NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 3.9282 8.3344 115.2545 57.5868 63.9906 173.5857 5 K 3.9946 7.8988 120.2242 55.4086 33.0317 174.5948 6 P 4.6634 0.0000 0.0000 62.0281 33.1380 175.4753 7 R 4.6169 8.4058 118.7355 57.0158 31.0168 175.3802 8 D 4.8106 8.6752 120.8956 52.6237 43.7153 173.6331 9 V 4.6975 8.2455 117.6865 61.1480 34.1358 174.1193 10 Q 4.5234 8.9614 129.6790 54.5518 30.7025 173.9989 11 V 4.8467 8.3374 126.5440 61.0727 33.6000 174.4686 12 L 4.7700 8.7058 128.9130 52.8210 45.8261 173.3128 13 P 5.0583 0.0000 0.0000 62.8183 31.5431 176.2683 14 I 4.6865 8.7061 114.6264 60.4609 39.3022 174.4781 15 A 4.3410 7.5979 122.2463 51.4153 21.6097 175.0377 16 T 4.0631 8.6192 115.9381 65.6871 68.6384 174.0019 17 N 4.2896 9.1419 121.7174 54.2029 36.5538 173.1306 18 T 5.2245 8.1188 114.2138 61.8534 72.3304 173.2853 19 K 5.2658 9.1835 124.8750 54.5310 36.6201 175.3341 20 V 4.5506 8.7721 122.5089 59.9814 34.2512 174.6597 21 L 4.9734 8.6514 123.7646 53.2687 44.2181 175.8206 22 R 4.5056 8.7710 124.9416 54.1338 31.8032 175.7400 23 A 4.2139 8.2572 127.8024 51.5177 19.2806 176.2110 24 R 4.8900 9.1181 122.2938 54.5392 33.4550 175.4400 25 S 4.6771 8.7022 116.6600 56.7677 65.3565 174.8130 26 W 4.3080 9.2811 126.7196 57.9574 29.4159 175.7787 27 S 4.8832 7.7123 111.6716 55.3093 65.3270 173.6603 28 R 3.5586 8.1742 116.8106 56.3432 29.2984 176.4673 29 L 3.8424 6.4800 120.8261 56.4619 42.6683 176.6312 30 R 4.3842 6.0103 114.6629 54.6571 34.3054 175.4006 31 F 4.5841 8.2808 120.2386 56.2833 37.6445 174.7163 32 E 4.9321 7.8185 122.3538 53.8971 34.2472 176.8202 33 I 3.8450 8.4646 113.7486 64.1550 37.6039 177.9285 34 E 3.6760 8.1859 119.4793 59.0411 29.3004 177.2362 35 Y 4.5792 7.9179 113.5883 57.5859 38.3978 177.2114 36 A 4.2154 8.1735 123.9344 54.6027 18.5149 178.8290 37 L 4.0288 7.9013 113.8384 54.8974 42.3368 176.2978 38 E 3.9348 8.2300 118.2596 58.2943 27.4126 175.1347 39 R 4.5842 7.9045 112.9323 55.6589 31.7996 177.9610 40 G 3.7981 9.7444 107.1666 45.7422 0.0000 172.2183 41 T 4.7987 8.1788 112.1710 61.6304 71.7395 173.4209 42 T 5.0630 8.4603 113.4033 59.8603 72.8942 173.0036 43 S 4.9767 8.7372 119.3429 57.1218 65.5482 172.6676 44 N 5.1066 9.0006 123.4168 51.6900 39.8817 174.8661 45 S 4.8926 8.6166 117.5087 56.6833 66.4628 172.0964 46 Y 5.2951 8.8060 120.3083 56.2300 42.6605 174.5142 47 V 4.8997 8.9297 121.0896 61.2728 34.9718 174.1467 48 I 4.9017 8.9395 128.7831 59.6497 39.8512 174.4410 49 E 4.6840 9.1812 127.8270 54.0660 29.9921 176.8710 50 G 4.1445 8.8513 120.8151 45.3161 0.0000 174.1669 51 D 4.5551 8.8816 122.2690 56.1836 41.4427 176.2547 52 K 4.8502 8.6566 117.3290 54.7467 36.1528 175.3034 53 T 5.1647 8.9533 118.4339 61.8350 71.2906 173.3573 54 A 5.4653 9.0048 127.4355 50.0467 22.4868 174.7820 55 I 4.9842 8.6707 114.8733 59.1916 40.9540 174.6027 56 I 4.6505 8.6606 125.2455 60.3153 39.7712 173.8888 57 D 4.9185 9.0257 128.7766 54.0294 37.7480 171.6403 58 P 3.8932 0.0000 0.0000 61.5108 32.3614 175.1302 59 P 4.4756 0.0000 0.0000 61.7805 32.4740 176.0905 60 V 3.9120 8.1160 111.7643 60.8048 32.0457 177.1370 61 E 3.9237 8.5303 120.3542 59.7140 29.1117 179.1621 62 S 4.0962 7.9663 112.4334 60.1516 63.6190 174.6241 63 F 4.8633 8.0188 121.8906 55.7461 38.1325 175.5140 *65 K 4.2701 7.8972 125.5211 56.2346 34.3696 177.8598 66 I 3.8858 7.7283 112.2819 63.8099 37.5898 177.3178 67 Y 4.0985 8.3355 121.4888 60.7127 38.6713 178.1720 68 L 3.7735 7.9508 119.3267 57.6028 41.8105 179.0189 69 E 3.9007 8.0698 117.9666 59.4704 29.1413 179.3862 70 A 3.9227 7.9507 120.5384 55.0291 18.3608 179.4540 71 L 3.7026 7.9846 119.2258 58.3508 41.8783 179.2444 72 Q 3.9209 8.1539 117.3374 58.9672 28.6442 178.5376 73 Q 4.1145 7.7500 118.2059 58.1586 28.7612 177.0948 74 T 4.3883 7.3159 108.3508 61.8319 70.3528 175.0618 75 V 4.3904 7.6913 113.5761 59.0398 35.3708 174.6584 76 N 4.5814 