NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.7482 8.1633 120.2818 54.8198 34.7112 174.1613 2 V 4.8734 7.7465 111.0393 57.9044 36.0325 173.5096 3 F 5.2161 9.5533 118.9347 55.2143 41.6123 173.6378 4 E 5.2540 8.8738 119.0709 54.8728 32.4525 174.8869 5 E 4.9085 9.5851 123.0268 54.7098 34.6518 174.1035 6 N 5.3735 8.7417 117.6013 51.8245 42.0252 175.1419 7 S 4.6019 9.2119 119.2690 57.3593 63.2507 176.2000 8 D 4.3012 8.3827 129.3279 55.1072 40.2981 175.4110 9 E 4.3762 9.0878 128.9593 57.1757 30.4778 175.6072 10 V 4.1380 7.7928 121.8851 61.7490 33.0665 174.4759 11 R 4.7233 8.8806 129.8885 55.5544 31.6151 174.9291 12 V 4.7582 9.2758 127.7982 61.4251 33.6850 174.2192 13 I 4.8541 9.0493 129.8372 60.1066 39.2380 174.7016 14 T 4.8442 8.3673 125.0614 61.3377 70.3792 174.2783 15 L 4.2016 8.4599 127.9112 54.1723 42.2587 177.0688 16 D 4.8893 8.6481 124.4864 53.4380 40.4737 175.2071 17 H 4.1516 8.2961 117.1433 55.5557 30.8492 172.8157 18 P 4.3067 0.0000 0.0000 65.6012 31.5783 176.6945 19 N 4.5635 8.3507 116.8966 52.6169 39.6133 175.6408 20 K 4.0532 8.6025 124.1721 59.2948 33.0706 177.5351 21 H 4.6641 8.9062 117.0823 54.9853 29.3454 174.4906 22 N 3.9775 7.8358 116.6130 53.3195 36.2691 173.0927 23 P 4.2807 0.0000 0.0000 62.9314 32.2908 177.7022 24 F 4.4512 8.3623 121.6761 56.8383 37.3149 176.1600 25 S 4.5499 7.9519 121.1195 57.1021 65.6527 174.9612 26 R 4.0654 8.5065 121.3498 60.0120 29.6540 178.3431 27 T 3.8511 7.9077 114.7968 66.7310 68.5641 176.1667 28 L 3.9652 7.8299 121.5844 58.1277 42.0145 178.7395 29 E 4.0165 8.4318 118.5888 59.7380 29.3167 179.5303 30 T 3.8516 7.9744 115.6200 66.7895 68.4943 176.9046 31 S 4.1252 8.2673 117.1825 61.5419 62.8550 177.0746 32 V 3.6353 7.9469 120.7937 65.9724 31.3593 178.1743 33 K 3.9999 8.2502 118.3773 59.7050 31.8622 179.0926 34 D 4.3561 8.4227 119.0199 57.3188 40.7425 178.7061 35 A 4.3002 8.1869 122.7449 54.6590 18.3664 179.7351 36 L 3.9920 8.1936 117.3523 57.8303 41.5987 179.6061 37 A 4.0263 8.1052 120.8478 55.1072 18.3146 179.9273 38 R 3.8589 8.2800 116.5201 59.3584 29.9448 179.0784 39 A 4.0163 7.9003 119.3726 55.3169 18.4585 178.9669 40 N 4.3959 8.1568 114.2141 56.1290 39.1063 176.3061 41 A 4.5335 7.6221 120.4459 52.0991 19.5536 176.5762 42 D 4.4768 7.8575 118.1958 53.7199 41.0096 176.7746 43 D 4.5048 8.6641 127.7090 56.8225 40.7474 177.7911 44 S 4.2780 8.4778 113.2852 59.2550 63.5371 173.6146 45 V 4.6206 7.4392 122.0592 61.6634 32.1550 175.2247 46 R 4.6868 8.8867 124.7148 56.0412 31.8338 175.2968 47 A 4.6987 7.5009 119.3111 50.8959 22.9777 175.1737 48 V 4.8266 8.9082 119.0420 61.1470 35.3329 174.3674 49 V 4.9615 9.0750 127.6823 61.1041 34.2433 174.1023 50 V 5.0704 9.0015 127.8743 61.4010 34.0710 173.6212 51 Y 5.5181 9.0671 128.2665 56.0524 41.9537 176.1662 52 G 3.3655 8.2006 113.7373 45.9436 0.0000 174.2491 53 G 3.6297 5.9545 105.7853 44.3373 0.0000 172.6712 54 A 4.1789 8.2836 122.5560 53.1898 18.8695 177.5490 55 E 3.8123 8.8692 121.7380 57.5750 27.1954 174.2657 56 R 4.6956 7.3648 114.4062 54.4267 34.2012 175.1534 57 S 4.7059 8.3825 114.9028 57.7060 64.3298 175.1174 58 F 4.0901 8.8819 125.9005 60.0732 39.2552 175.2227 59 S 4.5863 8.1636 107.6479 57.2758 66.0930 175.7807 60 A 4.0147 9.3353 129.5490 53.1422 18.4632 178.6124 61 G 3.8838 8.2550 104.0325 44.2528 0.0000 173.5475 62 G 4.1287 8.4603 107.6231 44.9038 0.0000 173.5136 63 D 4.3620 8.5051 120.0068 53.6925 42.0454 177.3539 64 F 4.6375 8.6020 126.5910 60.5257 38.7547 177.4283 65 N 4.3982 8.4460 117.8948 56.7806 38.7414 177.0177 66 E 4.0358 8.5441 119.9465 61.4858 29.5695 181.3196 67 V 3.1755 7.4181 118.6479 65.6518 31.3669 178.3694 68 K 3.9704 7.9647 116.5443 58.5976 31.8218 178.2678 69 Q 4.4926 7.2887 116.0723 55.9710 29.3483 176.1595 70 L 3.9023 7.3886 123.4576 55.3798 41.8918 177.1907 *72 R 4.1850 8.1629 120.0893 