NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4085 8.3344 115.4048 57.6321 64.5164 173.9586 3 K 3.9708 8.4043 121.2842 59.1216 31.9501 177.3580 4 G 3.6793 8.2820 105.7804 47.6186 0.0000 174.3112 5 E 4.0788 8.1121 121.1347 59.6780 29.3098 178.9266 6 E 4.0704 8.1008 118.1464 59.2055 29.2583 178.9812 7 L 4.0472 7.8232 117.6708 56.2207 40.7869 177.6464 8 F 4.8657 7.9906 117.3732 57.2916 39.3818 177.4404 9 T 4.1965 7.7959 111.6685 63.4998 69.1018 174.0854 10 G 4.3204 7.1394 107.7648 43.9956 0.0000 171.3322 11 V 4.0989 8.4882 120.2234 62.8400 32.3649 176.8820 12 V 4.6392 8.9132 128.5046 60.1514 34.1477 173.0692 13 P 4.8334 0.0000 0.0000 63.0814 32.9068 175.1376 14 I 5.1378 8.5846 121.9205 59.5001 41.1119 174.1380 15 L 5.0873 8.7323 127.4093 53.1895 45.6166 175.1161 16 V 5.0661 8.6708 124.4185 61.2113 34.9585 173.9715 17 E 5.2046 9.2757 126.2807 54.5061 33.4998 174.3536 18 L 5.2804 9.2474 126.0271 53.3231 45.6934 174.5523 19 D 5.1006 8.9517 125.6975 52.4636 43.6327 175.4395 20 G 3.9442 8.4127 110.2260 43.9496 0.0000 171.4818 21 D 5.0037 8.0871 120.2505 53.3726 44.0062 173.9254 22 V 4.7901 8.8838 127.3819 61.3779 34.0063 175.3002 23 N 4.4060 10.2536 126.8553 54.3837 36.6636 175.7818 24 G 3.8987 8.3764 105.7325 45.7453 0.0000 174.2714 25 H 4.4269 8.2472 117.9318 55.3384 28.2997 174.4744 26 K 5.0468 8.4739 124.7600 55.8976 33.1729 176.4424 27 F 5.0278 8.4405 117.3370 56.1445 41.8166 173.0537 28 S 5.1675 8.9933 115.0196 56.8487 67.0056 173.2884 29 V 5.1723 8.8310 122.9366 61.3347 34.8419 174.2321 30 S 5.3077 9.1358 122.9882 56.8040 65.8397 173.4017 31 G 4.2351 9.2895 110.3765 44.5360 0.0000 171.1461 32 E 4.9980 8.1202 117.9627 53.9983 33.3095 175.5694 33 G 4.0232 7.5506 107.7289 46.0697 0.0000 171.4626 34 E 4.9671 7.9846 120.4582 55.3781 33.3204 175.0263 35 G 3.5412 8.7033 107.5388 44.4379 0.0000 171.3208 36 D 5.0592 9.1722 120.9108 51.9380 41.7281 175.6937 37 A 4.5320 8.9362 126.6339 54.5261 19.1667 180.1463 38 T 3.7326 8.1598 112.0353 66.2743 68.4483 174.4620 39 Y 4.5498 8.0094 115.7770 56.8609 38.7296 175.6378 40 G 4.3608 8.1316 108.3774 46.6148 0.0000 173.0345 41 K 4.9015 8.1019 119.4005 54.0642 35.5875 174.4949 42 L 5.1399 8.4404 125.9259 53.0000 46.1577 175.5342 43 T 4.9335 8.5755 112.3568 59.9631 71.6862 172.8386 44 L 5.0077 9.0716 125.6525 52.5492 46.7339 175.1758 45 K 4.7691 8.3165 122.7319 54.5063 35.3524 174.7155 46 F 5.2678 9.0485 125.4922 55.6442 42.6011 174.2127 47 I 5.0506 8.9566 123.2329 59.6155 40.7642 174.2699 48 C 5.1400 9.4400 128.3424 59.1892 31.2248 173.4923 49 T 4.2785 8.9026 117.3643 62.9255 68.9699 175.4408 50 T 4.4374 7.8560 111.3425 61.0133 70.3054 174.0679 51 G 4.0693 7.9502 107.0924 44.5103 0.0000 174.7846 52 K 4.2327 8.5767 124.6004 55.5613 32.7213 176.4863 53 L 3.6214 8.6146 126.6935 54.3983 42.0962 175.1381 54 P 4.3279 0.0000 0.0000 63.5943 31.8600 175.9554 55 V 4.2171 6.4447 111.1108 58.3808 35.3835 173.3693 56 P 4.4294 0.0000 0.0000 62.1634 32.1093 177.6911 57 W 4.3869 9.1722 122.7294 59.8975 28.9602 177.0173 58 P 4.6045 0.0000 0.0000 65.7105 30.5835 178.3181 59 T 4.3722 7.9983 107.2704 63.5451 69.1401 175.5014 60 L 4.3087 7.9151 121.0830 54.4781 41.8653 178.1608 61 V 3.6186 7.6850 119.8138 66.4525 31.2392 178.0252 62 T 4.0678 8.0204 107.2543 64.9972 68.7035 176.1868 63 T 4.1038 7.1267 115.0166 66.1338 69.3890 177.2906 64 F 4.9144 7.5538 119.8525 56.8833 38.2156 177.1805 *68 V 4.1143 7.3345 111.1830 61.7823 32.8096 177.1871 69 Q 4.0051 7.9015 118.8025 57.2270 29.0433 178.6448 70 C 4.0630 7.8713 112.6584 60.3435 30.0206 174.2584 71 F 4.5662 7.9997 118.7784 57.7046 38.7618 175.5319 72 S 4.6330 7.6322 117.6571 58.6071 63.7039 173.9886 73 R 4.4296 8.9583 124.6468 56.0201 30.9860 174.6129 74 Y 4.6397 8.5910 124.8654 55.6207 39.1447 174.3646 75 P 4.4259 0.0000 0.0000 62.2921 32.4033 176.8799 76 D 4.4075 8.9825 120.6537 58.1226 40.7328 178.7740 77 H 4.5120 8.2198 111.0525 57.1277 29.0649 175.4071 78 M 4.7012 8.0102 119.8366 55.1317 32.2355 177.7484 79 K 3.9782 7.9041 121.2309 59.2341 32.2598 179.0572 80 R 4.0095 7.9486 115.8747 58.0033 29.9972 176.5477 81 H 4.7055 8.1340 114.4530 55.4924 28.7647 