NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2585 7.8827 121.4491 61.2418 38.3154 173.8282 17 V 4.2269 8.7179 126.8521 62.0915 32.3955 174.8165 18 G 4.0930 9.1549 114.9025 45.8258 0.0000 173.2275 19 G 4.3235 7.6030 107.8874 45.3015 0.0000 172.8593 20 Y 5.0676 7.7599 117.0165 55.2512 42.1565 174.9173 21 T 4.0211 8.6453 117.6186 64.2443 68.9394 175.6965 22 C 4.0510 8.6143 125.6559 59.5971 36.1620 175.5442 23 G 4.0088 7.6787 104.0643 44.8997 0.0000 172.7075 24 A 4.3345 8.4724 125.9538 53.7048 18.5245 176.8873 25 N 4.3442 8.9846 119.1629 54.5117 35.9946 175.6655 26 T 4.1059 7.8030 109.4487 63.2182 69.3524 175.1813 27 V 4.0267 7.2012 122.8943 60.1906 31.3154 173.4312 28 P 4.4972 0.0000 0.0000 63.9566 32.2642 178.3176 29 Y 5.0710 6.9811 115.9523 57.3243 38.7924 174.7525 30 Q 4.5719 7.0054 123.4898 56.2860 29.4750 175.6189 31 V 4.8918 8.9323 119.0077 59.6788 36.0873 174.1875 32 S 4.8199 8.8474 117.8448 56.7128 64.5266 172.7074 33 L 4.6867 8.4565 127.7508 53.4066 43.1684 175.0097 34 N 5.8247 8.8996 122.5186 50.0530 41.9815 175.0336 *37 S 4.2582 8.4979 121.0546 58.5847 64.2558 174.3471 38 G 4.0947 9.3534 110.2958 46.9588 0.0000 173.6075 39 Y 4.7064 6.7715 115.4493 55.5933 40.4298 173.2855 40 H 4.5051 8.8342 121.7200 56.5732 30.2353 174.6851 41 F 5.0904 8.1053 121.0308 57.6507 40.2294 174.1505 42 C 4.6918 6.7624 114.6380 55.9779 40.0778 173.1304 43 G 4.2049 9.2484 109.3354 45.6222 0.0000 172.2343 44 G 4.8354 8.0526 105.6518 46.3931 0.0000 172.6918 45 S 5.4476 8.9437 115.8513 56.3351 66.5274 173.7106 46 L 4.6958 9.3814 128.4809 55.0774 42.1938 177.1296 47 I 4.4330 8.6711 119.8707 61.1925 39.2564 174.4551 48 N 4.9538 7.6795 117.0372 51.7188 39.8286 174.7677 49 S 4.3577 8.8052 111.5333 60.7250 63.1906 174.9379 50 Q 4.6272 8.1870 117.7874 55.1533 31.2685 174.9276 51 W 5.5050 8.2142 118.1778 54.8168 33.4697 174.2997 52 V 4.9879 9.2814 124.1339 61.1892 34.1786 174.2206 53 V 4.8536 9.1776 127.5821 61.7092 33.5076 174.5479 54 S 4.9657 8.8588 122.2890 57.0109 66.5000 172.3684 55 A 4.6072 8.4272 120.7062 50.9250 20.0811 178.5353 56 A 3.8103 8.2127 123.5772 55.2179 18.4713 179.7687 57 H 4.3787 8.4114 110.5247 58.0169 28.5464 175.5195 58 C 4.6549 7.5359 116.1805 57.2447 40.4484 173.2400 59 Y 4.2251 7.6157 121.8774 58.1119 38.7631 175.4093 60 K 3.6854 6.6467 124.4775 55.0952 34.9442 174.8416 61 S 4.1054 8.0286 119.4416 58.4893 63.4328 173.2256 62 G 3.7988 8.2421 109.7093 46.5800 0.0000 173.9856 63 I 4.3531 7.3092 119.0269 60.2355 39.4774 175.9108 64 Q 4.7182 8.9019 128.3192 54.2264 31.4546 174.2371 65 V 4.2577 8.9596 127.1266 62.0881 33.3057 174.6192 66 R 5.0117 8.9606 127.5514 54.7219 32.0817 175.1633 67 L 4.8165 9.2135 124.7875 53.5625 44.8900 177.5622 68 G 4.1572 8.8357 108.0349 46.3732 0.0000 173.8539 69 E 4.0907 7.8807 118.7855 55.9761 29.6577 176.0055 *71 D 5.0666 7.7430 118.9317 54.3361 43.6058 174.1483 72 N 4.9444 9.0358 119.4378 52.9433 39.1945 176.2314 73 I 3.9111 7.7834 118.6207 62.2833 37.7861 176.2554 74 N 4.7306 8.4109 117.8847 53.1063 39.2207 174.8495 75 V 4.3148 7.3789 117.8733 60.5900 34.2062 174.9678 76 V 3.9489 8.5005 126.9333 62.9680 31.1736 175.1664 77 E 4.4550 10.0999 127.8551 55.4827 30.5187 176.9581 78 G 4.0528 8.2705 106.0797 45.4671 0.0000 174.2133 79 N 4.8909 7.8481 114.6908 52.7152 39.8265 174.4648 80 E 4.5032 7.8888 117.9547 56.4923 30.7047 176.2848 81 Q 4.4284 8.9669 120.9951 54.2536 32.4114 174.2562 82 F 5.5869 8.7490 123.1792 56.1223 40.7521 175.4152 83 I 4.6805 8.7725 124.6518 59.3377 40.9430 175.5595 84 S 4.6786 8.7191 122.3832 58.2782 64.3157 173.1828 85 A 4.5750 8.5146 125.8586 52.0078 18.0607 178.0533 86 S 4.4222 8.9295 119.0036 60.6728 64.1926 174.7831 87 K 4.5950 7.5473 116.8881 55.8551 35.3680 174.6247 88 S 5.3495 8.8062 117.7298 56.9830 65.9046 173.7888 89 I 4.5887 9.3629 124.5813 59.4340 39.8454 