8.4477 120.8944 52.5558 38.8919 175.9929 77 L 3.9572 8.4622 126.7638 57.5272 41.9476 179.5317 78 K 4.1030 8.1868 117.3214 58.0136 32.0649 177.7271 79 K 4.4061 7.8792 117.4076 56.1132 32.6583 175.6849 80 L 4.1107 7.4070 121.9271 55.5757 42.7444 175.7177 81 D 4.4138 8.8018 125.5938 55.6913 42.7606 176.1639 82 Y 5.2333 7.5521 114.2730 56.0167 42.7804 174.6469 83 V 4.6406 8.5938 122.7574 61.3209 34.1844 174.1447 84 I 4.8678 8.8243 130.1486 60.0820 38.9239 174.7825 85 L 4.9890 8.7871 127.9723 53.1554 42.5905 177.4063 86 G 3.6889 10.3350 113.3379 47.4394 0.0000 172.4508 87 H 5.2202 7.5922 112.9708 55.2378 30.7971 172.1628 88 F 4.8902 8.9691 121.2354 56.4406 41.4563 174.4485 89 S 4.6790 7.4860 122.5011 55.8909 66.8518 173.2886 90 P 4.0959 0.0000 0.0000 65.5777 31.2432 177.3749 91 N 4.6370 8.0044 114.3156 53.6293 37.6047 176.0361 92 R 4.0007 7.4404 118.3701 56.6799 30.7560 178.1057 93 I 3.5466 6.9439 120.5660 64.1190 37.1353 176.1396 94 P 4.3737 0.0000 0.0000 66.1504 31.0697 178.7870 95 T 4.0191 7.6654 113.9340 66.6500 68.4671 176.7457 96 F 4.8099 8.1596 119.8831 60.3410 38.7096 177.7015 97 K 4.2025 8.8628 118.9662 59.5324 32.4264 178.2851 98 A 4.2343 8.1442 121.0074 55.3922 18.3028 179.5135 99 L 4.0227 8.1276 117.3700 58.0532 41.6081 179.8309 100 L 3.9775 8.2057 118.8267 57.8123 41.3117 179.4875 101 E 3.9923 8.0142 117.0273 59.5109 29.6312 179.0233 102 L 4.2445 7.9362 117.3890 56.4826 43.3110 177.7401 103 A 4.7561 8.0651 121.3608 50.0697 19.3521 174.8707 104 P 4.6840 0.0000 0.0000 63.7574 32.0531 177.9812 105 Q 4.1824 7.8526 114.3969 56.5798 29.0503 176.1442 106 I 3.8657 7.3782 113.2538 61.4559 38.5369 175.4382 107 T 4.7251 8.2041 120.7359 61.8985 71.0031 173.5396 108 F 4.7395 9.3380 125.8152 56.8394 40.8164 174.7918 109 V 5.2654 9.3203 123.4505 60.3517 33.9983 174.1468 110 C 5.0324 8.2013 121.0798 56.8577 33.6255 173.1199 111 S 4.3851 8.6069 113.3288 57.5897 63.1136 174.0940 112 L 3.9004 8.7837 127.6640 58.2894 41.4364 177.8148 113 P 4.3261 0.0000 0.0000 64.8966 31.4460 177.8329 114 A 4.0188 8.2939 119.6903 54.1016 18.3845 179.2438 115 A 3.9650 7.8919 119.8471 55.4692 18.4489 180.0061 116 G 3.4986 7.9438 103.4813 47.9961 0.0000 175.3524 117 D 4.0523 7.6830 120.7511 56.8682 40.4943 178.7331 118 L 4.1172 7.4221 118.1698 57.9701 41.8216 179.4890 119 R 4.1079 8.1098 117.7666 59.3319 29.8040 179.0912 120 A 3.9995 7.7855 119.0340 54.7687 18.3958 179.0350 121 A 4.0594 7.6332 117.6723 53.1322 20.1015 177.6797 122 F 4.8868 7.6615 116.1927 55.3366 39.0915 174.1938 123 P 4.3589 0.0000 0.0000 65.6350 31.9900 178.6885 124 D 4.4869 8.1978 117.4900 56.0520 41.0753 175.7671 125 D 4.9253 7.6711 117.9927 52.6607 42.9294 176.1893 126 N 4.7458 8.2196 120.2882 51.7597 37.9381 174.2932 127 L 4.1551 7.9942 123.0848 54.2659 42.8264 176.6583 128 N 4.8196 8.6794 119.3271 52.5678 39.7054 174.0303 129 I 4.9987 8.4144 124.5592 59.3648 40.5540 175.4796 130 L 4.4941 9.5290 130.0670 52.7753 43.1193 174.9702 131 P 5.2717 0.0000 0.0000 61.4627 32.4986 176.6311 *133 R 4.2223 8.4642 116.9965 55.5723 31.8698 175.3882 134 G 4.5201 8.4439 107.3091 46.1763 0.0000 175.5689 135 K 4.1038 7.8175 119.4536 58.9333 32.4221 177.3220 136 E 4.2375 8.0348 115.3891 56.2795 30.3113 175.5381 137 T 4.9533 8.2494 110.4362 59.9934 72.3650 172.8874 138 L 4.6345 8.6459 123.4992 53.3189 44.6670 174.5269 139 D 5.0036 8.7622 126.9517 53.3913 41.6204 176.0224 140 L 4.2763 9.3412 126.5091 54.8428 42.6130 177.6865 141 G 4.1259 8.2260 104.9690 45.3668 0.0000 173.4362 142 K 3.7717 9.6831 113.6583 57.2278 29.5442 176.9557 143 G 3.9627 8.4298 107.1302 45.5020 0.0000 174.8836 144 H 4.6943 7.9929 118.5880 54.9384 27.3462 173.0294 145 V 4.4464 7.6162 120.5630 61.6255 33.6827 174.1744 146 L 4.8586 8.9172 128.5790 53.3194 43.4400 175.7203 147 K 4.8100 8.8191 123.7832 54.8661 34.9278 175.3961 148 F 5.2972 8.6633 121.3781 55.8392 