NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4831 8.4045 118.7945 53.9424 33.2896 175.7445 2 E 4.1787 8.5682 121.1642 55.5538 31.0438 172.2731 3 L 5.2239 8.5909 121.0939 53.3585 46.1334 174.8627 4 T 4.8167 9.1847 114.7501 61.2678 71.4354 172.0650 5 T 5.2138 8.4800 111.2018 60.0974 71.8574 173.4685 6 R 4.7129 8.7951 121.5229 55.2378 34.1453 173.5492 7 T 5.0197 8.4607 121.7282 62.1582 70.2937 174.0257 8 L 4.5105 9.1688 127.8197 52.8584 42.9623 175.3688 9 P 4.6883 0.0000 0.0000 62.1084 32.2978 176.4625 10 A 4.0118 8.5584 121.5620 55.2652 18.2881 178.4498 11 R 4.1961 7.7251 116.6156 55.4144 29.9204 176.4727 12 K 4.3823 8.6341 122.9000 56.2855 34.1472 176.2419 13 H 5.1751 9.4421 120.9857 54.7757 30.2131 173.8240 14 I 4.9888 9.2040 125.3726 59.4371 39.7609 174.7566 15 A 5.1202 9.1269 129.3121 50.5516 21.0596 175.5827 16 L 5.0524 9.1937 123.4434 52.9613 44.3020 175.9945 17 V 4.6906 8.9818 123.3585 61.2973 35.2413 173.6774 18 A 5.4805 8.2664 126.4614 51.0151 22.4713 175.8840 19 H 4.7105 9.4396 118.8608 55.6070 30.1967 176.4448 20 D 4.4149 9.1484 120.0807 58.3011 40.6495 179.0093 21 H 4.4644 8.3174 112.6470 57.5583 28.9759 176.0704 22 C 4.7554 8.2119 116.6454 59.2390 28.9204 175.6496 23 K 3.9980 7.8332 121.1299 59.7881 31.7869 178.8334 24 Q 4.1397 8.1665 119.0197 59.2587 28.9976 177.9095 25 M 4.1387 7.9871 119.0578 58.5483 32.3481 177.8180 26 L 4.2582 8.5469 120.8674 58.3619 42.1990 178.7908 27 M 4.1368 8.6670 119.2071 58.5090 31.9129 178.8401 28 S 4.1639 8.2549 115.2204 61.4115 62.8380 176.5665 29 W 4.1669 8.0339 129.1396 60.6159 30.5642 177.8370 30 V 3.5786 8.4749 118.4890 66.0067 30.6060 177.9016 31 E 3.9796 8.4802 118.8161 58.9381 29.1267 178.5528 32 R 4.2975 7.5967 113.1862 57.0507 30.1414 176.4072 33 H 4.6429 7.3378 115.2968 54.8694 30.6500 174.6431 34 Q 3.8870 7.7689 121.6403 59.2091 28.4304 177.0373 35 P 4.4636 0.0000 0.0000 64.8006 31.6056 178.0652 36 L 4.1308 7.7151 118.3176 58.2573 42.1923 178.8058 37 L 4.1866 7.9542 118.8116 57.7429 41.1338 179.0451 38 E 4.0731 8.6495 118.3399 58.3512 29.1379 178.1098 39 Q 4.4311 7.8762 116.7037 56.2119 29.4824 174.0381 40 H 5.0170 8.1086 116.8870 53.8154 32.8303 172.7547 41 V 4.2287 8.6168 119.2889 61.8814 32.9457 174.7028 42 L 5.3053 8.3832 127.5198 53.5071 44.1021 175.0506 43 Y 5.2274 9.1816 119.9568 56.6394 42.4369 174.2176 44 A 5.3815 8.8243 121.6043 51.9240 23.4485 176.0649 45 T 4.1041 8.4320 109.9317 61.2227 70.3093 175.3138 46 G 3.8908 8.9233 108.3438 48.6852 0.0000 176.0489 47 T 3.8603 7.7466 117.4132 66.1933 68.7508 176.6375 48 T 3.9948 8.0698 117.2364 66.8199 68.5336 176.3264 49 G 3.7427 8.3558 107.5485 48.2365 0.0000 175.3878 50 N 4.5070 7.9126 120.1181 55.2953 38.4186 177.6265 51 L 4.0327 8.0993 120.5371 57.6739 41.6956 179.6414 52 I 3.7267 7.9599 120.0364 64.4941 37.1604 178.7227 53 S 4.4469 8.1216 115.0013 61.3224 62.4390 176.5518 54 R 3.9657 7.8393 121.5970 59.2101 29.9578 177.9359 55 A 4.2072 8.2338 119.9903 54.2081 18.6404 178.6462 56 T 4.4081 8.4362 106.5250 60.8591 70.3638 175.9213 57 G 3.9152 7.9448 108.8156 45.6064 0.0000 173.6353 58 M 4.2094 7.6525 118.9891 54.8583 32.5975 175.3071 59 N 4.6186 8.4306 119.4680 52.6275 39.5600 174.3445 60 V 4.4274 8.0619 125.1651 61.1498 34.6649 175.0143 61 N 4.6056 8.9538 125.8853 52.2678 38.5861 173.4896 62 A 4.7395 8.3082 125.7087 51.8752 20.0826 176.7638 63 M 4.6257 8.8787 123.3559 53.9370 35.5924 175.7429 64 L 4.3929 9.1277 119.1431 55.0496 43.2053 177.1040 65 S 4.3817 8.7379 115.6479 58.7416 63.2981 174.9041 66 G 3.7964 9.1310 111.9539 48.0287 0.0000 174.0668 67 P 4.2879 0.0000 0.0000 64.8150 31.4193 177.5942 68 M 4.4450 7.7813 114.5410 54.7943 32.6047 176.0158 69 G 3.9042 8.3962 108.0769 45.4487 