NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -3 L 4.2247 8.1801 122.4912 53.4245 43.9477 176.2388 -2 A 4.5140 8.2081 119.4652 51.5633 20.0458 175.2602 -1 A 4.6200 8.1945 121.8636 53.2129 20.6929 177.7410 0 A 3.9985 8.3211 124.3267 56.2272 18.6445 179.8985 1 M 4.4075 7.9646 110.6926 55.9841 31.2516 177.0621 2 L 4.2960 7.8980 120.1734 55.0693 43.4300 177.5620 3 N 3.8981 8.2247 115.9214 53.0103 37.7350 177.1593 4 L 3.7786 8.7734 121.4455 56.5982 40.5942 173.9021 5 E 4.1116 7.9083 118.9023 58.5964 29.0817 175.6829 6 N 4.6184 8.9294 124.7465 52.7045 37.6595 175.2034 7 K 4.3829 7.6694 116.5414 56.1096 33.9296 176.1463 8 T 4.7669 9.5181 118.7826 62.0677 71.4092 173.0931 9 Y 5.0597 8.6522 123.6579 56.0098 41.7641 175.0703 10 V 4.2657 8.7458 123.7236 62.2894 33.1138 174.8615 11 I 4.6508 8.4888 130.4030 60.4302 38.2779 174.9207 12 M 4.9421 8.8443 127.5760 54.2119 34.3877 176.2579 13 G 3.8693 8.7700 107.6042 47.3524 0.0000 174.2514 14 I 4.5424 7.4836 113.6630 59.2210 38.2006 174.5233 15 A 4.2159 7.8641 127.0467 55.1054 19.6563 177.7436 16 N 4.8409 7.5658 115.1774 52.6323 37.5268 175.3204 17 K 3.8514 8.6672 117.3659 55.7733 32.9847 176.3564 18 R 4.6117 7.6405 112.3148 56.4606 30.3704 176.3144 19 S 4.2878 7.8001 115.9461 58.5783 63.7503 175.1786 20 I 3.6407 8.4901 124.6471 64.6043 36.7326 178.6123 21 A 4.1622 8.0771 120.8818 54.7533 18.0982 179.1942 22 F 4.4683 8.6272 119.9634 60.9959 39.3521 177.8043 23 G 3.3248 8.4330 106.1465 47.6732 0.0000 175.6843 24 V 3.3368 7.6040 120.5655 65.6347 30.7540 177.7571 25 A 3.9956 7.9730 120.4847 54.9638 18.1815 179.8825 26 K 3.8149 7.2704 116.8945 59.4690 31.9747 179.3937 27 V 3.4618 7.5482 117.3553 66.7533 31.5759 177.2922 28 L 3.7463 7.7525 117.5080 58.1306 41.3586 178.8239 29 D 4.3994 9.5473 117.6564 58.0258 41.0854 179.2027 30 Q 4.0323 8.1535 117.1260 59.0386 28.8354 178.4116 31 L 4.3252 8.1864 116.7663 55.1271 41.9146 177.8141 32 G 3.8886 8.2013 108.1220 44.6916 0.0000 172.7559 33 A 4.9416 7.6352 121.7530 50.4650 19.6261 177.6005 34 K 4.1315 8.8423 121.9266 57.6446 33.3619 175.9132 35 L 5.1495 8.5451 121.0472 53.3576 46.1474 175.3369 36 V 4.5689 8.2219 119.9961 61.4556 36.2105 174.3615 37 F 5.4509 8.6350 121.0747 56.4516 43.3053 173.7778 38 T 5.2795 9.4377 115.0673 59.1422 70.9495 172.6583 39 Y 5.0314 8.4218 124.5980 55.7005 39.6525 176.3403 40 R 4.9251 9.1049 122.2079 56.6656 31.1286 176.2805 41 K 4.2184 8.2627 112.8355 57.2570 34.8369 175.7737 42 E 3.5441 8.4407 125.1395 58.0920 27.9272 176.8425 43 R 2.6633 8.1864 115.8707 57.1612 32.7902 178.1268 44 S 4.0903 8.3686 121.2731 60.5023 63.3097 176.0281 45 R 3.4983 7.1816 119.2979 57.7137 29.1676 177.4675 46 K 4.5370 7.1634 121.8775 58.4746 32.4057 177.5477 47 E 3.7773 8.6597 120.5810 59.2397 29.2545 178.9661 48 L 3.8280 7.5587 118.3721 57.8395 41.8722 179.0161 49 E 4.0690 8.1103 117.5104 58.2276 29.1478 178.8731 50 K 3.9269 7.7072 120.2765 58.7004 32.5576 177.9407 51 L 4.0720 8.8031 119.7377 58.0679 41.6236 179.6057 52 L 4.0958 8.4394 119.4733 57.5553 41.7009 178.5484 53 E 4.0288 8.8840 118.5677 59.3451 29.3547 178.5779 54 Q 4.1746 8.0166 117.7529 57.3263 29.3164 176.6112 55 L 4.5095 7.1808 119.4948 54.4564 42.5224 177.5301 56 N 4.6077 8.9107 121.9394 51.8618 35.6433 173.1454 57 Q 4.5704 7.8604 118.1836 53.4046 29.9269 174.7672 58 P 4.4948 0.0000 0.0000 63.7371 31.8663 176.3078 59 E 4.6752 7.5736 114.3863 54.2691 32.9045 175.6693 60 A 4.5022 8.1151 122.1312 50.7679 19.5029 174.4286 61 H 4.8745 8.7715 118.3497 54.8773 30.9674 173.7600 62 L 5.2883 8.1269 122.5192 53.0884 45.5826 175.9024 63 Y 4.3153 8.4784 118.4894 55.9872 41.9938 174.3325 64 Q 3.5398 8.2951 126.2081 56.2218 29.9604 175.2965 65 I 4.3420 9.8685 128.1877 59.6046 40.4674 175.0100 66 D 5.0186 9.6202 128.6556 52.8358 39.7749 177.3550 67 V 3.4700 7.9218 118.9037 64.1809 32.0886 177.9514 68 Q 4.0795 7.8543 117.6049 58.1550 29.0122 177.0937 69 S 4.5796 8.6969 111.9992 55.8017 64.8203 173.9103 70 D 4.3791 8.7533 130.2508 57.4818 40.6175 178.2056 71 E 4.2045 8.1442 117.4835 58.1744 29.2745 178.6054 72 E 3.7784 8.1611 119.2863 