174.8839 82 D 3.7274 7.0278 121.9230 52.0896 39.8179 176.3939 83 F 4.1216 8.0791 127.6159 60.0564 39.3275 176.0196 84 F 4.0370 7.5494 115.3834 60.8013 39.1434 177.5171 85 K 4.1206 8.1581 117.7569 59.1562 31.5671 179.6610 86 S 4.1040 7.4151 112.7521 60.9806 63.0795 175.8513 87 A 4.0316 7.5742 122.9655 52.9572 18.1531 177.1314 88 M 4.7273 7.2233 117.1841 53.8471 33.4555 174.8689 89 P 4.7627 0.0000 0.0000 64.3734 32.2006 178.2213 90 E 3.8911 8.1067 118.5649 57.8068 29.8420 176.8427 91 G 3.8366 9.6187 105.1497 44.3678 0.0000 171.1668 92 Y 5.3940 7.8882 114.6659 55.6113 42.1215 174.1008 93 V 4.7685 9.1668 121.3801 61.7478 33.6716 174.2289 94 Q 5.3372 9.4975 129.3644 54.4673 31.6517 173.7506 95 E 5.3371 9.2577 125.7044 54.7500 33.0270 175.3329 96 R 5.2871 8.9929 121.5342 54.8588 35.2250 174.0383 97 T 4.8720 8.6797 118.3247 61.7844 71.6416 173.2542 98 I 4.4865 8.5657 127.2436 59.5122 39.9289 174.6889 99 F 4.8542 8.9460 127.7143 55.9053 40.5868 175.4541 100 F 4.6857 8.6967 124.4518 56.1148 39.8473 175.7258 101 K 4.0725 8.6834 126.1641 58.0569 32.3425 175.9910 102 D 4.5569 9.2740 124.0145 54.9331 38.7804 173.1444 103 D 4.3710 7.8608 118.9955 53.8998 43.9400 173.4863 104 G 2.9636 7.4986 106.8948 44.4988 0.0000 171.6810 105 N 5.4342 7.7098 114.7770 51.4851 41.2034 173.0484 106 Y 5.5512 8.7277 118.0457 56.7411 40.6861 174.7482 107 K 5.2022 9.3288 122.9184 54.8135 35.4559 175.3474 108 T 5.1634 9.1172 114.8239 59.8868 72.5721 172.8499 109 R 5.2200 8.9099 122.6472 54.7747 33.6233 173.6895 110 A 5.2825 9.3861 127.2748 50.2952 23.1810 174.1918 111 E 5.0410 9.0180 120.2186 54.5080 32.5574 175.2610 112 V 4.7691 8.2884 124.6210 61.1252 33.9472 174.3427 113 K 4.7653 8.5452 125.8110 55.7515 36.3428 174.7604 114 F 4.6313 8.7167 120.4281 57.3683 39.7723 175.5814 115 E 4.5292 9.3390 123.4630 55.1047 31.4674 176.5775 116 G 3.8989 8.2796 116.8101 47.0337 0.0000 173.4910 117 D 4.7148 8.9029 124.0506 53.6876 40.1048 175.8575 118 T 4.7594 7.6784 118.0933 61.9565 71.1759 173.3578 119 L 4.0522 8.4845 128.6142 54.2208 43.4811 175.3125 120 V 4.8468 8.6734 126.9947 61.0565 34.4768 173.6981 121 N 5.3308 9.1072 126.7547 52.2146 40.8878 172.8844 122 R 5.1805 8.9195 126.4762 54.5066 32.6266 175.5883 123 I 5.1498 9.0158 124.9109 59.4849 41.2478 174.2695 124 E 5.1755 9.1313 125.2872 54.4982 32.5856 174.7912 125 L 5.1884 8.7594 125.2691 53.0787 45.8275 174.8461 126 K 4.9978 9.2160 127.0148 54.5863 35.2411 174.7869 127 G 5.5572 9.5529 115.0307 45.5664 0.0000 171.9017 128 I 5.0454 8.1197 115.0302 59.6751 41.6681 174.5225 129 D 4.3254 8.8048 120.0129 55.3799 38.0570 174.1778 130 F 4.4685 7.4974 115.4728 56.7487 39.8561 175.8846 131 K 4.2454 9.4631 124.9798 56.1914 32.4239 178.5148 132 E 4.0881 8.8860 123.0603 58.6575 29.6187 176.9412 133 D 4.8616 7.8424 117.5067 53.5770 42.0893 175.9675 134 G 4.0372 7.6937 107.3729 43.9502 0.0000 174.8231 135 N 4.3705 8.6474 115.1878 56.0003 38.7433 177.4121 136 I 3.7102 7.3751 119.0018 63.6989 37.7313 177.9331 137 L 3.8109 7.5836 119.8322 56.8278 41.7742 178.2293 138 G 3.7158 7.8577 106.0469 45.0406 0.0000 173.1631 139 H 3.9834 7.4344 116.0447 57.1626 26.5150 174.9240 140 K 4.5428 8.1805 116.0446 56.2191 33.9199 178.1437 141 L 4.8208 7.7564 120.6569 54.1760 42.5155 176.7428 142 E 4.1884 8.9416 122.8114 56.4247 30.0743 177.2542 143 Y 4.5158 8.5345 124.7813 55.4312 37.3285 173.3778 144 N 4.7124 7.6197 119.6294 52.4524 40.3872 173.9046 145 Y 4.4391 8.0281 116.8587 56.8426 41.5300 173.7493 146 N 4.6844 8.1583 124.5629 52.4357 39.9360 174.2466 147 S 4.7288 8.1466 114.4536 58.4969 63.4065 172.8273 148 H 5.0653 8.7564 122.0094 54.2495 33.4897 171.7212 149 N 5.2042 8.7388 117.7299 51.7700 40.3014 174.5230 150 V 4.1101 8.5492 124.5250 61.4429 33.5830 173.9190 151 Y 4.8841 8.7833 126.4770 57.0471 39.7136 174.6958 152 I 5.0600 8.8364 125.5607 59.8165 40.0727 174.7363 153 M 5.2914 9.1065 125.4969 53.1339 36.2463 174.9067 154 A 4.2356 8.6394 123.1315 52.1873 19.7604 177.2566 155 D 4.6794 8.9878 120.8015 51.7648 41.0791 176.0857 156 K 3.9758 8.3494 124.3573 58.9333 32.8744 178.9605 157 Q 4.0798 8.1147 116.5007 58.0627 28.7492 177.0753 158 K 4.4405 