NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4598 8.3349 115.2666 58.1756 63.5318 173.6564 3 F 4.4332 8.9773 125.8655 59.3931 39.7261 176.2557 4 I 3.8892 8.3646 121.6314 64.2457 38.3919 177.4137 5 K 3.3500 8.6724 122.1086 58.9804 31.9178 176.8236 6 P 4.2351 0.0000 0.0000 64.7986 31.6086 177.0329 7 I 4.5905 7.7982 110.5745 60.6491 37.9605 176.7751 8 Y 4.0253 8.2373 124.9251 61.4221 38.4282 177.8540 9 Q 3.6637 8.1008 118.3778 59.3050 28.8356 178.4415 10 D 4.3266 8.0874 118.7606 57.9538 40.8405 178.5900 11 I 2.4842 7.3022 119.1741 64.1945 37.0495 177.5803 12 N 3.9177 7.8060 117.4947 57.2632 38.5167 177.1439 13 S 4.0529 8.1112 115.2319 61.3573 62.9298 176.4064 14 I 3.9640 7.5493 115.0815 63.4779 37.8535 177.9713 15 L 4.2396 7.9755 120.9215 56.1725 41.4809 177.3987 16 I 3.9357 7.2707 120.1260 63.0988 37.1770 176.2720 17 G 3.9903 8.9167 117.5198 45.6433 0.0000 174.3385 18 Q 4.3193 7.9994 120.1391 55.9852 29.3084 181.0482 19 K 5.4761 8.3234 118.1895 55.7979 36.4357 176.0379 20 V 3.8740 8.7002 131.3983 62.6284 36.3528 172.7386 *36 P 4.2292 0.0000 0.0000 62.1681 32.7024 179.6523 *37 F 4.2216 8.2330 125.2176 53.6687 37.1438 170.0743 38 E 3.9785 8.3604 121.9835 55.5545 29.1837 175.2109 39 K 4.6445 8.2531 125.9294 53.0187 35.1063 174.1502 40 L 3.4255 8.9664 119.8929 58.0872 39.6989 178.1684 41 V 3.7749 9.3152 121.8516 64.0818 32.3459 172.0762 42 Y 4.2900 8.3780 121.8197 61.6795 38.3684 178.4913 43 K 3.7687 8.4050 123.5731 60.3799 31.4286 179.6663 44 F 4.1351 8.3298 120.7710 61.2907 39.2756 176.7934 45 L 4.0640 8.6532 118.3393 58.0231 41.6145 179.9443 46 K 3.5816 8.1953 118.1693 59.4436 31.8387 178.8629 47 E 4.1273 7.7675 115.2671 57.6296 29.4687 177.1517 48 N 4.7482 7.4827 114.6627 52.8873 41.5897 174.4657 49 L 4.7623 8.0604 118.2564 53.7560 42.6562 178.2681 50 S 4.2155 8.3378 117.1855 61.4688 63.1199 176.7745 51 D 4.6966 7.8594 115.3532 53.8611 39.4896 176.2241 52 L 4.8098 8.0996 120.2018 54.3247 44.3678 176.0348 53 T 5.0304 6.9584 114.0705 61.9198 70.3095 174.4064 54 F 5.0827 9.1160 123.1010 55.9376 44.1391 174.5515 55 K 4.4171 9.2509 122.5503 56.5841 32.9165 178.0679 56 Q 4.0079 8.8191 121.8829 59.6929 29.0774 178.3006 57 Y 4.2402 8.0481 118.2795 59.9429 38.0340 177.7074 58 E 3.7255 7.1248 120.7913 59.1644 29.8069 177.8665 59 Y 3.4566 8.1174 119.6022 60.2845 38.7139 178.2069 60 L 3.3538 7.9231 119.9208 57.5538 41.7706 178.9148 61 N 4.3206 8.0784 116.3661 56.5203 38.5855 176.4879 62 D 4.2268 8.1645 119.4650 57.4869 40.9758 177.9316 63 L 3.5067 6.7745 119.1692 58.3679 42.1622 178.8445 64 F 4.3444 7.2785 117.1611 60.5364 38.4598 177.6437 65 M 4.3665 8.2027 117.8742 58.4922 31.9135 178.2984 66 K 4.3090 7.8331 115.5139 57.1301 33.7921 176.8858 67 N 5.0741 8.1082 116.7414 51.2891 39.2666 173.8496 68 P 4.3753 0.0000 0.0000 65.1945 32.3615 178.4245 69 A 4.1241 8.1372 120.7926 54.8152 18.4408 178.0211 70 I 4.0939 7.4480 108.0221 60.7777 38.5718 175.2128 71 I 4.3774 7.8176 121.4940 61.1616 41.4324 174.8158 72 G 4.0938 8.5935 108.6144 46.2983 0.0000 174.6011 73 H 3.9424 8.7460 116.9932 58.1284 28.3390 177.7319 74 E 3.7556 7.3922 120.5971 58.8044 29.8343 178.2867 75 A 4.0987 7.6516 120.2842 55.3509 18.3029 179.7664 76 R 3.8809 7.7002 115.8775 59.1278 29.4152 178.8250 77 Y 4.9536 8.2913 116.9892 60.8848 37.8299 178.1331 78 K 4.2451 8.3194 119.5851 59.0071 31.9176 179.0907 79 L 4.0790 7.4398 117.4510 57.6542 41.4856 179.1526 80 F 4.1276 8.1047 117.3189 58.0860 39.3449 175.0067 81 N 4.1169 8.1344 114.4144 53.6049 36.6523 175.5217 82 S 4.5690 7.6590 106.5791 56.1792 65.6047 173.4417 83 P 4.1856 0.0000 0.0000 66.0659 31.0352 178.8058 84 T 3.7896 8.2082 114.1945 66.7064 68.4868 176.8306 85 L 3.5200 7.4218 120.3489 57.4759 41.4050 179.3178 86 L 2.7887 8.1487 120.4994 57.7999 41.7070 178.8683 87 F 4.0391 7.7392 119.3054 61.1978 39.3551 176.7139 88 L 3.6786 7.4915 117.5530 56.7374 41.6104 178.3690 89 L 4.4359 7.6435 117.5307 54.6778 43.1251 177.5257 90 S 4.2435 6.4782 112.9667 57.7189 63.5890 174.3455 91 R 4.0977 8.2256 121.9747 55.0813 30.9983 176.6064 92 G 3.9744 8.3679 105.9070 44.6424 0.0000 174.7810 93 K 3.9018 8.8517 120.1617 58.7483 32.0382 179.4800 94 A 3.9728 8.0052 120.1368 55.3508 18.2001 179.4491 95 A 4.2464 8.0701 117.2485 55.4494 18.7886 