748 117.8312 60.3971 38.3304 176.8873 34 Q 4.3489 8.3887 115.2982 54.8368 30.0376 175.5783 35 R 3.8109 7.6969 118.5847 56.3179 28.3101 176.3701 36 R 4.4581 6.9991 112.7405 56.1280 31.3023 174.6146 37 C 4.9597 8.8198 118.5014 55.8410 40.0935 173.6387 38 K 4.1979 9.3085 127.9506 56.3513 32.4200 176.3478 39 N 4.6001 8.9729 125.1203 56.5013 40.1291 174.2819 40 Q 5.0839 7.8963 117.6798 54.7325 32.5773 173.6602 41 N 4.7987 8.8087 123.4464 52.7868 43.0835 172.8217 42 T 4.9511 8.4158 122.3684 62.0246 71.2316 173.2384 43 F 4.7761 9.0947 125.5353 55.6791 41.1947 174.8055 44 L 4.3696 8.8936 125.4134 53.9934 42.1193 178.3618 45 L 4.4247 8.5907 126.8588 53.3269 39.5465 175.2878 46 T 4.5431 7.5368 115.5191 60.1541 71.2055 172.8683 47 T 4.6227 8.0906 113.3626 60.0818 71.8757 175.3093 48 F 4.0477 8.7608 123.5432 61.5506 39.5213 177.1920 49 A 3.8450 8.2104 119.8662 55.1807 18.3204 179.1256 50 N 4.2983 8.2284 114.9743 56.5744 38.7007 177.8426 51 V 3.6944 7.6751 119.5473 65.8947 31.3620 178.1494 52 V 3.2345 7.3314 117.3859 66.0355 31.4349 177.5394 53 N 4.4515 8.2067 116.1390 56.0736 38.2625 177.5895 54 V 3.5615 7.6336 119.2654 65.8182 31.3556 177.2559 55 C 4.1008 7.7999 115.4261 58.9265 40.0263 175.2072 56 G 3.5953 7.8284 105.9318 44.6936 0.0000 173.5918 57 N 4.6942 7.5231 118.7372 51.6083 39.4749 173.0415 58 P 4.3542 0.0000 0.0000 62.9971 31.8605 176.4438 59 N 4.7174 8.5062 119.3900 53.8022 38.8369 174.1311 60 M 4.8626 8.7423 118.7765 53.7522 35.4250 174.2442 61 T 4.2743 8.3441 116.6420 63.7663 69.6860 175.1117 62 C 4.4488 9.0175 124.1494 55.9478 40.4136 172.7122 63 P 4.1492 0.0000 0.0000 65.8129 31.0056 177.9519 64 S 4.3486 8.6992 112.6592 60.2088 63.2647 174.4897 65 N 4.8555 8.0760 119.1100 51.4840 39.3974 174.3149 66 K 4.0581 8.5002 123.5080 58.7644 32.4795 178.0007 67 T 4.1820 7.6958 107.2429 62.3074 69.5174 174.7759 68 R 4.5250 8.1656 123.1435 54.8431 31.5818 176.4235 69 K 4.8570 8.5129 121.8094 56.2586 32.9752 175.3755 70 N 4.9037 8.0189 112.7746 52.5838 38.6136 174.9820 71 C 5.2407 7.7207 116.3302 57.1110 43.2483 172.3827 72 H 5.1509 9.0462 117.0089 54.6475 31.7243 172.0258 73 H 5.0080 8.7202 122.3332 54.7193 31.1569 175.9729 74 S 3.9416 8.6793 120.6728 59.3470 63.4593 176.5157 75 G 4.0433 8.3138 105.2429 45.8762 0.0000 173.2042 76 S 4.7860 7.8456 112.9086 56.9790 65.6070 173.9568 77 Q 3.8917 8.1933 125.3359 55.8461 29.5880 175.5998 78 V 4.6303 8.7492 114.1314 58.9030 36.6353 173.3124 79 P 4.9665 0.0000 0.0000 62.7444 32.6114 175.4408 80 L 5.1639 9.3506 122.8703 54.4433 44.6954 174.6873 81 I 4.8750 8.7829 120.8959 59.9168 40.3353 173.8902 82 H 5.2043 9.1967 127.7583 54.7843 31.8047 172.6002 83 C 5.4002 9.0442 124.2018 55.8785 40.6849 172.4256 84 N 5.5651 8.9471 120.5515 50.9545 41.6082 173.6608 85 L 3.3710 8.8817 127.3227 55.4735 41.9069 176.4802 86 T 4.3091 8.6020 116.6861 62.4031 71.1727 174.6978 87 T 4.5008 7.3700 118.1570 60.3734 69.9062 170.5373 88 P 4.4431 0.0000 0.0000 62.2243 32.3428 176.8517 89 S 4.5822 8.1845 117.4871 56.1175 61.6386 172.2522 90 P 4.2299 0.0000 0.0000 65.2616 31.7297 177.7521 91 Q 4.1014 7.9619 113.1799 56.3088 28.6876 175.1635 92 N 4.3063 7.8779 113.6349 53.1890 41.7392 174.7345 93 I 3.9444 7.8533 121.1882 63.1840 38.1283 177.7954 94 S 4.4299 8.0935 113.8532 59.5798 63.1916 174.0534 95 N 4.8298 7.6250 116.9940 53.3498 38.5774 173.7803 96 C 5.2770 7.7985 116.6682 56.1401 38.9828 173.4167 97 R 4.9939 8.4530 121.6469 54.7771 33.0971 174.4201 98 Y 5.2328 8.9966 118.1358 56.4245 42.2864 174.6404 99 A 4.9856 9.1416 123.1405 50.4680 22.1837 175.7947 100 Q 5.0916 8.5586 116.5542 54.6982 31.6379 175.0097 101 T 4.6828 8.8171 119.0370 