7.8157 115.2782 55.3542 32.3990 175.3254 159 N 4.2625 8.1318 115.8199 54.0149 38.2922 173.8667 160 G 4.0553 7.3921 103.6787 45.3922 0.0000 172.7118 161 I 4.9024 7.5040 113.3790 58.8831 41.3061 174.7537 162 K 5.0762 8.9006 122.5596 54.7169 35.2786 175.5137 163 V 5.0505 8.8381 123.2796 61.3187 35.4671 173.6553 164 N 5.6065 9.4221 124.9814 51.3681 42.7719 172.8590 165 F 5.1312 7.6292 118.2769 56.3014 41.3408 172.4744 166 K 4.8155 8.6556 119.6361 54.5611 34.3712 175.5235 167 I 3.6688 8.5718 129.5982 61.1771 38.4728 175.6019 168 R 4.6348 8.6345 125.6265 55.1903 31.3805 175.3112 169 H 4.8022 8.9692 123.0419 53.9261 30.7258 174.6354 170 N 4.7680 8.8183 121.6406 53.4371 39.7723 174.2778 171 I 4.9549 8.5339 124.2158 59.2727 39.5228 176.9105 172 E 4.1436 8.8404 123.3912 58.9393 29.4057 177.5644 173 D 4.5905 8.0452 117.0791 53.1158 39.8926 177.0533 174 G 3.9687 8.3756 109.2072 45.1674 0.0000 173.8885 175 S 4.6791 8.0841 114.8736 57.3301 66.0180 172.8674 176 V 4.8201 8.1240 118.1317 61.4313 34.4687 174.7216 177 Q 4.5894 9.4048 129.1313 54.7197 30.6484 174.3870 178 L 4.8651 8.5823 126.4227 54.2151 43.9042 175.9420 179 A 4.6036 8.8922 124.1539 50.0184 21.5883 174.3013 180 D 4.6799 8.9614 122.5898 54.7982 42.6012 174.7586 181 H 4.9094 8.7086 124.4558 54.3797 30.8840 173.6675 182 Y 4.6255 8.8329 121.3523 56.1798 40.4440 174.5852 183 Q 5.2179 9.0530 125.4874 54.2566 32.9794 173.6665 184 Q 5.0567 9.3586 126.3361 54.4006 32.8619 173.5486 185 N 5.7193 8.9531 122.1084 51.8893 42.6837 173.5681 186 T 5.0822 8.9625 118.5874 61.1075 72.8630 171.9702 187 P 4.8844 0.0000 0.0000 63.3219 31.6978 176.3841 188 I 4.0862 8.6992 123.7698 63.5826 38.0877 177.0052 189 G 3.9644 8.0527 109.6305 44.8230 0.0000 172.5228 190 D 4.6770 8.3705 116.9955 53.2370 40.4694 176.8939 191 G 3.8443 7.8504 108.9232 44.3008 0.0000 171.1509 192 P 4.4145 0.0000 0.0000 62.6097 31.8666 176.2525 193 V 4.4476 7.9196 113.3584 59.2606 35.1111 175.0389 194 L 4.2353 8.3266 122.4175 54.2039 42.1536 176.1857 195 L 4.8194 8.3766 123.9608 52.3645 43.0009 174.6870 196 P 4.6756 0.0000 0.0000 61.8085 32.5751 175.6924 197 D 4.6684 8.6378 119.1898 53.8640 41.5138 176.0534 198 N 4.8088 8.5843 118.5606 54.8260 39.2059 174.0880 199 H 4.9218 8.6489 117.2692 55.4294 32.5551 171.5395 200 Y 5.2691 8.2060 115.4806 55.4540 41.9918 173.9635 201 L 4.8768 8.6527 119.7537 52.9670 44.7064 175.5878 202 S 5.1285 9.1412 119.6600 57.3031 63.8189 172.7782 203 T 5.2896 9.0071 117.7625 60.1221 71.7698 173.1440 204 Q 4.8331 9.1541 121.7512 54.5490 33.4035 174.2257 205 S 5.0770 8.8688 117.7047 56.7075 67.0561 173.0605 206 A 4.7390 9.2308 126.2146 50.1648 21.2194 174.9399 207 L 5.2074 8.3907 122.7183 53.5177 44.2276 175.8660 208 S 4.8150 8.7168 115.8787 57.8977 66.9309 172.8070 209 K 4.9770 8.5391 118.3358 54.5492 35.3430 175.9171 210 D 4.6046 8.7655 122.9581 52.3967 41.3797 175.5309 211 P 4.3474 0.0000 0.0000 65.2469 31.5445 176.7153 212 N 4.5792 8.2533 115.1438 52.9736 38.6053 174.0723 213 E 4.4582 7.8750 120.5247 54.3521 30.3602 175.7948 214 K 4.1927 8.5238 126.1298 58.2356 32.7683 177.7780 215 R 4.2689 7.9275 117.4852 55.2357 30.9365 175.4492 216 D 4.7970 8.6059 119.7801 54.9148 42.1498 174.6812 217 H 4.9464 8.4649 119.9111 55.0644 31.9131 172.2904 218 M 4.4893 8.0911 117.6094 52.9889 35.7504 173.4637 219 V 4.6930 8.6062 125.9607 61.2844 33.9502 174.1592 220 L 5.2821 9.2437 129.2349 53.1751 45.7186 174.5704 221 L 5.1344 8.7840 127.3039 53.3077 45.1905 174.8871 222 E 5.2118 8.9305 124.3964 54.5640 34.1170 174.5721 223 F 5.5074 9.1587 120.5559 55.8357 42.7620 174.4287 224 V 4.9246 9.2922 122.8703 61.5956 35.1192 174.0875 225 T 5.0118 8.7168 123.3371 61.5360 72.2664 173.2718 226 A 4.3098 8.6342 128.3880 51.9010 19.2512 176.3620 227 A 4.2064 8.5867 121.8267 50.9047 23.1509 177.0402 228 G 4.0538 8.8472 105.4843 45.3382 0.0000 173.9484 229 I 4.5439 7.4989 120.2930 59.6832 39.7019 175.1812 230 T 4.6058 8.6155 113.0231 61.2540 69.8012 173.5306 231 H 4.5426 8.0821 122.9508 55.9647 28.8781 174.7872 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 2 S 8.33 4.41 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 3 K 8.40 