59.2211 29.5281 179.3444 73 V 3.8005 7.6750 118.8210 64.6896 31.7369 178.5670 74 I 4.0031 8.0148 122.2288 63.6187 36.5479 177.5552 75 N 4.7559 9.1928 116.5616 54.0433 38.5366 177.5745 76 G 3.3384 7.6065 107.9623 47.9011 0.0000 176.0307 77 F 3.9515 8.2970 121.4222 59.6357 38.9445 177.7431 78 E 3.9536 8.4084 117.3699 58.9182 29.4502 178.6612 79 Q 3.8553 7.6002 119.9447 59.5366 28.9681 178.9309 80 I 3.4518 7.6808 120.9205 63.9521 36.5830 178.7650 81 G 3.4379 8.1833 107.0784 47.6311 0.0000 175.4496 82 K 3.9586 8.2751 120.2708 59.7384 32.1084 178.5269 83 D 4.5229 8.5633 119.7519 57.2234 41.1204 178.2503 84 V 4.3354 8.6989 112.2059 60.4409 34.9715 175.9198 85 G 4.1156 7.5978 104.5872 44.3917 0.0000 174.3885 86 N 4.8493 8.6700 122.7949 51.7804 39.6292 174.6000 87 I 4.1248 7.5479 115.3863 60.1897 39.4240 175.3201 88 D 4.5322 7.8423 120.1301 54.6611 42.3519 176.3199 89 G 4.6743 6.9063 104.6129 46.0678 0.0000 172.3754 90 V 5.1297 7.6767 118.7930 59.6987 34.4434 174.2653 91 Y 4.1985 8.9872 127.2840 57.6608 39.9997 173.5279 92 H 4.8892 9.0142 126.7454 54.0019 32.7798 174.0122 93 S 4.9242 7.3231 123.6729 57.4137 60.2067 173.2583 94 I 4.0222 7.1897 121.1786 60.0513 40.0322 175.6249 *118 Q 3.8934 8.3259 122.7011 57.9600 29.4518 177.2467 119 D 4.5357 8.1093 123.6449 55.4230 37.8969 176.3232 120 I 3.9243 7.9826 116.2965 62.4860 37.9893 175.5583 121 S 4.7988 7.4842 121.3399 58.0500 65.1318 178.3442 122 S 4.2231 7.6443 114.9115 61.2799 62.2020 174.7910 123 Y 4.3923 7.8284 121.1427 61.1015 38.5139 178.1095 124 S 3.8814 8.2929 113.2700 61.5128 62.2336 175.6849 125 L 3.5694 7.5345 120.9747 58.6236 41.9843 178.7402 126 T 3.8645 7.8625 115.4450 67.0151 68.3969 176.5099 127 I 3.5543 7.5464 121.2528 64.4509 37.1887 178.7707 128 V 3.2764 7.6196 118.8425 65.3287 31.3888 177.4637 129 A 3.7252 8.0106 121.1858 55.7920 17.8698 179.4442 130 H 4.0797 7.5441 112.2557 59.0759 29.1020 177.3632 131 E 3.9140 8.3128 120.5665 59.6971 29.2860 179.4937 132 A 3.6433 7.7719 120.8191 54.2613 18.4108 179.7061 133 K 4.1581 7.7582 117.0983 59.6562 32.5012 179.3560 134 K 4.1020 7.4623 117.8937 58.3697 31.7885 177.8657 135 L 4.6180 8.2432 118.7640 53.8666 42.7433 175.7013 136 M 4.7602 7.9521 119.0370 52.7622 30.3988 174.3504 137 P 4.3898 0.0000 0.0000 65.1928 32.4048 177.7677 138 E 4.2936 7.9648 116.2257 55.0533 30.5181 174.1121 139 G 3.7817 6.8775 102.8993 44.3235 0.0000 172.3745 140 G 4.0683 8.5490 103.7424 45.9137 0.0000 171.8215 141 S 5.0016 8.6527 115.6522 56.9871 66.0094 174.2231 142 I 4.7625 9.1185 128.8375 59.6196 39.4324 175.0196 143 V 4.7192 8.1248 126.0669 61.7253 33.7320 174.6056 144 A 4.8366 8.6419 127.4991 50.6783 22.5818 174.8973 145 T 5.1692 8.4771 119.7980 62.0707 71.3679 174.0898 146 T 4.7920 8.4408 115.1532 60.2339 71.9416 172.4941 147 Y 5.4993 8.5689 123.1733 55.8261 41.4962 174.1658 148 L 4.1097 8.6826 125.3351 53.6219 44.1667 175.3688 *157 Y 4.5823 8.2325 115.5230 58.0438 40.0260 173.0962 158 N 4.9810 9.5800 120.7531 52.7875 41.6225 176.7959 159 V 4.0843 10.3576 124.2952 63.3396 35.0515 167.5408 160 M 2.7102 8.0188 118.2804 56.9393 32.3909 176.2919 161 G 3.8767 8.3937 109.5616 44.8337 0.0000 172.8121 162 V 3.0687 7.4508 125.1280 59.5554 35.3044 174.3137 163 A 4.1484 8.7678 124.3921 52.0250 16.9451 179.2812 164 K 4.1504 8.2134 114.0886 58.7929 33.1529 180.4928 165 A 3.7242 7.1071 121.3103 54.5845 20.1747 179.0672 166 S 4.2236 8.2328 109.2340 61.4843 62.5202 175.5314 167 L 3.8980 8.4604 123.2030 58.5703 41.9169 178.7066 168 E 3.8707 8.0910 117.5493 59.1255 29.3302 178.8846 169 A 4.3617 7.8162 119.7510 53.9836 19.9520 178.6524 170 N 4.4376 8.2722 115.5761 56.5361 39.0312 177.4072 171 V 3.6120 7.8018 119.5326 65.6860 31.2274 177.9572 172 K 3.9676 7.9622 118.1695 59.6275 31.9657 178.5055 173 Y 4.2463 8.1865 119.7201 60.8964 38.6694 178.3334 174 L 3.5279 7.8808 119.6258 57.6074 41.4441 179.3425 175 A 3.8937 7.6764 119.9046 55.2581 18.6011 179.4627 176 L 4.0632 7.4709 116.6525 58.2236 41.7154 178.6688 177 D 4.2678 7.6515 117.0126 58.0162 41.1166 178.3751 178 L 4.4470 8.0376 116.6675 54.8592 41.8360 