NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 S 4.5054 8.1933 115.4210 57.8604 64.6822 174.4682 7 Q 3.8453 8.7502 122.9117 57.2092 28.2252 177.5841 8 S 4.0975 8.9540 115.7047 61.8450 63.4258 175.7016 9 N 4.4367 7.9159 120.5725 55.8831 38.4379 177.1025 10 R 3.9863 8.2187 119.4000 59.7396 30.0266 177.8537 11 E 3.9354 8.0962 118.8300 59.1616 29.6256 178.7816 12 L 3.8093 7.8032 119.0980 57.5258 41.6102 179.6204 13 V 3.5371 7.6992 117.6341 66.1735 31.6402 178.0288 14 V 3.6987 7.7249 117.8087 65.9554 31.2524 177.5699 15 D 4.4221 8.1237 119.0450 56.7457 41.1886 177.9239 16 F 3.9382 8.6650 121.4391 61.2238 39.3720 176.9300 17 L 4.1758 8.7039 119.1696 57.9112 41.3456 179.6320 18 S 4.1332 8.0797 114.1196 61.7921 62.7752 175.8915 19 Y 4.0470 8.1494 123.3630 60.1045 38.2281 178.0291 20 K 3.6679 7.7189 119.7508 59.2657 32.6081 178.6192 21 L 4.2006 8.0430 119.3859 57.8671 41.6887 179.3353 22 S 4.7959 8.4145 114.7352 60.9783 61.9928 176.2627 23 Q 3.8986 7.4804 119.7118 57.8297 28.3045 177.6491 24 K 4.2918 7.5509 117.8063 55.9126 32.5661 175.7253 25 G 4.0440 7.7289 110.8653 45.9054 0.0000 174.2456 26 Y 4.5846 6.7580 116.2739 58.5422 38.1933 174.8366 27 S 4.7669 7.9626 112.7059 58.2851 65.4408 173.2016 28 A 4.3222 7.8398 122.0151 52.0037 21.5232 177.4964 29 G 3.8700 8.6507 105.5454 45.4368 0.0000 173.7497 30 G 3.9605 8.1287 114.3925 46.4499 0.0000 171.1534 31 G 4.1348 8.2377 106.9857 44.7388 0.0000 174.2741 32 G 3.9302 9.0307 107.5029 42.2645 0.0000 174.8536 33 G 4.6374 7.9609 118.6566 46.7011 0.0000 172.2631 34 G 3.5650 7.5484 106.6501 49.6372 0.0000 178.3190 35 G 4.3837 7.6035 116.8897 44.4529 0.0000 171.0404 36 G 4.2466 8.3274 112.3995 45.4599 0.0000 172.6013 37 M 3.1243 8.7356 114.7136 55.9891 29.9495 178.9259 38 A 3.7815 8.1041 122.5797 55.2125 19.1647 180.2775 *89 A 4.2631 7.9787 117.3972 52.3575 20.7323 178.8122 90 V 3.6486 7.7729 114.4636 66.0317 31.4530 178.0710 91 K 3.7570 7.9230 118.1189 59.4820 31.9161 178.8999 92 Q 3.7915 7.9315 119.2125 59.3129 29.0630 178.0060 93 A 4.0713 8.2628 121.8572 55.2340 18.2411 179.4702 94 L 4.2057 8.3216 118.6614 58.5251 42.4046 179.0503 95 R 3.7543 8.1437 118.3451 59.4834 29.8833 178.8412 96 E 3.9954 8.3266 117.6752 59.5129 29.6188 179.2682 97 A 4.3324 8.4164 120.8940 55.2637 18.1889 179.9803 98 G 3.9249 8.8130 104.7389 47.9916 0.0000 175.6004 99 D 4.5594 8.2425 121.0533 57.4781 40.8914 178.6916 100 E 4.0392 8.2164 119.2212 59.0779 29.3230 178.1534 101 F 4.1392 7.9613 119.7387 61.6771 39.4620 176.7104 102 E 3.4665 7.9349 116.7575 59.5224 29.4165 178.4603 103 L 3.8342 7.4583 117.8467 58.1286 42.2056 178.1566 104 R 3.9626 7.9664 117.5549 56.6854 30.9000 172.3778 105 Y 3.1641 8.4949 123.7590 57.5219 35.4388 170.1313 106 R 3.9550 7.9404 124.7275 58.3507 30.7464 179.3330 107 R 4.3276 7.5455 117.6586 55.6815 32.2904 175.8385 108 A 3.7435 8.3523 120.5311 51.2914 15.0882 176.2402 109 F 5.1602 7.5634 132.7873 58.2374 40.9113 176.3371 110 S 3.2648 7.7035 115.1236 61.0165 62.9682 175.9123 111 D 4.4641 7.8329 121.1158 56.8367 40.7731 178.3933 112 L 4.0065 7.9109 119.3171 58.2958 41.4765 179.3572 113 T 3.7776 7.6006 109.5604 65.2299 68.0753 175.9936 114 S 4.2305 7.7758 114.4746 60.6892 62.4442 175.3706 115 Q 4.1601 7.9502 120.9348 57.1117 28.7249 177.2371 116 L 4.7306 7.1687 120.1910 53.4705 44.2984 175.8380 117 H 4.8434 8.5821 123.6052 53.0094 28.5759 172.3280 118 I 3.7438 8.2123 122.2389 61.7343 38.4281 175.1083 119 T 4.7631 8.5907 116.1661 59.0315 71.8519 172.8934 120 P 4.1790 0.0000 0.0000 65.4889 31.4768 177.8426 121 G 3.8702 7.9833 105.3010 47.1972 0.0000 174.3649 122 T 3.9720 7.6592 115.5932 64.1607 69.3105 173.0801 123 A 5.0165 8.3443 126.2468 50.3652 21.8601 177.1512 124 Y 2.0000 8.1359 119.8914 60.2507 38.4596 178.6634 125 Q 3.5988 7.7850 118.4749 58.8446 27.6540 178.6229 126 S 4.0812 7.8290 114.1160 61.0211 62.2585 175.8542 127 F 4.6085 7.7501 123.0430 60.7816 39.2441 176.8574 128 E 3.3037 7.8276 119.4700 58.7244 29.1688 178.7058 129 Q 3.8070 7.5353 117.6682 59.3096 28.7030 178.9371 130 V 3.3195 6.8931 120.4463 65.3947 31.5826 178.2530 131 V 3.0927 6.5864 117.9090 65.5530 