3.97 0.00 1.90 1.82 0.00 1.70 0.00 0.00 1.79 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.54 7.81 4 G 8.28 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 5 E 8.11 4.08 0.00 2.07 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 0.00 2.35 2.37 0.00 6 E 8.10 4.07 0.00 2.11 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 2.33 2.35 0.00 7 L 7.82 4.05 0.00 1.29 0.99 0.52 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 8 F 7.99 4.87 0.00 3.25 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 9 T 7.80 4.20 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 10 G 7.14 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 11 V 8.49 4.10 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 0.82 0.00 0.00 0.98 0.00 0.00 12 V 8.91 4.64 2.56 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 1.24 0.00 0.00 1.10 0.00 0.00 13 P 0.00 4.83 0.00 2.22 2.14 0.00 3.65 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 2.10 2.13 0.00 14 I 8.58 5.14 1.74 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.03 0.90 0.00 0.00 15 L 8.73 5.09 0.00 1.63 1.44 1.04 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.67 5.07 2.19 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 1.26 0.00 0.00 1.04 0.00 0.00 17 E 9.28 5.20 0.00 1.93 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 2.24 2.38 0.00 18 L 9.25 5.28 0.00 1.93 1.86 0.80 1.26 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 19 D 8.95 5.10 0.00 2.55 2.42 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 20 G 8.41 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.09 5.00 0.00 2.61 2.44 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 22 V 8.88 4.79 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 0.96 0.00 0.00 23 N 10.25 4.41 0.00 2.98 2.98 0.00 0.00 7.18 8.52 0.00 0.00 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 G 8.38 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 25 H 8.25 4.43 0.00 3.42 3.33 0.00 5.81 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.47 5.05 0.00 1.66 1.71 0.00 1.77 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 1.44 7.81 27 F 8.44 5.03 0.00 3.01 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 28 S 8.99 5.17 0.00 3.84 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 29 V 8.83 5.17 2.46 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 1.40 0.00 0.00 1.27 0.00 0.00 30 S 9.14 5.31 0.00 3.83 3.72 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 31 G 9.29 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 0.00 0.00 0.00 0.00 32 E 8.12 5.00 0.00 1.89 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 33 G 7.55 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 0.00 0.00 0.00 34 E 7.98 4.97 0.00 2.02 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 2.08 2.13 0.00 35 G 8.70 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 9.17 5.06 0.00 2.73 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.94 4.53 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 3.73 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 0.63 0.00 0.00 39 Y 8.01 4.55 0.00 3.11 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 40 G 8.13 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.10 4.90 0.00 1.80 1.63 0.00 1.40 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.10 0.66 7.81 42 L 8.44 5.14 0.00 1.48 1.34 0.97 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.58 4.93 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 1.06 0.00 0.00 44 L 9.07 5.01 0.00 1.37 0.67 1.03 0.20 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 45 K 8.32 4.77 0.00 1.61 1.37 0.00 1.44 0.00 0.00 1.51 0.00 0.00 2.71 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.14 1.23 7.81 46 F 9.05 5.27 0.00 2.55 2.74 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 47 I 8.96 5.05 1.93 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.04 1.00 0.00 0.00 48 C 9.44 5.14 0.00 3.15 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 49 T 8.90 4.28 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 50 T 7.86 4.44 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 