NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.2866 8.3349 115.2545 58.1967 63.4364 173.6201 3 F 4.5359 8.7841 125.9604 56.9815 39.6709 175.6755 4 I 4.3723 7.8934 114.9730 62.0835 39.3467 177.9625 5 K 3.5833 7.7287 125.8731 59.6855 31.2445 182.0623 6 P 4.5859 0.0000 0.0000 64.5530 31.4885 176.9950 7 I 4.5661 7.5486 108.6330 60.3395 38.1424 176.4788 8 Y 4.2041 8.4824 125.3122 61.6002 38.1560 178.3898 9 Q 3.6649 7.9375 118.2954 58.9781 28.8832 178.2838 10 D 4.2243 7.9750 119.3166 57.2663 40.8710 178.7325 11 I 2.6943 7.5566 120.1868 64.3683 37.1433 177.3338 12 N 3.9117 8.5891 118.3999 57.2288 38.3076 176.5622 13 S 4.0418 8.6413 117.1889 61.7928 63.1862 176.5621 14 I 3.7833 7.7483 120.9967 64.5705 37.1260 178.1704 15 L 4.2054 8.1012 119.6107 56.7497 41.4431 177.8044 16 I 4.0050 7.0393 118.9043 63.1981 37.5677 174.5901 17 G 4.3485 9.3519 117.5573 46.2021 0.0000 174.1966 18 Q 4.1720 8.3225 122.1182 56.7734 29.8610 177.2970 19 K 5.3092 8.6092 124.0712 53.6851 35.9269 175.1316 20 V 4.4316 8.3487 112.8299 59.5587 36.2824 177.4624 21 K 4.4277 8.1930 120.0343 58.4227 32.4797 175.6402 22 R 4.2969 8.3144 113.9306 55.2481 33.1904 171.9878 23 P 3.5335 0.0000 0.0000 67.1937 31.1638 177.0776 *33 A 4.4314 8.6980 124.7433 52.5423 21.1586 179.4985 34 G 3.5701 8.0831 105.0411 45.9739 0.0000 175.9861 35 E 4.0417 8.6067 121.6183 60.7218 29.2024 179.9007 36 P 4.5884 0.0000 0.0000 63.9816 31.2767 178.3654 37 F 4.1218 8.3558 118.2852 60.2924 38.6952 176.9713 38 E 4.1598 8.8247 121.9219 59.6359 29.3893 179.3764 39 K 4.0206 7.6893 122.6416 60.0709 31.6097 181.4152 40 L 4.2649 7.9701 119.7955 57.5003 41.5362 179.3905 41 V 3.9331 7.7583 117.7865 66.3617 31.3861 177.1938 42 Y 4.3093 8.6481 121.7963 61.4114 38.4144 178.9166 43 K 3.7700 8.4939 123.2299 59.7327 32.0464 180.2360 44 F 4.3757 9.0597 123.2582 61.1034 39.3409 177.0759 45 L 3.8984 8.8478 119.2457 57.8083 41.2364 179.4746 46 K 3.6582 8.1376 118.8203 58.9205 32.0333 177.6997 47 E 4.2151 7.7719 116.8124 56.7307 29.8779 176.2519 48 N 4.8702 7.2022 112.7433 52.5181 41.2739 174.2723 49 L 4.7012 8.2831 121.7434 56.8155 43.4286 180.4659 50 S 3.8397 7.7582 116.7635 61.2634 62.6520 177.6328 51 D 4.6651 7.7449 117.8062 54.0936 40.9027 176.6227 52 L 4.8250 8.1200 119.2698 53.5977 44.6909 176.0082 53 T 4.9101 7.3154 115.6926 62.1754 69.4706 174.3403 54 F 5.2390 9.3763 124.9480 55.3229 43.8621 175.0435 55 K 4.1563 9.1084 121.9698 56.3743 32.7504 178.1129 56 Q 4.0156 8.5270 121.9259 59.3382 28.8490 178.3265 57 Y 4.1347 7.6972 118.5466 60.1365 38.4652 177.2798 58 E 3.9167 7.0309 120.8605 59.0298 29.4943 178.2564 59 Y 3.6217 7.9157 119.4674 60.3550 38.9357 177.3299 60 L 3.3690 7.7467 119.7209 57.8757 41.7577 178.8513 61 N 4.2528 8.4097 116.3332 56.9598 38.5867 176.8923 62 D 4.3182 7.8242 119.0769 57.4501 40.7398 178.8624 63 L 3.6303 7.0118 119.3518 58.0680 42.2747 178.7368 64 F 4.3121 7.9539 117.8992 60.2823 38.4038 177.7815 65 M 4.4448 8.3665 118.3047 58.3530 31.8416 178.6306 66 K 4.1847 8.0822 117.4928 58.0973 33.6954 176.9345 67 N 5.0892 7.6979 114.8066 50.6532 38.9612 173.4458 68 P 4.3664 0.0000 0.0000 65.6984 31.9897 178.4359 69 A 4.0437 7.9874 121.0157 54.6940 18.5858 177.3648 70 I 3.6799 7.5155 117.0709 61.8991 36.9218 175.4308 71 I 4.5263 7.6859 125.0404 60.0917 41.3124 174.4264 72 G 4.1680 8.5102 110.4392 44.1466 0.0000 174.6774 73 H 3.8369 8.8605 118.2859 58.2759 28.4107 177.7826 74 E 4.0558 7.4798 120.4382 58.6612 29.8855 178.3662 75 A 4.0838 7.6619 120.4017 55.3248 18.6595 179.6346 76 R 3.6722 7.8370 116.5871 59.5526 29.9734 178.9201 77 Y 4.8604 8.5583 119.4561 61.8247 37.4071 179.3788 78 K 4.2694 8.1375 123.8588 59.2106 31.5459 181.0525 79 L 4.4247 7.7861 116.4507 57.5148 41.5134 178.8976 80 F 4.1307 8.3653 117.9822 58.3700 39.5294 175.3475 81 N 4.1173 7.9053 112.4027 53.3150 36.1800 175.5364 82 S 5.3061 7.6949 116.2567 56.5321 64.4551 174.9015 83 P 4.0760 0.0000 0.0000 65.9915 31.1945 178.3629 84 T 4.0021 7.5809 113.4069 66.3533 68.5642 176.6884 85 L 3.4884 7.5597 120.1892 57.7083 41.4132 179.2306 86 L 2.5690 