0.0000 176.5620 70 G 3.6670 8.7711 108.3619 48.0134 0.0000 175.4117 71 D 4.2905 8.0567 120.5987 57.4796 40.9037 178.9416 72 Q 4.0597 8.0019 117.4912 58.5208 28.7539 178.5713 73 Q 3.9352 7.8715 119.5824 58.9204 28.7408 178.7872 74 V 3.6233 7.8932 119.4668 65.7006 31.5399 178.2489 75 G 3.5766 8.1250 105.3824 47.7945 0.0000 175.5135 76 A 4.0145 8.0000 124.7644 54.2295 18.3834 179.6956 77 L 3.7866 7.8085 117.4979 57.8614 41.5863 179.8511 78 I 3.5111 7.7107 119.9915 64.3007 36.9360 178.6875 79 S 2.7900 7.8667 114.5736 60.0880 62.4988 175.1954 80 E 4.2185 7.1977 119.9827 55.1593 29.4115 176.2836 81 G 3.6758 7.1759 106.8078 46.4318 0.0000 175.1843 82 K 4.0415 8.1315 120.1731 56.3970 32.7310 177.0559 83 I 4.3436 7.2831 118.9423 59.4283 39.4730 174.6794 84 D 4.8791 8.9311 123.7498 54.6780 43.2025 176.9846 85 V 4.7001 7.6183 117.1122 60.8885 35.5887 173.7643 86 L 5.1219 8.8178 128.7711 53.3896 45.0659 174.9487 87 I 4.6562 9.0216 128.1290 59.7437 39.2815 174.6821 88 F 5.5128 9.3768 131.1449 56.6775 41.6462 173.8210 89 F 5.3576 9.6702 127.5882 56.1294 38.5653 175.0519 90 W 4.6677 8.0124 120.1788 54.6313 30.1549 175.8993 91 D 4.3233 9.0619 121.8947 53.5554 40.5741 173.9510 92 P 4.3502 0.0000 0.0000 62.8560 31.4910 176.1623 93 L 4.7003 9.0374 117.4731 54.3143 43.0914 176.2427 94 N 4.6215 7.9353 115.9528 51.9917 41.6957 174.2606 95 A 4.1763 8.6794 127.2193 52.3159 19.1300 176.7143 96 V 4.5794 7.9734 114.7703 58.4937 34.7068 174.4694 97 P 4.4165 0.0000 0.0000 65.3953 31.5958 176.8659 98 N 4.8977 7.8635 116.8281 52.8465 38.7566 176.7794 99 D 4.3502 8.1760 122.4186 58.1567 41.5153 175.0199 100 P 4.2314 0.0000 0.0000 66.0206 31.1983 178.0848 101 D 4.4086 8.0712 118.1979 56.9881 40.7828 178.7715 102 V 3.7871 7.8342 118.6950 66.1234 31.5629 178.3283 103 K 3.8240 8.1624 118.0704 59.2085 31.8504 179.2566 104 A 3.9621 8.5259 121.5133 55.0141 18.3401 179.4203 105 L 3.9293 8.1957 119.0476 58.4059 42.2245 179.2637 106 L 4.0740 7.9512 118.9233 57.5430 41.3992 179.3921 107 R 3.8639 8.1620 118.8250 59.5936 29.9832 178.6331 108 L 4.0578 8.0725 118.4417 57.7968 41.1374 179.4298 109 A 4.0905 8.2492 120.7765 55.2150 18.2364 179.9764 110 T 3.8304 7.9540 114.4100 66.7715 68.3943 176.8979 111 V 3.3236 7.6508 119.3281 65.9269 31.3902 176.9530 112 W 4.2040 8.2689 115.8340 56.1734 29.3033 175.6109 113 N 4.1447 7.6946 116.7495 54.8040 37.1349 173.1465 114 I 4.6664 7.1832 109.3315 58.2744 40.9719 175.1465 115 P 4.4917 0.0000 0.0000 63.1331 32.3689 175.5410 116 V 5.0390 8.4205 122.5728 61.1606 34.7986 174.0147 117 A 4.9476 9.1948 129.2734 50.4819 21.4150 176.4733 118 T 5.3623 9.1183 110.9615 60.9217 70.0939 173.8515 119 N 4.1797 7.3831 119.4645 50.2156 41.6550 175.2595 120 V 3.3055 7.5527 118.9902 66.0715 31.5922 177.4061 121 A 4.1342 7.9587 119.9398 55.8930 18.1492 179.6447 122 T 3.9225 8.6470 114.1550 66.4631 68.5079 177.0393 123 A 3.9893 7.9575 122.8853 55.2466 18.4550 179.4529 124 D 4.5428 8.9573 117.7589 57.6874 40.7168 178.9677 125 F 3.8832 8.2960 117.2407 60.4662 39.2936 177.6599 126 I 4.0372 8.1278 119.6390 64.4540 36.8817 178.4766 127 I 2.6788 7.6584 111.5872 62.6701 37.4735 177.1318 128 Q 4.2106 7.5606 117.9395 55.6163 29.6404 175.9496 129 S 4.3146 7.4083 116.0548 57.1189 63.2927 172.6397 130 P 4.2331 0.0000 0.0000 66.6188 30.8384 177.6857 131 H 4.6769 8.1125 113.2159 56.0621 28.6091 176.9447 132 F 4.0984 8.3516 123.7058 60.6272 39.2959 175.6419 133 N 4.9328 8.0205 115.1360 52.8880 38.6160 173.7425 134 D 4.9764 7.4140 116.0443 51.9567 44.7242 175.0099 135 A 4.6896 8.3444 122.3373 52.1123 19.4082 177.3843 136 V 4.4278 8.6447 119.4120 60.5473 35.2894 172.8868 137 D 5.3629 8.6144 122.6919 53.1280 42.3217 175.7779 138 I 4.6479 8.8544 116.3799 