51 G 7.95 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 52 K 8.58 4.23 0.00 1.73 1.70 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.35 7.81 53 L 8.61 3.62 0.00 1.01 0.96 0.13 -0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.33 0.00 1.93 1.99 0.00 2.55 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.81 0.00 55 V 6.44 4.22 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 0.39 0.00 0.00 0.44 0.00 0.00 56 P 0.00 4.43 0.00 2.18 2.04 0.00 3.42 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 57 W 9.17 4.39 0.00 3.69 3.43 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.60 0.00 2.33 2.44 0.00 3.73 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.31 0.00 59 T 8.00 4.37 4.48 0.00 0.00 0.00 0.00 0.00 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 60 L 7.92 4.31 0.00 1.64 0.53 0.69 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 61 V 7.68 3.62 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 0.64 0.00 0.00 0.85 0.00 0.00 62 T 8.02 4.07 4.55 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 1.51 0.00 0.00 63 T 7.13 4.10 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 1.13 0.00 0.00 64 F 7.55 4.91 0.00 3.00 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 *68 V 7.33 4.11 2.44 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 0.91 0.00 0.00 1.17 0.00 0.00 69 Q 7.90 4.01 0.00 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.81 0.00 0.00 0.00 0.00 0.00 2.15 2.16 0.00 70 C 7.87 4.06 0.00 2.28 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 71 F 8.00 4.57 0.00 3.29 3.14 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 72 S 7.63 4.63 0.00 3.96 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 73 R 8.96 4.43 0.00 2.04 1.81 0.00 3.09 0.00 0.00 3.22 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 74 Y 8.59 4.64 0.00 2.82 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 75 P 0.00 4.43 0.00 2.08 1.98 0.00 3.48 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 2.04 0.00 76 D 8.98 4.41 0.00 2.73 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 77 H 8.22 4.51 0.00 3.27 3.41 0.00 5.47 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 78 M 8.01 4.70 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.30 0.00 79 K 7.90 3.98 0.00 1.78 1.82 0.00 1.67 0.00 0.00 1.98 0.00 0.00 3.16 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.62 7.81 80 R 7.95 4.01 0.00 1.64 1.82 0.00 3.12 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 81 H 8.13 4.71 0.00 3.24 3.25 0.00 5.84 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.03 3.73 0.00 1.58 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 8.08 4.12 0.00 2.95 2.35 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 84 F 7.55 4.04 0.00 3.13 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 85 K 8.16 4.12 0.00 1.68 1.81 0.00 1.56 0.00 0.00 1.48 0.00 0.00 2.92 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.30 1.28 7.81 86 S 7.42 4.10 0.00 3.93 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 87 A 7.57 4.03 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 M 7.22 4.73 0.00 2.40 2.44 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 3.22 3.04 0.00 89 P 0.00 4.76 0.00 2.21 2.02 0.00 3.68 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 2.04 1.88 0.00 90 E 8.11 3.89 0.00 1.99 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 2.33 2.39 0.00 91 G 9.62 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 0.00 0.00 0.00 92 Y 7.89 5.39 0.00 3.38 3.14 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 93 V 9.17 4.77 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.02 0.00 0.00 94 Q 9.50 5.34 0.00 2.62 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.53 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 95 E 9.26 5.34 0.00 1.99 1.84 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 2.26 2.32 0.00 96 R 8.99 5.29 0.00 1.76 1.75 0.00 3.17 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 97 T 8.68 4.87 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 0.34 0.00 0.00 98 I 8.57 4.49 1.72 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 