58.9214 32.0288 171.8819 73 S 4.5490 8.2230 110.5596 62.5264 63.6644 176.0985 74 E 3.9896 8.2450 121.6723 59.4911 29.0860 179.0739 75 D 4.3970 8.0325 118.2336 57.3528 40.9948 178.5807 76 I 3.8297 7.3468 118.9739 64.5905 37.1718 178.3804 77 E 4.0618 8.2911 119.3797 59.2894 29.1803 179.4008 78 E 3.9294 8.2174 118.4052 59.1595 29.6599 178.8958 79 W 4.2582 8.0658 128.0286 60.7413 30.7023 177.9446 80 I 3.0167 7.8938 119.4577 64.1991 36.4819 178.0459 81 D 4.2256 7.8627 119.4675 57.4412 40.6698 178.9957 82 R 3.7407 7.9317 118.4914 59.1908 29.8749 179.2554 83 V 2.9274 7.1975 117.6115 65.9373 31.3974 178.2408 84 I 3.4840 7.3734 119.4523 64.1297 36.8946 178.0575 85 D 4.2167 8.4144 120.1534 57.1880 40.2678 178.3670 86 L 3.8171 7.5355 120.6444 58.7064 41.9444 178.8695 87 Y 4.4596 7.1810 116.2396 61.1885 37.4326 178.2405 88 Q 3.9083 8.3716 119.0374 58.7706 28.5242 178.5801 89 A 3.9710 7.8351 121.0693 55.2040 18.7689 179.6565 90 V 3.4775 7.3541 115.2650 66.1195 31.4093 178.4146 91 L 3.9417 7.6648 117.2472 57.1980 41.4496 178.2372 92 N 4.7887 7.9124 114.1994 52.1943 38.7938 175.1210 93 V 3.9350 7.1382 121.5766 62.8325 31.5579 175.1501 94 N 4.8489 9.4454 124.9060 53.2670 38.6296 175.0125 95 K 4.7396 7.6390 117.5306 53.7798 34.7358 174.3846 96 P 4.6598 0.0000 0.0000 63.8126 32.0350 175.2163 97 T 5.2157 9.2373 113.6505 59.9691 71.9024 172.8658 98 I 5.1074 9.2385 125.3733 59.5134 40.9570 174.0078 99 A 4.5367 8.7365 128.7122 50.2683 20.7277 175.6485 100 A 4.7293 8.9168 126.2043 50.5054 19.9814 176.0605 101 V 3.8736 8.6943 122.8830 62.4206 32.8335 174.3836 102 D 5.0839 8.4777 126.8781 51.8850 45.1191 176.8862 103 G 3.6046 8.4555 109.7876 47.2112 0.0000 173.4065 104 Y 4.8519 8.8850 121.2702 56.3031 40.2285 174.3158 105 A 4.9658 8.8669 125.7899 50.3002 20.8497 174.4093 106 I 4.9999 8.7803 122.0127 60.1612 40.5104 175.7635 107 G 4.2391 9.6562 116.1414 45.7198 0.0000 176.3164 108 M 4.6889 8.8809 126.7915 57.6380 31.6329 177.8214 109 G 4.0772 8.7682 105.9880 47.7963 0.0000 175.6639 110 F 4.5032 8.4219 122.5308 61.3865 39.4397 177.0782 111 Q 3.9690 8.4459 116.7057 58.9688 28.8467 178.3389 112 F 4.4346 9.0574 121.6944 61.5193 39.5546 176.9662 113 A 4.1280 8.6071 119.9632 55.2204 17.9733 179.2050 114 L 4.3817 7.9556 115.3667 57.1114 41.7941 178.5483 115 M 4.1928 7.9314 117.7150 55.6302 32.4902 176.5154 116 F 4.4582 7.4362 116.7757 56.1708 40.0256 175.4277 117 D 4.7437 8.5143 123.5651 57.2913 41.2920 176.9483 118 Q 4.9164 8.1592 115.0019 54.2361 33.9318 174.3742 119 R 5.0837 10.0435 120.7247 54.4611 33.9386 174.5147 120 L 5.3060 8.9082 123.5187 53.0735 45.2265 175.3733 121 M 5.3436 8.7019 118.4443 53.1959 35.2130 174.5599 122 A 4.9280 8.7118 121.6220 51.4926 19.4857 179.2047 123 S 4.0654 8.9027 115.2141 60.6292 63.1794 175.4063 124 T 4.3127 7.7446 109.0130 61.1897 68.9310 173.9777 125 A 4.4556 7.7040 124.2940 51.7892 20.1320 177.0215 126 N 5.2686 8.6181 115.6550 51.7204 43.2006 173.8364 127 F 4.9826 9.2649 121.8597 56.0280 41.5379 175.1460 128 V 4.8453 9.0198 121.7941 61.5636 35.1628 173.7448 129 M 5.1162 8.8363 126.6546 53.2108 31.0032 172.8832 130 P 4.8719 0.0000 0.0000 62.5276 32.7737 178.1455 131 E 3.6918 8.6079 120.5743 60.2554 29.2897 179.2859 132 L 4.0039 7.9170 117.9936 57.6616 41.5382 179.2849 133 K 3.9803 8.1573 118.1949 59.1551 32.1595 177.3159 134 H 4.7767 7.6509 113.8341 54.7921 28.9319 175.3553 135 G 3.8331 7.7279 108.5485 46.2232 0.0000 173.4550 136 I 4.2630 7.5835 120.2836 58.3944 38.8604 176.2474 137 G 3.8100 8.6312 113.9161 46.3228 0.0000 172.6660 138 C 4.9003 8.4901 122.6645 58.6539 32.5112 176.0513 139 S 4.1741 8.2521 116.2897 60.7083 62.6813 175.8672 140 V 3.6787 7.8080 121.6491 65.9013 31.5097 178.0515 141 G 3.6088 8.1633 104.7973 47.6805 0.0000 175.3414 142 A 3.8684 8.3789 123.1186 54.9024 18.5420 179.4959 143 A 