175.0067 90 V 4.1859 8.4726 127.3624 62.3480 32.5809 175.2308 91 H 3.6092 8.5397 126.6278 55.6984 30.0744 174.5836 92 P 4.2972 0.0000 0.0000 65.3310 31.3173 177.1415 93 S 4.6949 7.7711 112.9495 58.0574 63.1941 173.1607 94 Y 4.3033 7.9312 123.3295 57.6350 39.0170 174.3897 95 N 4.6313 8.2502 126.0598 51.3523 39.5339 174.9477 96 S 4.1316 7.6710 120.0404 59.5383 63.6595 175.4631 97 N 4.3803 8.1941 119.1343 55.8528 38.5618 176.3085 98 T 3.9869 7.7174 104.7539 60.9496 69.8615 175.2515 99 L 3.8075 8.0774 120.9907 55.0618 39.8019 173.9684 100 N 4.4420 7.6512 118.2349 54.8216 39.3712 174.5754 101 N 4.9601 8.7471 119.9177 54.3187 35.8181 175.4073 102 D 4.6320 8.0488 117.9808 53.1402 39.9197 174.0179 103 I 4.7342 7.1771 121.1083 59.1474 42.2293 172.6182 104 M 5.3717 9.2362 128.1420 53.8770 36.0219 173.5756 105 L 5.3894 9.3320 125.2682 53.3303 44.6249 175.4560 106 I 4.9132 8.8893 123.7718 59.3995 40.3976 174.4476 107 K 3.5958 8.5584 129.6561 54.9907 33.2656 175.9087 108 L 4.3176 8.4084 128.1818 54.2773 41.7727 177.3739 109 K 4.1755 8.7093 124.8174 58.8946 32.6877 177.2181 110 S 4.6142 7.7363 111.7664 55.7163 66.0570 173.2705 111 A 4.3368 8.4750 123.9719 52.1438 18.6076 177.4093 112 A 4.2769 9.0341 124.5122 51.9150 19.6341 177.3589 113 S 4.4894 9.2829 117.0596 57.5969 63.5385 174.3645 114 L 4.6308 8.5239 125.8178 54.0819 42.6563 176.2577 115 N 4.8183 8.9303 119.7005 52.3833 39.6852 174.5273 116 S 4.2321 8.9572 111.6081 61.9247 62.9212 175.3983 117 R 4.2253 7.8688 117.0240 56.0277 30.7151 176.3194 118 V 4.4056 7.4764 117.5673 60.7339 32.6900 173.4621 119 A 5.2240 8.4294 128.2185 49.7164 22.5243 175.4790 120 S 4.9046 8.8414 115.2672 58.3341 64.4931 172.9989 121 I 4.4041 8.2746 121.5221 58.9071 39.8322 175.4950 122 S 4.2961 8.4893 125.0560 58.6209 63.7433 173.9288 123 L 4.4919 8.4550 124.2137 53.8579 42.2868 175.2901 124 P 4.4795 0.0000 0.0000 62.9837 32.1982 176.2939 125 T 4.2543 8.2378 108.7087 62.0117 70.2179 174.2391 *127 S 4.4693 7.5694 115.0934 58.0746 64.0359 174.0915 128 C 4.4071 8.4369 117.9679 56.7541 40.6743 173.0320 129 A 4.5139 7.9994 124.9616 50.7130 19.7663 177.8333 130 S 4.1391 8.2063 117.1349 57.6887 64.2898 173.1106 *132 A 4.0512 8.1592 123.2282 53.3001 19.2146 176.9555 133 G 3.9985 8.9752 109.6648 45.3715 0.0000 174.5402 134 T 3.9784 7.2597 116.0619 63.7734 69.3805 173.8119 135 Q 4.6832 8.6202 125.5170 55.9301 29.8272 175.9631 136 C 5.2333 9.2659 120.1346 55.0756 45.7400 172.5489 137 L 5.1503 9.0513 123.0731 53.6989 43.7203 175.0208 138 I 5.1971 9.1988 127.8321 58.7297 39.8217 175.0252 139 S 5.3332 8.1694 119.7071 55.5234 66.5964 173.0926 140 G 3.7675 7.2417 107.5521 46.1767 0.0000 172.7073 141 W 4.5866 8.6208 117.3207 56.2680 29.5993 177.0971 142 G 4.1556 8.5243 109.5415 44.3408 0.0000 173.5258 143 N 3.7228 9.0864 118.2811 54.0629 39.0565 175.4883 144 T 5.0657 8.1378 113.8471 60.6605 69.4923 174.5425 145 K 4.6126 7.4368 121.5252 54.7058 34.9706 176.4631 146 S 4.3468 8.7255 117.3349 60.1692 62.9981 173.9064 147 S 4.6196 7.3786 115.0294 59.8593 65.8360 177.6624 148 G 4.1704 7.4077 120.6569 45.6343 0.0000 175.6260 149 T 4.5285 8.1649 124.7073 62.8545 71.7458 172.9395 150 S 4.5898 8.2326 121.3547 56.8663 66.0066 171.8515 151 Y 4.4754 8.6163 124.4252 55.8013 39.3053 173.5388 152 P 3.8628 0.0000 0.0000 65.3975 31.8178 175.7590 153 D 5.0539 7.9793 114.6983 54.5341 42.4715 176.4667 154 V 4.5615 7.7086 112.0486 59.8183 33.2702 175.6089 155 L 3.1440 8.3958 124.3555 55.0414 42.8702 176.0562 156 K 4.8365 8.2256 125.5975 55.0383 34.9170 174.7583 157 C 5.1833 8.3508 119.6162 55.0795 41.1663 173.0081 158 L 5.0231 8.9355 123.1751 53.6305 45.4047 174.8882 159 K 5.0820 9.0636 125.8099 55.7260 33.1909 176.1100 160 A 4.8027 9.1749 125.9004 50.2895 23.1423 173.5874 161 P 5.0439 0.0000 0.0000 61.6092 34.0326 175.2794 162 I 4.3618 8.2916 