30.9572 177.6055 132 N 4.3332 7.8598 115.7667 56.4706 38.4733 176.5095 133 E 3.9465 7.4645 119.4893 59.0958 29.7077 178.2800 134 L 3.7555 6.9121 118.2892 56.8738 42.9590 177.7014 135 F 5.0176 7.4648 115.8322 56.5411 39.0059 176.1711 136 R 4.2462 7.7618 117.4479 57.7133 30.7037 177.0398 137 D 4.7615 7.9077 118.1052 53.7982 41.3795 175.6697 138 G 3.7753 8.8138 105.4521 44.3689 0.0000 173.0694 139 V 4.1834 7.2725 116.4312 60.3225 34.5914 174.8442 140 N 4.0823 7.4991 121.2520 50.2580 40.8171 175.3574 141 W 4.8667 8.7587 121.5140 60.2061 28.8600 178.8394 142 G 3.7771 8.1566 103.9792 48.2400 0.0000 175.5379 143 R 4.1205 8.7376 121.4758 58.3960 29.9280 178.8785 144 I 3.7880 8.4158 120.3277 64.8150 37.1284 178.3744 145 V 3.6936 7.7951 118.4835 65.8327 31.1803 177.6931 146 A 3.0040 7.6755 120.5938 54.7933 18.1825 179.0335 147 F 3.9317 7.8475 119.1417 61.6892 39.2893 177.4586 148 F 4.1152 7.8603 116.3729 60.7286 38.3900 177.2434 149 S 4.4551 8.1523 112.7948 61.8135 61.8639 176.3489 150 F 4.2905 8.7159 123.5843 61.0883 39.1816 177.4759 151 G 3.7790 8.0957 105.1394 47.7459 0.0000 175.6888 152 G 3.8690 8.5696 108.4578 47.6388 0.0000 175.3419 153 A 4.0291 7.7583 122.8661 54.9092 18.3266 179.6917 154 L 3.8070 7.4510 117.3842 58.0616 41.6670 179.5546 155 C 4.0361 7.9805 116.5657 62.9153 28.0652 176.3056 156 V 3.7138 7.9771 119.8466 65.9760 30.8832 177.7458 157 E 3.9141 8.2264 119.3535 59.1778 29.5252 178.7188 158 S 4.0412 8.0912 114.4395 61.6465 62.8459 176.7552 159 V 3.3108 7.6379 121.7202 65.6416 30.9306 177.6643 160 D 4.5124 7.6414 117.2979 56.5895 40.6734 177.7287 161 K 4.4531 7.6221 117.2581 55.8626 34.7870 176.6420 162 E 3.7298 7.8262 114.9664 57.4142 27.6999 175.9472 163 M 4.8057 7.9913 118.4958 53.9463 34.1433 177.6017 164 Q 3.9204 8.0827 120.1507 58.8555 29.8038 179.8083 165 V 3.6241 7.8907 117.8033 65.1528 30.9185 178.3354 166 L 3.8019 7.9057 119.2208 57.0638 41.3250 179.2368 167 V 3.4516 7.8398 119.0852 66.3270 31.4636 177.8117 168 S 4.0248 7.4630 111.8096 61.4154 62.0005 176.0663 169 R 3.5703 7.5757 120.5388 59.5292 29.8733 178.1046 170 I 3.2075 7.3482 119.1430 64.2971 37.0777 178.1268 171 A 4.0325 7.9373 121.0544 55.1682 18.2189 179.5902 172 A 4.0075 7.8478 118.8248 55.2789 18.4411 179.7390 173 W 4.2956 8.5069 117.8070 60.3339 28.9609 178.8018 174 M 4.7097 8.5301 118.3068 58.5604 31.3408 178.4011 175 A 4.1938 8.1275 119.5952 55.8563 18.7956 179.4429 176 T 3.9632 8.2860 114.0401 67.1284 68.4457 176.0535 177 Y 4.2199 8.4188 120.9500 61.0848 38.8240 178.5748 178 L 3.9098 8.7358 120.1856 56.6039 41.3945 177.6770 179 N 4.8591 7.8680 115.5332 52.8342 39.8474 175.3685 180 D 4.5304 7.3959 115.3171 54.0878 43.1485 175.1759 181 H 4.4919 7.6550 117.8833 55.6508 37.5156 175.8196 182 L 3.9309 7.2732 118.6630 56.6296 41.7667 178.4437 183 E 3.8979 7.9083 119.6097 59.1468 29.2521 177.1170 184 P 4.1669 0.0000 0.0000 65.3683 31.6463 178.1596 185 W 4.0112 7.9418 126.3045 60.5986 30.7223 177.6579 186 I 3.0840 8.3450 120.1217 64.6549 36.2783 178.1049 187 Q 3.9522 7.7957 119.1010 57.9083 29.1164 176.3228 188 E 4.5284 7.7538 120.3614 55.0447 30.8815 176.2685 189 N 4.3786 7.6320 111.4832 52.1841 39.7240 175.0566 190 G 4.1958 7.9406 103.6557 46.7413 0.0000 175.9260 191 G 4.3508 7.9595 108.9142 45.7864 0.0000 174.2970 192 W 4.3064 8.8187 116.2421 59.3888 29.4250 177.5511 193 D 4.4496 8.5521 117.7942 58.0317 40.4011 178.7339 194 T 3.9763 7.8066 115.8474 66.3579 68.4372 176.5047 195 F 3.2319 7.7543 122.7282 60.8730 38.9155 177.3239 196 V 3.8792 7.6410 117.9526 64.9826 31.6254 177.1764 197 E 4.0067 7.9160 117.8385 58.6574 29.4817 178.1241 198 L 4.3192 7.7541 117.8718 55.2607 42.6189 176.3531 199 Y 4.3422 7.4550 118.9688 55.8320 38.8150 176.0053 200 G 3.7484 8.1462 112.2434 46.1709 0.0000 171.3418 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 6 S 8.19 4.51 0.00 4.13 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.75 3.85 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.82 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 8 S 8.95 4.10 0.00 4.02 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 N 7.92 4.44 0.00 