42.4148 174.3610 149 L 4.6662 9.1994 123.2385 51.9316 43.8071 173.6608 150 P 4.7535 0.0000 0.0000 62.0381 31.9437 176.9061 151 I 4.8150 8.3003 117.2284 58.5493 36.1116 173.5849 152 P 4.7313 0.0000 0.0000 63.6280 32.3512 176.7112 153 S 4.5633 8.1506 114.4918 55.8424 66.2165 171.9359 154 P 4.2767 0.0000 0.0000 65.9187 31.1947 178.1216 155 R 3.6250 7.5798 116.4407 58.1898 30.2185 176.2819 156 W 5.0720 7.6168 117.5516 53.5524 29.5758 173.6400 157 P 4.2549 0.0000 0.0000 64.8783 31.2631 177.2386 158 A 4.6493 8.0803 118.7230 51.6278 19.2922 176.7018 159 G 3.9549 8.1847 106.8958 48.2172 0.0000 173.1021 160 L 5.2964 8.8385 126.1047 53.7589 45.4247 174.9717 161 C 5.1284 9.1920 123.5651 58.5751 31.1735 172.8281 162 T 5.0017 8.5827 117.3716 61.9079 72.1885 172.2793 163 Y 5.0700 8.9166 126.7408 55.8362 42.0332 173.6145 164 D 4.7987 8.4228 127.1859 52.7847 41.6950 176.9991 165 V 3.2979 8.0757 127.5223 65.9404 31.9193 177.1426 166 Q 3.9831 8.2038 120.1258 58.9916 27.4805 177.1650 167 T 4.1958 7.7842 105.6575 60.8449 70.0263 174.7314 168 Q 3.1727 7.8897 121.1949 56.8520 27.0439 172.5509 169 I 4.4200 6.6340 116.4084 60.1256 39.1045 174.7250 170 L 4.9986 8.4990 128.9444 53.6074 44.3185 174.6344 171 Y 4.7742 9.3080 125.5225 57.3981 38.3062 176.2025 172 T 4.4701 8.7071 114.2254 60.3614 71.2895 176.3127 173 D 4.2660 7.9878 122.3570 55.5071 41.2925 177.0461 174 K 4.1667 6.8862 115.0520 57.6701 32.0350 177.0706 175 I 3.8528 7.1922 120.1592 61.9312 37.5144 176.1710 176 F 3.8877 8.4894 121.6671 57.5585 36.9174 175.3748 177 G 3.3977 7.3699 109.6557 44.8274 0.0000 172.8220 178 A 4.4555 8.0157 120.2972 51.2794 22.2028 176.0201 179 H 4.9564 8.8538 120.7325 54.4923 27.4389 173.1399 180 I 4.7984 7.6336 121.1172 59.5564 41.2572 172.7510 181 C 4.4077 9.0667 130.9103 57.9240 32.4994 172.7468 182 G 4.4114 8.1346 111.8748 45.2334 0.0000 172.0458 183 D 4.7344 9.0116 118.8666 56.6584 41.2345 177.4285 184 D 4.6097 8.1037 119.3409 54.1313 41.5571 176.3228 185 V 3.6206 8.6354 124.4558 65.2488 32.5821 175.6774 186 F 5.3929 8.0428 116.9017 55.4858 41.4664 175.3805 187 D 4.6631 8.5736 120.7158 54.3762 40.5435 174.0265 188 D 4.9907 9.6086 123.7734 54.5887 38.4476 174.6979 189 N 4.6141 8.6188 122.3593 52.7529 37.9024 175.9737 190 W 4.7053 9.2343 134.3917 60.5528 30.4983 177.2309 191 E 3.6037 8.4091 118.4009 59.4721 28.6410 179.1704 192 S 3.8021 7.5645 112.5295 60.1106 63.4120 175.3137 193 F 5.0381 8.4792 120.6761 57.8304 40.0760 177.5779 194 K 4.0932 7.4879 118.6668 59.6107 31.7550 178.5384 195 E 4.0115 8.2374 118.9013 59.4793 29.4891 178.5380 196 D 4.5646 8.2336 118.4841 57.4602 41.0155 178.4944 197 Q 4.4121 8.4615 118.7350 59.1736 28.6954 178.9510 198 R 3.1394 8.2460 119.6419 59.1204 30.0222 177.8372 199 Y 4.0699 8.3285 119.5850 60.7581 38.7692 177.4115 200 Y 3.9160 8.5741 120.7574 60.5914 38.7299 177.5980 201 F 4.0641 8.3761 120.2706 61.6795 39.5480 176.5693 202 N 4.4121 8.1783 114.6280 56.3438 38.3034 177.0807 203 C 4.0516 7.6696 117.4318 61.9897 28.2952 174.8134 204 L 4.3615 7.2035 116.4966 54.6678 41.9831 177.0641 *206 A 4.1115 7.9686 123.4512 51.7005 20.0501 177.8797 207 P 4.3789 0.0000 0.0000 64.8473 31.6335 176.4940 208 H 4.9731 7.5624 115.7188 54.8236 29.9708 175.7542 209 A 4.1323 8.0058 124.5278 55.4476 18.2848 180.0407 210 I 3.7570 7.8540 111.0607 64.5739 37.5906 178.0829 211 H 4.2838 8.2858 117.4286 58.3253 28.6460 177.6886 212 V 3.6901 8.0101 120.4079 65.9899 31.3597 177.9564 213 E 4.0484 8.4854 118.1601 59.2842 29.3483 179.0816 214 A 3.9888 7.9758 120.1702 55.1139 18.4606 179.3468 215 A 3.9770 8.2141 119.3040 55.4766 18.2438 179.6815 216 L 4.0188 7.8469 115.9210 58.0751 42.1084 179.1078 217 E 4.1011 8.2786 119.0133 59.3675 29.3654 179.0497 218 K 4.0265 7.9277 117.5331 59.0095 32.4697 178.6031 219 I 4.0910 7.8280 112.0162 61.6978 37.8398 177.8481 220 S 4.1459 7.6997 114.9116 