3.9827 8.1113 119.3337 55.3720 18.3348 180.0561 144 I 3.8058 7.7126 117.9664 64.6451 37.2705 178.5383 145 L 4.2544 7.4854 122.6409 57.4036 41.7828 179.1325 146 G 3.6792 8.4021 106.1994 47.5268 0.0000 175.5943 147 F 3.9875 7.8671 122.2035 61.2588 39.6232 177.1367 148 T 3.8346 8.1872 109.6434 64.0423 68.6435 175.4883 149 H 4.6552 8.3737 115.1542 54.3958 30.3211 174.6927 150 G 4.0679 7.8897 105.2718 45.5923 0.0000 175.0023 151 F 4.0783 8.7215 120.3007 61.3366 39.4499 177.5003 152 S 4.0519 8.1492 113.4884 61.5786 62.9846 176.3264 153 T 3.8366 7.8238 118.8992 66.4671 68.1790 175.9308 154 M 3.7533 7.7424 119.9705 58.7085 32.2262 178.0291 155 Q 3.2599 7.7511 118.3330 58.7908 28.9055 178.7108 156 E 3.9317 7.9256 119.9233 59.4477 29.8065 179.0418 157 I 3.6604 7.5221 119.8432 64.3571 37.0125 178.4862 158 I 3.8126 7.5416 112.2310 63.3285 37.5729 176.9423 159 Y 4.7489 7.5129 117.3059 59.6898 38.2704 177.1224 160 Q 4.2531 8.1439 118.0331 55.9770 29.5533 175.4536 161 C 4.2314 7.8219 115.6673 60.7685 26.4612 173.0289 162 Q 4.5709 7.9254 115.7277 54.4520 30.3378 175.6766 163 S 4.4528 8.5795 115.4571 58.3282 63.2570 173.3707 164 L 4.7176 9.3699 129.0463 53.4299 42.7727 176.3950 165 D 5.2046 8.5796 124.3399 52.3103 41.5616 177.1654 166 A 3.9610 8.8540 119.5433 55.2910 18.1421 177.7861 167 P 4.1302 0.0000 0.0000 65.8885 31.3704 178.8512 168 R 3.7797 7.9073 116.8543 59.4613 29.9991 178.3913 169 C 4.1315 8.3706 116.9809 62.5018 28.0560 176.1739 170 V 3.4932 8.0230 120.2626 66.1271 30.9387 177.6078 171 D 4.2676 7.8491 116.2978 57.4791 41.1255 177.3106 172 Y 4.4290 7.8302 115.1268 58.1468 38.2303 175.6032 173 R 3.9073 7.8059 117.8439 57.2926 28.0450 177.4750 174 L 4.1350 8.3400 119.1838 56.5088 42.0849 177.7591 175 V 4.5166 7.1925 109.6129 59.6847 35.4558 174.5717 176 N 4.8355 9.0261 118.3893 54.5899 39.9825 175.5959 177 Q 4.6554 7.7864 115.7921 54.3934 33.6847 173.6070 178 V 4.9574 8.3248 121.4863 61.3971 34.1240 174.8338 179 V 4.6485 8.5084 119.5686 59.3771 36.8194 174.6796 180 E 4.3516 8.6327 120.4810 56.2830 30.3834 178.3420 181 S 4.1670 9.0029 118.8991 62.2353 62.6949 177.4930 182 S 4.2919 8.1514 113.8883 60.1558 63.2054 174.9117 183 A 4.5702 7.9561 123.2829 51.7340 19.5713 178.0549 184 L 3.8171 7.6036 119.6564 57.9632 42.1794 178.7043 185 L 3.5279 7.5539 119.7710 58.0558 41.9344 178.4624 186 D 4.2678 7.9145 118.1812 57.2936 40.8180 178.4477 187 A 3.9388 8.0382 121.1166 54.8838 18.3262 179.6634 188 A 3.8591 8.0182 119.3696 55.3776 18.4503 179.8059 189 I 3.5656 7.9468 118.7317 64.7457 37.1177 178.6333 190 T 3.8858 8.1548 116.7463 66.9715 68.3586 176.5451 191 Q 3.9558 8.0459 119.4865 58.9792 28.6363 178.9143 192 A 3.9172 7.9949 121.7364 55.2531 18.2484 179.4278 193 H 4.3013 8.2247 116.2970 58.3851 28.5542 178.1033 194 V 3.4542 7.3967 118.7429 66.4492 31.5647 177.8300 195 M 2.7091 7.8265 117.9194 57.5565 31.4623 178.6065 196 A 3.8302 7.7204 120.6810 54.6184 18.5579 179.2264 197 S 4.2683 7.3172 111.1748 59.4790 63.6447 174.5067 198 Y 4.4610 6.7094 121.4717 57.2411 38.3582 174.7565 199 P 4.2827 0.0000 0.0000 63.3012 32.8716 177.3511 200 A 4.1372 8.6955 124.0523 55.2537 18.4984 179.9705 201 S 4.0706 8.1298 112.9689 61.8602 63.0596 176.6641 202 A 4.0262 8.0267 122.8634 54.9647 18.1205 179.2169 203 F 3.9013 8.2739 119.0318 61.5002 39.5585 177.3725 204 I 3.9007 8.3717 119.7374 64.6917 37.0540 178.2801 205 N 4.3581 8.2064 117.1997 56.4403 38.2237 177.7822 206 T 3.7729 7.8256 117.1717 66.4567 68.5058 176.7068 207 K 3.7040 7.8914 121.9293 59.3045 32.2647 178.5411 208 R 3.8318 8.0007 118.7380 59.5786 29.7394 178.3295 209 A 4.0011 7.5674 118.5721 55.0461 18.4152 179.4642 210 V 3.6999 7.8692 116.1948 66.2605 31.9274 177.6469 211 N 4.7292 8.5755 115.6702 54.7858 38.4950 177.1978 212 K 3.8596 7.8806 121.8034 59.2120 32.2126 176.9168 213 