2.98 3.08 0.00 0.00 6.98 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 10 R 8.22 3.99 0.00 1.92 2.11 0.00 3.23 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 11 E 8.10 3.94 0.00 2.13 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 2.26 2.35 0.00 12 L 7.80 3.81 0.00 1.60 1.22 0.04 0.35 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 13 V 7.70 3.54 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.29 0.00 0.00 14 V 7.72 3.70 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 0.96 0.00 0.00 0.99 0.00 0.00 15 D 8.12 4.42 0.00 2.82 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 16 F 8.67 3.94 0.00 2.83 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 17 L 8.70 4.18 0.00 1.80 1.77 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 18 S 8.08 4.13 0.00 4.09 4.15 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 19 Y 8.15 4.05 0.00 2.94 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 20 K 7.72 3.67 0.00 1.78 1.94 0.00 1.69 0.00 0.00 1.86 0.00 0.00 3.03 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.51 1.49 7.81 21 L 8.04 4.20 0.00 1.91 1.82 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.41 4.80 0.00 3.96 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 7.48 3.90 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.04 0.00 0.00 0.00 0.00 0.00 2.08 1.61 0.00 24 K 7.55 4.29 0.00 1.37 1.44 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.52 7.81 25 G 7.73 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 6.76 4.58 0.00 3.15 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.96 4.77 0.00 3.95 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 28 A 7.84 4.32 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 29 G 8.65 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 G 8.13 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 31 G 8.24 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 32 G 9.03 3.93 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 0.00 0.00 0.00 33 G 7.96 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 0.00 0.00 0.00 0.00 34 G 7.55 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 7.60 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.33 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 M 8.74 3.12 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 38 A 8.10 3.78 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *89 A 7.98 4.26 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 90 V 7.77 3.65 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 0.81 0.00 0.00 0.97 0.00 0.00 91 K 7.92 3.76 0.00 1.94 1.86 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.42 7.81 92 Q 7.93 3.79 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 93 A 8.26 4.07 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.32 4.21 0.00 1.90 1.85 0.97 0.07 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 95 R 8.14 3.75 0.00 1.67 1.06 0.00 2.90 0.00 0.00 2.89 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.44 0.00 96 E 8.33 4.00 0.00 2.05 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 2.33 2.55 0.00 97 A 8.42 4.33 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 0.00 0.00 0.00 0.00 0.00 98 G 8.81 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 D 8.24 4.56 0.00 3.13 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 E 8.22 4.04 0.00 2.17 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 2.40 2.44 0.00 101 F 7.96 4.14 0.00 3.33 3.42 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 0.00 102 E 7.93 3.47 0.00 1.88 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.63 0.00 103 L 7.46 3.83 0.00 1.85 1.75 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.97 3.96 0.00 1.94 1.96 0.00 3.54 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 105 Y 8.49 3.16 0.00 2.87 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 0.00 106 R 7.94 3.95 0.00 1.74 1.90 0.00 3.35 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 107 R 7.55 4.33 0.00 1.82 1.94 0.00 3.38 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 108 A 8.35 3.74 