179.6961 96 T 4.4843 8.2700 114.5153 66.9530 68.4247 176.1888 97 E 3.9181 8.4026 120.1422 59.6871 29.7674 178.3116 98 N 4.5714 8.6754 113.0497 52.9815 39.2123 175.4565 99 W 4.1484 7.4329 131.1946 57.7830 31.5462 174.7932 100 S 4.0919 6.7332 117.6194 56.2866 65.0106 175.0548 101 I 3.4015 7.6572 117.6679 62.8276 37.3024 176.2950 102 E 4.3688 7.5974 119.5112 55.7828 30.2398 175.5073 103 N 4.7759 7.6599 115.9021 52.3508 38.9639 173.3520 104 L 4.1894 7.2553 120.3437 53.5885 43.3369 177.2902 105 F 4.8944 9.1154 119.5886 57.7613 39.4417 174.6667 106 E 4.2857 8.3682 121.1222 53.5538 33.1502 175.3674 107 E 3.5685 7.5405 122.6807 57.1696 29.9871 176.6685 108 K 4.5993 8.5118 126.5577 52.2541 34.9099 174.1916 109 Q 4.0268 8.9485 122.6661 58.4508 28.2966 177.7048 110 N 4.4477 7.9612 114.6112 54.8294 39.7673 174.6710 111 D 4.4341 8.1200 119.1264 54.9675 41.5722 177.3841 112 T 3.6897 8.6064 119.6787 65.9647 68.6382 174.4311 113 A 4.9763 6.9611 119.2990 50.2632 21.9340 175.7247 114 D 4.6333 9.0339 121.4607 56.9932 41.6322 177.3170 115 I 4.9984 8.4176 118.4873 59.3893 42.0272 174.0004 116 L 5.1995 9.6411 128.5467 53.2788 44.8335 174.7690 117 L 5.5735 9.1374 126.7420 53.0649 44.3876 175.8140 118 V 5.1723 8.8209 123.1385 58.6218 34.6013 174.7697 119 K 4.3829 8.2018 124.3993 55.9802 35.4601 175.1896 120 D 4.5844 9.4053 123.9393 56.7885 38.6939 173.2152 121 Q 3.3323 8.0131 112.4145 57.3047 28.1435 172.5030 122 F 5.2744 8.1778 117.7698 56.6495 43.8459 173.1934 123 Y 5.0905 7.9017 122.0058 56.1212 40.9368 174.0676 124 E 4.9123 9.9555 126.3840 54.5310 31.8456 174.5479 125 L 4.6298 8.9002 128.5972 53.8507 43.3051 175.5901 126 L 4.9557 9.2075 126.8974 53.3917 44.5663 174.7113 127 D 5.0890 8.2937 126.4881 52.9341 43.3279 176.0048 128 V 4.7630 8.7113 122.9433 61.3582 32.6497 175.0405 129 K 4.6014 8.9680 128.8970 55.9624 33.4268 176.6302 130 T 5.2073 8.4873 114.1054 60.5991 71.8159 174.1941 131 R 4.3457 8.6419 122.4920 55.3454 33.4328 173.5619 132 N 3.2783 8.4595 126.5088 52.6981 38.9917 174.7826 133 I 3.9203 7.5796 119.0955 61.8081 37.7928 177.5779 134 S 4.1005 8.2659 120.3030 61.7206 62.7422 174.9892 135 K 4.2725 7.2351 117.4568 55.3731 32.7558 176.2249 136 S 4.2657 8.2680 114.4270 57.3708 62.9172 173.4644 137 A 4.0325 8.4773 130.5672 52.3652 18.4990 176.6615 138 F 4.8204 8.7371 124.3528 55.9520 41.4297 173.9412 139 A 3.9073 8.9837 130.8990 51.6349 18.6399 175.0646 140 P 4.3883 0.0000 0.0000 61.8085 33.4409 175.3776 141 N 3.9792 8.5787 118.4775 54.7579 38.4103 173.8666 142 I 3.8865 8.5229 124.6670 61.9342 38.8273 175.4614 143 I 4.4697 6.7694 118.1531 58.1846 41.1682 173.8400 144 S 4.5145 8.5959 119.4807 58.2715 63.1880 175.1364 145 A 4.4843 9.1217 133.3171 54.4389 18.1315 178.7194 146 Y 4.0745 8.0286 118.0077 60.2640 39.1358 177.1167 147 K 3.8715 8.4910 121.0857 59.5369 32.2896 178.5124 148 L 3.9163 8.4464 120.7038 57.8368 41.9213 178.8341 149 A 4.0440 7.4925 120.5401 55.3570 18.2460 179.6357 150 Q 3.7020 7.7135 116.4791 59.1168 28.5518 179.3082 151 T 3.8769 7.8997 116.7761 67.0160 68.5697 176.5617 152 C 4.3071 8.3398 118.3717 62.5656 28.1062 175.9957 153 A 4.0054 8.0888 122.5049 55.1144 17.9881 179.8935 154 K 3.8062 8.0835 116.9469 59.8519 32.1291 179.2188 155 M 3.8390 8.3427 119.3703 58.6505 31.8746 179.0688 156 I 3.7812 7.7654 119.4049 64.6794 37.2672 178.1455 157 D 4.4681 7.9784 118.2064 56.5921 40.6336 177.3217 158 N 4.7624 7.7050 113.6717 51.7995 39.0622 174.4619 159 K 3.1136 7.3154 116.2034 57.1805 30.3575 176.0858 160 E 4.1931 7.2299 119.0061 55.1667 27.8606 176.3945 161 F 4.9360 7.9595 117.1977 57.2865 40.1888 175.7214 162 D 5.0216 7.7215 120.4838 54.2697 42.1398 175.4503 163 L 4.8700 8.1585 121.2345 56.2232 44.8750 175.9036 164 F 4.6338 7.3051 110.1954 55.4405 40.8900 173.1521 165 D 5.3382 9.1608 120.0821 52.7951 44.8202 175.3266 166 I 4.7373 7.8901 120.0794 59.8746 40.1673 174.4631 167 N 5.2892 9.3580 124.6416 51.4088 42.8177 173.3048 168 Y 5.1885 8.6860 117.6492 56.1819 42.6557 174.5083 169 L 5.3253 9.1079 124.1207 53.5209 45.3554 174.5271 170 E 5.1242 9.4816 128.7300 54.8034 31.8277 174.5672 171 V 4.5690 9.0635 128.1874 61.5635 33.3286 174.0550 172 D 5.3476 9.3937 129.7803 53.1970 42.6121 175.9857 173 W 5.9925 8.4499 119.4718 54.0880 