60.8644 62.8674 174.7880 221 D 4.7696 7.8966 118.5364 53.8177 40.9443 175.9416 222 L 4.1105 7.5437 119.6061 53.7733 42.5500 176.4693 223 Q 4.2969 8.3085 121.1028 54.8719 29.1781 175.5379 224 V 4.7060 8.1707 122.5667 61.1766 34.0212 175.0508 225 R 4.3661 8.7535 125.3021 57.0125 31.7143 176.4332 226 L 4.4386 7.3922 119.5110 53.9019 46.0288 173.8241 227 Y 4.9441 8.7639 124.3858 56.9295 39.3583 174.7548 228 A 4.7688 8.6670 129.1518 50.8854 17.8577 176.9832 229 V 4.2547 7.4637 113.9760 60.1925 32.8852 176.5087 230 G 3.7934 9.1754 109.8892 48.9708 0.0000 173.6031 231 H 5.5871 7.3084 116.8708 54.4735 33.0377 174.7280 232 G 4.1175 8.7508 110.4755 44.7855 0.0000 171.0164 233 P 4.4372 0.0000 0.0000 62.1116 32.2353 176.8129 234 L 4.0768 8.5913 123.4947 54.9415 43.1208 176.6093 235 V 3.8400 8.6163 123.6950 62.3290 32.1390 174.5175 236 R 4.3992 9.1331 127.2179 57.5561 33.1452 177.6969 237 T 3.7085 7.9655 117.6823 66.4344 69.4011 175.5467 238 S 3.5206 8.2128 115.9820 57.9157 63.0505 175.3944 239 L 3.2930 7.2268 123.5483 58.4718 41.5437 179.2991 240 I 3.4882 7.2039 118.4113 64.1698 37.1038 178.2017 241 A 3.9544 7.5401 121.1494 55.0400 18.1920 179.2843 242 L 3.9607 8.2275 119.1635 58.5772 42.1625 179.3185 243 T 4.0019 7.9200 115.8346 66.6894 68.2648 176.4535 244 Q 3.9270 8.1916 121.3274 58.7622 28.9584 177.9065 245 A 3.1887 7.9603 122.0132 55.1000 18.1967 178.9388 246 Y 3.8332 8.2615 115.3154 61.2425 38.0063 179.0013 247 A 4.0622 8.0141 121.2491 55.3911 18.6568 179.4435 248 D 4.2702 8.1313 117.4951 57.3850 40.9055 179.1258 249 W 4.3027 8.3948 120.1266 59.7535 28.9766 178.7825 250 S 4.4303 8.4649 115.6262 61.6199 62.1425 176.9285 251 K 4.0656 8.0224 119.9810 59.9156 32.4242 178.7034 252 A 4.1523 8.0164 121.5564 55.0496 18.2420 179.4183 253 Q 3.8838 8.3044 118.0473 59.1368 29.1110 178.5716 254 K 4.0305 7.9328 119.2704 59.1243 31.7629 179.3051 255 L 3.9829 7.4543 118.6824 57.9213 41.9099 178.8566 256 E 4.0027 8.1063 117.8644 59.8184 29.2039 178.9017 257 H 4.2636 8.2168 115.3211 59.2650 28.9682 176.9246 258 H 4.0809 7.7290 117.0408 57.1970 30.0478 174.0372 259 H 4.0468 8.5300 115.7914 58.3302 26.1521 174.5114 260 H 4.5797 8.1038 119.3920 55.7513 28.5024 173.2786 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 4 S 8.33 3.93 0.00 3.41 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.90 3.99 0.00 1.74 1.76 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.48 7.81 6 P 0.00 4.66 0.00 2.30 2.09 0.00 3.84 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 7 R 8.41 4.62 0.00 1.85 2.15 0.00 3.20 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.75 0.00 8 D 8.68 4.81 0.00 2.77 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.25 4.70 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.94 0.00 0.00 10 Q 8.96 4.52 0.00 2.12 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.55 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 11 V 8.34 4.85 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.89 0.00 0.00 12 L 8.71 4.77 0.00 1.75 1.40 0.97 0.87 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 13 P 0.00 5.06 0.00 2.03 2.01 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 14 I 8.71 4.69 2.18 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 1.52 0.80 1.09 0.00 0.00 15 A 7.60 4.34 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 T 8.62 4.06 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 1.24 0.00 0.00 17 N 9.14 4.29 0.00 2.84 2.94 0.00 0.00 6.88 7.05 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 18 T 8.12 5.22 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 19 K 9.18 5.27 0.00 1.70 1.67 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.37 7.81 20 V 8.77 4.55 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 0.75 0.00 0.00 0.53 0.00 0.00 21 L 8.65 4.97 0.00 1.60 1.62 0.90 0.63 