NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.6342 8.4244 118.2083 51.8279 39.2336 174.0413 4 R 3.6661 7.8384 119.1371 56.0014 30.4223 174.5032 5 L 3.9478 8.0920 124.2765 54.6532 43.1423 177.6842 6 S 4.1202 8.3959 118.5816 57.6662 64.9820 175.2517 7 W 4.1130 8.3841 122.1285 60.0529 28.8256 178.3514 8 Q 4.2857 8.3493 118.7574 59.6212 28.4240 178.1560 9 D 4.4554 8.1619 119.7758 57.3720 40.8309 177.9548 10 Y 4.0184 8.4227 120.3817 60.9628 38.6415 178.3773 11 F 4.3395 7.9405 118.3386 60.2194 38.9880 177.7280 12 M 4.1481 8.1498 117.8860 58.4540 31.9886 177.9540 13 A 3.9980 8.3244 121.3865 55.2753 18.5544 179.1052 14 N 4.1329 8.0116 115.1592 56.7099 39.0265 176.7862 15 A 4.0549 8.3141 122.4444 55.2936 18.2672 179.2146 16 E 3.9199 8.0910 116.4931 59.3022 29.9791 178.4088 17 L 4.0670 8.1735 120.5592 58.3259 42.2956 178.9881 18 I 3.7534 8.3737 120.3154 64.3254 37.0389 178.2684 19 S 4.5275 8.1338 114.4076 60.4947 62.6198 176.2210 20 K 3.9121 7.8696 121.6772 58.2734 31.7713 178.0296 21 R 4.0158 6.5784 115.9118 54.4579 30.7131 176.2780 22 S 4.4775 7.2218 115.3305 59.2404 62.7067 174.5321 23 T 5.0639 8.7038 115.4884 60.4361 68.9597 173.0694 24 C 4.8478 8.0282 122.2060 58.2680 33.0332 173.7381 25 N 4.4654 8.9322 124.0329 53.8064 37.2919 176.4411 26 R 3.8550 7.9233 118.2666 59.1948 30.4031 176.9004 27 A 3.7823 7.0898 115.9155 51.4754 22.3434 175.5766 28 Y 4.7491 8.1970 121.5577 56.7028 37.5468 174.5974 29 V 4.4863 9.0882 126.0218 60.9342 34.1622 174.7574 30 G 4.6603 9.2215 113.5377 44.5105 0.0000 171.2060 31 A 5.4231 9.2850 124.0424 49.9412 23.1714 175.1620 32 V 4.7232 9.0676 121.1625 61.0278 34.8173 173.9032 33 L 4.8804 9.0573 130.8783 53.7775 43.8134 175.1749 34 V 4.7004 8.8975 126.1110 60.8259 34.9311 173.9402 35 K 4.5886 8.6538 128.2134 54.8514 35.0247 175.8522 36 N 4.0482 9.5454 126.0819 54.7386 36.1221 174.0501 37 N 4.0446 8.0115 108.3152 53.9683 36.5695 174.4785 38 R 4.7360 7.6668 117.3191 54.2579 32.3493 175.5295 39 I 4.3203 8.4314 123.3323 61.1154 37.6669 175.6298 40 I 4.5122 8.1705 118.1487 61.0656 39.5303 175.2976 41 A 4.8002 7.5620 122.4014 51.5569 22.2814 174.8987 42 T 5.0962 8.7011 109.3234 60.6638 72.6240 173.1764 43 G 4.2570 8.7538 106.4276 45.5870 0.0000 172.0238 44 Y 5.9819 8.2874 119.5212 53.4879 41.9838 174.3294 45 N 5.1698 8.3117 117.4627 52.1694 39.0752 174.3648 46 G 4.4452 8.3400 108.2855 45.0787 0.0000 172.4453 47 G 4.2697 8.8853 108.2279 45.4406 0.0000 173.9260 48 V 3.6326 8.4791 119.0305 62.6753 31.8954 175.2725 49 A 4.1650 8.4252 128.5990 54.2809 18.4832 177.2536 50 D 4.5792 8.9963 120.3082 54.7353 38.2579 173.2988 51 T 4.6958 7.5283 109.1109 59.2153 71.5284 173.2911 52 D 4.5362 8.4394 120.8178 54.4594 41.5962 175.8738 53 N 5.0632 8.3108 119.1307 51.4683 41.1452 175.8510 54 C 4.4242 8.5909 117.6985 62.5087 28.5914 175.9593 55 D 4.3932 8.0671 118.9694 57.1375 40.6723 178.2871 56 D 4.5507 8.0700 117.0878 55.2802 41.7209 177.5912 57 V 4.2052 7.8367 108.1085 60.3426 33.1629 176.4892 58 G 3.9939 8.3433 105.8962 45.1759 0.0000 172.7933 59 H 4.5187 8.1422 115.5990 55.7781 29.9975 175.5416 60 E 4.5068 8.7592 122.0246 55.0022 30.4362 173.8822 61 M 4.9104 8.4185 125.9215 54.3653 33.7180 175.8380 62 E 4.4688 9.3731 124.1275 55.9733 32.6984 174.7270 63 D 4.3723 9.9580 126.9192 55.5354 38.5992 174.6232 64 G 3.9037 8.5899 103.5297 45.8352 0.0000 173.4960 65 H 4.8817 7.9392 115.9628 53.5500 31.9807 172.5629 66 C 4.7922 8.7178 123.6459 59.1020 31.3399 173.1111 67 I 4.2903 8.7315 120.8647 60.8485 37.7788 176.8312 68 R 4.0290 8.0128 122.5288 59.3138 30.2327 176.5349 