8.2347 120.4991 58.1624 41.6237 179.1128 87 F 4.0331 7.9851 118.9396 60.5183 39.3117 176.3359 88 L 3.8146 7.2332 116.8542 55.5172 42.2207 177.2158 89 L 4.3004 7.3813 117.1592 55.0884 42.8891 177.0965 90 S 4.4259 6.9811 112.9467 57.4486 63.7797 174.4581 91 R 4.1768 8.2003 122.3263 55.0178 31.1450 176.5976 92 G 3.9547 8.3073 105.5208 44.4387 0.0000 174.8133 93 K 3.9701 8.5999 119.1858 59.3103 32.0538 179.3693 94 A 4.0079 8.0514 120.1171 55.4395 18.1265 179.4246 95 A 4.1356 8.0277 117.1460 55.6938 18.4952 179.5365 96 T 4.4323 8.9650 115.2590 66.5728 68.3022 176.5478 97 E 3.9819 8.8124 121.9281 59.3128 29.5679 177.9548 98 N 4.7565 8.2517 112.9645 52.1220 39.2487 175.3763 99 W 4.0067 7.1520 130.6931 57.7192 31.6033 174.8512 100 S 3.4639 5.8100 113.9278 56.9867 65.2376 177.2166 101 I 3.4563 7.7413 124.9943 63.4371 37.6618 176.3737 102 E 4.2962 7.4549 117.0810 56.4070 30.1082 175.5013 103 N 4.8129 7.8871 117.7280 51.9614 38.9646 173.4567 104 L 3.8451 7.2342 119.0320 54.2713 43.0201 177.7539 105 F 4.6040 8.6937 120.1456 57.9954 39.2591 175.3548 106 E 4.0879 8.4170 124.0603 53.8483 31.7449 174.5792 107 E 3.9001 7.5538 120.8313 56.7638 30.1141 175.9465 108 K 4.2099 8.5765 121.9261 56.2155 34.5954 176.0059 109 Q 3.9660 9.0597 126.3145 58.2212 27.8986 174.2993 110 N 4.8079 7.9228 112.5096 52.2836 37.7568 174.8564 111 D 4.4003 8.0427 119.4547 55.0291 41.3304 176.6355 112 T 3.7394 8.3904 119.5840 66.3071 68.6743 174.8328 113 A 4.5397 7.9893 122.7447 51.2418 20.6838 176.2621 114 D 4.8350 8.4483 118.0505 55.5711 42.6620 177.5283 115 I 4.9431 8.1645 117.5228 59.5588 42.1478 174.3282 116 L 5.2148 9.5924 125.6417 53.0299 44.5730 175.2693 117 L 5.8788 9.2073 123.6465 52.4185 43.6749 175.9846 118 V 5.0155 7.9979 122.1789 60.1299 35.4448 174.4606 119 K 4.1442 9.0120 119.0055 57.1955 35.6096 174.8719 120 D 4.4839 9.8615 128.0495 56.3197 38.4264 174.6873 121 Q 3.6298 8.3090 112.1148 55.5723 26.0810 174.6856 122 F 5.2634 8.3669 121.4126 57.8648 41.8203 174.0545 123 Y 5.2007 8.3333 122.9836 56.1464 40.9753 174.0890 124 E 5.1359 10.0419 125.4050 54.4706 32.5816 174.4440 125 L 4.7794 8.8920 127.7253 53.4382 43.4037 175.0921 126 L 4.9753 8.8119 127.5532 53.2706 44.1728 174.4583 127 D 5.1547 8.3896 125.8227 52.3902 44.1071 174.5454 128 V 4.6326 9.1659 126.7943 60.8039 32.5577 175.5830 129 K 4.5391 8.7487 129.3976 55.7501 32.8276 177.0136 130 T 4.8609 8.5920 115.8045 61.6665 70.8077 174.3353 131 R 4.2784 8.6037 118.9470 55.7223 34.1206 173.4254 132 N 3.3227 8.5728 126.5708 52.0607 37.4822 174.4552 133 I 3.7657 7.6749 119.6225 62.8040 38.3756 178.5711 134 S 4.0964 7.9620 115.4787 61.2327 62.9230 174.9914 135 K 4.1264 7.5895 119.3624 55.2060 32.3098 176.0860 136 S 4.2531 8.3478 113.4659 58.6793 63.0491 173.4868 137 A 4.4294 8.2621 122.1637 50.4847 19.0998 174.6312 138 F 4.7342 8.5335 122.2460 56.4100 40.4041 174.9046 139 A 3.8042 8.8551 130.2727 52.1065 18.4282 175.1170 140 P 4.5734 0.0000 0.0000 60.9627 34.3704 174.6530 141 N 4.2555 8.4860 117.3974 54.4939 38.3006 174.7094 142 I 3.8693 8.3396 125.2311 62.1245 37.9418 175.6394 143 I 4.2899 6.9171 119.2893 59.8215 41.6209 172.8673 144 S 4.5576 8.5386 121.4030 58.0458 63.0049 174.5921 145 A 4.3490 9.3542 132.1471 55.0400 18.0796 179.0296 146 Y 4.0830 8.2274 117.4361 60.8116 39.0172 177.8824 147 K 3.8355 8.2772 120.5947 59.3168 32.1358 178.5748 148 L 3.9635 8.1437 120.7405 57.7225 41.8719 178.6769 149 A 4.0831 8.1827 121.0494 55.5105 18.3903 179.5193 150 Q 3.7027 7.9846 116.5325 59.3015 28.6440 179.6537 151 T 3.8818 7.8351 116.6126 66.8196 68.5569 176.3605 152 C 4.1920 8.4507 118.5537 62.9187 28.1586 175.7764 153 A 4.0145 8.2203 122.5240 55.5236 17.7747 179.9245 154 K 3.8258 7.8897 116.4216 59.7819 32.0829 179.4237 155 M 3.8008 8.0224 118.9630 58.3175 31.7283 179.0255 156 I 3.9339 7.7842 119.7418 64.6506 37.2873 178.1534 157 D 4.3618 8.1681 118.3588 56.7941 40.7375 177.2455 158 N 4.6904 8.3132 115.9605 52.4542 39.2802 175.0641 159 K 2.9733 7.5566 119.0207 55.3487 29.8872 181.2598 160 E 4.2751 7.1854 119.5394 55.7295 27.8628 