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 22 R 8.77 4.51 0.00 1.57 1.74 0.00 3.11 0.00 0.00 2.97 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.39 0.00 23 A 8.26 4.21 0.04 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 24 R 9.12 4.89 0.00 1.76 1.43 0.00 2.79 0.00 0.00 3.14 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.56 0.00 25 S 8.70 4.68 0.00 4.02 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 26 W 9.28 4.31 0.00 3.37 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 27 S 7.71 4.88 0.00 3.92 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.17 3.56 0.00 1.56 1.84 0.00 2.88 0.00 0.00 2.51 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.08 0.00 29 L 6.48 3.84 0.00 0.98 1.29 0.38 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 30 R 6.01 4.38 0.00 1.81 1.77 0.00 3.36 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.86 1.90 0.00 1.74 0.00 0.00 1.90 0.00 0.00 3.11 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.44 1.48 7.81 66 I 7.73 3.89 1.95 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 1.79 0.84 0.99 0.00 0.00 67 Y 8.34 4.10 0.00 3.12 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 68 L 7.95 3.77 0.00 1.74 1.68 1.00 1.04 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 69 E 8.07 3.90 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.59 0.00 70 A 7.95 3.92 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 71 L 7.98 3.70 0.00 1.06 1.43 0.81 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.15 3.92 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 73 Q 7.75 4.11 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.48 0.00 74 T 7.32 4.39 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 75 V 7.69 4.39 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 0.66 0.00 0.00 0.88 0.00 0.00 76 N 8.45 4.58 0.00 2.77 2.68 0.00 0.00 6.99 6.66 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 77 L 8.46 3.96 0.00 1.71 1.67 0.88 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.19 4.10 0.00 1.83 1.83 0.00 1.65 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.50 7.81 79 K 7.88 4.41 0.00 1.78 1.83 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.30 7.81 80 L 7.41 4.11 0.00 1.72 1.51 0.85 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.80 4.41 0.00 2.53 1.65 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 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115 A 7.89 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 0.00 116 G 7.94 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 D 7.68 4.05 0.00 1.90 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 0.00 118 L 7.42 4.12 0.00 1.71 1.65 0.70 0.97 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 0.00 119 R 8.11 4.11 0.00 1.83 1.99 0.00 3.12 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 120 A 7.79 4.00 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 0.00 121 A 7.63 4.06 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 F 7.66 4.89 0.00 3.02 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 4.36 0.00 2.19 2.19 0.00 3.77 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 124 D 8.20 4.49 0.00 2.76 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 0.00 125 D 7.67 4.93 0.00 2.69 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 0.00 126 N 8.22 4.75 0.00 2.68 2.75 0.00 0.00 7.05 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 L 7.99 4.16 0.00 1.70 1.65 0.83 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 128 N 8.68 4.82 0.00 2.80 2.78 0.00 0.00 6.75 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 0.00 129 I 8.41 5.00 1.89 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 1.28 0.67 0.93 0.00 0.00 130 L 9.53 4.49 0.00 1.65 1.62 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 5.27 0.00 2.04 1.98 0.00 3.78 