179.2671 179 G 3.5026 7.9339 108.1456 47.7680 0.0000 174.4254 180 P 4.1844 0.0000 0.0000 65.1954 31.4717 176.7265 181 D 4.6131 7.8651 114.5143 53.6090 40.9728 175.5142 182 N 4.1478 8.5290 117.4168 54.7667 37.7260 173.0012 183 I 4.8152 7.6089 117.1335 59.2430 38.8553 176.1999 184 R 4.2766 8.7795 126.9931 55.7513 31.8330 175.8307 185 V 4.7984 8.7117 122.0599 61.3814 34.4712 174.1395 186 N 5.5499 9.2666 123.9419 51.5225 43.5495 173.0317 187 A 5.2621 9.0753 121.3457 50.4510 22.9696 175.1738 188 I 4.9276 8.7582 120.7317 59.6317 40.4159 174.9143 189 S 4.9263 9.3642 123.5757 56.8340 64.8495 173.3077 190 A 4.6029 9.3179 128.9791 50.7153 19.3090 177.1436 191 G 4.0078 8.5124 109.4616 45.7328 0.0000 170.7358 192 P 4.1682 0.0000 0.0000 62.5821 31.7174 175.6657 193 I 4.9413 8.6764 122.6938 59.3190 40.7116 176.3111 194 R 3.8242 8.8745 126.1637 59.5577 30.1094 177.5769 195 T 4.3830 7.3162 104.8053 61.6010 68.7853 175.0822 196 L 4.4382 7.6038 123.2369 54.9990 42.4531 176.1461 *205 N 4.7313 8.3859 117.3658 53.4349 40.6634 175.5016 206 T 4.0595 7.8095 110.8256 63.5376 67.5552 173.4171 207 I 4.6528 7.1343 114.5202 59.4066 36.2095 175.2340 208 L 4.2889 7.5804 124.1792 55.4332 44.5370 177.3828 209 K 3.9620 8.0445 120.9775 59.5128 32.1259 177.7800 210 E 4.0693 8.0425 119.2103 59.2897 29.7311 178.5764 211 I 3.4829 7.5662 119.1716 64.8514 37.1315 178.2582 212 E 3.9395 7.7932 119.3367 58.8275 29.1031 178.6126 213 E 4.7216 7.8973 114.8330 56.0995 30.6209 176.4859 214 R 4.5900 8.4259 116.2032 55.3409 32.6461 175.6522 215 A 4.4989 7.9679 122.0944 51.0186 19.1524 176.3854 216 P 4.3224 0.0000 0.0000 65.4092 31.4613 177.1505 217 L 4.4246 7.5459 114.1778 53.7329 42.0962 176.1681 218 K 4.1674 8.9967 117.0805 56.4732 29.5894 175.3063 219 R 4.3917 7.5593 111.2435 55.7228 31.6041 173.3508 220 N 4.8338 8.4638 116.7803 52.3385 40.6965 174.6865 221 V 4.5843 7.8672 113.0174 59.7020 32.9618 176.6026 222 D 5.1110 8.2730 122.7388 53.5426 42.4445 177.2779 223 Q 3.8765 8.8375 113.3235 59.0023 29.1469 177.7030 224 V 3.5444 7.7350 118.7078 66.2642 31.0927 177.2504 225 E 4.1473 8.0201 114.7410 57.6477 29.4069 178.5417 226 V 3.9202 7.1637 118.9968 65.1568 32.1610 177.6535 227 G 3.6475 10.0705 103.8381 46.1994 0.0000 175.4559 228 K 3.9669 8.3699 121.8402 59.7597 32.1535 179.1897 229 T 3.9522 7.4809 115.4693 66.5306 68.2591 176.2299 230 A 4.0490 8.1441 122.4052 55.3050 18.1709 179.4689 231 A 3.7793 7.6233 117.6518 55.4034 18.7015 178.5853 232 Y 4.3047 7.9869 117.9261 61.2828 38.5662 178.5511 233 L 3.5970 8.0312 118.4816 57.7769 41.9117 179.2720 234 L 4.5756 8.1125 118.5950 55.0019 41.6759 177.4426 235 S 4.4321 7.4466 114.0499 57.4390 63.6501 174.5139 236 D 4.4661 9.2836 119.4853 55.6293 40.3856 178.6398 237 L 4.1348 7.8656 120.1803 56.8071 42.1604 177.6828 238 S 4.4021 7.6190 112.4965 59.1497 63.0888 177.4227 239 S 3.7512 7.0219 116.6008 61.3488 62.7496 176.2157 240 G 4.0821 7.8864 106.8084 45.0655 0.0000 172.5991 241 V 4.3084 8.0624 120.4755 60.8733 32.8549 174.7514 242 T 4.4362 8.4114 120.0214 62.1093 69.9405 173.4452 243 G 3.9156 9.4405 115.6664 45.9392 0.0000 173.7615 244 E 4.3536 7.6737 119.1392 56.0077 31.3193 175.2633 245 N 5.4142 8.5896 119.1536 52.2177 41.6203 173.4141 246 I 4.4979 8.5636 127.4443 59.9052 39.9401 174.4903 247 H 4.7510 8.8458 124.4040 54.4304 29.3858 175.7662 248 V 4.1972 8.2296 126.9131 60.7316 30.2778 175.8170 249 D 4.6476 7.6104 128.8405 53.4575 39.6117 176.8996 250 S 3.6962 9.6712 111.8363 60.2865 61.7277 173.6998 251 G 4.2155 8.4513 107.7320 45.3108 0.0000 175.9427 252 F 4.2792 8.5991 123.6375 61.0944 39.9742 176.5766 253 H 3.9867 8.5310 115.9014 58.3803 28.1441 177.1219 254 A 3.8507 7.3473 122.1030 54.4772 18.3541 178.4424 255 I 3.4925 6.9437 115.9473 63.0133 38.1526 175.4738 256 K 4.0856 7.2943 122.9051 56.7273 32.4331 175.7291 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 L 8.18 4.22 0.00 1.60 1.56 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 -2 A 8.21 4.51 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 -1 A 8.19 4.62 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 0 A 8.32 4.00 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 1 M 7.96 4.41 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 2 L 7.90 4.30 0.00 1.78 1.74 1.