176.6437 161 F 4.5985 7.5082 116.0839 57.7800 40.2898 175.7951 162 D 5.1044 7.7185 120.1699 54.0960 42.0301 175.5367 163 L 4.6948 7.8408 122.1658 56.3764 44.4863 176.0270 164 F 5.0799 6.7070 109.5516 56.3065 40.6662 172.9313 165 D 5.2566 8.6784 118.3880 52.7535 45.4785 174.7430 166 I 4.6667 8.1328 121.4645 60.0558 38.9713 174.5091 167 N 5.2478 8.9414 124.4676 51.3963 42.9789 173.1556 168 Y 5.0378 8.1997 117.7904 56.1419 41.5954 174.7152 169 L 5.1305 8.6121 124.9808 53.1259 44.9136 174.8699 170 E 4.5890 9.0247 128.2748 56.1778 30.8057 175.9492 171 V 4.6897 8.6671 119.2508 59.7718 34.8146 174.4682 172 D 4.9940 9.5638 127.5580 53.4533 42.6378 175.9414 173 W 5.6848 8.2021 120.1289 56.7097 32.2681 173.4301 174 E 4.8351 9.1292 115.8449 54.9857 34.0291 172.8523 175 L 4.4661 8.5854 122.7438 55.7822 42.7371 177.3240 176 N 4.8516 8.6410 123.2407 52.4692 39.9064 175.1396 177 G 3.8955 8.5928 111.2912 47.3043 0.0000 171.7656 *179 D 4.6722 7.6209 119.3511 53.7270 41.9062 179.8203 180 L 5.4649 8.6532 122.3494 52.5143 45.3448 176.0515 181 V 5.1595 8.6161 120.8032 60.4714 35.3124 173.4664 182 C 5.2950 9.0632 125.4688 59.2967 31.8188 174.0242 183 V 4.2669 8.3581 119.4092 61.6788 32.4914 175.5239 184 S 4.7806 7.5905 114.6417 58.8362 65.2745 175.5083 185 T 5.0602 8.2738 108.3945 61.0383 71.4451 172.6731 186 S 5.3017 8.9782 117.7999 56.0246 67.7964 172.5927 187 F 5.3420 8.5749 121.4067 57.2010 42.4117 172.8991 188 A 4.3787 7.3226 124.4069 50.8919 23.2522 174.6923 189 E 5.4400 8.0200 118.3053 53.7089 31.6791 176.4999 190 L 3.9735 8.8974 127.2775 58.4016 42.2599 178.7698 191 F 2.9833 7.1904 113.5408 57.2832 38.4248 175.5833 192 K 4.7142 8.2287 119.4833 55.6850 33.2246 175.4329 193 S 5.3721 7.8594 110.3933 55.5315 65.6931 173.3228 194 E 4.2545 9.3127 122.2615 55.2988 28.6415 175.2450 195 P 3.7094 0.0000 0.0000 65.5951 31.2990 178.3492 196 S 4.0035 8.0255 111.2469 59.6385 63.3200 174.9349 197 E 4.4707 7.8917 116.5330 55.5748 30.0979 181.3923 198 L 4.2490 7.3916 119.2207 55.8535 42.1615 175.9127 199 Y 4.3895 8.7996 125.5497 56.8393 39.8830 174.1228 200 I 4.0197 7.6378 128.7423 60.0583 38.1767 175.6460 201 N 4.3934 8.5006 128.1440 51.7557 38.7476 175.5745 202 W 4.2436 8.6382 126.2623 59.6713 29.4911 178.9737 203 A 4.0229 8.3413 118.9338 54.8707 18.7360 178.0315 204 A 4.2581 8.0646 121.3403 52.4306 17.1302 177.0279 205 A 3.6411 8.5282 118.6285 52.9767 17.3638 177.0004 206 M 3.1264 7.7251 114.0121 57.9797 30.4889 176.9616 207 Q 4.8876 7.7392 116.8602 54.1598 31.0888 176.5995 208 I 4.0829 8.1839 124.7733 62.4326 38.5187 175.0586 209 Q 4.7248 9.2439 124.4256 53.2104 32.1344 174.3543 210 F 4.8043 7.8340 117.0844 56.6451 41.0571 172.5931 211 H 4.8246 8.7158 116.3205 54.5854 30.0331 176.5659 212 V 3.5718 9.2212 123.4670 66.8104 31.6630 178.1648 213 R 3.7764 8.1079 118.3869 59.6656 29.9661 176.5541 214 D 4.6091 7.7480 113.8826 54.2396 41.0929 176.3386 215 L 3.8748 7.8303 123.7216 54.1329 42.1455 176.4073 216 D 4.5882 8.3782 125.3821 53.6704 40.2634 176.3620 217 Q 5.4305 7.9138 116.8918 54.8225 30.3541 176.8679 218 G 3.9839 8.2282 104.4956 45.9875 0.0000 174.0356 219 F 4.3333 7.8719 122.8200 58.5115 40.3214 175.3330 220 N 4.8539 7.2411 123.0193 50.9533 39.0014 172.2399 221 G 3.8834 6.6049 106.1590 43.5757 0.0000 171.4427 222 T 4.2973 8.8593 110.3759 61.0233 70.9052 175.5542 223 R 3.8705 8.4133 121.2859 59.4848 30.1581 178.1432 224 E 3.8638 7.8919 118.6102 59.1973 29.4861 178.2253 225 E 3.9622 8.0993 118.5217 59.3606 29.6472 178.8598 226 W 4.1183 8.4427 128.0023 60.8175 30.5879 177.6309 227 A 4.5215 8.5600 122.7728 56.1428 17.6874 180.4531 228 K 4.0500 8.1768 121.9652 59.6604 31.7894 181.1939 229 S 4.3749 8.2410 113.2305 61.0657 62.2444 175.6644 230 Y 3.8266 8.3165 122.6547 60.7254 38.6273 177.7379 231 L 4.0009 8.4387 122.5605 58.4485 41.5812 180.6075 232 K 3.9929 7.7088 123.5210 59.9587 31.6773 181.3154 233 H 4.2918 8.1148 119.9224 59.2502 29.6686 176.4572 234 F 3.8171 8.0198 122.4155 61.6118 38.9674 177.0919 235 V 3.5422 8.0505 117.1184 66.5040 31.3662 177.8429 236 T 3.8320 