61.0391 71.5466 171.6719 102 P 5.0112 0.0000 0.0000 62.9251 32.8158 175.1154 103 A 4.4624 8.2892 121.4948 51.6891 23.5677 175.0460 104 N 5.8319 8.6102 115.4394 51.0612 41.5090 173.9241 105 M 4.7728 8.2415 122.1178 53.6686 37.5199 174.4434 106 F 4.8717 8.5775 118.1607 57.3750 40.9773 174.6080 107 Y 5.3425 8.4213 117.8781 55.4308 41.9881 174.1692 108 I 4.9308 9.1230 122.0275 59.7689 40.1734 174.9660 109 V 4.9530 8.9186 120.1099 59.4159 35.2923 174.5954 110 A 4.9342 8.7249 125.9067 51.3346 20.2920 175.8030 111 C 5.3661 8.9592 118.7435 55.4025 44.5200 172.6071 112 D 4.7808 8.7573 119.8182 52.7026 45.2473 173.9004 113 N 5.0673 8.6820 117.9680 52.7530 39.1228 175.8457 114 R 4.2827 8.7427 119.4586 56.0741 30.8088 176.1348 115 D 4.4869 9.8652 120.4628 54.2565 40.9927 176.6672 116 Q 4.0575 9.0294 126.8595 59.3743 28.8962 179.2379 117 R 4.1656 8.1453 114.6518 58.1780 30.4600 177.5011 118 R 4.4806 8.8622 115.0316 56.4172 31.9875 176.2012 119 D 4.7317 8.2725 118.5349 52.3946 41.7671 174.5975 120 P 4.4079 0.0000 0.0000 62.0217 31.8024 175.6805 121 P 4.3033 0.0000 0.0000 65.1847 31.4362 177.0599 122 Q 3.8252 8.1253 119.7033 58.4246 27.6290 175.4140 123 Y 4.8558 7.5488 116.2031 54.9841 38.6371 173.8904 124 P 4.5838 0.0000 0.0000 64.7324 32.6627 176.3729 125 V 4.9136 7.3469 117.2213 60.9947 33.6393 175.5125 126 V 4.5483 8.7732 120.0369 58.6906 36.7377 172.9499 127 P 4.5078 0.0000 0.0000 62.9747 32.0579 176.8498 128 V 4.6835 8.4691 113.6771 61.3118 33.9000 175.3367 129 H 4.9753 7.7919 116.1771 54.6777 33.3517 172.6852 130 L 4.7476 8.7271 125.2247 54.0911 41.4882 175.3764 131 D 4.5383 8.8064 127.7613 57.1178 41.9809 176.2577 132 R 4.5990 7.4690 115.0387 55.4788 33.4582 173.0834 133 I 5.1435 8.5453 117.6414 59.0117 39.9118 175.3002 134 I 4.3466 8.6878 119.1379 61.1466 37.2870 174.9335 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 4.54 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.62 0.00 1 K 7.80 2.92 0.00 0.81 0.79 0.00 1.45 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.58 0.62 7.81 2 P 0.00 4.22 0.00 2.33 1.89 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.72 0.00 3 P 0.00 4.13 0.00 2.07 2.09 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.89 0.00 4 Q 7.78 3.98 0.00 1.84 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.79 0.00 0.00 0.00 0.00 0.00 1.16 1.56 0.00 5 F 7.46 5.01 0.00 2.75 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 6 T 8.55 4.35 4.36 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 1.36 0.00 0.00 7 W 8.68 4.39 0.00 3.50 3.31 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 8 A 8.21 4.86 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 8.43 4.12 0.00 2.64 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 10 W 8.61 4.11 0.00 3.26 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 F 8.61 3.95 0.00 3.43 3.42 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 12 E 8.67 4.08 0.00 2.37 2.17 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 2.33 2.46 0.00 13 T 7.64 3.88 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 14 Q 7.22 3.52 0.00 1.10 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.69 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 15 H 7.71 4.69 0.00 2.00 2.73 0.00 5.56 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 7.39 4.18 2.08 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 1.33 1.17 1.06 0.00 0.00 17 N 8.21 4.54 0.00 2.69 2.79 0.00 0.00 7.06 7.44 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 18 M 7.71 3.48 0.00 1.64 1.41 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.83 0.00 19 T 7.98 3.88 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 1.25 0.00 0.00 20 S 6.97 4.51 0.00 3.84 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 21 Q 8.55 4.04 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.51 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 22 Q 7.94 4.63 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 23 C 9.43 4.19 0.00 3.11 3.12 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 24 T 7.92 4.