69 T 4.5794 7.5688 106.7197 60.5000 70.8167 174.9043 70 V 3.9076 8.5940 124.8756 62.9591 32.6581 175.4977 71 H 4.7191 8.9696 124.4924 55.6207 29.9548 176.3739 72 A 4.0220 8.8612 122.0720 55.6937 18.3392 179.9290 73 E 3.9231 8.2094 116.3840 59.9848 29.5922 179.4731 74 M 4.0778 7.9991 118.0688 58.4788 32.0839 178.3882 75 N 4.3813 8.6125 116.8518 56.0126 38.4843 177.3756 76 A 4.0813 8.0128 122.2158 55.2605 18.5295 179.6853 77 L 3.9307 7.9297 117.4796 58.1078 41.7004 179.9527 78 I 3.7381 8.3632 120.0903 63.9563 36.9810 178.0123 79 Q 3.9316 8.1503 120.7319 59.5556 28.7163 178.5632 80 C 4.1069 7.7895 117.1128 62.8185 27.0322 176.0296 81 A 3.9529 8.1235 122.4058 54.9493 17.7255 179.6706 82 K 4.0693 8.3725 117.5251 59.7375 32.4130 178.6447 83 E 4.1580 8.1985 117.6978 56.6572 30.4376 176.6193 84 G 3.6475 7.6548 105.6233 46.4138 0.0000 173.5070 85 I 4.3879 7.7146 118.0455 58.9872 39.7258 176.2940 86 S 4.1751 8.6367 119.9378 58.1572 62.5166 173.4048 87 A 4.4038 8.4372 129.6257 52.0109 19.3503 176.5291 88 N 4.5532 7.6668 115.9197 54.1716 39.5189 174.4664 89 N 4.3840 8.4848 120.6339 54.8142 36.7781 174.1104 90 T 4.7661 7.0644 105.1275 60.0792 72.3176 172.6481 91 E 5.0642 9.0851 119.0669 54.4525 33.3670 174.5381 92 I 5.0285 8.4230 119.8933 59.4295 41.7636 173.4550 93 Y 5.1897 8.9719 125.4297 56.3056 40.7421 174.9707 94 V 5.1007 9.1014 123.6097 61.3638 35.2363 176.1434 95 T 4.1134 9.1366 117.1945 64.3895 69.8668 173.8623 96 H 5.4887 8.1054 117.3561 53.2042 32.3982 173.4520 97 F 3.8377 9.1206 125.0939 57.8697 39.6391 173.3386 98 P 4.8120 0.0000 0.0000 61.9607 31.8366 176.4474 99 C 4.5073 8.5767 117.2303 58.0496 31.6004 174.5563 100 I 3.6852 8.2265 119.7473 64.1715 37.4831 177.4319 101 N 4.3000 8.0429 116.9289 56.5370 38.4714 177.0460 102 C 4.1163 7.9516 117.5950 62.9298 28.2069 175.9756 103 T 3.7264 8.1911 117.7360 66.6122 67.9852 176.5880 104 K 3.8341 8.1442 120.0139 59.4692 32.1295 179.2753 105 A 3.9446 7.8780 120.7795 55.0224 18.3054 179.5622 106 L 3.8850 8.2304 117.8708 58.0128 41.8770 179.7899 107 L 3.9305 7.9852 118.8423 57.9712 41.3711 179.5214 108 Q 3.9791 8.1949 118.1896 58.7902 28.9983 177.4247 109 A 4.2543 8.0431 120.7478 52.7569 18.5486 178.5810 110 G 3.9689 7.8848 105.2871 46.3173 0.0000 173.0497 111 V 4.1981 7.5406 119.9106 62.7113 31.3772 176.0996 112 K 4.5060 9.1666 126.7681 56.6802 33.6507 176.3603 113 K 4.7465 7.6268 120.2616 55.1065 36.0401 174.2874 114 I 4.8605 9.0021 127.0860 59.8490 40.6021 174.3420 115 T 5.2313 8.7691 124.5165 61.8300 71.0905 173.0717 116 Y 5.8128 8.7924 123.7442 54.6466 41.9289 174.7001 117 N 4.7780 9.0716 117.8062 55.0375 40.0462 173.9638 118 T 4.6933 8.9339 114.6642 62.2032 70.0950 175.0201 119 A 4.7179 8.5554 131.2134 51.4234 16.8827 175.4587 120 Y 4.2591 8.0276 121.1523 56.8428 39.9785 175.7623 121 R 3.3776 8.1679 128.8474 57.0045 27.6949 177.5035 122 I 3.3693 7.1673 117.0622 61.4179 37.8817 176.5578 123 H 4.3781 8.7525 126.1695 54.8235 30.9119 173.8730 124 P 4.2668 0.0000 0.0000 66.0455 30.9742 178.2320 125 F 4.4172 8.6274 119.7608 60.7678 39.3133 176.8799 126 A 3.7929 7.9576 120.2828 55.0880 18.1824 179.4032 127 I 3.3285 7.5544 118.0014 64.3450 37.1448 178.1284 128 E 3.8960 8.1413 120.0287 59.3514 29.3562 179.0011 129 L 3.7748 7.5904 118.7842 57.9987 41.6056 179.2776 130 M 4.0352 8.0006 118.6732 58.6918 31.9858 178.9508 131 T 3.9491 8.1868 115.9465 66.8753 68.4855 176.5198 132 Q 3.9963 7.9625 119.9735 58.8399 29.2009 177.4421 133 K 4.0848 8.2932 118.6513 56.2084 32.7623 175.9093 134 E 3.7128 7.8266 116.2752 58.2127 27.1068 174.2337 135 V 