P 4.3175 0.0000 0.0000 65.5031 31.1130 178.1437 214 F 3.2837 8.0586 120.4562 60.9909 39.4118 176.9819 215 I 3.8268 8.0771 121.2378 64.1144 36.8892 177.9278 216 H 4.1371 8.4205 119.1687 58.9806 29.6025 176.9102 217 L 4.1788 7.9237 123.6350 57.7240 41.8265 179.0211 218 L 3.9642 8.1062 118.9900 57.7347 41.6120 179.2407 219 E 3.8823 8.1821 119.3399 59.3050 29.3639 178.8655 220 Q 3.9719 8.1162 118.1723 59.2550 28.7576 178.9745 221 T 3.8759 8.0702 117.0005 66.3477 68.4611 176.3989 222 R 3.7899 8.2283 121.1166 59.9155 29.8095 178.2720 223 D 4.3310 7.7355 116.2313 57.2309 40.5813 178.4517 224 A 4.1469 8.3256 121.6210 55.1823 18.4126 179.8798 225 S 4.1329 8.5856 114.0346 61.8341 62.7534 177.0799 226 K 4.1759 7.9931 119.4318 58.4314 31.7388 177.9854 227 A 4.7843 7.2922 119.1133 51.7293 20.2972 178.2239 228 V 3.6411 8.2797 123.4996 67.3952 31.9436 175.8356 229 H 4.5277 8.1473 119.6880 55.8754 28.7863 174.7304 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 1 M 8.16 4.75 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 2 V 7.75 4.87 2.12 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 0.70 0.00 0.00 0.97 0.00 0.00 3 F 9.55 5.22 0.00 3.06 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 4 E 8.87 5.25 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 5 E 9.59 4.91 0.00 1.90 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 6 N 8.74 5.37 0.00 2.56 2.70 0.00 0.00 6.72 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 S 9.21 4.60 0.00 3.80 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 D 8.38 4.30 0.00 2.90 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 0.00 0.00 0.00 9 E 9.09 4.38 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.17 0.00 10 V 7.79 4.14 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 0.86 0.00 0.00 0.63 0.00 0.00 11 R 8.88 4.72 0.00 1.98 1.80 0.00 3.20 0.00 0.00 3.37 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 12 V 9.28 4.76 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.91 0.00 0.00 13 I 9.05 4.85 1.96 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 1.27 0.55 0.94 0.00 0.00 14 T 8.37 4.84 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 0.88 0.00 0.00 15 L 8.46 4.20 0.00 1.27 1.45 0.46 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.65 4.89 0.00 2.73 2.65 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 0.00 0.00 0.00 17 H 8.30 4.15 0.00 3.08 3.26 0.00 5.83 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 P 0.00 4.31 0.00 2.03 2.09 0.00 3.21 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.03 0.00 19 N 8.35 4.56 0.00 2.73 2.60 0.00 0.00 6.96 6.11 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 20 K 8.60 4.05 0.00 1.87 1.98 0.00 1.44 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.10 7.81 21 H 8.91 4.66 0.00 3.24 3.25 0.00 5.76 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 N 7.84 3.98 0.00 2.77 2.42 0.00 0.00 6.92 8.13 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 23 P 0.00 4.28 0.00 2.02 1.90 0.00 3.41 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.74 0.00 24 F 8.36 4.45 0.00 3.07 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 25 S 7.95 4.55 0.00 4.10 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.51 4.07 0.00 1.93 2.00 0.00 3.21 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 27 T 7.91 3.85 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 28 L 7.83 3.97 0.00 1.81 1.71 0.86 0.62 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 29 E 8.43 4.02 0.00 2.22 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.64 0.00 30 T 7.97 3.85 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 1.21 0.00 0.00 31 S 8.27 4.13 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 40 N 8.16 4.40 0.00 2.84 2.87 0.00 0.00 7.18 7.91 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 41 A 7.62 4.53 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 42 D 7.86 4.48 0.00 2.86 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 43 D 8.66 4.50 0.00 2.72 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.48 4.28 0.00 4.03 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 45 V 7.44 4.62 2.38 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 0.86 0.00 0.00 0.99 0.00 0.00 46 R 8.89 4.69 0.00 1.60 1.84 0.00 3.23 0.00 0.00 3.22 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 47 A 7.50 4.