59.0252 41.3505 174.1258 139 L 5.1471 8.4218 123.1739 53.6184 42.7263 176.1263 140 I 4.8170 8.9204 117.4844 57.8668 41.2611 173.2038 141 P 4.4468 0.0000 0.0000 62.9256 32.2504 176.6322 142 D 4.6443 9.0668 122.3799 53.5783 41.0733 176.4595 143 Y 4.1575 8.6061 128.6990 60.6145 39.0586 177.2467 144 Q 4.0166 8.4601 121.0471 59.9435 28.8791 179.8731 145 R 4.0034 7.8465 120.2291 61.1478 29.2105 179.8857 146 Y 4.1545 7.6269 118.8687 60.6568 39.1077 177.8231 147 L 3.6658 8.1098 121.2046 57.9290 42.0511 178.4942 148 A 3.9209 7.7668 120.7135 55.5507 18.0542 179.3692 149 D 4.2609 7.7442 115.7256 57.0261 40.9035 178.7904 150 R 3.9219 7.5207 118.0382 58.1969 30.1468 177.8851 151 L 4.4133 7.2864 119.3020 55.6198 42.1904 177.3987 152 K 4.1331 7.9126 124.8057 54.7706 31.6590 182.1141 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.40 4.48 0.00 2.05 1.93 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.11 0.00 2 E 8.57 4.18 0.00 1.73 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.98 0.00 3 L 8.59 5.22 0.00 1.48 1.66 0.90 0.75 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 4 T 9.18 4.82 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 1.34 0.00 0.00 5 T 8.48 5.21 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 1.23 0.00 0.00 6 R 8.80 4.71 0.00 1.92 1.79 0.00 3.04 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 7 T 8.46 5.02 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 1.23 0.00 0.00 8 L 9.17 4.51 0.00 1.53 1.56 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.69 0.00 2.18 2.08 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 10 A 8.56 4.01 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 11 R 7.73 4.20 0.00 1.78 1.86 0.00 3.17 0.00 0.00 3.19 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 12 K 8.63 4.38 0.00 1.38 1.53 0.00 1.46 0.00 0.00 1.82 0.00 0.00 2.50 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 0.47 7.81 13 H 9.44 5.18 0.00 3.15 3.17 0.00 5.78 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 9.20 4.99 2.02 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.76 1.13 0.00 0.00 15 A 9.13 5.12 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 16 L 9.19 5.05 0.00 1.57 1.56 1.01 0.90 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 17 V 8.98 4.69 1.45 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 0.57 0.00 0.00 0.66 0.00 0.00 18 A 8.27 5.48 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 19 H 9.44 4.71 0.00 3.28 3.34 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 9.15 4.41 0.00 2.71 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 21 H 8.32 4.46 0.00 3.30 3.38 0.00 5.86 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 C 8.21 4.76 0.00 3.30 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 23 K 7.83 4.00 0.00 2.02 1.92 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.67 7.81 24 Q 8.17 4.14 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.92 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 25 M 7.99 4.14 0.00 2.41 2.09 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 26 L 8.55 4.26 0.00 1.84 1.88 0.35 1.21 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 27 M 8.67 4.14 0.00 2.08 2.31 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.97 0.00 28 S 8.25 4.16 0.00 4.17 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.03 4.17 0.00 3.50 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.47 3.58 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.22 0.00 0.00 31 E 8.48 3.98 0.00 2.16 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 2.33 2.60 0.00 32 R 7.60 4.30 0.00 1.78 1.92 0.00 2.84 0.00 0.00 3.15 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.09 