32.6862 173.3531 174 E 4.9200 8.8800 118.1401 55.1591 32.5580 173.4976 175 L 4.6660 8.1080 129.3821 54.3715 43.0904 175.9811 176 N 4.8920 9.0041 124.0656 51.8195 41.2291 177.0775 177 G 3.9427 8.9634 119.1156 47.3835 0.0000 174.2933 178 E 4.2527 9.4823 119.0321 56.9549 30.7334 177.4678 179 D 5.0809 7.9145 117.3163 51.7208 42.3795 175.6805 180 L 5.0799 8.1912 121.3442 53.4791 43.7800 175.5217 181 V 5.5947 8.9500 124.1058 58.8798 34.0216 174.8977 182 C 4.8641 8.8228 125.5571 59.8150 32.6128 173.7701 183 V 4.6257 9.6113 116.6828 60.0374 34.3029 175.0896 184 S 5.0674 7.5440 117.7456 58.8647 64.8136 175.7092 185 T 5.8459 8.1624 109.4154 60.5580 72.0999 172.7650 186 S 4.9079 8.6161 116.0948 57.2824 67.8755 172.9826 187 F 5.4001 8.4078 122.9786 56.7831 42.1552 173.3667 188 A 4.5656 8.4216 126.2222 50.2288 23.5408 174.1756 189 E 5.0569 8.9788 118.8281 53.5905 31.5413 177.1343 190 L 3.7764 8.5364 127.5472 58.2893 42.1639 178.3903 191 F 3.3698 7.2028 113.1327 57.5599 38.8612 175.8672 192 K 4.6643 8.0155 120.5206 56.1868 32.6868 176.2663 193 S 5.4231 7.7652 113.2900 55.8465 64.5671 173.6582 194 E 4.0320 8.9712 122.7343 56.1089 29.5275 175.3897 195 P 3.9281 0.0000 0.0000 65.6818 31.2570 178.7063 196 S 3.6413 7.7129 108.6589 59.5262 62.8357 174.3400 197 E 4.3035 8.0733 120.6787 57.2537 29.8951 176.5858 198 L 4.1793 7.7623 120.4518 54.7192 42.1976 175.7617 199 Y 4.4489 8.8220 125.3781 57.0352 39.9174 174.3294 200 I 4.1733 7.8626 129.0309 59.8919 37.6449 175.5305 201 N 4.2469 8.5135 128.1790 52.1418 38.3597 175.1154 202 W 4.1000 8.8466 126.6413 59.7517 29.5677 178.7955 203 A 4.0937 8.4140 119.1136 55.2126 18.6418 178.1016 204 A 4.2417 8.1971 119.8935 51.5973 17.2516 177.2234 205 A 3.5855 8.0683 117.0093 53.2506 16.8291 177.5469 206 M 3.0197 8.2341 115.8491 57.8919 30.6054 176.9370 207 Q 4.7546 7.6326 115.9387 54.9868 30.9544 175.7923 208 I 4.4104 8.6070 123.9639 61.4951 38.4824 175.0819 209 Q 4.9800 9.0336 125.1841 52.9984 31.4932 174.7393 210 F 4.8811 7.6896 116.8302 56.3530 40.8924 173.3683 211 H 4.7054 8.7777 116.9731 55.0025 30.0668 176.6807 212 V 3.6508 9.1503 126.2597 66.9855 31.4563 179.1998 213 R 4.2068 8.3720 115.9525 59.0864 29.0616 178.5737 214 D 4.6624 7.7120 113.8603 54.5665 41.3905 176.3418 215 L 3.7346 7.9763 123.1855 54.0960 42.4642 175.8799 216 D 4.4083 8.6150 125.0734 55.4917 41.3771 176.5298 217 Q 5.0239 8.5395 124.2010 56.0133 30.1206 175.8222 218 G 4.0149 9.2748 105.5763 45.1579 0.0000 174.7167 219 F 4.3628 8.3925 123.1186 58.0628 39.7739 174.6173 220 N 4.7685 7.2937 122.0056 52.0017 38.8032 175.2888 221 G 3.5657 5.7182 107.3458 45.2752 0.0000 173.3581 222 T 4.4031 9.1240 110.8567 60.4717 71.4937 175.5026 223 R 3.8151 8.3731 120.6485 59.5737 29.9377 177.8429 224 E 3.1217 7.5668 118.3467 59.0480 29.3994 178.4286 225 E 3.9754 8.2394 118.5389 59.1494 29.4865 178.9267 226 W 3.7060 8.6817 128.3922 60.4542 30.6083 177.8193 227 A 4.4497 8.5186 122.8739 55.9749 18.0227 180.4396 228 K 4.0278 8.3539 122.3773 59.8993 31.7613 181.0827 229 S 4.2395 8.8190 114.9594 61.2707 61.7866 175.5547 230 Y 3.6541 8.3287 122.8453 60.7539 38.5506 178.1087 231 L 4.1038 8.2905 119.8711 57.7139 41.7744 179.5981 232 K 3.9690 7.8559 119.2256 59.4978 32.0572 178.3117 233 H 4.0624 8.0075 118.5688 59.1948 29.6886 176.7788 234 F 3.9250 8.0590 122.6343 61.4288 39.3465 176.9934 235 V 3.5616 7.9820 117.6515 66.5070 31.2892 178.1677 236 T 3.8338 7.7280 114.7413 66.8237 68.3559 176.8564 237 Q 4.0558 8.3663 119.8866 58.4086 28.6171 178.5897 238 A 2.9811 8.0297 122.5076 54.7275 18.3778 179.4141 239 E 3.7121 7.7593 116.7208 59.5644 29.5296 179.3251 240 Q 3.8631 7.7516 119.2834 59.2438 29.0951 178.4761 241 R 3.6963 7.8810 120.6969 58.4260 29.7081 177.9673 242 A 3.8201 7.4407 119.8201 55.4447 18.6431 179.4057 243 I 3.7466 7.6558 117.9638 64.5277 36.7057 178.9312 244 S 4.0883 8.3703 115.3201 61.5977 62.4968 176.3494 245 M 3.9675 8.0431 122.4216 58.2746 31.6327 178.7141 246 I 3.7224 7.6581 119.9674 64.5439 37.0749 178.2338 247 D 4.3835 7.9389 120.4531 57.6727 40.8685 179.1884 248 K 3.9254 7.8031 123.5728 58.7190 31.7840 180.4728 249 F 5.5898 8.1039 115.4486 57.3293 40.7327 175.8298 250 V 4.4365 7.8381 117.9964 64.7918 33.0958 177.5774 251 K 3.9215 8.3586 122.7490 59.6436 