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.91 4.83 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 1.15 0.00 0.00 0.95 0.00 0.00 49 V 9.08 4.96 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 0.72 0.00 0.00 0.90 0.00 0.00 50 V 9.00 5.07 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 1.23 0.00 0.00 1.33 0.00 0.00 51 Y 9.07 5.52 0.00 2.96 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 52 G 8.20 3.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 G 5.95 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.28 4.18 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.87 3.81 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00 56 R 7.36 4.70 0.00 1.82 1.80 0.00 3.13 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 57 S 8.38 4.71 0.00 3.85 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 58 F 8.88 4.09 0.00 2.85 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 59 S 8.16 4.59 0.00 3.23 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 9.34 4.01 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 61 G 8.25 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 62 G 8.46 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 63 D 8.51 4.36 0.00 2.78 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.60 4.64 0.00 3.03 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 74 E 8.24 3.99 0.00 2.08 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 2.41 2.49 0.00 75 D 8.03 4.40 0.00 2.89 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 76 I 7.35 3.83 1.99 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 1.70 0.94 0.91 0.00 0.00 77 E 8.29 4.06 0.00 2.26 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.59 0.00 78 E 8.22 3.93 0.00 2.15 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 2.35 2.37 0.00 79 W 8.07 4.26 0.00 3.37 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 I 7.89 3.02 1.93 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.75 0.76 0.00 0.00 81 D 7.86 4.23 0.00 2.83 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 82 R 7.93 3.74 0.00 1.86 1.99 0.00 3.36 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 83 V 7.20 2.93 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 0.57 0.00 0.00 0.19 0.00 0.00 84 I 7.37 3.48 1.71 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 1.53 0.61 0.88 0.00 0.00 85 D 8.41 4.22 0.00 2.65 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 86 L 7.54 3.82 0.00 1.53 1.24 -0.06 0.75 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 87 Y 7.18 4.46 0.00 2.88 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 88 Q 8.37 3.91 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.51 2.43 0.00 89 A 7.84 3.97 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.35 3.48 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 -0.04 0.00 0.00 0.83 0.00 0.00 91 L 7.66 3.94 0.00 1.62 1.56 0.15 0.62 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 92 N 7.91 4.79 0.00 2.73 2.82 0.00 0.00 6.96 7.48 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 93 V 7.14 3.94 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 0.81 0.00 0.00 0.95 0.00 0.00 94 N 9.45 4.85 0.00 2.76 2.89 0.00 0.00 6.99 7.16 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 