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 3 N 8.22 3.90 0.00 2.89 2.51 0.00 0.00 7.00 7.61 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 4 L 8.77 3.78 0.00 1.81 1.81 0.82 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 5 E 7.91 4.11 0.00 1.94 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 2.31 2.34 0.00 6 N 8.93 4.62 0.00 2.82 3.31 0.00 0.00 7.09 7.12 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 7 K 7.67 4.38 0.00 1.81 1.96 0.00 2.08 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.60 7.81 8 T 9.52 4.77 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 1.10 0.00 0.00 9 Y 8.65 5.06 0.00 2.98 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 10 V 8.75 4.27 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 0.96 0.00 0.00 0.93 0.00 0.00 11 I 8.49 4.65 1.88 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 1.21 0.79 1.10 0.00 0.00 12 M 8.84 4.94 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.61 0.00 13 G 8.77 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 0.00 0.00 0.00 14 I 7.48 4.54 2.12 0.00 0.00 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 1.38 1.09 1.23 0.00 0.00 15 A 7.86 4.22 1.31 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 0.00 0.00 16 N 7.57 4.84 0.00 2.70 2.51 0.00 0.00 5.79 7.13 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 17 K 8.67 3.85 0.00 1.46 1.75 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.81 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.25 1.16 7.81 18 R 7.64 4.61 0.00 1.93 1.98 0.00 3.01 0.00 0.00 3.51 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.70 0.00 19 S 7.80 4.29 0.00 3.94 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 20 I 8.49 3.64 1.91 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.39 0.90 0.00 0.00 21 A 8.08 4.16 1.59 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 0.00 0.00 22 F 8.63 4.47 0.00 3.14 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 23 G 8.43 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 0.00 0.00 0.00 24 V 7.60 3.34 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 0.64 0.00 0.00 -0.25 0.00 0.00 25 A 7.97 4.00 1.53 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 26 K 7.27 3.81 0.00 1.51 1.62 0.00 1.41 0.00 0.00 1.12 0.00 0.00 2.80 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.30 0.68 7.81 27 V 7.55 3.46 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 0.75 0.00 0.00 0.84 0.00 0.00 28 L 7.75 3.75 0.00 1.91 1.57 0.71 0.59 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 29 D 9.55 4.40 0.00 2.87 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 30 Q 8.15 4.03 0.00 2.38 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 31 L 8.19 4.33 0.00 1.77 1.68 0.90 1.24 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 32 G 8.20 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 33 A 7.64 4.94 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 34 K 8.84 4.13 0.00 1.77 1.80 0.00 1.55 0.00 0.00 1.96 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.62 7.81 35 L 8.55 5.15 0.00 1.49 0.87 1.04 1.29 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 36 V 8.22 4.57 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 1.16 0.00 0.00 0.83 0.00 0.00 37 F 8.64 5.45 0.00 3.08 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 38 T 9.44 5.28 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 1.15 0.00 0.00 39 Y 8.42 5.03 0.00 2.94 3.16 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 40 R 9.10 4.93 0.00 1.85 2.08 0.00 3.20 0.00 0.00 3.99 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 41 K 8.26 4.22 0.00 1.90 1.80 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.42 7.81 42 E 8.44 3.54 0.00 2.13 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 0.00 2.21 2.30 0.00 43 R 8.19 2.66 0.00 1.86 2.02 0.00 3.15 0.00 0.00 3.32 