0.00 33 H 7.34 4.64 0.00 2.40 2.81 0.00 5.65 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 34 Q 7.77 3.89 0.00 2.29 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.40 6.73 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 35 P 0.00 4.46 0.00 2.02 2.09 0.00 3.63 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 36 L 7.72 4.13 0.00 1.74 1.78 1.13 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.95 4.19 0.00 1.73 1.76 0.73 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.65 4.07 0.00 2.12 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 0.00 2.32 2.55 0.00 39 Q 7.88 4.43 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.64 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 40 H 8.11 5.02 0.00 3.07 3.49 0.00 5.64 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.62 4.23 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 0.78 0.00 0.00 0.88 0.00 0.00 42 L 8.38 5.31 0.00 1.76 1.58 0.95 0.94 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 43 Y 9.18 5.23 0.00 2.83 2.81 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 44 A 8.82 5.38 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 45 T 8.43 4.10 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 1.11 0.00 0.00 46 G 8.92 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 0.00 0.00 0.00 47 T 7.75 3.86 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 1.23 0.00 0.00 48 T 8.07 3.99 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 1.28 0.00 0.00 49 G 8.36 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 50 N 7.91 4.51 0.00 2.85 2.88 0.00 0.00 6.57 8.06 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 51 L 8.10 4.03 0.00 1.88 1.74 0.95 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.96 3.73 2.03 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 1.62 0.72 0.93 0.00 0.00 53 S 8.12 4.45 0.00 4.05 4.11 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 54 R 7.84 3.97 0.00 1.93 2.24 0.00 3.26 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 55 A 8.23 4.21 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 56 T 8.44 4.41 4.40 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 1.21 0.00 0.00 57 G 7.94 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 58 M 7.65 4.21 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.46 0.00 59 N 8.43 4.62 0.00 2.64 2.68 0.00 0.00 6.71 7.71 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 60 V 8.06 4.43 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 0.85 0.00 0.00 0.92 0.00 0.00 61 N 8.95 4.61 0.00 2.06 2.54 0.00 0.00 6.59 7.09 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 62 A 8.31 4.74 1.21 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 0.00 0.00 63 M 8.88 4.63 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.80 0.00 64 L 9.13 4.39 0.00 1.70 1.58 0.95 0.89 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 65 S 8.74 4.38 0.00 3.91 3.75 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 66 G 9.13 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 67 P 0.00 4.29 0.00 2.05 2.17 0.00 3.70 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 2.06 2.23 0.00 68 M 7.78 4.44 0.00 1.99 2.20 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 69 G 8.40 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 70 G 8.77 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 D 8.06 4.29 0.00 2.73 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 72 Q 8.00 4.06 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.92 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 73 Q 7.87 3.94 0.00 2.31 2.12 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 2.36 2.53 0.00 74 V 7.89 3.62 