8.0048 115.2786 67.2451 68.3165 176.5269 237 Q 4.0508 8.4663 119.5020 58.6853 28.6665 178.9876 238 A 3.0429 7.9924 122.3622 54.7428 18.3640 179.4270 239 E 3.7482 8.1628 117.3180 59.5991 29.4660 179.5840 240 Q 3.8962 7.9684 117.8796 58.9443 28.9382 178.8784 241 R 3.9707 8.0779 120.8132 58.6332 29.7187 177.9990 242 A 3.8229 7.2534 119.1091 55.3738 18.6489 179.1935 243 I 3.7500 7.3737 117.6872 64.7695 37.4185 178.8378 244 S 4.1576 8.2881 114.8227 61.6226 62.4873 176.4159 245 M 4.2612 7.9422 122.2439 58.1516 31.6500 178.4735 246 I 3.7255 7.6098 119.6242 64.7147 37.1104 177.8384 247 D 4.3290 8.0870 119.9100 58.0530 40.7989 179.2915 248 K 3.8448 8.2465 123.5838 59.3350 31.8232 180.5794 249 F 5.3344 8.2299 116.9164 57.7571 40.3240 177.5085 250 V 4.2861 7.8187 119.4456 65.3958 31.6301 177.9609 251 K 3.8555 8.4459 123.6667 59.7382 31.3686 179.1588 252 P 4.3417 0.0000 0.0000 63.9525 31.5677 176.8528 253 F 5.0132 8.5606 117.5955 57.4873 41.3174 177.8491 254 K 3.9971 7.9548 122.5443 57.4293 31.6044 184.4950 255 K 3.7952 7.9962 117.4478 60.1547 32.0994 177.0711 256 Y 4.6630 7.3411 114.3890 57.7969 37.5260 175.6117 257 I 4.1456 7.8415 127.1334 61.9593 38.5514 174.6522 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 4.29 0.00 3.96 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 F 8.78 4.54 0.00 3.17 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 7.89 4.37 1.91 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.19 1.15 0.00 0.00 5 K 7.73 3.58 0.00 1.82 1.88 0.00 1.85 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.37 7.81 6 P 0.00 4.59 0.00 2.06 2.21 0.00 3.59 0.00 0.00 3.71 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 7 I 7.55 4.57 1.99 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 1.26 0.98 0.96 0.00 0.00 8 Y 8.48 4.20 0.00 2.77 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 9 Q 7.94 3.66 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 10 D 7.97 4.22 0.00 2.93 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 11 I 7.56 2.69 1.87 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 1.34 0.76 0.68 0.00 0.00 12 N 8.59 3.91 0.00 1.89 2.63 0.00 0.00 7.30 7.51 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 13 S 8.64 4.04 0.00 3.72 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 7.75 3.78 1.65 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.65 0.83 0.00 0.00 15 L 8.10 4.21 0.00 1.60 1.73 0.94 0.81 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 16 I 7.04 4.00 1.84 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 1.17 0.55 1.00 0.00 0.00 17 G 9.35 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 8.32 4.17 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.63 0.00 0.00 0.00 0.00 0.00 2.58 2.58 0.00 19 K 8.61 5.31 0.00 1.49 1.52 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.24 0.99 7.81 20 V 8.35 4.43 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 0.44 0.00 0.00 21 K 8.19 4.43 0.00 2.06 1.82 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.71 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.41 1.01 7.81 22 R 8.31 4.30 0.00 1.69 1.76 0.00 3.46 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.54 0.00 23 P 0.00 3.53 0.00 2.09 1.92 0.00 3.75 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.13 0.00 0.00 42 Y 8.65 4.31 0.00 3.04 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 43 K 8.49 3.77 0.00 1.84 1.72 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.39 1.33 7.81 44 F 9.06 4.38 0.00 3.10 3.31 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 45 L 8.85 3.90 0.00 1.96 1.69 1.07 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.14 3.66 0.00 1.15 1.64 0.00 1.21 0.00 0.00 1.12 0.00 0.00 3.06 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.10 1.25 7.81 47 E 7.77 4.22 0.00 1.77 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 2.17 2.28 0.00 48 N 7.20 4.87 0.00 2.03 2.55 0.00 0.00 6.72 7.85 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 49 L 8.28 4.70 0.00 1.62 1.45 0.97 0.73 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 58 E 7.03 3.92 0.00 1.49 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 2.52 2.45 0.00 59 Y 7.92 3.62 0.00 3.04 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 60 L 7.75 3.37 0.00 1.98 1.37 0.60 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 61 N 8.41 4.25 0.00 3.08 3.09 0.00 0.00 7.11 8.