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 44 S 8.37 4.09 0.00 3.95 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 45 R 7.18 3.50 0.00 1.37 0.87 0.00 2.96 0.00 0.00 3.18 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 46 K 7.16 4.54 0.00 1.76 1.71 0.00 1.60 0.00 0.00 1.88 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.32 7.81 47 E 8.66 3.78 0.00 1.86 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 2.10 2.22 0.00 48 L 7.56 3.83 0.00 1.65 1.54 0.68 0.89 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 49 E 8.11 4.07 0.00 1.93 1.94 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 2.28 2.26 0.00 50 K 7.71 3.93 0.00 1.97 1.80 0.00 1.70 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.39 7.81 51 L 8.80 4.07 0.00 1.59 1.40 0.53 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.44 4.10 0.00 1.56 1.74 0.96 1.24 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 53 E 8.88 4.03 0.00 2.10 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 2.52 2.48 0.00 54 Q 8.02 4.17 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.85 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 55 L 7.18 4.51 0.00 1.79 1.80 1.11 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 56 N 8.91 4.61 0.00 2.70 2.80 0.00 0.00 6.81 8.42 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 57 Q 7.86 4.57 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.95 0.00 0.00 0.00 0.00 0.00 2.55 2.50 0.00 58 P 0.00 4.49 0.00 2.07 2.12 0.00 3.67 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 2.05 2.13 0.00 59 E 7.57 4.68 0.00 1.75 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 2.28 2.33 0.00 60 A 8.12 4.50 1.20 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 61 H 8.77 4.87 0.00 3.19 3.32 0.00 5.56 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 L 8.13 5.29 0.00 1.56 1.72 1.03 0.85 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 63 Y 8.48 4.32 0.00 2.67 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 64 Q 8.30 3.54 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.62 0.00 65 I 9.87 4.34 1.83 0.00 0.00 0.46 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 0.59 0.96 0.00 0.00 66 D 9.62 5.02 0.00 2.82 2.60 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 67 V 7.92 3.47 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 0.86 0.00 0.00 0.99 0.00 0.00 68 Q 7.85 4.08 0.00 2.36 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.71 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 69 S 8.70 4.58 0.00 3.83 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 70 D 8.75 4.38 0.00 2.80 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 71 E 8.14 4.20 0.00 2.03 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 2.41 2.41 0.00 72 E 8.16 3.78 0.00 2.30 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 2.42 2.39 0.00 73 V 7.67 3.80 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 0.89 0.00 0.00 1.03 0.00 0.00 74 I 8.01 4.00 1.89 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 1.71 1.59 1.03 0.00 0.00 75 N 9.19 4.76 0.00 2.61 2.83 0.00 0.00 6.95 7.78 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 76 G 7.61 3.34 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 0.00 77 F 8.30 3.95 0.00 2.98 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 78 E 8.41 3.95 0.00 2.19 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 0.00 2.35 2.38 0.00 79 Q 7.60 3.86 0.00 2.35 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.84 0.00 0.00 0.00 0.00 0.00 2.46 2.76 0.00 80 I 7.68 3.45 1.76 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.35 0.74 0.00 0.00 81 G 8.18 3.44 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 0.00 82 K 8.28 3.96 0.00 1.90 1.85 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.61 7.81 83 D 8.56 4.52 0.00 2.83 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 84 V 8.70 4.34 2.01 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 0.69 0.00 0.00 0.89 0.00 0.00 85 G 7.60 4.12 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 0.00 0.00 0.00 86 N 8.67 