0.62 0.89 0.13 0.00 0.00 99 F 8.95 4.85 0.00 2.90 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 0.00 100 F 8.70 4.69 0.00 3.22 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 0.00 101 K 8.68 4.07 0.00 1.74 1.77 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.43 7.81 102 D 9.27 4.56 0.00 2.90 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 0.00 103 D 7.86 4.37 0.00 2.69 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 G 7.50 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 0.00 0.00 0.00 105 N 7.71 5.43 0.00 2.54 2.70 0.00 0.00 7.34 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 0.00 106 Y 8.73 5.55 0.00 2.96 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 K 9.33 5.20 0.00 1.64 1.67 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.26 1.28 7.81 108 T 9.12 5.16 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 1.22 0.00 0.00 109 R 8.91 5.22 0.00 1.90 1.78 0.00 3.07 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 110 A 9.39 5.28 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 0.00 111 E 9.02 5.04 0.00 1.93 1.85 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 2.27 2.25 0.00 112 V 8.29 4.77 1.02 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 0.79 0.00 0.00 0.93 0.00 0.00 113 K 8.55 4.77 0.00 2.10 1.84 0.00 1.38 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.31 1.41 7.81 114 F 8.72 4.63 0.00 2.97 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 0.00 115 E 9.34 4.53 0.00 1.96 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 116 G 8.28 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 0.00 117 D 8.90 4.71 0.00 2.82 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 0.00 118 T 7.68 4.76 4.39 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 1.20 0.00 0.00 119 L 8.48 4.05 0.00 1.13 1.51 0.99 0.18 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 0.00 120 V 8.67 4.85 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 0.88 0.00 0.00 0.91 0.00 0.00 121 N 9.11 5.33 0.00 2.90 2.78 0.00 0.00 6.73 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 0.00 122 R 8.92 5.18 0.00 1.80 1.84 0.00 3.12 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 123 I 9.02 5.15 1.95 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.11 0.93 0.00 0.00 124 E 9.13 5.18 0.00 1.87 1.79 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 2.20 2.21 0.00 125 L 8.76 5.19 0.00 1.52 1.22 0.48 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 126 K 9.22 5.00 0.00 1.86 1.61 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.45 7.81 127 G 9.55 5.56 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 0.00 0.00 0.00 128 I 8.12 5.05 1.92 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 1.38 0.64 0.98 0.00 0.00 129 D 8.80 4.33 0.00 2.73 2.74 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 0.00 130 F 7.50 4.47 0.00 3.17 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 0.00 131 K 9.46 4.25 0.00 1.80 1.75 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.41 7.81 132 E 8.89 4.09 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.27 0.00 133 D 7.84 4.86 0.00 2.56 2.58 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 0.00 134 G 7.69 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 N 8.65 4.37 0.00 2.80 2.88 0.00 0.00 6.84 7.44 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 0.00 136 I 7.38 3.71 1.63 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 -0.04 0.25 0.00 0.00 137 L 7.58 3.81 0.00 1.73 1.59 0.99 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 138 G 7.86 3.72 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 0.00 0.00 0.00 139 H 7.43 3.98 0.00 3.29 3.30 0.00 5.63 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 0.00 140 K 8.18 4.54 0.00 1.70 1.82 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.38 7.81 141 L 7.76 4.82 0.00 1.60 1.66 0.83 1.00 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 0.00 142 E 8.94 4.19 0.00 2.04 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 2.40 2.41 0.00 143 Y 8.53 4.52 0.00 3.05 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 