122.5654 61.6938 37.8841 175.6142 163 L 4.8342 8.7523 127.5742 53.1628 43.1859 177.0638 164 S 4.2135 8.6258 115.9092 58.7125 63.4446 175.1642 165 D 4.3975 8.6821 121.0372 57.0116 40.9182 178.6361 166 S 4.0803 8.0237 113.6505 61.6715 62.5624 176.0358 167 S 4.1453 8.4220 118.2470 61.5234 62.5018 175.8702 168 C 4.3123 8.4247 121.3056 59.8834 38.4654 175.9792 169 K 3.9892 8.3766 120.0871 59.3178 31.3450 179.4110 170 S 4.1043 7.9811 112.9062 61.1612 62.3462 175.7453 171 A 4.0250 7.9585 122.8561 53.8280 19.6974 177.3294 172 Y 4.8034 7.7635 114.2663 54.9315 38.2806 172.3552 173 P 4.7428 0.0000 0.0000 63.3717 32.1821 177.5453 174 G 4.0280 9.0176 110.8063 45.8631 0.0000 173.6985 175 Q 4.4083 8.2130 117.0073 55.9017 29.7841 175.4622 176 I 4.4877 7.8176 119.4387 59.7954 38.6117 175.2667 177 T 4.5969 8.2044 115.1563 59.5278 70.9626 175.2474 178 S 4.3369 8.5709 115.1405 60.2519 63.1184 174.4143 179 N 5.1195 8.3937 118.7620 53.3516 38.6173 173.7796 180 M 5.6285 7.8783 117.7013 53.6199 35.9692 174.6871 181 F 5.1610 8.7696 115.5914 55.6003 42.1992 172.6995 182 C 5.4168 8.9535 116.3465 55.8090 41.0235 172.6276 183 A 5.0687 9.4126 122.5701 50.4234 22.6262 174.6592 184A G 4.1501 7.6412 104.7168 44.3720 0.0000 175.3920 184 Y 4.6824 8.5816 121.8903 56.2595 41.7372 175.9534 185 L 4.2314 8.7066 124.7576 57.3090 42.0570 178.9333 186 E 4.1926 8.1910 117.1498 57.4703 29.8982 177.6451 187 G 3.7320 7.9022 106.9307 44.7596 0.0000 172.4453 188A G 4.1351 9.1101 107.1933 44.9314 0.0000 174.2759 188 K 4.8620 7.4117 117.7775 54.9185 35.5147 175.5903 189 D 4.6677 8.9268 123.5575 53.5754 45.6246 174.7848 190 S 4.9150 8.2434 116.6943 58.4170 64.8274 171.8017 191 C 4.7737 9.2959 118.9468 55.4467 43.5324 172.4070 192 Q 4.3917 8.5941 119.5689 57.5812 28.4515 177.7953 193 G 4.3965 9.2968 110.6120 45.5663 0.0000 173.6367 194 D 4.7987 8.2075 118.5281 54.5801 42.0138 176.8662 195 S 4.5145 8.0241 115.8805 60.2732 63.5846 175.4060 196 G 3.6011 8.8003 111.8632 46.5869 0.0000 173.9981 197 G 4.3529 7.6715 106.8105 44.9987 0.0000 171.3591 198 P 4.8917 0.0000 0.0000 62.5449 33.2656 175.6396 199 V 4.5537 8.7829 122.1229 61.3986 34.0174 174.1145 200 V 4.8696 8.5933 128.7445 61.2327 33.9496 173.6300 201 C 5.0630 8.8221 124.9481 55.2933 43.6098 174.6078 202 S 3.3365 9.7208 121.6741 59.7533 59.8484 173.4450 203 G 3.9309 8.5646 105.3586 45.3643 0.0000 173.7542 204 K 4.9157 7.3757 117.7190 53.0955 35.3198 175.2517 *209 L 4.3635 8.2472 123.2770 55.6145 42.1153 175.7009 210 Q 4.4175 9.0672 125.9182 56.8549 30.5441 175.8208 211 G 5.3451 8.0599 104.5412 45.6749 0.0000 171.4400 212 I 5.2170 8.2580 120.3255 58.8096 40.6216 175.3956 213 V 3.7081 8.7989 127.2925 64.3638 31.8224 174.4339 214 S 4.9050 8.5941 121.0741 58.1388 63.8489 173.8724 215 W 5.0465 7.7686 113.4271 55.7477 32.4085 172.6958 216 G 3.8928 8.3546 106.1997 46.2500 0.0000 173.2001 217 S 4.6107 8.6769 114.9486 56.8027 62.0095 172.7344 *219 G 4.4240 7.9621 117.9727 45.5788 0.0000 170.6398 220 C 4.8135 8.0666 115.2138 56.3303 42.1774 173.9287 221A A 4.2867 9.0307 125.3081 53.1719 16.8242 177.1435 221 Q 4.5042 7.3588 117.0943 56.1535 29.6549 175.8475 222 K 4.2009 8.4742 121.8192 58.1563 32.5229 176.3033 223 N 4.2252 9.2375 121.9240 53.9527 37.1429 175.1599 224 K 4.2681 7.5593 116.4929 54.0173 32.0346 173.5563 225 P 4.6061 0.0000 0.0000 61.6870 33.1192 177.0811 226 G 3.5013 8.2296 105.0003 46.1156 0.0000 172.7719 227 V 4.3624 7.4912 122.6656 60.7123 33.9583 174.1427 228 Y 4.9138 8.3557 124.1474 55.9925 42.1387 174.9697 229 T 4.4430 8.6861 119.6109 63.6823 70.0124 174.4796 230 K 4.9281 9.3876 128.5133 55.0748 30.7637 177.1170 231 V 3.9875 8.7793 124.6639 65.7073 31.4343 174.7380 232 C 4.4216 8.2707 112.6124 58.1269 41.6844 174.7619 233 N 4.2006 8.1088 117.2607 54.5602 38.3796 175.3971 234 Y 4.8292 7.9722 117.0986 57.2651 39.4824 