4.4711 7.8200 118.3231 61.0432 33.2658 175.1758 136 E 4.1436 8.8005 129.2548 56.2450 31.1232 174.9761 137 Y 5.3096 7.8193 123.6608 55.4792 39.9297 174.1351 138 V 4.3376 8.9915 126.2113 61.2050 33.7110 174.3754 139 Q 3.7287 8.5080 129.3642 55.7167 29.8714 174.4588 140 H 4.8080 9.0768 126.0672 54.6170 33.5090 172.5160 141 D 5.0365 8.4994 125.2194 53.5112 41.4120 176.3270 142 V 3.7565 8.3499 123.1646 62.1082 32.0869 174.2578 143 P 4.3892 0.0000 0.0000 62.1626 32.0235 176.0136 144 R 4.0284 8.3565 120.4639 56.1898 29.8923 176.0252 145 V 4.3738 8.1561 124.6284 60.8950 34.3686 174.3096 146 K 4.5404 8.7026 126.2021 54.6000 33.7206 175.4435 147 L 4.5711 8.5643 123.6868 53.9425 43.9717 177.0869 148 G 3.8080 8.3907 107.8965 45.5717 0.0000 173.3499 149 E 4.0847 8.4491 116.6427 56.8453 29.4411 174.8308 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 N 8.42 4.63 0.00 2.82 2.97 0.00 0.00 5.98 6.77 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 4 R 7.84 3.67 0.00 1.75 1.72 0.00 3.01 0.00 0.00 3.08 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.55 0.00 5 L 8.09 3.95 0.00 1.58 1.56 0.96 0.87 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 6 S 8.40 4.12 0.00 4.04 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 W 8.38 4.11 0.00 3.49 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 8 Q 8.35 4.29 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.91 0.00 0.00 0.00 0.00 0.00 2.18 2.66 0.00 9 D 8.16 4.46 0.00 2.88 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 10 Y 8.42 4.02 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 11 F 7.94 4.34 0.00 1.59 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 0.00 0.00 0.00 12 M 8.15 4.15 0.00 2.28 2.37 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.92 0.00 13 A 8.32 4.00 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 14 N 8.01 4.13 0.00 2.81 2.93 0.00 0.00 7.13 8.03 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 15 A 8.31 4.05 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 16 E 8.09 3.92 0.00 2.04 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 0.00 2.34 2.36 0.00 17 L 8.17 4.07 0.00 1.76 1.80 0.88 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.37 3.75 2.09 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 1.90 1.00 1.08 0.00 0.00 19 S 8.13 4.53 0.00 4.16 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 0.00 20 K 7.87 3.91 0.00 1.71 1.76 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.69 1.55 7.81 21 R 6.58 4.02 0.00 0.90 0.85 0.00 3.10 0.00 0.00 3.06 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.36 0.00 22 S 7.22 4.48 0.00 4.05 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 23 T 8.70 5.06 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 1.34 0.00 0.00 24 C 8.03 4.85 0.00 3.00 2.86 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 0.00 0.00 0.00 25 N 8.93 4.47 0.00 2.84 3.07 0.00 0.00 6.32 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 26 R 7.92 3.85 0.00 1.72 2.00 0.00 3.02 0.00 0.00 3.02 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.27 0.00 27 A 7.09 3.78 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Y 8.20 4.75 0.00 3.02 2.99 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 29 V 9.09 4.49 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 0.97 0.00 0.00 0.65 0.00 0.00 30 G 9.22 4.66 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 0.00 0.00 0.00 31 A 9.29 5.42 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 32 V 9.07 4.72 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 