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 25 N 8.05 4.61 0.00 2.70 2.81 0.00 0.00 6.98 7.10 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 26 A 7.98 3.84 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 M 8.48 3.99 0.00 1.32 1.53 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.34 0.00 28 Q 7.70 4.03 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.62 0.00 29 V 7.45 3.45 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 1.16 0.00 0.00 0.91 0.00 0.00 30 I 7.70 3.83 1.94 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 1.25 0.34 0.87 0.00 0.00 31 N 8.51 4.80 0.00 2.82 2.95 0.00 0.00 6.57 6.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.52 4.45 0.00 2.59 2.73 0.00 0.00 7.08 7.23 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 33 Y 7.67 4.71 0.00 3.52 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 34 Q 8.39 4.35 0.00 2.28 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.68 0.00 0.00 0.00 0.00 0.00 2.86 2.66 0.00 35 R 7.70 3.81 0.00 1.94 2.03 0.00 3.57 0.00 0.00 3.34 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 36 R 7.00 4.46 0.00 2.02 2.06 0.00 3.01 0.00 0.00 3.39 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.49 0.00 37 C 8.82 4.96 0.00 3.03 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 38 K 9.31 4.20 0.00 1.91 1.79 0.00 1.80 0.00 0.00 1.54 0.00 0.00 3.17 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.61 1.45 7.81 39 N 8.97 4.60 0.00 2.85 2.84 0.00 0.00 6.60 7.52 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 40 Q 7.90 5.08 0.00 2.11 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.40 0.00 0.00 0.00 0.00 0.00 2.44 2.61 0.00 41 N 8.81 4.80 0.00 2.67 2.29 0.00 0.00 6.89 7.25 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 42 T 8.42 4.95 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 1.21 0.00 0.00 43 F 9.09 4.78 0.00 2.86 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 44 L 8.89 4.37 0.00 1.29 1.37 0.23 0.86 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 45 L 8.59 4.42 0.00 1.66 1.63 0.91 0.86 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 46 T 7.54 4.54 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 1.12 0.00 0.00 47 T 8.09 4.62 4.34 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 1.26 0.00 0.00 48 F 8.76 4.05 0.00 3.21 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 49 A 8.21 3.85 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 N 8.23 4.30 0.00 3.03 2.97 0.00 0.00 6.65 7.21 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 51 V 7.68 3.69 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 0.83 0.00 0.00 0.94 0.00 0.00 52 V 7.33 3.23 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 0.82 0.00 0.00 -0.04 0.00 0.00 53 N 8.21 4.45 0.00 2.92 2.84 0.00 0.00 6.64 7.08 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 54 V 7.63 3.56 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 1.07 0.00 0.00 0.96 0.00 0.00 55 C 7.80 4.10 0.00 3.10 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 G 7.83 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 57 N 7.52 4.69 0.00 2.85 2.77 0.00 0.00 6.95 8.86 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 58 