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 2.00 2.04 0.00 *133 R 8.46 4.22 0.00 1.97 2.03 0.00 3.18 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 134 G 8.44 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 0.00 0.00 0.00 0.00 135 K 7.82 4.10 0.00 1.80 1.86 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.44 7.81 136 E 8.03 4.24 0.00 2.14 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.22 0.00 137 T 8.25 4.95 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 1.25 0.00 0.00 138 L 8.65 4.63 0.00 2.00 1.58 0.25 0.80 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 0.00 139 D 8.76 5.00 0.00 2.74 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 9.34 4.28 0.00 1.86 1.85 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.23 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 K 9.68 3.77 0.00 2.00 1.93 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.37 1.44 7.81 143 G 8.43 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 0.00 144 H 7.99 4.69 0.00 3.23 3.24 0.00 5.61 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 V 7.62 4.45 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 0.98 0.00 0.00 0.96 0.00 0.00 146 L 8.92 4.86 0.00 1.60 0.80 0.83 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.82 4.81 0.00 1.77 1.72 0.00 1.87 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.46 7.81 148 F 8.66 5.30 0.00 2.97 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 L 9.20 4.67 0.00 1.61 1.60 0.92 0.78 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 0.00 150 P 0.00 4.75 0.00 1.98 2.03 0.00 3.68 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.14 0.00 151 I 8.30 4.82 1.92 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 1.32 0.70 0.98 0.00 0.00 152 P 0.00 4.73 0.00 2.25 2.27 0.00 3.78 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 2.05 2.00 0.00 153 S 8.15 4.56 0.00 3.75 3.86 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 0.00 154 P 0.00 4.28 0.00 1.93 2.10 0.00 3.35 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.03 0.00 155 R 7.58 3.62 0.00 1.00 1.04 0.00 2.59 0.00 0.00 2.70 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 156 W 7.62 5.07 0.00 3.40 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 P 0.00 4.25 0.00 2.08 2.14 0.00 3.75 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 158 A 8.08 4.65 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 0.00 159 G 8.18 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 0.00 160 L 8.84 5.30 0.00 1.80 1.58 1.10 0.96 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 0.00 161 C 9.19 5.13 0.00 2.95 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 0.00 162 T 8.58 5.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 163 Y 8.92 5.07 0.00 2.91 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 0.00 164 D 8.42 4.80 0.00 2.83 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 0.00 165 V 8.08 3.30 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 0.79 0.00 0.00 1.07 0.00 0.00 166 Q 8.20 3.98 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.54 0.00 0.00 0.00 0.00 0.00 1.99 2.18 0.00 167 T 7.78 4.20 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 1.22 0.00 0.00 168 Q 7.89 3.17 0.00 2.20 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.92 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 169 I 6.63 4.42 1.50 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 0.92 0.65 -0.10 0.00 0.00 170 L 8.50 5.00 0.00 1.94 1.66 1.07 0.78 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 0.00 171 Y 9.31 4.77 0.00 2.95 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 0.00 172 T 8.71 4.47 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 1.11 0.00 0.00 173 D 7.99 4.27 0.00 2.92 1.72 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 0.00 174 K 6.89 4.17 0.00 0.81 1.34 0.00 