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 D 7.82 4.32 0.00 2.53 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 63 L 7.01 3.63 0.00 0.79 1.09 0.66 -0.05 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 64 F 7.95 4.31 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 8.37 4.44 0.00 2.03 2.37 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 3.12 2.83 0.00 66 K 8.08 4.18 0.00 1.81 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0.00 0.00 0.00 83 P 0.00 4.08 0.00 1.97 2.04 0.00 3.94 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 84 T 7.58 4.00 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 1.27 0.00 0.00 85 L 7.56 3.49 0.00 1.52 1.57 0.16 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 86 L 8.23 2.57 0.00 1.56 1.55 0.42 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 87 F 7.99 4.03 0.00 2.87 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 88 L 7.23 3.81 0.00 1.22 1.35 0.46 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 89 L 7.38 4.30 0.00 1.71 1.71 0.66 0.50 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 90 S 6.98 4.43 0.00 3.90 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.20 4.18 0.00 1.68 1.87 0.00 3.25 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.52 0.00 92 G 8.31 3.95 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 0.00 0.00 0.00 93 K 8.60 3.97 0.00 1.76 1.49 0.00 1.72 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.63 1.68 7.81 94 A 8.05 4.01 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 8.03 4.14 1.54 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 96 T 8.96 4.43 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 0.96 0.00 0.00 97 E 8.81 3.98 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 98 N 8.25 4.76 0.00 2.77 2.84 0.00 0.00 7.06 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 W 7.15 4.01 0.00 3.17 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 2.31 2.41 0.00 108 K 8.58 4.21 0.00 1.76 1.66 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.40 7.81 109 Q 9.06 3.97 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.97 0.00 0.00 0.00 0.00 0.00 2.30 1.97 0.00 110 N 7.92 4.81 0.00 2.79 2.92 0.00 0.00 6.03 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 D 8.04 4.40 0.00 2.77 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 0.00 112 T 8.39 3.74 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 1.08 0.00 0.00 113 A 7.99 4.54 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 D 8.45 4.84 0.00 2.76 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 0.00 115 I 8.16 4.94 1.98 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 1.31 1.16 1.11 0.00 0.00 116 L 9.59 5.21 0.00 1.72 1.58 0.33 0.47 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 0.00 117 L 9.21 5.88 0.00 1.95 1.79 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.00 5.02 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 0.88 0.00 0.00 0.63 0.00 0.00 119 K 9.01 4.14 0.00 1.24 1.02 0.00 1.90 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.25 1.19 7.81 120 D 9.86 4.48 0.00 2.93 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 0.00 121 Q 8.31 3.63 0.00 2.24 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 2.17 1.90 0.00 122 F 8.37 5.26 0.00 3.24 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 0.00 123 Y 8.33 5.20 0.00 2.83 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 0.00 124 E 10.04 5.14 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 125 L 8.89 4.78 0.00 1.63 1.49 0.86 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.81 4.98 0.00 1.82 1.57 1.12 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 127 D 8.39 5.15 0.00 2.70 