1.00 0.00 0.00 1.03 0.00 0.00 33 L 9.06 4.88 0.00 1.75 1.58 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 34 V 8.90 4.70 1.89 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 0.53 0.00 0.00 0.05 0.00 0.00 35 K 8.65 4.59 0.00 1.76 1.54 0.00 1.80 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.51 7.81 36 N 9.55 4.05 0.00 2.80 2.76 0.00 0.00 7.18 8.00 0.00 0.00 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 N 8.01 4.04 0.00 2.20 1.42 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 38 R 7.67 4.74 0.00 1.85 1.83 0.00 3.30 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 39 I 8.43 4.32 1.95 0.00 0.00 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 1.49 0.73 0.93 0.00 0.00 40 I 8.17 4.51 1.85 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 1.26 0.62 0.88 0.00 0.00 41 A 7.56 4.80 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 42 T 8.70 5.10 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 1.24 0.00 0.00 43 G 8.75 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 0.00 0.00 0.00 0.00 44 Y 8.29 5.98 0.00 2.98 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 45 N 8.31 5.17 0.00 2.80 2.99 0.00 0.00 6.45 6.98 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 46 G 8.34 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.89 4.27 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 0.00 48 V 8.48 3.63 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 0.96 0.00 0.00 0.93 0.00 0.00 49 A 8.43 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 0.00 0.00 0.00 0.00 0.00 0.00 50 D 9.00 4.58 0.00 2.86 2.85 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 51 T 7.53 4.70 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 1.30 0.00 0.00 52 D 8.44 4.54 0.00 2.70 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 53 N 8.31 5.06 0.00 2.76 2.75 0.00 0.00 7.04 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 54 C 8.59 4.42 0.00 3.18 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.07 4.39 0.00 2.74 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 56 D 8.07 4.55 0.00 2.78 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 57 V 7.84 4.21 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 0.78 0.00 0.00 1.01 0.00 0.00 58 G 8.34 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 0.00 0.00 0.00 59 H 8.14 4.52 0.00 3.09 3.26 0.00 5.67 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 60 E 8.76 4.51 0.00 2.10 1.87 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 2.30 2.39 0.00 61 M 8.42 4.91 0.00 1.96 2.00 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 2.59 2.52 0.00 62 E 9.37 4.47 0.00 1.92 1.77 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 2.22 2.29 0.00 63 D 9.96 4.37 0.00 2.87 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 64 G 8.59 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 0.00 0.00 0.00 65 H 7.94 4.88 0.00 3.36 3.20 0.00 5.61 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 C 8.72 4.79 0.00 2.92 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 67 I 8.73 4.29 1.90 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 1.42 0.78 0.95 0.00 0.00 68 R 8.01 4.03 0.00 1.83 2.05 0.00 3.33 0.00 0.00 3.51 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 69 T 7.57 4.58 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 1.26 0.00 0.00 70 V 8.59 3.91 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 0.95 0.00 0.00 0.92 0.00 0.00 71 H 8.97 4.72 0.00 3.11 3.20 0.00 5.70 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 72 A 8.86 4.02 