95 K 7.64 4.74 0.00 1.63 1.87 0.00 1.79 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.48 7.81 96 P 0.00 4.66 0.00 1.85 1.77 0.00 3.51 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.73 0.00 97 T 9.24 5.22 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 1.23 0.00 0.00 98 I 9.24 5.11 1.89 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 1.20 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4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 M 8.88 4.69 0.00 2.26 2.45 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.66 0.00 109 G 8.77 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 F 8.42 4.50 0.00 3.44 3.29 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 0.00 111 Q 8.45 3.97 0.00 2.24 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.71 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 112 F 9.06 4.43 0.00 3.47 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 A 8.61 4.13 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.96 4.38 0.00 1.98 1.99 1.02 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 115 M 7.93 4.19 0.00 1.72 1.93 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.67 0.00 116 F 7.44 4.46 0.00 3.12 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 0.00 117 D 8.51 4.74 0.00 2.87 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 0.00 118 Q 8.16 4.92 0.00 2.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.86 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 119 R 10.04 5.08 0.00 1.65 1.75 0.00 3.20 0.00 0.00 3.35 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.60 0.00 120 L 8.91 5.31 0.00 1.51 1.50 0.93 0.90 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 0.00 121 M 8.70 5.34 0.00 2.22 2.26 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 2.48 2.46 0.00 122 A 8.71 4.93 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 0.00 123 S 8.90 4.07 0.00 3.98 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 T 7.74 4.31 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 1.19 0.00 0.00 125 A 7.70 4.46 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 N 8.62 5.27 0.00 2.21 2.71 0.00 0.00 7.30 8.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 F 9.26 4.98 0.00 2.61 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 9.02 4.85 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 1.22 0.00 0.00 1.17 0.00 0.00 129 M 8.84 5.12 0.00 2.00 1.87 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.38 0.00 130 P 0.00 4.87 0.00 2.55 2.42 0.00 4.08 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.13 0.00 131 E 8.61 3.69 0.00 2.09 2.23 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 2.62 2.46 0.00 132 L 7.92 4.00 0.00 1.76 1.77 1.22 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 133 K 8.16 3.98 0.00 1.78 2.12 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.27 1.51 7.81 134 H 7.65 4.78 0.00 3.11 3.33 0.00 5.78 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 G 7.73 3.83 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 0.00 0.00 0.00 136 I 7.58 4.26 1.31 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 0.33 -0.36 0.73 0.00 0.00 137 G 8.63 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 0.00 0.00 0.00 138 C 8.49 4.90 0.00 2.94 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 0.00 139 S 8.25 4.17 0.00 4.12 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 0.00 140 V 7.81 3.68 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.87 0.00 0.00 141 G 8.16 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.38 3.87 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 0.00 143 A 8.11 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 0.00 144 I 7.71 3.81 2.01 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 1.57 0.80 