177.2237 235 V 3.6302 8.0549 119.9474 66.4862 31.3953 177.6128 236 S 4.1218 8.0890 112.0703 60.7555 62.2712 175.7460 237 W 4.1362 8.2891 130.6512 60.5631 30.6721 177.4482 238 I 3.1130 8.2321 120.0923 64.4001 36.5926 178.1486 239 K 3.6894 8.0759 118.9077 59.8049 31.7601 179.2873 240 Q 3.9076 7.7010 117.9762 59.2505 28.7966 178.0441 241 T 3.7611 7.6150 117.2952 66.2767 68.0656 176.9637 242 I 2.6375 7.0532 121.5044 63.8340 36.7675 178.3513 243 A 3.9737 7.6025 120.4842 54.2795 18.2391 178.7278 244 S 4.6450 7.4183 109.6781 58.4270 64.0475 174.0503 245 N 4.7295 7.8742 124.1220 53.3956 39.0966 174.0406 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 16 I 7.88 4.26 1.78 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 1.10 0.90 0.00 0.00 17 V 8.72 4.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.94 0.00 0.00 18 G 9.15 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 0.00 0.00 0.00 19 G 7.60 4.32 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 0.00 20 Y 7.76 5.07 0.00 3.07 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 21 T 8.65 4.02 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 1.23 0.00 0.00 22 C 8.61 4.05 0.00 2.86 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 23 G 7.68 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.47 4.33 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 25 N 8.98 4.34 0.00 2.91 2.96 0.00 0.00 7.20 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 26 T 7.80 4.11 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 1.25 0.00 0.00 27 V 7.20 4.03 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 0.28 0.00 0.00 0.78 0.00 0.00 28 P 0.00 4.50 0.00 2.41 2.29 0.00 3.74 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.00 0.00 29 Y 6.98 5.07 0.00 3.28 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 30 Q 7.01 4.57 0.00 1.67 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.71 0.00 0.00 0.00 0.00 0.00 1.89 2.49 0.00 31 V 8.93 4.89 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.96 0.00 0.00 32 S 8.85 4.82 0.00 3.02 3.33 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 33 L 8.46 4.69 0.00 0.55 0.93 0.77 0.14 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 34 N 8.90 5.82 0.00 2.45 2.37 0.00 0.00 6.78 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 *37 S 8.50 4.26 0.00 3.69 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 38 G 9.35 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 0.00 0.00 0.00 39 Y 6.77 4.71 0.00 3.08 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 40 H 8.83 4.51 0.00 2.90 3.20 0.00 5.86 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.11 5.09 0.00 3.09 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 42 C 6.76 4.69 0.00 2.17 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 43 G 9.25 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.05 4.84 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 0.00 0.00 0.00 45 S 8.94 5.45 0.00 3.79 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.38 4.70 0.00 1.84 1.68 1.08 0.69 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 47 I 8.67 4.43 1.90 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 1.51 1.00 1.01 0.00 0.00 48 N 7.68 4.95 0.00 2.92 3.01 0.00 0.00 6.03 7.64 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 49 S 8.81 4.36 0.00 4.24 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.19 4.63 0.00 2.11 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 51 W 8.21 5.50 0.00 3.36 3.02 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 52 V 9.28 4.99 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 1.06 0.00 0.00 0.98 0.00 0.00 53 V 9.18 4.85 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 0.90 0.00 0.00 1.02 0.00 0.00 54 S 8.86 4.97 0.00 3.92 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 