P 0.00 4.35 0.00 2.01 1.98 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 59 N 8.51 4.72 0.00 2.55 2.82 0.00 0.00 6.75 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 60 M 8.74 4.86 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 61 T 8.34 4.27 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 1.22 0.00 0.00 62 C 9.02 4.45 0.00 3.17 3.36 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 63 P 0.00 4.15 0.00 2.03 2.13 0.00 3.89 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 64 S 8.70 4.35 0.00 4.21 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 65 N 8.08 4.86 0.00 2.64 2.59 0.00 0.00 7.00 6.52 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 66 K 8.50 4.06 0.00 1.76 1.88 0.00 1.79 0.00 0.00 1.96 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.39 7.81 67 T 7.70 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 1.20 0.00 0.00 68 R 8.17 4.52 0.00 1.84 2.01 0.00 3.17 0.00 0.00 3.05 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 69 K 8.51 4.86 0.00 1.61 1.69 0.00 1.55 0.00 0.00 1.79 0.00 0.00 3.12 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.27 1.40 7.81 70 N 8.02 4.90 0.00 2.96 2.96 0.00 0.00 6.10 7.68 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 71 C 7.72 5.24 0.00 3.06 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 72 H 9.05 5.15 0.00 2.98 3.20 0.00 5.60 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 H 8.72 5.01 0.00 3.12 3.02 0.00 5.68 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 S 8.68 3.94 0.00 3.26 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.31 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 76 S 7.85 4.79 0.00 3.87 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 77 Q 8.19 3.89 0.00 1.60 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.57 0.00 0.00 0.00 0.00 0.00 1.38 1.16 0.00 78 V 8.75 4.63 2.17 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 1.02 0.00 0.00 1.19 0.00 0.00 79 P 0.00 4.97 0.00 2.07 1.96 0.00 3.74 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 80 L 9.35 5.16 0.00 1.83 1.72 0.96 0.83 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 81 I 8.78 4.87 1.93 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 1.11 0.80 0.94 0.00 0.00 82 H 9.20 5.20 0.00 3.27 3.21 0.00 5.76 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 C 9.04 5.40 0.00 2.86 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 84 N 8.95 5.57 0.00 2.68 2.72 0.00 0.00 6.33 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.88 3.37 0.00 1.32 1.43 0.34 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 86 T 8.60 4.31 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 87 T 7.37 4.50 4.26 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 1.18 0.00 0.00 88 P 0.00 4.44 0.00 1.90 1.94 0.00 3.59 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 89 S 8.18 4.58 0.00 3.83 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 90 P 0.00 4.23 0.00 2.08 2.12 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 91 Q 7.96 4.10 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.06 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 92 N 7.88 4.31 0.00 2.72 2.70 0.00 0.00 6.88 8.