NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 M 4.3781 8.3044 120.3485 54.8015 34.0573 175.2625 9 R 4.3589 7.8137 117.2755 53.8586 32.4922 172.6485 10 R 4.5818 9.1814 125.5291 55.0831 33.4863 175.0093 11 S 5.0385 8.5197 118.2448 56.8117 66.6863 172.7842 12 V 4.8633 9.1873 125.6468 61.3562 33.6406 173.5027 13 Y 4.5572 8.7898 129.6587 56.0688 40.4445 173.9244 14 F 5.1002 8.7006 129.7048 57.5948 40.9980 174.5792 15 C 4.8781 8.5201 124.0248 58.0189 30.3921 173.2459 16 G 4.5816 8.8675 110.6575 44.2669 0.0000 171.5547 17 S 4.4718 9.0623 120.2023 58.3359 63.1031 173.1030 18 I 4.2506 8.7487 120.9980 61.4036 38.8470 176.4941 19 R 3.8586 8.9899 118.5234 56.9336 28.2863 175.7910 20 G 3.9232 8.4207 99.8067 46.1045 0.0000 174.5365 21 G 4.0549 8.2174 108.1494 44.4144 0.0000 174.5985 22 R 4.5209 8.4262 117.7800 55.9694 30.2305 177.1370 23 E 4.5118 8.0955 116.9048 56.8508 30.6958 176.8957 24 D 4.7814 7.8861 118.3095 55.7034 41.6123 178.1450 25 Q 4.0059 8.1310 119.7747 59.1628 28.9650 178.0077 26 A 3.9683 7.9979 121.2405 55.1906 18.3989 179.2444 27 L 3.8326 7.8438 118.3187 58.3616 42.1729 178.5996 28 Y 3.3299 8.4219 117.0013 60.7124 37.2107 178.3400 29 A 3.9319 8.3406 122.1524 55.1033 18.0470 179.6872 30 R 3.8884 7.7330 117.6780 59.1904 30.1405 178.6375 31 I 3.7129 7.7511 113.1881 63.4501 37.5916 178.4334 32 V 3.5000 7.8387 120.6696 65.7698 31.4618 178.1706 33 S 4.1153 7.7094 113.1646 61.5633 62.3587 176.7660 34 R 4.0380 7.6740 120.5135 58.9178 29.6627 179.0196 35 L 4.1951 8.1802 119.0040 57.7714 41.4312 179.4655 36 R 3.9399 8.1256 118.1587 59.1767 30.0556 178.0953 37 R 4.0791 7.8240 117.7546 59.5633 30.0798 177.9917 38 Y 4.1210 7.6740 115.5327 60.9139 38.1159 176.0612 39 G 4.2609 8.1713 105.1816 46.0378 0.0000 171.8631 40 K 4.9011 8.0729 118.1003 53.9005 36.7626 175.5222 41 V 5.0349 8.2780 125.4591 57.9954 33.9360 174.2074 42 L 3.5309 7.8446 121.0617 53.1706 42.4480 179.3165 43 T 3.1261 5.7900 120.5842 65.5457 65.1847 172.3564 44 E 4.1254 6.5561 125.4173 58.2940 30.7737 179.0465 45 H 5.0476 8.6620 113.1024 58.0126 28.4555 175.6554 46 V 3.7695 6.6841 111.9162 61.1361 31.8987 175.4277 47 A 4.5240 6.6783 115.7605 52.1034 21.7997 178.1513 48 D 4.6026 7.4744 121.2459 52.2354 42.0919 176.6460 49 A 4.6010 8.2122 132.0398 49.3601 18.5092 177.2202 50 E 5.4278 7.3011 125.3062 55.1463 31.5031 175.3729 51 L 3.7550 7.9130 120.5956 54.8454 42.2902 175.7778 52 E 3.8848 8.7508 127.7974 55.8169 29.5646 175.2196 53 P 4.3939 0.0000 0.0000 63.1358 32.9429 175.7075 54 L 3.6842 9.0017 119.2980 54.7699 41.0282 172.9783 55 G 3.8271 8.5329 103.1260 44.0029 0.0000 172.6379 56 E 3.9898 8.6924 120.5825 56.7448 30.1249 178.7361 57 E 4.2866 8.5239 126.8355 54.8524 28.0928 174.5538 58 A 4.6988 7.4638 123.8249 50.1562 23.1679 177.3826 59 A 4.3074 8.3497 123.1726 51.1447 16.8990 176.9121 60 G 3.9379 7.4922 109.8080 43.5122 0.0000 169.5466 61 G 3.7949 8.6162 117.9537 44.8472 0.0000 175.3863 62 D 4.3599 8.8636 120.9556 56.6321 40.3757 178.4544 63 Q 4.0125 7.7706 118.5125 58.6006 28.6395 179.0757 64 F 3.8897 8.3660 118.2860 60.3279 38.8710 177.4925 65 I 3.7134 7.9389 119.6095 64.8453 36.8998 177.9868 66 H 4.1093 8.1674 118.5846 59.1806 29.7854 177.2142 67 E 3.9437 8.0475 120.4292 59.3191 29.2767 179.3031 68 Q 3.6341 8.4453 118.4453 58.7260 28.8319 178.6311 69 A 4.4882 7.8289 121.8467 55.1453 17.8568 179.7384 70 L 3.9581 7.7494 117.3565 57.9280 40.1505 179.2276 71 N 4.3735 8.0453 116.7502 56.3990 38.8270 177.1008 72 W 4.8487 8.1752 120.1388 59.7120 28.9982 178.3361 73 L 4.1410 8.0359 119.1923 57.9429 41.5230 177.9896 74 Q 4.1968 7.6954 117.0141 58.7073 28.8413 177.7575 