55 A 8.43 4.61 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 56 A 8.21 3.81 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.41 4.38 0.00 3.36 3.59 0.00 5.56 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.54 4.65 0.00 3.23 3.33 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 59 Y 7.62 4.23 0.00 2.97 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 6.65 3.69 0.00 1.09 1.08 0.00 0.61 0.00 0.00 0.73 0.00 0.00 2.52 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.81 0.91 7.81 61 S 8.03 4.11 0.00 3.83 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.24 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 63 I 7.31 4.35 1.86 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 1.36 0.62 0.94 0.00 0.00 64 Q 8.90 4.72 0.00 1.99 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.91 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 65 V 8.96 4.26 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 0.98 0.00 0.00 0.90 0.00 0.00 66 R 8.96 5.01 0.00 1.61 1.82 0.00 2.59 0.00 0.00 2.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 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 77 E 10.10 4.45 0.00 2.01 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 2.26 2.40 0.00 78 G 8.27 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 79 N 7.85 4.89 0.00 2.67 2.81 0.00 0.00 7.00 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 80 E 7.89 4.50 0.00 1.45 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 2.54 2.61 0.00 81 Q 8.97 4.43 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 82 F 8.75 5.59 0.00 2.82 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.77 4.68 1.87 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 1.24 0.83 0.94 0.00 0.00 84 S 8.72 4.68 0.00 3.75 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 85 A 8.51 4.58 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 86 S 8.93 4.42 0.00 3.79 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 87 K 7.55 4.60 0.00 1.83 1.87 0.00 1.44 0.00 0.00 1.89 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.22 1.46 7.81 88 S 8.81 5.35 0.00 4.02 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 89 I 9.36 4.59 2.07 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.01 1.15 0.00 0.00 90 V 8.47 4.19 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 0.73 0.00 0.00 0.88 0.00 0.00 91 H 8.54 3.61 0.00 2.88 3.03 0.00 5.64 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 92 P 0.00 4.30 0.00 2.17 2.18 0.00 2.39 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.88 0.00 93 S 7.77 4.69 0.00 3.95 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.93 4.30 0.00 2.98 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 95 N 8.25 4.63 0.00 2.55 2.46 0.00 0.00 6.61 7.15 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 96 S 7.67 4.13 0.00 3.96 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.19 4.38 0.00 2.82 2.78 0.00 0.00 6.89 6.82 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 98 T 7.72 3.99 4.14 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 1.11 0.00 0.00 99 L 8.08 3.81 0.00 1.49 1.88 0.41 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.65 4.44 0.00 2.69 2.65 0.00 0.00 7.24 7.65 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 0.00 101 N 8.75 4.96 0.00 3.10 2.71 0.00 0.00 7.24 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 0.00 102 D 8.05 4.63 0.00 3.12 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 0.00 103 I 7.18 4.73 1.46 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 1.38 1.16 0.01 0.00 0.00 104 M 9.24 5.37 0.00 2.21 1.84 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.63 0.00 105 L 9.33 5.39 0.00 1.72 1.90 -0.04 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.89 4.91 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 