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 73 E 8.21 3.92 0.00 2.06 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 2.37 2.48 0.00 74 M 8.00 4.08 0.00 2.00 2.24 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 2.63 2.54 0.00 75 N 8.61 4.38 0.00 2.88 2.74 0.00 0.00 6.91 6.67 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 76 A 8.01 4.08 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 77 L 7.93 3.93 0.00 1.83 1.71 0.89 0.61 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 78 I 8.36 3.74 1.88 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 1.38 0.66 0.88 0.00 0.00 79 Q 8.15 3.93 0.00 2.21 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 80 C 7.79 4.11 0.00 3.15 3.19 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 81 A 8.12 3.95 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 82 K 8.37 4.07 0.00 1.75 1.86 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.46 7.81 83 E 8.20 4.16 0.00 2.06 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 2.33 2.37 0.00 84 G 7.65 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 85 I 7.71 4.39 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 1.22 1.03 0.90 0.00 0.00 86 S 8.64 4.18 0.00 3.81 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 87 A 8.44 4.40 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 88 N 7.67 4.55 0.00 2.75 2.67 0.00 0.00 7.37 6.57 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 89 N 8.48 4.38 0.00 2.90 2.86 0.00 0.00 6.86 7.01 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 90 T 7.06 4.77 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 1.19 0.00 0.00 91 E 9.09 5.06 0.00 1.93 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 2.10 2.13 0.00 92 I 8.42 5.03 1.83 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 1.25 1.95 0.90 0.00 0.00 93 Y 8.97 5.19 0.00 2.93 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 94 V 9.10 5.10 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 1.27 0.00 0.00 0.96 0.00 0.00 95 T 9.14 4.11 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 1.38 0.00 0.00 96 H 8.11 5.49 0.00 2.95 3.27 0.00 5.92 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 97 F 9.12 3.84 0.00 2.72 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 98 P 0.00 4.81 0.00 2.02 1.96 0.00 2.20 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.48 0.00 99 C 8.58 4.51 0.00 3.25 3.28 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 0.00 100 I 8.23 3.69 1.76 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.47 0.90 0.00 0.00 101 N 8.04 4.30 0.00 2.70 2.78 0.00 0.00 7.16 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 C 7.95 4.12 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 0.00 103 T 8.19 3.73 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 1.07 0.00 0.00 104 K 8.14 3.83 0.00 1.91 1.84 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.62 7.81 105 A 7.88 3.94 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.23 3.88 0.00 1.73 1.67 0.85 0.52 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 0.00 107 L 7.99 3.93 0.00 1.76 1.67 0.83 0.68 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 0.00 108 Q 8.19 3.98 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 109 A 8.04 4.25 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 0.00 110 G 7.88 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 0.00 111 V 7.54 4.20 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 0.71 0.00 0.00 0.92 0.00 0.00 112 K 9.17 4.51 0.00 1.57 1.79 0.00 1.77 