75 Q 4.1232 7.5830 112.3827 57.6489 29.3882 175.2495 76 A 4.1344 8.0221 121.3257 52.4955 17.9900 176.5171 77 D 4.7110 8.6405 123.6988 57.4138 42.1044 176.9272 78 V 4.8509 7.7249 116.5921 59.9410 35.2899 174.2195 79 V 5.1383 8.7236 122.6328 61.1298 34.5937 174.5534 80 V 4.7090 9.0690 126.4429 59.7932 34.5041 174.2637 81 A 4.6215 8.5874 125.5098 50.1481 22.4943 175.0341 82 E 5.0314 8.3327 119.4175 54.4290 31.8890 174.1742 83 V 4.6464 8.9783 123.5116 61.1778 34.3805 176.2299 84 T 3.8379 9.0177 118.1089 63.0786 69.3883 174.3834 85 Q 4.8098 7.7224 118.5284 52.9600 31.5821 173.0839 86 P 4.2984 0.0000 0.0000 63.5420 30.8606 176.0986 87 S 4.7551 8.4308 120.5329 56.5861 65.1338 174.6304 88 L 4.0741 8.5537 128.5869 58.2868 41.9910 179.2803 89 G 3.6459 8.0665 105.1979 47.9086 0.0000 175.6892 90 V 4.4493 7.3457 121.8715 65.1162 31.6511 178.1376 91 G 3.6571 8.5127 105.9980 47.8652 0.0000 175.0000 92 Y 3.9066 8.0136 121.4608 60.5695 38.9451 178.0200 93 E 4.0478 8.1466 119.6369 59.4672 29.6318 179.3672 94 L 3.9394 8.0039 119.1613 57.6304 41.7688 179.8022 95 G 3.4158 7.8751 105.6410 47.7607 0.0000 175.7915 96 R 3.8192 7.8354 120.9073 58.8942 29.9836 178.4601 97 A 3.9626 7.9005 120.8555 55.0202 18.0929 179.7767 98 V 3.4306 7.3539 115.5763 65.7527 31.6358 177.8552 99 A 4.0825 7.5977 119.5270 54.3439 18.3289 179.0254 100 L 4.1973 8.2060 118.5690 56.8432 42.9615 177.0892 101 G 4.2552 8.2301 107.1004 44.6768 0.0000 173.3513 102 K 4.2792 8.2317 125.6159 56.2950 40.1054 173.9985 103 P 4.7685 0.0000 0.0000 62.9211 31.6868 174.2227 104 I 4.9907 8.6698 126.7891 59.5324 40.4447 174.5647 105 L 5.1981 8.8232 126.3363 53.4332 45.5987 174.7287 106 C 5.0075 9.0332 125.1274 57.6091 35.3637 172.4622 107 L 5.3251 8.9200 126.0541 53.3090 43.6380 174.8000 108 F 6.0007 9.0756 126.9782 55.3649 42.1029 174.4702 109 R 4.5760 7.6989 126.4760 54.4723 30.5731 174.7003 110 P 4.5985 0.0000 0.0000 63.6337 31.3778 176.2674 111 Q 4.4239 7.3461 116.8805 56.0389 30.2548 175.5183 112 S 4.0491 7.5369 113.4676 59.8648 62.6604 174.1241 113 G 3.9561 8.1259 110.6537 46.1032 0.0000 174.2197 114 R 4.5084 7.6536 117.8947 55.1960 32.1281 175.3594 115 V 4.8263 7.8711 115.9983 60.6856 34.0906 173.8764 116 L 3.7769 7.9760 121.6178 54.0158 42.1407 178.0609 117 S 4.3602 8.3129 118.4098 57.7409 65.1407 175.0483 118 A 3.9291 8.4019 122.9141 55.4846 17.9919 179.3977 119 M 3.9513 7.9467 116.1574 58.8234 32.2396 178.4519 120 I 3.7683 7.6045 119.4106 64.4655 37.1901 178.4405 121 R 3.9620 7.9810 117.9674 59.2331 29.9549 179.0931 122 G 3.7051 8.2576 104.6135 47.6088 0.0000 175.0949 123 A 4.3260 7.8542 122.1003 54.4030 19.6851 179.0541 124 A 4.1405 7.3398 120.0949 51.5671 15.6439 176.9076 125 D 4.3350 8.0951 122.2728 54.1501 40.6891 178.8140 126 G 4.3458 7.7953 108.5540 45.7652 0.0000 174.8633 127 S 4.2814 7.4660 116.2977 59.5761 63.4405 174.6419 128 R 3.9834 7.7730 118.5568 55.6422 32.9028 174.4342 129 F 5.6794 8.1248 122.5806 56.6622 41.6682 174.0687 130 Q 4.5177 9.0602 125.1330 53.9266 31.9015 174.6814 131 V 4.1482 8.1496 124.1875 61.1011 32.7904 174.4930 132 W 5.2644 9.0459 129.0952 55.3885 31.5016 175.3029 133 D 5.8500 9.0958 122.9594 51.6773 40.5244 175.0181 134 Y 4.7424 8.6636 121.8760 55.0401 40.8544 174.6460 135 A 4.3689 8.7602 126.6227 52.2157 19.5494 179.6853 136 E 3.6930 9.0236 124.0698 58.0267 28.7828 177.2759 137 G 3.8597 9.4311 114.6761 47.9926 0.0000 174.5160 138 E 4.4616 8.2088 119.6251 56.5026 29.7932 178.2533 139 V 3.5111 8.2019 121.5578 64.6488 31.2818 178.2034 140 E 3.9356 8.0968 117.8765 59.4886 29.5490 179.1240 141 T 3.8593 7.8495 116.2340 66.6665 68.5865 176.4442 142 M 4.1965 