1.20 0.77 0.88 0.00 0.00 107 K 8.56 3.60 0.00 0.79 1.01 0.00 1.29 0.00 0.00 1.34 0.00 0.00 2.64 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.76 0.21 7.81 108 L 8.41 4.32 0.00 1.40 1.59 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.71 4.18 0.00 1.71 1.98 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.50 7.81 110 S 7.74 4.61 0.00 3.93 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.47 4.34 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 0.00 112 A 9.03 4.28 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 0.00 113 S 9.28 4.49 0.00 3.72 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 0.00 114 L 8.52 4.63 0.00 1.66 1.62 0.95 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.93 4.82 0.00 2.84 2.92 0.00 0.00 6.47 7.18 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 0.00 116 S 8.96 4.23 0.00 4.01 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 7.87 4.23 0.00 1.83 2.03 0.00 3.16 0.00 0.00 3.16 7.34 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.57 4.47 0.00 4.00 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 0.00 128 C 8.44 4.41 0.00 2.94 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 0.00 129 A 8.00 4.51 1.11 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 0.00 0.00 130 S 8.21 4.14 0.00 3.99 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 *132 A 8.16 4.05 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 0.00 133 G 8.98 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 0.00 0.00 0.00 134 T 7.26 3.98 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 135 Q 8.62 4.68 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 136 C 9.27 5.23 0.00 2.84 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 0.00 137 L 9.05 5.15 0.00 1.75 1.59 1.03 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.20 5.20 1.85 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.14 0.91 0.00 0.00 139 S 8.17 5.33 0.00 3.50 3.55 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 0.00 140 G 7.24 3.77 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 0.00 0.00 0.00 141 W 8.62 4.59 0.00 3.17 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 0.00 142 G 8.52 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 9.09 3.72 0.00 2.53 2.60 0.00 0.00 7.33 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 0.00 144 T 8.14 5.07 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 1.21 0.00 0.00 145 K 7.44 4.61 0.00 1.64 1.68 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.29 1.32 7.81 146 S 8.73 4.35 0.00 4.22 4.07 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 0.00 147 S 7.38 4.62 0.00 3.86 3.82 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 0.00 148 G 7.41 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 0.00 0.00 0.00 0.00 149 T 8.16 4.53 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 1.47 0.00 0.00 150 S 8.23 4.59 0.00 3.80 3.56 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.62 4.48 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 0.00 152 P 0.00 3.86 0.00 2.33 2.11 0.00 3.91 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 2.15 2.19 0.00 153 D 7.98 5.05 0.00 2.88 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 0.00 154 V 7.71 4.56 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 0.97 0.00 0.00 155 L 8.40 3.14 0.00 1.45 1.29 -0.83 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.23 4.84 0.00 1.56 1.50 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.47 7.81 157 C 8.35 5.18 0.00 1.63 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 0.00 0.00 0.00 0.00 158 L 8.94 5.02 0.00 1.64 1.45 1.01 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.06 5.08 0.00 1.83 1.84 0.00 1.85 0.00 0.00 1.76 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.51 1.64 7.81 