4.85 0.00 2.67 2.78 0.00 0.00 6.72 7.45 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 87 I 7.55 4.12 1.72 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 1.24 0.49 0.87 0.00 0.00 88 D 7.84 4.53 0.00 2.13 2.62 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 89 G 6.91 4.67 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 90 V 7.68 5.13 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 0.78 0.00 0.00 1.05 0.00 0.00 91 Y 8.99 4.20 0.00 3.17 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 92 H 9.01 4.89 0.00 3.05 3.06 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 7.32 4.92 0.00 4.09 3.84 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 94 I 7.19 4.02 1.99 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 1.25 0.79 0.98 0.00 0.00 *118 Q 8.33 3.89 0.00 2.16 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.27 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 119 D 8.11 4.54 0.00 2.85 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 0.00 120 I 7.98 3.92 1.93 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 1.24 0.59 0.98 0.00 0.00 121 S 7.48 4.80 0.00 3.89 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 0.00 122 S 7.64 4.22 0.00 3.99 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 0.00 123 Y 7.83 4.39 0.00 3.07 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 S 8.29 3.88 0.00 3.96 4.12 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 0.00 125 L 7.53 3.57 0.00 1.88 1.93 0.80 0.84 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 0.00 126 T 7.86 3.86 4.53 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 1.48 0.00 0.00 127 I 7.55 3.55 1.82 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 -0.09 0.73 0.00 0.00 128 V 7.62 3.28 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 0.64 0.00 0.00 0.91 0.00 0.00 129 A 8.01 3.73 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 0.00 130 H 7.54 4.08 0.00 3.33 3.27 0.00 5.71 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.31 3.91 0.00 1.57 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 2.39 2.44 0.00 132 A 7.77 3.64 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 0.00 133 K 7.76 4.16 0.00 1.96 1.97 0.00 1.28 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.42 7.81 134 K 7.46 4.10 0.00 1.87 1.89 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.44 7.81 135 L 8.24 4.62 0.00 1.73 1.71 1.05 0.89 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 0.00 136 M 7.95 4.76 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 137 P 0.00 4.39 0.00 2.17 2.19 0.00 3.70 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.15 0.00 138 E 7.96 4.29 0.00 1.93 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 2.19 2.19 0.00 139 G 6.88 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 0.00 0.00 0.00 140 G 8.55 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 0.00 0.00 0.00 141 S 8.65 5.00 0.00 3.92 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 0.00 142 I 9.12 4.76 1.81 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 1.07 0.49 0.84 0.00 0.00 143 V 8.12 4.72 2.25 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 1.11 0.00 0.00 1.00 0.00 0.00 144 A 8.64 4.84 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 0.00 145 T 8.48 5.17 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 146 T 8.44 4.79 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 1.21 0.00 0.00 147 Y 8.57 5.50 0.00 2.85 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 0.00 148 L 8.68 4.11 0.00 1.30 1.38 0.89 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 *157 Y 8.23 4.58 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 0.00 158 N 9.58 4.98 0.00 2.64 2.51 0.00 0.00 7.15 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 0.00 159 V 10.36 4.08 2.13 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 0.72 0.00 0.00 0.99 0.00 0.00 160 M 8.02 2.71 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.98 0.00 161 G 8.39 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 0.00 0.00 0.00 162 V 7.45 