8.1726 120.6623 58.3901 31.9799 178.8737 143 L 4.0785 8.0125 119.2931 57.7962 41.7630 179.2706 144 D 4.4271 8.4898 119.3056 57.4063 40.7262 179.0303 145 R 4.0690 8.3862 118.7885 59.1995 29.9052 178.4534 146 Y 4.6638 8.7470 119.6860 60.9228 38.9643 177.8280 147 F 4.1791 8.4750 118.8268 60.1524 39.1322 177.5598 148 E 4.1221 8.6848 119.0685 59.2039 29.6170 178.6471 149 A 4.1535 8.6011 121.1660 54.8486 18.3557 179.0034 150 Y 3.9063 7.8365 118.6538 60.6365 38.6370 177.4910 151 L 4.0069 7.8610 120.3332 57.9200 42.2747 178.9486 152 V 3.8018 7.6307 118.3046 64.5668 31.3009 177.6387 153 E 3.9650 8.2741 119.5519 56.6909 29.2420 176.9572 154 H 4.4448 8.2488 115.9500 56.0132 28.9605 173.0449 155 H 4.5940 6.6723 111.7462 55.9599 31.3245 173.9976 156 H 4.8928 8.8412 117.7702 54.6611 29.2526 171.4115 157 H 4.6174 8.2464 120.7013 57.2337 32.1040 174.5751 158 H 4.2516 8.2680 115.0910 56.2219 29.1838 174.9043 159 H 5.4087 8.6450 118.3137 55.6665 28.6749 175.3367 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 8 M 8.30 4.38 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.53 0.00 9 R 7.81 4.36 0.00 1.84 1.76 0.00 3.28 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.71 0.00 10 R 9.18 4.58 0.00 1.77 1.72 0.00 3.08 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 11 S 8.52 5.04 0.00 3.95 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 12 V 9.19 4.86 2.22 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 1.23 0.00 0.00 0.94 0.00 0.00 13 Y 8.79 4.56 0.00 3.15 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 14 F 8.70 5.10 0.00 3.09 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 15 C 8.52 4.88 0.00 2.64 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 16 G 8.87 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 9.06 4.47 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 18 I 8.75 4.25 1.95 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 1.38 1.14 1.21 0.00 0.00 19 R 8.99 3.86 0.00 1.97 2.03 0.00 3.39 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 20 G 8.42 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 21 G 8.22 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 0.00 0.00 0.00 22 R 8.43 4.52 0.00 1.82 1.96 0.00 3.20 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 23 E 8.10 4.51 0.00 1.99 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 2.26 2.28 0.00 24 D 7.89 4.78 0.00 2.90 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 25 Q 8.13 4.01 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.88 0.00 0.00 0.00 0.00 0.00 2.54 2.36 0.00 26 A 8.00 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 27 L 7.84 3.83 0.00 1.74 1.75 0.86 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 28 Y 8.42 3.33 0.00 3.14 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 29 A 8.34 3.93 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.73 3.89 0.00 1.83 1.83 0.00 3.10 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 31 I 7.75 3.71 1.48 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 0.13 0.59 0.00 0.00 32 V 7.84 3.50 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.87 0.00 0.00 33 S 7.71 4.12 0.00 4.12 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 R 7.67 4.04 0.00 1.91 1.94 0.00 3.27 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.72 0.00 35 L 8.18 4.20 0.00 1.91 1.78 0.95 0.85 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 36 R 8.13 3.94 0.00 1.90 1.98 0.00 3.27 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 37 R 7.82 4.08 0.00 2.28 2.16 0.00 3.38 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 38 Y 7.67 4.12 0.00 2.67 