160 A 9.17 4.80 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 0.00 161 P 0.00 5.04 0.00 2.02 2.30 0.00 3.20 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 1.76 1.89 0.00 162 I 8.29 4.36 1.76 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.45 0.78 0.00 0.00 163 L 8.75 4.83 0.00 1.56 1.60 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.63 4.21 0.00 4.01 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.68 4.40 0.00 2.86 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 0.00 166 S 8.02 4.08 0.00 3.94 3.85 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 0.00 167 S 8.42 4.15 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 0.00 168 C 8.42 4.31 0.00 3.20 3.32 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 0.00 169 K 8.38 3.99 0.00 1.95 1.90 0.00 1.76 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 1.60 7.81 170 S 7.98 4.10 0.00 3.98 4.02 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 0.00 171 A 7.96 4.03 1.11 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 0.00 0.00 172 Y 7.76 4.80 0.00 3.20 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 0.00 173 P 0.00 4.74 0.00 2.08 2.05 0.00 3.86 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 174 G 9.02 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 0.00 0.00 0.00 175 Q 8.21 4.41 0.00 2.42 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.57 0.00 0.00 0.00 0.00 0.00 2.68 2.73 0.00 176 I 7.82 4.49 1.99 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.10 1.05 0.00 0.00 177 T 8.20 4.60 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 1.25 0.00 0.00 178 S 8.57 4.34 0.00 4.01 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 0.00 179 N 8.39 5.12 0.00 2.92 3.12 0.00 0.00 6.64 7.27 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 0.00 180 M 7.88 5.63 0.00 1.83 2.01 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 181 F 8.77 5.16 0.00 3.14 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 0.00 182 C 8.95 5.42 0.00 2.98 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 0.00 183 A 9.41 5.07 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 184A G 7.64 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Y 8.58 4.68 0.00 3.05 3.18 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 0.00 185 L 8.71 4.23 0.00 1.73 1.87 0.92 0.95 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 0.00 186 E 8.19 4.19 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 187 G 7.90 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A G 9.11 4.14 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 0.00 0.00 0.00 188 K 7.41 4.86 0.00 1.53 1.70 0.00 1.79 0.00 0.00 1.45 0.00 0.00 2.13 0.00 0.00 2.31 0.00 0.00 0.00 0.00 1.27 1.12 7.81 189 D 8.93 4.67 0.00 2.76 2.53 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 0.00 190 S 8.24 4.91 0.00 4.07 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.30 4.77 0.00 2.93 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 0.00 192 Q 8.59 4.39 0.00 2.33 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.35 0.00 0.00 0.00 0.00 0.00 2.55 2.53 0.00 193 G 9.30 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 0.00 0.00 0.00 0.00 194 D 8.21 4.80 0.00 3.03 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 0.00 195 S 8.02 4.51 0.00 4.00 3.88 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 0.00 196 G 8.80 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 0.00 197 G 7.67 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 0.00 198 P 0.00 4.89 0.00 2.38 2.44 0.00 3.68 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.21 0.00 199 V 8.78 4.55 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 0.89 0.00 0.00 0.44 0.00 0.00 200 V 8.59 4.87 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.63 0.00 0.00 201 C 8.82 5.06 