31.5431 179.3558 252 P 4.3722 0.0000 0.0000 64.0527 31.4702 176.8066 253 F 5.3262 8.1957 114.6626 56.9788 41.2584 177.1859 254 K 3.9812 8.0738 121.3195 59.4194 31.8989 178.7862 255 K 3.9092 8.0132 115.3420 58.7369 32.2452 176.5381 256 Y 4.6079 7.8960 116.1844 58.0683 39.0864 175.7614 257 I 4.1574 8.0651 125.9679 61.3312 37.5639 175.2127 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 4.46 0.00 4.10 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 3 F 8.98 4.43 0.00 3.25 3.04 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 4 I 8.36 3.89 1.70 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.29 0.73 0.00 0.00 5 K 8.67 3.35 0.00 1.69 1.78 0.00 1.43 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.47 7.81 6 P 0.00 4.24 0.00 2.10 2.13 0.00 3.69 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 7 I 7.80 4.59 1.98 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 1.35 0.82 0.96 0.00 0.00 8 Y 8.24 4.03 0.00 2.82 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 9 Q 8.10 3.66 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.60 0.00 0.00 0.00 0.00 0.00 2.46 2.05 0.00 10 D 8.09 4.33 0.00 3.05 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.30 2.48 1.72 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 0.52 0.17 0.68 0.00 0.00 12 N 7.81 3.92 0.00 1.92 2.59 0.00 0.00 7.36 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.11 4.05 0.00 3.94 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 14 I 7.55 3.96 1.96 0.00 0.00 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 1.20 0.31 1.14 0.00 0.00 15 L 7.98 4.24 0.00 1.64 1.74 0.91 0.69 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 16 I 7.27 3.94 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.65 0.92 0.00 0.00 17 G 8.92 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 8.00 4.32 0.00 1.77 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.57 0.00 0.00 0.00 0.00 0.00 2.29 2.22 0.00 19 K 8.32 5.48 0.00 1.84 1.70 0.00 1.92 0.00 0.00 2.41 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 0.81 7.81 20 V 8.70 3.87 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 0.52 0.00 0.00 0.86 0.00 0.00 *36 P 0.00 4.23 0.00 2.14 1.94 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.59 0.00 *37 F 8.23 4.22 0.00 2.27 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 0.00 0.00 0.00 38 E 8.36 3.98 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.90 0.00 39 K 8.25 4.64 0.00 1.86 1.76 0.00 1.73 0.00 0.00 1.82 0.00 0.00 3.10 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.39 7.81 40 L 8.97 3.43 0.00 1.89 1.64 1.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 41 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 50 S 8.34 4.22 0.00 3.75 3.81 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 51 D 7.86 4.70 0.00 2.74 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.10 4.81 0.00 1.48 1.45 0.64 0.57 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 53 T 6.96 5.03 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 1.07 0.00 0.00 54 F 9.12 5.08 0.00 2.99 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 55 K 9.25 4.42 0.00 1.70 1.30 0.00 0.77 0.00 0.00 0.61 0.00 0.00 2.22 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.63 1.40 7.81 56 Q 8.82 4.01 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 57 Y 8.05 4.24 0.00 3.36 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 7.12 3.73 0.00 1.43 1.80 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 2.78 2.45 0.00 59 Y 8.12 3.46 0.00 2.80 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 60 L 7.92 3.35 0.00 2.07 1.60 0.67 0.72 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 61 N 8.08 4.32 0.00 3.03 3.11 0.00 0.00 6.70 8.08 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 62 D 8.16 4.23 0.00 2.67 2.27 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 63 L 6.77 3.51 0.00 0.72 0.93 0.60 -0.26 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 64 F 7.28 4.34 0.00 1.51 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 M 8.20 4.37 0.00 2.05 2.34 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 3.22 2.95 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 2.25 2.38 0.00 75 A 7.65 4.10 