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 9.17 4.63 2.28 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 1.21 0.00 0.00 1.04 0.00 0.00 129 K 8.75 4.54 0.00 1.82 1.80 0.00 1.60 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.70 1.43 7.81 130 T 8.59 4.86 4.62 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 1.40 0.00 0.00 131 R 8.60 4.28 0.00 1.95 1.75 0.00 3.19 0.00 0.00 3.42 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.52 0.00 132 N 8.57 3.32 0.00 2.05 2.45 0.00 0.00 7.24 7.94 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 0.00 133 I 7.67 3.77 1.76 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 1.24 0.61 0.80 0.00 0.00 134 S 7.96 4.10 0.00 3.95 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 0.00 135 K 7.59 4.13 0.00 2.12 1.82 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.26 7.81 136 S 8.35 4.25 0.00 3.95 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 0.00 137 A 8.26 4.43 1.19 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 0.00 0.00 138 F 8.53 4.73 0.00 2.97 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 0.00 139 A 8.86 3.80 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 P 0.00 4.57 0.00 2.04 2.14 0.00 3.68 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.94 0.00 141 N 8.49 4.26 0.00 2.55 3.00 0.00 0.00 6.84 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 8.34 3.87 1.38 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 0.15 -0.36 0.08 0.00 0.00 143 I 6.92 4.29 1.94 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.09 0.89 0.00 0.00 144 S 8.54 4.56 0.00 3.93 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 0.00 145 A 9.35 4.35 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 146 Y 8.23 4.08 0.00 3.32 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 0.00 147 K 8.28 3.84 0.00 1.85 1.92 0.00 1.60 0.00 0.00 1.38 0.00 0.00 2.65 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.35 7.81 148 L 8.14 3.96 0.00 1.83 1.75 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 149 A 8.18 4.08 0.75 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 0.00 0.00 150 Q 7.98 3.70 0.00 1.74 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.76 0.00 0.00 0.00 0.00 0.00 1.98 1.88 0.00 151 T 7.84 3.88 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 1.47 0.00 0.00 152 C 8.45 4.19 0.00 3.27 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 0.00 153 A 8.22 4.01 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 0.00 154 K 7.89 3.83 0.00 1.87 1.76 0.00 1.32 0.00 0.00 1.25 0.00 0.00 2.13 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.26 1.26 7.81 155 M 8.02 3.80 0.00 1.89 2.24 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.59 0.00 156 I 7.78 3.93 1.95 0.00 0.00 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 1.90 1.10 1.12 0.00 0.00 157 D 8.17 4.36 0.00 2.71 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 0.00 158 N 8.31 4.69 0.00 2.63 2.72 0.00 0.00 7.01 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 0.00 159 K 7.56 2.97 0.00 1.87 1.72 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.26 7.81 160 E 7.19 4.28 0.00 1.80 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 2.26 2.07 0.00 161 F 7.51 4.60 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 0.00 162 D 7.72 5.10 0.00 2.73 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 0.00 163 L 7.84 4.69 0.00 1.76 1.69 1.04 0.84 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 0.00 164 F 6.71 5.08 0.00 2.94 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 0.00 165 D 8.68 5.26 0.00 2.68 2.66 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 0.00 0.00 0.00 166 I 8.13 4.67 1.53 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.90 0.67 0.00 0.00 167 N 8.94 5.25 0.00 2.55 2.46 0.00 0.00 6.35 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 Y 8.20 5.04 0.00 2.89 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 0.00 169 L 8.61 5.13 0.00 2.02 1.70 1.26 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 170 E 