0.00 144 N 7.62 4.71 0.00 2.86 2.82 0.00 0.00 6.09 7.55 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 0.00 145 Y 8.03 4.44 0.00 2.87 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 0.00 146 N 8.16 4.68 0.00 2.53 2.56 0.00 0.00 7.01 7.57 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 0.00 147 S 8.15 4.73 0.00 3.89 3.72 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 0.00 148 H 8.76 5.07 0.00 3.05 3.10 0.00 5.84 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 N 8.74 5.20 0.00 2.40 2.00 0.00 0.00 6.76 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 0.00 150 V 8.55 4.11 1.85 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 0.89 0.00 0.00 0.03 0.00 0.00 151 Y 8.78 4.88 0.00 3.17 2.92 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 0.00 152 I 8.84 5.06 1.75 0.00 0.00 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 1.34 1.45 0.87 0.00 0.00 153 M 9.11 5.29 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.62 0.00 154 A 8.64 4.24 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 0.00 155 D 8.99 4.68 0.00 2.60 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.35 3.98 0.00 1.83 1.79 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.48 7.81 157 Q 8.11 4.08 0.00 2.08 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.06 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 158 K 7.82 4.44 0.00 1.74 1.79 0.00 1.99 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.34 7.81 159 N 8.13 4.26 0.00 2.88 2.90 0.00 0.00 6.82 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 0.00 160 G 7.39 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 0.00 0.00 0.00 161 I 7.50 4.90 1.66 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 0.47 0.30 0.00 0.00 162 K 8.90 5.08 0.00 1.67 1.74 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.33 7.81 163 V 8.84 5.05 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 1.30 0.00 0.00 1.03 0.00 0.00 164 N 9.42 5.61 0.00 2.61 2.54 0.00 0.00 6.65 7.06 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 0.00 165 F 7.63 5.13 0.00 3.08 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 0.00 166 K 8.66 4.82 0.00 1.67 1.71 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.70 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.39 7.81 167 I 8.57 3.67 1.76 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 1.17 0.85 0.43 0.00 0.00 168 R 8.63 4.63 0.00 1.69 1.87 0.00 3.19 0.00 0.00 3.24 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 169 H 8.97 4.80 0.00 3.24 3.23 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 0.00 170 N 8.82 4.77 0.00 2.85 2.87 0.00 0.00 7.00 7.24 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 0.00 171 I 8.53 4.95 1.99 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 1.50 1.10 1.01 0.00 0.00 172 E 8.84 4.14 0.00 2.12 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 0.00 2.33 2.27 0.00 173 D 8.05 4.59 0.00 2.79 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 0.00 174 G 8.38 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 S 8.08 4.68 0.00 3.95 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 0.00 176 V 8.12 4.82 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 0.00 177 Q 9.40 4.59 0.00 2.24 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.72 0.00 0.00 0.00 0.00 0.00 2.44 2.64 0.00 178 L 8.58 4.87 0.00 1.66 1.55 0.92 0.67 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 0.00 179 A 8.89 4.60 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 D 8.96 4.68 0.00 2.75 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 H 8.71 4.91 0.00 1.81 2.39 0.00 5.81 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 8.83 4.63 0.00 3.06 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 0.00 183 Q 9.05 5.22 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 184 Q 9.36 5.06 0.00 2.14 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.53 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 185 N 8.95 5.72 0.00 2.21 2.58 0.00 0.00 6.62 6.63 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 0.00 186 T 8.96 5.08 