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 0.00 109 F 7.56 5.16 0.00 3.05 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 0.00 110 S 7.70 3.26 0.00 3.70 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 D 7.83 4.46 0.00 2.75 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 0.00 112 L 7.91 4.01 0.00 1.74 1.87 0.93 0.74 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 0.00 113 T 7.60 3.78 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 1.10 0.00 0.00 114 S 7.78 4.23 0.00 3.91 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 0.00 115 Q 7.95 4.16 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.35 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 116 L 7.17 4.73 0.00 1.66 1.83 1.13 1.45 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 0.00 117 H 8.58 4.84 0.00 3.16 3.20 0.00 5.81 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 8.21 3.74 1.90 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 1.22 0.49 0.85 0.00 0.00 119 T 8.59 4.76 4.26 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 1.28 0.00 0.00 120 P 0.00 4.18 0.00 2.06 2.18 0.00 3.66 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 2.02 2.08 0.00 121 G 7.98 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 T 7.66 3.97 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 1.57 0.00 0.00 123 A 8.34 5.02 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 Y 8.14 2.00 0.00 1.81 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Q 7.78 3.60 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.66 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 126 S 7.83 4.08 0.00 3.94 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 0.00 127 F 7.75 4.61 0.00 3.55 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 0.00 128 E 7.83 3.30 0.00 1.33 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 0.00 2.24 2.44 0.00 129 Q 7.54 3.81 0.00 2.17 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.56 0.00 0.00 0.00 0.00 0.00 2.40 2.25 0.00 130 V 6.89 3.32 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 0.29 0.00 0.00 0.91 0.00 0.00 131 V 6.59 3.09 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 0.00 0.00 0.59 0.00 0.00 -0.48 0.00 0.00 132 N 7.86 4.33 0.00 2.82 2.80 0.00 0.00 7.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 E 7.46 3.95 0.00 1.75 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 2.23 2.27 0.00 134 L 6.91 3.76 0.00 1.25 0.91 0.66 -0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 135 F 7.46 5.02 0.00 3.04 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 R 7.76 4.25 0.00 1.88 2.14 0.00 3.02 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 137 D 7.91 4.76 0.00 2.63 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.81 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 V 7.27 4.18 0.70 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 -0.46 0.00 0.00 0.49 0.00 0.00 140 N 7.50 4.08 0.00 2.98 2.74 0.00 0.00 6.19 8.90 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 0.00 141 W 8.76 4.87 0.00 3.33 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 0.00 142 G 8.16 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.74 4.12 0.00 2.07 1.81 0.00 3.11 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.80 0.00 144 I 8.42 3.79 2.17 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.64 0.99 0.00 0.00 145 V 7.80 3.69 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 0.93 0.00 0.00 1.32 0.00 0.00 146 A 7.68 3.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.85 3.93 0.00 3.24 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 0.00 148 F 7.86 4.12 0.00 2.67 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 0.00 149 S 8.15 4.46 0.00 3.81 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 0.00 150 F 8.72 4.29 0.00 3.19 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 0.00 151 G 8.10 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 G 8.57 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 A 7.76 4.03 1.33 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 0.00 0.00 0.00 154 L 7.45 3.81 0.00 1.73 1.63 1.12 0.77 