3.07 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 0.82 0.00 0.00 0.94 0.00 0.00 163 A 8.77 4.15 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 K 8.21 4.15 0.00 1.86 1.82 0.00 1.70 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.51 1.47 7.81 165 A 7.11 3.72 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 0.00 166 S 8.23 4.22 0.00 3.92 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 0.00 167 L 8.46 3.90 0.00 1.77 1.72 0.94 1.07 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 0.00 168 E 8.09 3.87 0.00 2.24 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 0.00 2.54 2.45 0.00 169 A 7.82 4.36 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 0.00 170 N 8.27 4.44 0.00 2.92 2.88 0.00 0.00 6.86 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 V 7.80 3.61 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 1.01 0.00 0.00 0.96 0.00 0.00 172 K 7.96 3.97 0.00 2.08 1.89 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.64 7.81 173 Y 8.19 4.25 0.00 3.00 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 0.00 174 L 7.88 3.53 0.00 1.55 1.48 0.85 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 175 A 7.68 3.89 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 0.00 176 L 7.47 4.06 0.00 1.90 1.72 1.06 1.05 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 0.00 177 D 7.65 4.27 0.00 2.28 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 L 8.04 4.45 0.00 1.61 1.58 0.76 0.59 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 0.00 179 G 7.93 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 0.00 180 P 0.00 4.18 0.00 2.02 2.14 0.00 3.98 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 181 D 7.87 4.61 0.00 2.61 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 0.00 182 N 8.53 4.15 0.00 2.88 2.82 0.00 0.00 7.09 7.75 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 0.00 183 I 7.61 4.82 1.98 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.69 0.83 0.00 0.00 184 R 8.78 4.28 0.00 1.71 1.80 0.00 3.24 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 185 V 8.71 4.80 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 0.92 0.00 0.00 0.84 0.00 0.00 186 N 9.27 5.55 0.00 2.72 2.81 0.00 0.00 6.21 7.28 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 0.00 187 A 9.08 5.26 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 0.00 188 I 8.76 4.93 1.97 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 1.32 1.25 1.04 0.00 0.00 189 S 9.36 4.93 0.00 3.60 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 0.00 190 A 9.32 4.60 1.49 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 0.00 0.00 0.00 191 G 8.51 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 0.00 192 P 0.00 4.17 0.00 2.07 1.91 0.00 3.41 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 193 I 8.68 4.94 1.92 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 1.27 1.20 0.94 0.00 0.00 194 R 8.87 3.82 0.00 1.85 1.93 0.00 3.17 0.00 0.00 3.39 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 195 T 7.32 4.38 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 1.22 0.00 0.00 196 L 7.60 4.44 0.00 1.54 1.56 0.82 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 *205 N 8.39 4.73 0.00 2.83 2.86 0.00 0.00 6.70 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 0.00 206 T 7.81 4.06 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 1.22 0.00 0.00 207 I 7.13 4.65 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 1.36 0.73 0.92 0.00 0.00 208 L 7.58 4.29 0.00 1.73 1.80 0.89 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 209 K 8.04 3.96 0.00 2.01 1.90 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.44 0.00 0.00 0.00 0.00 1.46 1.62 7.81 210 E 8.04 4.07 0.00 2.09 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 2.33 2.48 0.00 211 I 7.57 3.48 1.75 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.20 -0.24 0.64 0.00 0.00 212 E 7.79 3.94 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 2.32 2.38 0.00 213 E 7.90 4.72 0.00 2.03 1.97 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 2.25 