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 39 G 8.17 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 40 K 8.07 4.90 0.00 1.88 1.62 0.00 1.46 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.40 7.81 41 V 8.28 5.03 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 1.21 0.00 0.00 0.88 0.00 0.00 42 L 7.84 3.53 0.00 0.27 0.13 0.58 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 43 T 5.79 3.13 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 1.71 0.00 0.00 44 E 6.56 4.13 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 45 H 8.66 5.05 0.00 3.40 3.79 0.00 5.13 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 V 6.68 3.77 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 0.41 0.00 0.00 -0.34 0.00 0.00 47 A 6.68 4.52 1.13 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 0.00 0.00 48 D 7.47 4.60 0.00 2.86 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 49 A 8.21 4.60 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 50 E 7.30 5.43 0.00 1.93 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 2.04 2.07 0.00 51 L 7.91 3.76 0.00 1.63 1.61 0.88 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.75 3.88 0.00 1.95 1.90 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 2.30 2.37 0.00 53 P 0.00 4.39 0.00 2.20 2.07 0.00 3.92 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 54 L 9.00 3.68 0.00 1.82 1.75 0.92 0.91 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 55 G 8.53 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 56 E 8.69 3.99 0.00 1.98 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 2.36 2.44 0.00 57 E 8.52 4.29 0.00 1.97 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 2.26 2.34 0.00 58 A 7.46 4.70 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 59 A 8.35 4.31 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 60 G 7.49 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.62 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 D 8.86 4.36 0.00 2.88 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 7.77 4.01 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.87 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 64 F 8.37 3.89 0.00 3.24 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 I 7.94 3.71 2.13 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.40 0.93 0.00 0.00 66 H 8.17 4.11 0.00 3.16 3.23 0.00 5.59 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.05 3.94 0.00 2.09 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.23 0.00 68 Q 8.45 3.63 0.00 2.19 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.98 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 69 A 7.83 4.49 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 70 L 7.75 3.96 0.00 1.85 1.71 0.93 0.91 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 71 N 8.05 4.37 0.00 2.89 2.61 0.00 0.00 7.15 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 72 W 8.18 4.85 0.00 4.02 3.51 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 73 L 8.04 4.14 0.00 1.87 1.71 0.72 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 7.70 4.20 0.00 2.36 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 75 Q 7.58 4.12 0.00 2.21 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 7.06 0.00 0.00 0.00 0.00 0.00 2.68 2.45 0.00 76 A 8.02 4.13 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 77 D 8.64 4.71 0.00 2.74 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 78 V 7.72 4.85 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 0.65 0.00 0.00 1.35 0.00 0.00 79 V 8.72 5.14 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 1.03 0.00 