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 76 R 7.70 3.88 0.00 1.58 1.18 0.00 2.21 0.00 0.00 2.25 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.60 0.00 77 Y 8.29 4.95 0.00 3.25 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 78 K 8.32 4.25 0.00 2.02 1.91 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.75 7.81 79 L 7.44 4.08 0.00 1.71 1.64 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.10 4.13 0.00 3.08 3.04 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 81 N 8.13 4.12 0.00 2.91 2.92 0.00 0.00 6.82 7.56 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 82 S 7.66 4.57 0.00 3.81 3.63 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 83 P 0.00 4.19 0.00 2.11 2.03 0.00 3.80 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.16 0.00 84 T 8.21 3.79 4.23 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 1.25 0.00 0.00 85 L 7.42 3.52 0.00 1.48 1.47 -0.01 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 86 L 8.15 2.79 0.00 1.43 1.57 -0.22 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 87 F 7.74 4.04 0.00 2.86 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 88 L 7.49 3.68 0.00 1.23 1.34 0.15 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 89 L 7.64 4.44 0.00 1.58 1.74 0.67 0.73 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 90 S 6.48 4.24 0.00 3.54 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 91 R 8.23 4.10 0.00 1.72 1.84 0.00 3.19 0.00 0.00 3.04 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.50 0.00 92 G 8.37 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 93 K 8.85 3.90 0.00 1.71 1.37 0.00 1.97 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.50 7.81 94 A 8.01 3.97 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 95 A 8.07 4.25 1.56 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 96 T 8.27 4.48 4.47 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 1.23 0.00 0.00 97 E 8.40 3.92 0.00 2.04 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 98 N 8.68 4.57 0.00 2.82 2.87 0.00 0.00 7.05 7.82 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 99 W 7.43 4.15 0.00 3.18 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 0.00 100 S 6.73 4.09 0.00 3.56 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 0.00 101 I 7.66 3.40 1.79 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.56 0.88 0.00 0.00 102 E 7.60 4.37 0.00 1.76 1.80 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 2.11 2.23 0.00 103 N 7.66 4.78 0.00 2.48 2.36 0.00 0.00 7.22 6.60 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 0.00 104 L 7.26 4.19 0.00 1.71 1.86 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 105 F 9.12 4.89 0.00 3.48 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 0.00 106 E 8.37 4.29 0.00 1.79 1.58 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 2.16 2.27 0.00 107 E 7.54 3.57 0.00 1.52 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 108 K 8.51 4.60 0.00 1.67 1.62 0.00 1.87 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.32 0.95 7.81 109 Q 8.95 4.03 0.00 2.13 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.04 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 110 N 7.96 4.45 0.00 2.65 2.83 0.00 0.00 6.98 8.47 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 0.00 111 D 8.12 4.43 0.00 2.83 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 0.00 112 T 8.61 3.69 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 1.07 0.00 0.00 113 A 6.96 4.98 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 0.00 114 D 9.03 4.63 0.00 2.82 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 I 8.42 5.00 2.