1.09 0.00 0.00 145 L 7.49 4.25 0.00 1.83 1.52 0.83 0.27 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 0.00 146 G 8.40 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 F 7.87 3.99 0.00 3.07 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 0.00 148 T 8.19 3.83 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 149 H 8.37 4.66 0.00 3.12 3.29 0.00 5.88 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.89 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 F 8.72 4.08 0.00 3.11 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 0.00 152 S 8.15 4.05 0.00 4.13 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 T 7.82 3.84 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 1.02 0.00 0.00 154 M 7.74 3.75 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.50 0.00 155 Q 7.75 3.26 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.56 0.00 0.00 0.00 0.00 0.00 2.06 1.40 0.00 156 E 7.93 3.93 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.46 0.00 157 I 7.52 3.66 1.63 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.27 0.89 0.00 0.00 158 I 7.54 3.81 1.71 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 -0.36 0.76 0.00 0.00 159 Y 7.51 4.75 0.00 3.06 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 0.00 160 Q 8.14 4.25 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.72 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 161 C 7.82 4.23 0.00 3.19 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 0.00 162 Q 7.93 4.57 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.97 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 163 S 8.58 4.45 0.00 4.02 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 0.00 164 L 9.37 4.72 0.00 1.75 1.74 1.07 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.58 5.20 0.00 2.80 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 A 8.85 3.96 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 0.00 167 P 0.00 4.13 0.00 2.13 2.09 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 168 R 7.91 3.78 0.00 2.06 2.08 0.00 2.96 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.62 0.00 169 C 8.37 4.13 0.00 3.02 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 0.00 170 V 8.02 3.49 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.93 0.00 0.00 171 D 7.85 4.27 0.00 2.56 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 0.00 172 Y 7.83 4.43 0.00 3.03 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 0.00 173 R 7.81 3.91 0.00 2.06 2.06 0.00 3.16 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 174 L 8.34 4.13 0.00 1.29 1.12 0.71 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 175 V 7.19 4.52 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 0.50 0.00 0.00 0.83 0.00 0.00 176 N 9.03 4.84 0.00 2.63 2.87 0.00 0.00 6.75 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 Q 7.79 4.66 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 178 V 8.32 4.96 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 0.91 0.00 0.00 179 V 8.51 4.65 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 0.65 0.00 0.00 0.94 0.00 0.00 180 E 8.63 4.35 0.00 1.99 1.86 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 2.39 2.27 0.00 181 S 9.00 4.17 0.00 3.88 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 S 8.15 4.29 0.00 4.03 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 7.96 4.57 1.29 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 0.00 0.00 0.00 184 L 7.60 3.82 0.00 1.92 1.82 0.86 0.60 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 0.00 185 L 7.55 3.53 0.00 0.87 1.34 0.45 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 186 D 7.91 4.27 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 0.00 187 A 8.04 3.94 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 0.00 188 A 