2.30 0.00 214 R 8.43 4.59 0.00 1.96 2.05 0.00 3.24 0.00 0.00 3.36 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.85 0.00 215 A 7.97 4.50 1.40 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 0.00 216 P 0.00 4.32 0.00 2.06 2.17 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 217 L 7.55 4.42 0.00 1.66 1.70 0.93 0.90 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 0.00 218 K 9.00 4.17 0.00 1.87 1.93 0.00 1.72 0.00 0.00 1.62 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.47 7.81 219 R 7.56 4.39 0.00 1.85 1.85 0.00 3.02 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 220 N 8.46 4.83 0.00 2.62 2.94 0.00 0.00 6.89 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 0.00 221 V 7.87 4.58 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 0.75 0.00 0.00 1.02 0.00 0.00 222 D 8.27 5.11 0.00 2.70 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 0.00 223 Q 8.84 3.88 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.88 0.00 0.00 0.00 0.00 0.00 2.53 2.43 0.00 224 V 7.74 3.54 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 1.11 0.00 0.00 0.86 0.00 0.00 225 E 8.02 4.15 0.00 2.23 1.97 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 2.32 2.30 0.00 226 V 7.16 3.92 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 1.07 0.00 0.00 1.03 0.00 0.00 227 G 10.07 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 0.00 228 K 8.37 3.97 0.00 1.80 1.84 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.54 7.81 229 T 7.48 3.95 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 1.32 0.00 0.00 230 A 8.14 4.05 1.35 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 0.00 231 A 7.62 3.78 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 0.00 232 Y 7.99 4.30 0.00 2.99 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 0.00 233 L 8.03 3.60 0.00 2.01 1.73 1.03 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 234 L 8.11 4.58 0.00 1.38 1.69 0.45 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 235 S 7.45 4.43 0.00 4.11 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 0.00 236 D 9.28 4.47 0.00 2.89 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 0.00 237 L 7.87 4.13 0.00 1.66 1.81 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 238 S 7.62 4.40 0.00 3.45 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 0.00 239 S 7.02 3.75 0.00 4.03 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 0.00 240 G 7.89 4.08 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 0.00 0.00 0.00 241 V 8.06 4.31 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 0.86 0.00 0.00 1.01 0.00 0.00 242 T 8.41 4.44 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 243 G 9.44 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 0.00 244 E 7.67 4.35 0.00 1.95 1.92 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 2.42 2.29 0.00 245 N 8.59 5.41 0.00 2.71 2.72 0.00 0.00 7.02 7.28 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 0.00 246 I 8.56 4.50 1.93 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 1.29 0.93 0.94 0.00 0.00 247 H 8.85 4.75 0.00 2.99 3.54 0.00 5.89 0.00 0.00 0.00 0.00 6.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 V 8.23 4.20 2.13 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 1.06 0.00 0.00 1.01 0.00 0.00 249 D 7.61 4.65 0.00 2.90 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 0.00 250 S 9.67 3.70 0.00 4.05 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 0.00 251 G 8.45 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 0.00 0.00 0.00 0.00 252 F 8.60 4.28 0.00 3.12 3.13 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 0.00 253 H 8.53 3.99 0.00 3.20 3.51 0.00 5.31 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 A 7.35 3.85 1.16 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 0.00 255 I 6.94 3.49 1.26 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.49 0.24 0.00 0.00 256 K 7.29 4.09 0.00 1.81 1.62 0.00 1.51 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.29 1.25 7.81 * Residues marked with a * may have inaccurate shift predictions.