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 0.90 0.00 0.00 0.93 0.00 0.00 75 G 8.13 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 0.00 0.00 0.00 76 A 8.00 4.01 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 77 L 7.81 3.79 0.00 1.71 1.47 0.79 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 78 I 7.71 3.51 1.96 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 1.48 0.65 0.89 0.00 0.00 79 S 7.87 2.79 0.00 3.80 3.98 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 80 E 7.20 4.22 0.00 1.90 1.81 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 2.09 2.29 0.00 81 G 7.18 3.68 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 0.00 0.00 0.00 82 K 8.13 4.04 0.00 1.57 1.61 0.00 1.56 0.00 0.00 1.56 0.00 0.00 2.84 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.40 1.38 7.81 83 I 7.28 4.34 1.71 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.65 0.87 0.00 0.00 84 D 8.93 4.88 0.00 2.47 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 85 V 7.62 4.70 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 1.17 0.00 0.00 0.93 0.00 0.00 86 L 8.82 5.12 0.00 1.81 1.53 0.87 1.06 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 87 I 9.02 4.66 1.69 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.72 0.13 0.00 0.00 88 F 9.38 5.51 0.00 3.02 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 89 F 9.67 5.36 0.00 3.00 2.87 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 90 W 8.01 4.67 0.00 3.09 1.82 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 91 D 9.06 4.32 0.00 2.79 2.77 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 0.00 0.00 0.00 92 P 0.00 4.35 0.00 1.84 1.09 0.00 3.46 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.51 0.00 93 L 9.04 4.70 0.00 1.55 1.59 0.84 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 94 N 7.94 4.62 0.00 2.77 2.67 0.00 0.00 7.00 7.35 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 95 A 8.68 4.18 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 96 V 7.97 4.58 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 0.73 0.00 0.00 1.04 0.00 0.00 97 P 0.00 4.42 0.00 2.19 2.20 0.00 3.76 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 2.01 1.97 0.00 98 N 7.86 4.90 0.00 3.08 3.10 0.00 0.00 5.91 8.07 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 99 D 8.18 4.35 0.00 2.95 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 0.00 100 P 0.00 4.23 0.00 2.30 2.29 0.00 3.65 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 101 D 8.07 4.41 0.00 3.06 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 0.00 102 V 7.83 3.79 2.20 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 0.65 0.00 0.00 1.27 0.00 0.00 103 K 8.16 3.82 0.00 2.04 1.77 0.00 1.31 0.00 0.00 1.78 0.00 0.00 2.85 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.35 1.34 7.81 104 A 8.53 3.96 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 0.00 105 L 8.20 3.93 0.00 1.89 1.96 0.89 0.67 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 0.00 106 L 7.95 4.07 0.00 1.67 1.66 0.41 0.92 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 0.00 107 R 8.16 3.86 0.00 1.99 2.10 0.00 3.08 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 108 L 8.07 4.06 0.00 1.95 1.84 1.00 0.87 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 0.00 109 A 8.25 4.09 1.44 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 0.00 0.00 0.00 110 T 7.95 3.83 4.41 0.00 0.00 0.00 0.00 0.00 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 0.00 111 V 7.65 3.32 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 -0.01 0.00 0.00 0.83 0.00 0.00 112 W 8.27 4.20 0.00 3.43 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 7.69 4.14 0.00 2.79 2.92 0.00 