9.02 4.59 0.00 2.25 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 2.38 2.37 0.00 171 V 8.67 4.69 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 0.93 0.00 0.00 1.07 0.00 0.00 172 D 9.56 4.99 0.00 2.59 2.50 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 0.00 173 W 8.20 5.68 0.00 3.54 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 0.00 174 E 9.13 4.84 0.00 1.66 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 2.15 2.13 0.00 175 L 8.59 4.47 0.00 1.78 1.71 1.04 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 176 N 8.64 4.85 0.00 2.79 2.74 0.00 0.00 6.98 6.98 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 0.00 177 G 8.59 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 *179 D 7.62 4.67 0.00 2.41 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 0.00 180 L 8.65 5.46 0.00 1.44 1.68 1.01 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 181 V 8.62 5.16 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 0.78 0.00 0.00 1.11 0.00 0.00 182 C 9.06 5.30 0.00 2.58 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 0.00 183 V 8.36 4.27 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 0.88 0.00 0.00 0.91 0.00 0.00 184 S 7.59 4.78 0.00 3.87 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 0.00 185 T 8.27 5.06 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 1.22 0.00 0.00 186 S 8.98 5.30 0.00 3.86 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 0.00 187 F 8.57 5.34 0.00 2.30 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 0.00 0.00 0.00 0.00 188 A 7.32 4.38 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 8.02 5.44 0.00 1.88 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.95 0.00 190 L 8.90 3.97 0.00 1.75 1.12 1.04 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 191 F 7.19 2.98 0.00 2.72 2.28 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 0.00 192 K 8.23 4.71 0.00 1.76 2.00 0.00 1.62 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.44 7.81 193 S 7.86 5.37 0.00 3.99 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 0.00 194 E 9.31 4.25 0.00 2.16 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 2.33 2.47 0.00 195 P 0.00 3.71 0.00 1.83 1.34 0.00 3.53 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.44 0.00 196 S 8.03 4.00 0.00 3.90 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 0.00 197 E 7.89 4.47 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 2.18 2.13 0.00 198 L 7.39 4.25 0.00 2.02 1.86 1.06 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 199 Y 8.80 4.39 0.00 3.18 3.12 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 0.00 200 I 7.64 4.02 1.22 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.54 -0.66 0.00 0.00 201 N 8.50 4.39 0.00 3.08 2.73 0.00 0.00 6.79 7.51 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 0.00 202 W 8.64 4.24 0.00 3.48 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 0.00 203 A 8.34 4.02 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 0.00 204 A 8.06 4.26 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 0.00 205 A 8.53 3.64 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 0.00 206 M 7.73 3.13 0.00 2.31 2.22 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.86 0.00 207 Q 7.74 4.89 0.00 1.98 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.89 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 208 I 8.18 4.08 1.74 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.01 0.98 0.00 0.00 209 Q 9.24 4.72 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.68 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 210 F 7.83 4.80 0.00 2.87 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 0.00 211 H 8.72 4.82 0.00 3.16 3.30 0.00 5.63 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 9.22 3.57 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 0.97 0.00 0.00 1.10 0.00 0.00 213 R 8.11 3.78 0.00 2.05 1.96 0.00 3.29 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 214 D 7.75 4.61 0.00 2.73 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 