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 1.29 0.00 0.00 187 P 0.00 4.88 0.00 2.14 2.02 0.00 3.85 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 188 I 8.70 4.09 2.14 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 1.23 0.59 0.98 0.00 0.00 189 G 8.05 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 D 8.37 4.68 0.00 2.79 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 G 7.85 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 0.00 0.00 0.00 192 P 0.00 4.41 0.00 2.17 2.06 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 193 V 7.92 4.45 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.02 0.00 0.00 194 L 8.33 4.24 0.00 1.65 1.65 0.87 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 195 L 8.38 4.82 0.00 1.63 1.60 0.94 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 196 P 0.00 4.68 0.00 2.36 2.25 0.00 3.72 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 197 D 8.64 4.67 0.00 2.74 2.74 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 0.00 198 N 8.58 4.81 0.00 2.69 2.89 0.00 0.00 6.77 8.16 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 0.00 199 H 8.65 4.92 0.00 3.33 3.34 0.00 5.21 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 8.21 5.27 0.00 2.66 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 L 8.65 4.88 0.00 1.46 1.47 0.88 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.14 5.13 0.00 3.95 3.72 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 0.00 203 T 9.01 5.29 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 1.10 0.00 0.00 204 Q 9.15 4.83 0.00 2.10 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 205 S 8.87 5.08 0.00 3.52 3.46 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 0.00 206 A 9.23 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 0.00 207 L 8.39 5.21 0.00 0.94 1.02 0.61 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 208 S 8.72 4.82 0.00 3.92 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 0.00 209 K 8.54 4.98 0.00 1.61 1.72 0.00 1.33 0.00 0.00 1.37 0.00 0.00 2.13 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.21 1.15 7.81 210 D 8.77 4.60 0.00 2.58 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 0.00 0.00 0.00 0.00 211 P 0.00 4.35 0.00 2.20 2.16 0.00 3.78 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 1.97 1.97 0.00 212 N 8.25 4.58 0.00 2.82 2.85 0.00 0.00 6.77 7.44 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 0.00 213 E 7.88 4.46 0.00 1.86 1.62 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 1.86 2.32 0.00 214 K 8.52 4.19 0.00 1.79 1.85 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.44 7.81 215 R 7.93 4.27 0.00 1.92 1.95 0.00 3.18 0.00 0.00 3.44 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 216 D 8.61 4.80 0.00 2.94 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 0.00 217 H 8.46 4.95 0.00 3.22 3.19 0.00 5.54 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 M 8.09 4.49 0.00 1.41 0.98 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 2.46 2.34 0.00 219 V 8.61 4.69 2.19 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 0.81 0.00 0.00 0.90 0.00 0.00 220 L 9.24 5.28 0.00 1.82 1.62 0.87 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 221 L 8.78 5.13 0.00 1.63 1.35 0.65 0.49 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 0.00 222 E 8.93 5.21 0.00 1.94 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 2.21 2.12 0.00 223 F 9.16 5.51 0.00 2.91 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 V 9.29 4.92 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 0.99 0.00 0.00 0.93 0.00 0.00 225 T 8.72 5.01 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 1.12 0.00 0.00 226 A 8.63 4.31 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 0.00 227 A 8.59 4.21 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 G 8.85 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 0.00 229 I 7.50 4.54 1.70 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.66 0.60 0.00 0.00 230 T 8.62 4.61 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 0.00 231 H 8.08 4.54 0.00 3.30 3.33 0.00 5.56 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.