1.74 0.00 0.00 1.61 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.00 0.41 7.81 175 I 7.19 3.85 1.30 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.51 -0.06 0.00 0.00 176 F 8.49 3.89 0.00 3.09 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 0.00 177 G 7.37 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 A 8.02 4.46 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 0.00 179 H 8.85 4.96 0.00 3.28 3.36 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 I 7.63 4.80 2.07 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.89 1.05 0.00 0.00 181 C 9.07 4.41 0.00 3.02 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 G 8.13 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 D 9.01 4.73 0.00 2.83 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 0.00 184 D 8.10 4.61 0.00 2.92 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 0.00 185 V 8.64 3.62 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 0.34 0.00 0.00 0.88 0.00 0.00 186 F 8.04 5.39 0.00 2.99 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 0.00 187 D 8.57 4.66 0.00 2.80 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 0.00 188 D 9.61 4.99 0.00 2.93 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 0.00 189 N 8.62 4.61 0.00 2.71 2.78 0.00 0.00 6.71 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 0.00 190 W 9.23 4.71 0.00 3.59 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 E 8.41 3.60 0.00 1.96 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 192 S 7.56 3.80 0.00 3.71 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 0.00 193 F 8.48 5.04 0.00 3.45 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 0.00 194 K 7.49 4.09 0.00 1.50 1.85 0.00 1.34 0.00 0.00 1.09 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.57 0.74 7.81 195 E 8.24 4.01 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 196 D 8.23 4.56 0.00 3.10 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 Q 8.46 4.41 0.00 2.72 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.83 0.00 0.00 0.00 0.00 0.00 2.61 2.86 0.00 198 R 8.25 3.14 0.00 1.74 1.95 0.00 3.01 0.00 0.00 2.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.50 0.00 199 Y 8.33 4.07 0.00 3.22 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 0.00 200 Y 8.57 3.92 0.00 3.26 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 F 8.38 4.06 0.00 3.11 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 0.00 202 N 8.18 4.41 0.00 2.66 2.75 0.00 0.00 7.17 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 0.00 203 C 7.67 4.05 0.00 2.48 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 L 7.20 4.36 0.00 1.19 1.60 0.05 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 *206 A 7.97 4.11 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 P 0.00 4.38 0.00 1.46 1.91 0.00 3.30 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 1.77 1.94 0.00 208 H 7.56 4.97 0.00 3.16 3.23 0.00 5.63 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 A 8.01 4.13 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 I 7.85 3.76 1.88 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 1.70 0.60 0.96 0.00 0.00 211 H 8.29 4.28 0.00 3.43 3.47 0.00 5.62 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 V 8.01 3.69 2.40 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 1.34 0.00 0.00 1.03 0.00 0.00 213 E 8.49 4.05 0.00 2.31 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 0.00 2.42 2.55 0.00 214 A 7.98 3.99 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 A 8.21 3.98 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 L 7.85 4.02 0.00 1.91 1.86 1.12 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 217 E 8.28 4.10 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 218 K 7.93 4.03 0.00 1.96 1.87 0.00 1.78 0.00 0.00 1.78 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.70 