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.79 1.18 0.00 0.00 116 L 9.64 5.20 0.00 1.67 1.67 0.97 -0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 117 L 9.14 5.57 0.00 1.94 1.59 1.08 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.82 5.17 1.42 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 0.90 0.00 0.00 0.29 0.00 0.00 119 K 8.20 4.38 0.00 1.09 1.01 0.00 1.98 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.40 1.02 7.81 120 D 9.41 4.58 0.00 2.91 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 0.00 121 Q 8.01 3.33 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.74 0.00 0.00 0.00 0.00 0.00 2.56 2.49 0.00 122 F 8.18 5.27 0.00 3.33 3.23 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 0.00 123 Y 7.90 5.09 0.00 2.81 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 0.00 124 E 9.96 4.91 0.00 2.31 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 0.00 2.36 2.41 0.00 125 L 8.90 4.63 0.00 1.76 1.48 0.92 0.22 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 0.00 126 L 9.21 4.96 0.00 1.77 1.71 1.13 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 127 D 8.29 5.09 0.00 2.61 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 8.71 4.76 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 0.91 0.00 0.00 1.03 0.00 0.00 129 K 8.97 4.60 0.00 1.83 1.76 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.59 1.52 7.81 130 T 8.49 5.21 4.64 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 1.39 0.00 0.00 131 R 8.64 4.35 0.00 1.95 1.91 0.00 3.02 0.00 0.00 3.26 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.49 0.00 132 N 8.46 3.28 0.00 1.86 2.34 0.00 0.00 6.94 7.82 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 0.00 133 I 7.58 3.92 1.76 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.60 0.83 0.00 0.00 134 S 8.27 4.10 0.00 3.84 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 0.00 135 K 7.24 4.27 0.00 2.09 1.76 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.47 1.24 7.81 136 S 8.27 4.27 0.00 3.80 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 0.00 137 A 8.48 4.03 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 0.00 138 F 8.74 4.82 0.00 2.92 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 0.00 139 A 8.98 3.91 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 0.00 140 P 0.00 4.39 0.00 2.06 2.09 0.00 3.37 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.06 0.00 141 N 8.58 3.98 0.00 2.53 2.97 0.00 0.00 6.88 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 0.00 142 I 8.52 3.89 1.44 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 -0.36 0.14 0.00 0.00 143 I 6.77 4.47 1.93 0.00 0.00 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 1.29 1.42 0.92 0.00 0.00 144 S 8.60 4.51 0.00 3.96 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 0.00 145 A 9.12 4.48 1.43 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 0.00 0.00 146 Y 8.03 4.07 0.00 3.27 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 0.00 147 K 8.49 3.87 0.00 1.83 1.88 0.00 1.59 0.00 0.00 1.33 0.00 0.00 2.57 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.35 7.81 148 L 8.45 3.92 0.00 1.75 1.44 0.96 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 149 A 7.49 4.04 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 7.71 3.70 0.00 1.90 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.75 0.00 0.00 0.00 0.00 0.00 1.94 1.84 0.00 151 T 7.90 3.88 4.52 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 1.46 0.00 0.00 152 C 8.34 4.31 0.00 3.14 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 0.00 153 A 8.09 4.01 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 K 8.08 3.81 0.00 1.84 1.75 0.00 1.30 0.00 0.00 1.41 0.00 0.00 2.13 0.00 0.00 2.29 0.00 0.00 0.00 0.00 1.25 1.34 7.81 155 M 8.34 3.84 0.00 1.95 2.34 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 2.87 2.74 0.00 156 I 7.77 3.78 2.07 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.14 1.05 0.00 0.00 157 D 7.98 4.47 0.00 2.59 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 0.00 158 N 7.70 4.76 0.00 2.71 2.71 0.00 0.00 7.26 7.14 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 0.00 159 K 7.32 3.11 0.00 1.75 1.75 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.47 1.37 7.81 160 E 7.23 4.19 0.00 1.89 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.16 0.00 161 F 7.96 4.94 0.00 3.03 2.90 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 0.00 162 D 7.72 5.02 0.00 2.67 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 0.00 163 L 8.16 4.87 0.00 1.74 1.76 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 164 F 7.31 4.63 0.00 2.98 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 0.00 165 D 9.16 5.34 0.00 2.78 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 0.00 166 I 7.89 4.74 1.43 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.22 