0.00 0.92 0.00 0.00 80 V 9.07 4.71 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 0.91 0.00 0.00 0.23 0.00 0.00 81 A 8.59 4.62 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 82 E 8.33 5.03 0.00 1.75 1.78 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 1.80 1.97 0.00 83 V 8.98 4.65 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 1.09 0.00 0.00 0.97 0.00 0.00 84 T 9.02 3.84 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 1.06 0.00 0.00 85 Q 7.72 4.81 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.17 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 86 P 0.00 4.30 0.00 2.23 2.16 0.00 3.92 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 87 S 8.43 4.76 0.00 3.95 3.89 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 88 L 8.55 4.07 0.00 1.79 1.70 0.97 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 89 G 8.07 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 90 V 7.35 4.45 2.14 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 1.46 0.00 0.00 1.04 0.00 0.00 91 G 8.51 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 0.00 0.00 0.00 0.00 92 Y 8.01 3.91 0.00 3.10 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.15 4.05 0.00 2.18 1.90 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 2.35 2.61 0.00 94 L 8.00 3.94 0.00 1.84 1.54 0.94 1.03 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 95 G 7.88 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 0.00 0.00 0.00 96 R 7.84 3.82 0.00 1.84 2.03 0.00 3.10 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 97 A 7.90 3.96 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 V 7.35 3.43 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 0.73 0.00 0.00 0.55 0.00 0.00 99 A 7.60 4.08 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 0.00 100 L 8.21 4.20 0.00 1.66 1.70 0.95 1.02 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 0.00 101 G 8.23 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 0.00 102 K 8.23 4.28 0.00 1.70 1.77 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.26 1.34 7.81 103 P 0.00 4.77 0.00 2.46 2.45 0.00 3.69 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 2.33 2.13 0.00 104 I 8.67 4.99 1.34 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 1.14 0.83 0.61 0.00 0.00 105 L 8.82 5.20 0.00 1.40 0.99 0.36 0.60 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 0.00 106 C 9.03 5.01 0.00 3.15 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 0.00 107 L 8.92 5.33 0.00 1.83 1.53 0.93 0.03 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 0.00 108 F 9.08 6.00 0.00 3.11 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 R 7.70 4.58 0.00 1.10 1.19 0.00 2.93 0.00 0.00 3.08 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.16 0.00 110 P 0.00 4.60 0.00 2.18 2.14 0.00 3.58 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 1.90 2.13 0.00 111 Q 7.35 4.42 0.00 1.87 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.13 0.00 0.00 0.00 0.00 0.00 2.17 2.26 0.00 112 S 7.54 4.05 0.00 3.54 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 G 8.13 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.65 4.51 0.00 1.94 2.17 0.00 3.30 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 115 V 7.87 4.83 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 0.78 0.00 0.00 0.99 0.00 0.00 116 L 7.98 3.78 0.00 1.43 1.39 0.74 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.31 4.36 0.00 4.02 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 0.00 118 A 8.40 3.93 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 0.00 119 M 7.95 3.95 