7.81 219 I 7.83 4.09 1.87 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 1.93 0.89 0.98 0.00 0.00 220 S 7.70 4.15 0.00 4.02 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 0.00 221 D 7.90 4.77 0.00 2.62 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 0.00 222 L 7.54 4.11 0.00 1.35 0.84 0.54 0.12 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 0.00 223 Q 8.31 4.30 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.68 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 224 V 8.17 4.71 1.98 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 0.90 0.00 0.00 0.99 0.00 0.00 225 R 8.75 4.37 0.00 1.57 1.83 0.00 3.30 0.00 0.00 3.08 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 226 L 7.39 4.44 0.00 1.61 1.29 1.05 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 227 Y 8.76 4.94 0.00 2.69 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 0.00 228 A 8.67 4.77 0.30 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 0.00 229 V 7.46 4.25 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.00 0.00 0.00 230 G 9.18 3.79 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 0.00 0.00 0.00 231 H 7.31 5.59 0.00 2.92 3.06 0.00 5.90 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 G 8.75 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 P 0.00 4.44 0.00 1.56 1.71 0.00 3.27 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.37 0.00 234 L 8.59 4.08 0.00 1.38 1.63 0.83 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 235 V 8.62 3.84 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 0.79 0.00 0.00 0.97 0.00 0.00 236 R 9.13 4.40 0.00 1.88 1.77 0.00 2.80 0.00 0.00 2.71 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.36 0.00 237 T 7.97 3.71 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 1.13 0.00 0.00 238 S 8.21 3.52 0.00 3.12 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 L 7.23 3.29 0.00 1.41 1.23 0.35 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 240 I 7.20 3.49 1.70 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.47 0.81 0.00 0.00 241 A 7.54 3.95 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 0.00 242 L 8.23 3.96 0.00 1.74 1.70 1.46 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 243 T 7.92 4.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 244 Q 8.19 3.93 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 245 A 7.96 3.19 0.31 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 0.00 246 Y 8.26 3.83 0.00 3.29 3.27 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 0.00 247 A 8.01 4.06 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 D 8.13 4.27 0.00 2.52 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 0.00 249 W 8.39 4.30 0.00 2.17 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 0.00 250 S 8.46 4.43 0.00 4.12 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 251 K 8.02 4.07 0.00 1.96 1.99 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.76 1.49 7.81 252 A 8.02 4.15 1.48 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 0.00 0.00 0.00 253 Q 8.30 3.88 0.00 2.41 2.34 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 2.50 2.04 0.00 254 K 7.93 4.03 0.00 2.12 1.89 0.00 1.83 0.00 0.00 1.81 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.55 7.81 255 L 7.45 3.98 0.00 1.83 1.75 0.97 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 256 E 8.11 4.00 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 2.53 2.34 0.00 257 H 8.22 4.26 0.00 3.32 3.38 0.00 5.70 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 0.00 258 H 7.73 4.08 0.00 3.20 3.56 0.00 5.85 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 H 8.53 4.05 0.00 3.24 3.44 0.00 5.84 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 0.00 260 H 8.10 4.58 0.00 3.23 3.32 0.00 5.58 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.