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 7.85 3.94 1.93 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 1.49 0.57 0.94 0.00 0.00 94 S 8.09 4.43 0.00 4.01 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 7.62 4.83 0.00 2.94 2.86 0.00 0.00 6.97 7.54 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 96 C 7.80 5.28 0.00 3.06 2.97 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 97 R 8.45 4.99 0.00 1.69 1.81 0.00 3.06 0.00 0.00 3.33 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 98 Y 9.00 5.23 0.00 2.75 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 99 A 9.14 4.99 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 0.00 100 Q 8.56 5.09 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.74 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 101 T 8.82 4.68 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 1.24 0.00 0.00 102 P 0.00 5.01 0.00 2.08 2.05 0.00 3.82 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 103 A 8.29 4.46 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 N 8.61 5.83 0.00 2.49 2.66 0.00 0.00 7.05 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 M 8.24 4.77 0.00 1.84 1.95 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 106 F 8.58 4.87 0.00 2.98 2.76 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 0.00 107 Y 8.42 5.34 0.00 2.96 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 0.00 108 I 9.12 4.93 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.13 0.96 0.00 0.00 109 V 8.92 4.95 1.96 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 0.92 0.00 0.00 1.02 0.00 0.00 110 A 8.72 4.93 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 0.00 111 C 8.96 5.37 0.00 2.76 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 0.00 112 D 8.76 4.78 0.00 2.71 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.68 5.07 0.00 2.68 2.77 0.00 0.00 6.88 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 0.00 114 R 8.74 4.28 0.00 2.02 2.28 0.00 3.35 0.00 0.00 3.46 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 115 D 9.87 4.49 0.00 2.76 2.80 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 0.00 116 Q 9.03 4.06 0.00 2.11 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.88 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 117 R 8.15 4.17 0.00 1.81 1.99 0.00 3.17 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 118 R 8.86 4.48 0.00 1.85 1.95 0.00 3.10 0.00 0.00 3.18 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 119 D 8.27 4.73 0.00 3.01 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 0.00 120 P 0.00 4.41 0.00 2.21 2.19 0.00 3.79 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.00 0.00 121 P 0.00 4.30 0.00 2.19 2.24 0.00 3.78 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 122 Q 8.13 3.83 0.00 1.81 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.04 0.00 0.00 0.00 0.00 0.00 1.16 1.70 0.00 123 Y 7.55 4.86 0.00 3.14 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 0.00 124 P 0.00 4.58 0.00 2.15 2.35 0.00 3.77 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.02 0.00 125 V 7.35 4.91 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 0.78 0.00 0.00 0.94 0.00 0.00 126 V 8.77 4.55 2.18 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 0.93 0.00 0.00 1.02 0.00 0.00 127 P 0.00 4.51 0.00 0.49 1.39 0.00 3.16 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.14 0.00 128 V 8.47 4.68 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.79 0.00 0.00 129 H 7.79 4.98 0.00 3.03 3.14 0.00 5.60 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.73 4.75 0.00 1.29 1.35 1.00 0.93 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 0.00 131 D 8.81 4.54 0.00 2.79 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 0.00 132 R 7.47 4.60 0.00 1.92 1.70 0.00 3.23 0.00 0.00 3.39 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 133 I 8.55 5.14 1.92 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 1.40 0.85 0.96 0.00 0.00 134 I 8.69 4.35 1.97 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 1.14 1.02 0.95 0.00 0.00