0.68 0.00 0.00 167 N 9.36 5.29 0.00 2.56 2.40 0.00 0.00 6.37 7.11 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 0.00 168 Y 8.69 5.19 0.00 2.82 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 0.00 169 L 9.11 5.33 0.00 2.03 1.67 1.29 0.82 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 0.00 170 E 9.48 5.12 0.00 2.16 1.91 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 2.32 2.34 0.00 171 V 9.06 4.57 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 1.05 0.00 0.00 1.04 0.00 0.00 172 D 9.39 5.35 0.00 2.73 2.54 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 0.00 173 W 8.45 5.99 0.00 3.50 3.19 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 0.00 174 E 8.88 4.92 0.00 2.02 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 2.36 2.33 0.00 175 L 8.11 4.67 0.00 1.97 1.71 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 176 N 9.00 4.89 0.00 2.93 2.75 0.00 0.00 6.46 8.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 G 8.96 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 0.00 178 E 9.48 4.25 0.00 2.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.86 0.00 179 D 7.91 5.08 0.00 2.81 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 0.00 180 L 8.19 5.08 0.00 1.44 1.38 0.76 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 181 V 8.95 5.59 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 1.05 0.00 0.00 182 C 8.82 4.86 0.00 3.13 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 0.00 183 V 9.61 4.63 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 0.88 0.00 0.00 0.95 0.00 0.00 184 S 7.54 5.07 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 0.00 185 T 8.16 5.85 4.50 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 1.27 0.00 0.00 186 S 8.62 4.91 0.00 3.83 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 0.00 187 F 8.41 5.40 0.00 2.71 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 0.00 0.00 0.00 0.00 188 A 8.42 4.57 1.04 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 0.00 189 E 8.98 5.06 0.00 1.80 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 2.38 1.96 0.00 190 L 8.54 3.78 0.00 1.78 1.02 1.07 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 0.00 191 F 7.20 3.37 0.00 2.75 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 0.00 192 K 8.02 4.66 0.00 1.99 1.90 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.39 7.81 193 S 7.77 5.42 0.00 4.00 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 0.00 194 E 8.97 4.03 0.00 2.24 1.93 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 2.40 2.37 0.00 195 P 0.00 3.93 0.00 1.72 1.15 0.00 3.35 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.44 0.00 196 S 7.71 3.64 0.00 3.86 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 0.00 197 E 8.07 4.30 0.00 2.14 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 0.00 2.29 2.58 0.00 198 L 7.76 4.18 0.00 1.89 1.84 1.26 1.19 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 0.00 199 Y 8.82 4.45 0.00 3.15 3.15 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 0.00 200 I 7.86 4.17 1.47 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.63 -0.40 0.00 0.00 201 N 8.51 4.25 0.00 2.87 2.73 0.00 0.00 7.22 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 0.00 202 W 8.85 4.10 0.00 3.52 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 0.00 203 A 8.41 4.09 1.43 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 0.00 0.00 204 A 8.20 4.24 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 0.00 205 A 8.07 3.59 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 0.00 206 M 8.23 3.02 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.78 0.00 207 Q 7.63 4.75 0.00 2.03 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.58 7.01 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 208 I 8.61 4.41 1.80 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 1.33 1.05 1.10 0.00 0.00 209 Q 9.03 4.98 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.64 0.00 0.00 0.00 0.00 0.00 2.31 2.07 0.00 210 F 7.69 4.88 0.00 2.90 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 H 8.78 4.71 0.00 3.44 3.49 0.00 5.63 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 9.15 3.65 