8.02 3.86 1.29 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 0.00 0.00 0.00 189 I 7.95 3.57 1.95 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.62 0.86 0.00 0.00 190 T 8.15 3.89 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 191 Q 8.05 3.96 0.00 2.23 2.12 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 2.49 2.68 0.00 192 A 7.99 3.92 1.29 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 0.00 0.00 0.00 193 H 8.22 4.30 0.00 3.35 3.28 0.00 5.64 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 0.00 194 V 7.40 3.45 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.91 0.00 0.00 195 M 7.83 2.71 0.00 1.70 1.81 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.40 0.00 196 A 7.72 3.83 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 0.00 197 S 7.32 4.27 0.00 4.02 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 0.00 198 Y 6.71 4.46 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 0.00 199 P 0.00 4.28 0.00 2.22 2.06 0.00 3.69 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 200 A 8.70 4.14 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 201 S 8.13 4.07 0.00 3.92 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 0.00 202 A 8.03 4.03 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 0.00 203 F 8.27 3.90 0.00 3.36 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 I 8.37 3.90 2.04 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.96 0.94 0.00 0.00 205 N 8.21 4.36 0.00 2.84 2.85 0.00 0.00 7.10 6.72 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 0.00 206 T 7.83 3.77 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 1.11 0.00 0.00 207 K 7.89 3.70 0.00 1.10 1.57 0.00 1.94 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.40 1.39 7.81 208 R 8.00 3.83 0.00 2.01 2.06 0.00 3.15 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 209 A 7.57 4.00 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 210 V 7.87 3.70 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 0.92 0.00 0.00 0.93 0.00 0.00 211 N 8.58 4.73 0.00 2.97 2.86 0.00 0.00 6.68 7.60 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 0.00 212 K 7.88 3.86 0.00 2.03 2.00 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.47 7.81 213 P 0.00 4.32 0.00 2.56 2.40 0.00 3.96 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.13 0.00 214 F 8.06 3.28 0.00 3.02 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 I 8.08 3.83 2.03 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 1.43 1.28 0.88 0.00 0.00 216 H 8.42 4.14 0.00 3.32 3.44 0.00 5.79 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 L 7.92 4.18 0.00 1.65 1.64 0.96 0.66 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 0.00 218 L 8.11 3.96 0.00 1.80 1.67 0.75 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 219 E 8.18 3.88 0.00 2.23 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 2.28 2.35 0.00 220 Q 8.12 3.97 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 221 T 8.07 3.88 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 1.22 0.00 0.00 222 R 8.23 3.79 0.00 1.91 2.15 0.00 3.05 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 223 D 7.74 4.33 0.00 2.86 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 0.00 224 A 8.33 4.15 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 0.00 225 S 8.59 4.13 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 0.00 226 K 7.99 4.18 0.00 1.75 2.07 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.18 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.68 7.81 227 A 7.29 4.78 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 0.00 228 V 8.28 3.64 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 0.55 0.00 0.00 0.95 0.00 0.00 229 H 8.15 4.53 0.00 3.18 3.23 0.00 5.98 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.