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.47 7.81 113 K 7.63 4.75 0.00 1.74 1.49 0.00 1.61 0.00 0.00 1.91 0.00 0.00 2.76 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.42 7.81 114 I 9.00 4.86 1.88 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.51 0.79 0.00 0.00 115 T 8.77 5.23 3.66 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 1.33 0.00 0.00 116 Y 8.79 5.81 0.00 3.17 3.04 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 0.00 117 N 9.07 4.78 0.00 2.94 3.07 0.00 0.00 7.67 7.22 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 0.00 118 T 8.93 4.69 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 1.36 0.00 0.00 119 A 8.56 4.72 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 0.00 120 Y 8.03 4.26 0.00 3.06 3.08 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 0.00 121 R 8.17 3.38 0.00 1.60 1.70 0.00 2.82 0.00 0.00 2.94 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.00 122 I 7.17 3.37 1.49 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.09 0.09 0.00 0.00 123 H 8.75 4.38 0.00 3.25 3.22 0.00 5.68 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 0.00 124 P 0.00 4.27 0.00 2.35 2.29 0.00 3.54 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 125 F 8.63 4.42 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 0.00 126 A 7.96 3.79 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 0.00 127 I 7.55 3.33 1.96 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.72 0.89 0.00 0.00 128 E 8.14 3.90 0.00 2.10 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 2.30 2.41 0.00 129 L 7.59 3.77 0.00 1.57 1.47 0.60 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 130 M 8.00 4.04 0.00 2.37 2.02 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.51 0.00 131 T 8.19 3.95 4.44 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 1.27 0.00 0.00 132 Q 7.96 4.00 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 133 K 8.29 4.08 0.00 1.79 1.84 0.00 1.85 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.42 1.50 7.81 134 E 7.83 3.71 0.00 2.20 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 2.24 2.38 0.00 135 V 7.82 4.47 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 0.79 0.00 0.00 0.97 0.00 0.00 136 E 8.80 4.14 0.00 2.05 1.74 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 2.19 2.19 0.00 137 Y 7.82 5.31 0.00 3.25 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 0.00 138 V 8.99 4.34 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 1.00 0.00 0.00 0.90 0.00 0.00 139 Q 8.51 3.73 0.00 1.82 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.45 0.00 0.00 0.00 0.00 0.00 2.04 2.23 0.00 140 H 9.08 4.81 0.00 3.15 3.14 0.00 5.64 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.50 5.04 0.00 2.61 2.55 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 0.00 142 V 8.35 3.76 2.11 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 0.84 0.00 0.00 1.03 0.00 0.00 143 P 0.00 4.39 0.00 2.22 2.20 0.00 3.85 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.13 0.00 144 R 8.36 4.03 0.00 1.77 1.90 0.00 3.23 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 145 V 8.16 4.37 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 0.88 0.00 0.00 0.97 0.00 0.00 146 K 8.70 4.54 0.00 1.75 1.70 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.41 7.81 147 L 8.56 4.57 0.00 1.58 1.54 0.89 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.39 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 0.00 0.00 0.00 0.00 149 E 8.45 4.08 0.00 2.13 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 0.00 2.20 2.28 0.00