0.00 6.96 8.02 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 0.00 114 I 7.18 4.67 2.12 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 1.31 0.88 1.01 0.00 0.00 115 P 0.00 4.49 0.00 2.20 2.13 0.00 3.86 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 2.18 2.16 0.00 116 V 8.42 5.04 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 1.06 0.00 0.00 117 A 9.19 4.95 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 0.00 118 T 9.12 5.36 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 1.43 0.00 0.00 119 N 7.38 4.18 0.00 2.62 2.59 0.00 0.00 5.85 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 0.00 120 V 7.55 3.31 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 1.21 0.00 0.00 0.74 0.00 0.00 121 A 7.96 4.13 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 0.00 122 T 8.65 3.92 4.40 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 1.28 0.00 0.00 123 A 7.96 3.99 0.80 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 0.00 124 D 8.96 4.54 0.00 2.85 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 0.00 125 F 8.30 3.88 0.00 3.26 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 0.00 126 I 8.13 4.04 2.18 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.37 1.17 0.00 0.00 127 I 7.66 2.68 1.26 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.43 0.44 0.00 0.00 128 Q 7.56 4.21 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.88 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 129 S 7.41 4.31 0.00 4.22 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 0.00 130 P 0.00 4.23 0.00 2.14 2.29 0.00 3.77 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 131 H 8.11 4.68 0.00 3.28 3.38 0.00 5.62 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 F 8.35 4.10 0.00 3.30 3.22 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 0.00 133 N 8.02 4.93 0.00 2.84 2.90 0.00 0.00 6.81 7.88 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 0.00 134 D 7.41 4.98 0.00 2.77 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 0.00 135 A 8.34 4.69 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 0.00 136 V 8.64 4.43 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.76 0.00 0.00 137 D 8.61 5.36 0.00 2.57 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 0.00 138 I 8.85 4.65 1.90 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 1.39 1.00 0.93 0.00 0.00 139 L 8.42 5.15 0.00 1.55 1.65 0.93 0.77 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 0.00 140 I 8.92 4.82 2.10 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.08 1.11 0.00 0.00 141 P 0.00 4.45 0.00 1.77 1.80 0.00 3.45 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.12 0.00 142 D 9.07 4.64 0.00 2.81 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 Y 8.61 4.16 0.00 3.39 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 Q 8.46 4.02 0.00 2.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.69 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 145 R 7.85 4.00 0.00 1.91 1.93 0.00 3.27 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 146 Y 7.63 4.15 0.00 2.95 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 0.00 147 L 8.11 3.67 0.00 1.03 1.47 0.88 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 148 A 7.77 3.92 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 0.00 149 D 7.74 4.26 0.00 2.65 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 0.00 150 R 7.52 3.92 0.00 1.77 1.80 0.00 3.07 0.00 0.00 2.79 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.02 0.00 151 L 7.29 4.41 0.00 1.51 1.67 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 152 K 7.91 4.13 0.00 1.77 1.59 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.36 1.01 7.81