0.00 215 L 7.83 3.87 0.00 0.75 1.29 -0.12 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 216 D 8.38 4.59 0.00 2.95 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 0.00 217 Q 7.91 5.43 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.12 0.00 0.00 0.00 0.00 0.00 2.45 2.20 0.00 218 G 8.23 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 0.00 0.00 0.00 219 F 7.87 4.33 0.00 3.11 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 0.00 220 N 7.24 4.85 0.00 2.49 2.56 0.00 0.00 6.75 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 G 6.60 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 0.00 222 T 8.86 4.30 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 223 R 8.41 3.87 0.00 1.86 1.97 0.00 2.21 0.00 0.00 2.54 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 224 E 7.89 3.86 0.00 1.16 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 0.00 2.19 1.95 0.00 225 E 8.10 3.96 0.00 2.48 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 2.35 2.34 0.00 226 W 8.44 4.12 0.00 3.51 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 0.00 227 A 8.56 4.52 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 0.00 0.00 0.00 0.00 0.00 228 K 8.18 4.05 0.00 1.81 1.83 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.31 7.81 229 S 8.24 4.37 0.00 3.90 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 0.00 230 Y 8.32 3.83 0.00 2.40 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 0.00 231 L 8.44 4.00 0.00 1.84 1.79 1.01 1.23 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 0.00 232 K 7.71 3.99 0.00 1.73 1.81 0.00 1.82 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.31 7.81 233 H 8.11 4.29 0.00 3.15 3.31 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 F 8.02 3.82 0.00 2.38 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 0.00 235 V 8.05 3.54 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.13 0.00 0.00 236 T 8.00 3.83 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 237 Q 8.47 4.05 0.00 2.28 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 238 A 7.99 3.04 0.98 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 0.00 0.00 239 E 8.16 3.75 0.00 2.11 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 2.26 2.27 0.00 240 Q 7.97 3.90 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.78 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 241 R 8.08 3.97 0.00 1.13 1.10 0.00 3.13 0.00 0.00 3.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 1.10 0.00 242 A 7.25 3.82 1.19 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 0.00 0.00 243 I 7.37 3.75 1.98 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 1.69 1.12 0.87 0.00 0.00 244 S 8.29 4.16 0.00 3.98 4.10 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 0.00 245 M 7.94 4.26 0.00 2.33 2.37 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.90 0.00 246 I 7.61 3.73 1.85 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 1.67 0.77 0.91 0.00 0.00 247 D 8.09 4.33 0.00 2.72 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 8.25 3.84 0.00 1.80 1.72 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.35 7.81 249 F 8.23 5.33 0.00 3.17 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 0.00 250 V 7.82 4.29 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 1.09 0.00 0.00 1.02 0.00 0.00 251 K 8.45 3.86 0.00 1.75 1.84 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.39 1.39 7.81 252 P 0.00 4.34 0.00 0.95 1.68 0.00 3.68 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 2.14 2.01 0.00 253 F 8.56 5.01 0.00 3.20 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 K 7.95 4.00 0.00 1.71 1.84 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.28 7.81 255 K 8.00 3.80 0.00 1.58 1.75 0.00 0.89 0.00 0.00 1.35 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.62 0.23 7.81 256 Y 7.34 4.66 0.00 3.17 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 0.00 257 I 7.84 4.15 2.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.46 0.95 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.