0.00 2.77 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 0.00 202 S 9.72 3.34 0.00 3.97 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.56 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.38 4.92 0.00 1.68 1.63 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.40 7.81 *209 L 8.25 4.36 0.00 1.58 1.66 1.01 0.79 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 0.00 210 Q 9.07 4.42 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.43 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 211 G 8.06 5.35 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 0.00 212 I 8.26 5.22 1.94 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 1.31 0.79 0.97 0.00 0.00 213 V 8.80 3.71 2.34 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 1.09 0.00 0.00 1.17 0.00 0.00 214 S 8.59 4.90 0.00 4.01 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 0.00 215 W 7.77 5.05 0.00 3.36 2.96 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 0.00 216 G 8.35 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 0.00 217 S 8.68 4.61 0.00 4.33 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *219 G 7.96 4.42 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 0.00 220 C 8.07 4.81 0.00 2.95 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 221A A 9.03 4.29 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 0.00 221 Q 7.36 4.50 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.91 0.00 0.00 0.00 0.00 0.00 2.52 2.47 0.00 222 K 8.47 4.20 0.00 1.71 1.72 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.48 7.81 223 N 9.24 4.23 0.00 2.80 2.81 0.00 0.00 6.82 7.63 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 0.00 224 K 7.56 4.27 0.00 1.76 1.79 0.00 1.78 0.00 0.00 1.54 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.47 7.81 225 P 0.00 4.61 0.00 2.35 2.10 0.00 3.57 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 226 G 8.23 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.49 4.36 0.67 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 0.56 0.00 0.00 -0.62 0.00 0.00 228 Y 8.36 4.91 0.00 1.43 2.32 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 0.00 229 T 8.69 4.44 4.32 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 1.27 0.00 0.00 230 K 9.39 4.93 0.00 2.12 1.91 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.65 7.81 231 V 8.78 3.99 2.36 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 1.13 0.00 0.00 1.08 0.00 0.00 232 C 8.27 4.42 0.00 3.16 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 0.00 233 N 8.11 4.20 0.00 2.27 2.31 0.00 0.00 6.79 7.02 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 0.00 234 Y 7.97 4.83 0.00 3.27 3.21 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 0.00 235 V 8.05 3.63 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 1.13 0.00 0.00 1.08 0.00 0.00 236 S 8.09 4.12 0.00 3.96 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 0.00 237 W 8.29 4.14 0.00 3.53 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.23 3.11 2.03 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.16 0.74 0.00 0.00 239 K 8.08 3.69 0.00 1.88 1.79 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.41 7.81 240 Q 7.70 3.91 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.98 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 241 T 7.61 3.76 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 0.79 0.00 0.00 242 I 7.05 2.64 1.35 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.26 0.53 0.00 0.00 243 A 7.60 3.97 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 0.00 244 S 7.42 4.64 0.00 3.82 3.88 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 0.00 245 N 7.87 4.73 0.00 3.15 2.99 0.00 0.00 6.79 7.26 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 * Residues marked with a * may have inaccurate shift predictions.