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.67 0.00 120 I 7.60 3.77 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.68 0.86 0.00 0.00 121 R 7.98 3.96 0.00 1.74 1.95 0.00 3.32 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 122 G 8.26 3.71 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 0.00 0.00 0.00 123 A 7.85 4.33 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 A 7.34 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.10 4.33 0.00 2.80 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 0.00 126 G 7.80 4.35 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 0.00 127 S 7.47 4.28 0.00 4.15 3.78 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 0.00 128 R 7.77 3.98 0.00 1.71 2.00 0.00 3.15 0.00 0.00 3.19 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 129 F 8.12 5.68 0.00 2.97 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 0.00 130 Q 9.06 4.52 0.00 1.64 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 131 V 8.15 4.15 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 0.76 0.00 0.00 0.17 0.00 0.00 132 W 9.05 5.26 0.00 3.33 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 0.00 133 D 9.10 5.85 0.00 2.71 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 Y 8.66 4.74 0.00 3.16 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 0.00 135 A 8.76 4.37 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 0.00 136 E 9.02 3.69 0.00 2.14 1.65 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 2.27 2.21 0.00 137 G 9.43 3.86 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 0.00 0.00 0.00 138 E 8.21 4.46 0.00 2.29 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 2.29 2.36 0.00 139 V 8.20 3.51 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.37 0.00 0.00 140 E 8.10 3.94 0.00 2.20 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 0.00 2.54 2.40 0.00 141 T 7.85 3.86 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 1.17 0.00 0.00 142 M 8.17 4.20 0.00 2.30 2.34 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.97 0.00 143 L 8.01 4.08 0.00 1.85 1.55 0.88 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 144 D 8.49 4.43 0.00 2.82 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 0.00 145 R 8.39 4.07 0.00 1.95 1.81 0.00 2.89 0.00 0.00 2.73 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 146 Y 8.75 4.66 0.00 3.34 3.39 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 0.00 147 F 8.48 4.18 0.00 3.07 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 0.00 148 E 8.68 4.12 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 149 A 8.60 4.15 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 0.00 150 Y 7.84 3.91 0.00 3.00 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 0.00 151 L 7.86 4.01 0.00 1.93 1.76 0.74 0.82 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 0.00 152 V 7.63 3.80 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 0.85 0.00 0.00 0.94 0.00 0.00 153 E 8.27 3.96 0.00 2.19 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 2.41 2.11 0.00 154 H 8.25 4.44 0.00 3.29 3.36 0.00 5.88 0.00 0.00 0.00 0.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 H 6.67 4.59 0.00 3.24 3.37 0.00 5.55 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 0.00 156 H 8.84 4.89 0.00 3.16 3.25 0.00 5.68 0.00 0.00 0.00 0.00 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 H 8.25 4.62 0.00 3.05 3.24 0.00 5.99 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 H 8.27 4.25 0.00 3.29 3.30 0.00 5.94 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 H 8.64 5.41 0.00 3.19 3.23 0.00 5.78 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