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 0.00 155 C 7.98 4.04 0.00 3.18 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 V 7.98 3.71 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 1.19 0.00 0.00 1.06 0.00 0.00 157 E 8.23 3.91 0.00 2.13 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 2.24 2.26 0.00 158 S 8.09 4.04 0.00 4.11 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 0.00 159 V 7.64 3.31 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 -0.29 0.00 0.00 0.72 0.00 0.00 160 D 7.64 4.51 0.00 2.86 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 0.00 161 K 7.62 4.45 0.00 1.62 1.77 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.55 7.81 162 E 7.83 3.73 0.00 2.03 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 2.22 0.00 163 M 7.99 4.81 0.00 1.96 2.04 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.45 0.00 164 Q 8.08 3.92 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.13 0.00 165 V 7.89 3.62 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.87 0.00 0.00 166 L 7.91 3.80 0.00 1.85 1.59 0.84 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 167 V 7.84 3.45 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 1.03 0.00 0.00 0.87 0.00 0.00 168 S 7.46 4.02 0.00 4.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 R 7.58 3.57 0.00 1.64 1.47 0.00 3.17 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 1.07 0.00 170 I 7.35 3.21 1.85 0.00 0.00 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 1.20 0.33 0.80 0.00 0.00 171 A 7.94 4.03 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 0.00 172 A 7.85 4.01 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 0.00 173 W 8.51 4.30 0.00 3.28 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 M 8.53 4.71 0.00 2.66 2.54 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.63 0.00 175 A 8.13 4.19 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 T 8.29 3.96 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 177 Y 8.42 4.22 0.00 3.58 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 0.00 178 L 8.74 3.91 0.00 2.15 1.77 1.39 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 7.87 4.86 0.00 2.74 2.80 0.00 0.00 7.06 7.99 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 0.00 180 D 7.40 4.53 0.00 2.64 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 H 7.65 4.49 0.00 2.28 2.58 0.00 5.69 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 L 7.27 3.93 0.00 1.39 1.30 0.20 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 183 E 7.91 3.90 0.00 2.16 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 184 P 0.00 4.17 0.00 2.00 2.05 0.00 3.66 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 1.92 2.07 0.00 185 W 7.94 4.01 0.00 3.17 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 I 8.34 3.08 1.92 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.29 0.66 0.00 0.00 187 Q 7.80 3.95 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.45 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 188 E 7.75 4.53 0.00 1.78 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 0.00 2.04 2.16 0.00 189 N 7.63 4.38 0.00 1.44 1.81 0.00 0.00 6.74 7.40 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 0.00 190 G 7.94 4.20 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 0.00 191 G 7.96 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 0.00 192 W 8.82 4.31 0.00 3.48 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 0.00 193 D 8.55 4.45 0.00 2.83 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 T 7.81 3.98 4.45 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 1.37 0.00 0.00 195 F 7.75 3.23 0.00 1.51 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 V 7.64 3.88 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 1.07 0.00 0.00 1.15 0.00 0.00 197 E 7.92 4.01 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 198 L 7.75 4.32 0.00 1.58 0.92 1.12 0.65 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 0.00 199 Y 7.45 4.34 0.00 2.11 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 G 8.15 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.