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.14 0.00 0.00 213 R 8.37 4.21 0.00 1.87 1.87 0.00 3.31 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.25 0.00 214 D 7.71 4.66 0.00 2.90 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 0.00 215 L 7.98 3.73 0.00 0.88 1.36 0.23 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 216 D 8.61 4.41 0.00 2.69 2.54 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 0.00 217 Q 8.54 5.02 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 2.42 2.21 0.00 218 G 9.27 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 0.00 219 F 8.39 4.36 0.00 3.16 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 N 7.29 4.77 0.00 2.66 2.72 0.00 0.00 6.10 7.00 0.00 0.00 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 G 5.72 3.57 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 0.00 0.00 0.00 222 T 9.12 4.40 4.18 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 1.20 0.00 0.00 223 R 8.37 3.82 0.00 1.88 1.95 0.00 2.21 0.00 0.00 2.78 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 224 E 7.57 3.12 0.00 1.16 1.41 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 2.12 1.75 0.00 225 E 8.24 3.98 0.00 2.51 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 0.00 2.35 2.31 0.00 226 W 8.68 3.71 0.00 3.32 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 0.00 227 A 8.52 4.45 1.60 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 0.00 228 K 8.35 4.03 0.00 1.78 1.83 0.00 1.82 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.32 7.81 229 S 8.82 4.24 0.00 3.86 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 0.00 230 Y 8.33 3.65 0.00 2.27 3.05 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 0.00 231 L 8.29 4.10 0.00 1.93 1.80 1.06 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 232 K 7.86 3.97 0.00 1.85 1.95 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.44 7.81 233 H 8.01 4.06 0.00 3.11 3.13 0.00 5.85 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 0.00 234 F 8.06 3.93 0.00 2.51 3.05 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 0.00 235 V 7.98 3.56 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 0.98 0.00 0.00 1.12 0.00 0.00 236 T 7.73 3.83 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 1.19 0.00 0.00 237 Q 8.37 4.06 0.00 2.09 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 238 A 8.03 2.98 0.97 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 0.00 239 E 7.76 3.71 0.00 2.13 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 2.25 2.34 0.00 240 Q 7.75 3.86 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 241 R 7.88 3.70 0.00 1.11 0.92 0.00 3.15 0.00 0.00 3.22 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.15 0.00 242 A 7.44 3.82 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 0.00 243 I 7.66 3.75 1.91 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.55 0.85 0.00 0.00 244 S 8.37 4.09 0.00 3.91 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 0.00 245 M 8.04 3.97 0.00 2.26 2.39 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.82 0.00 246 I 7.66 3.72 1.94 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 1.49 1.18 0.90 0.00 0.00 247 D 7.94 4.38 0.00 2.52 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 0.00 248 K 7.80 3.93 0.00 1.85 1.72 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.35 7.81 249 F 8.10 5.59 0.00 3.13 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 0.00 250 V 7.84 4.44 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.08 0.00 0.00 251 K 8.36 3.92 0.00 1.82 1.82 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.37 7.81 252 P 0.00 4.37 0.00 1.06 1.72 0.00 3.56 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 253 F 8.20 5.33 0.00 3.27 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 0.00 254 K 8.07 3.98 0.00 1.95 1.90 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.67 7.81 255 K 8.01 3.91 0.00 1.52 1.76 0.00 1.34 0.00 0.00 1.49 0.00 0.00 2.18 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.18 0.56 7.81 256 Y 7.90 4.61 0.00 3.16 3.04 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 0.00 257 I 8.07 4.16 1.94 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.94 0.95 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.