NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -6 E 4.2125 8.4449 120.2278 57.2099 31.3533 175.6634 -5 N 3.9390 8.7592 122.8417 53.8198 36.1355 174.4679 -4 L 4.3602 7.8275 121.9815 57.2781 42.9396 178.0928 -3 Y 4.2158 7.8891 120.5383 60.2906 38.2359 178.4359 -2 F 4.7367 7.5299 118.3584 59.5264 38.7303 176.6427 -1 Q 4.5229 7.6064 115.8620 55.2114 30.0269 176.4736 0 G 3.7060 7.7577 109.1701 45.7463 0.0000 172.3189 -4 A 4.3402 7.9075 123.9815 54.6781 19.6396 178.2928 -3 N 4.4058 8.1691 118.9383 55.4906 39.3359 177.7359 -2 I 4.2867 7.2299 117.9584 62.9264 37.9303 177.2427 -1 V 4.3029 7.3164 115.2620 61.7114 33.5269 176.7736 0 F 4.3660 7.7277 120.6701 58.3463 36.2462 173.2189 7 I 4.7348 8.4310 125.5473 59.4875 41.9158 173.0020 8 A 5.2868 8.5469 129.2149 50.9806 20.5042 176.2871 9 T 5.0864 8.9560 116.3234 59.9469 71.6504 173.4565 10 S 4.6593 8.5837 121.5068 57.5838 64.2523 174.9608 11 L 3.9587 8.6663 122.4993 58.0191 41.7629 177.2206 12 D 4.5586 8.0361 115.3120 53.2104 39.6493 176.7232 13 G 3.9715 8.2070 107.9622 45.6718 0.0000 172.7899 14 Y 4.9308 7.6002 117.5720 56.4920 39.1118 176.3525 15 I 4.4097 8.8715 115.9050 61.0293 39.2250 175.3463 16 A 5.1191 7.5702 123.1567 50.4823 22.3315 175.3323 17 D 4.8665 8.6867 120.0295 51.9092 41.1368 177.2517 18 K 4.0249 8.3219 116.9736 58.8244 32.5708 177.5151 19 R 4.3248 8.1425 117.6033 55.6333 30.3750 176.5345 20 G 3.8825 8.2464 105.6085 46.0890 0.0000 174.0835 21 K 4.5508 8.6091 119.7339 54.9780 34.0733 176.6574 22 L 4.2097 7.9187 117.1635 54.5492 42.6507 178.8282 23 D 4.3679 8.2325 122.2857 57.0079 41.0947 178.7703 24 W 4.2743 8.2075 115.8072 59.0396 28.0786 177.9680 25 L 2.9160 6.3296 119.4445 57.7094 40.9544 178.1765 26 H 4.8400 7.9219 113.7333 56.0611 28.4571 176.5083 27 S 4.3231 8.2566 116.1786 59.9762 63.1763 174.3971 28 V 4.3971 7.1578 121.2319 59.8398 32.9469 173.3789 29 P 4.4384 0.0000 0.0000 63.0581 32.7213 176.1564 30 N 5.0267 8.3265 118.1185 51.5093 38.9377 172.9048 31 P 4.2502 0.0000 0.0000 65.8610 31.9603 177.6256 32 N 4.6995 8.1289 113.4297 52.1925 38.5497 174.3319 33 N 4.1747 7.9084 113.9461 53.9704 36.7269 175.0845 34 V 3.6686 8.0879 117.0771 62.9445 32.3215 174.5461 35 D 4.7655 8.5849 126.7625 53.8506 41.9366 176.1588 36 T 4.6577 8.4948 117.1069 61.8447 69.4429 174.1259 37 G 3.9652 8.3196 111.6429 47.0788 0.0000 177.0250 38 F 3.6444 8.4331 122.0086 61.1160 39.7016 176.2955 39 V 3.5109 7.6659 117.9855 65.8194 31.7167 177.0154 40 A 3.9939 7.8671 122.2725 55.0458 18.5746 179.2027 41 L 3.3902 7.6082 114.5409 56.2006 41.8343 178.0786 *43 E 4.2084 8.1144 119.0968 55.7407 31.2901 176.9599 44 R 4.0483 7.7547 118.1482 58.9313 30.3709 177.3551 45 V 4.0863 7.7641 110.0610 61.4896 32.1029 175.8000 46 D 4.7556 9.1345 122.4546 55.7874 41.9080 176.2704 47 G 4.1972 7.4705 104.0668 46.1457 0.0000 171.8453 48 L 5.3251 8.3481 119.0975 52.7603 45.1175 176.3600 49 V 5.2463 7.7693 121.5803 60.3395 34.9163 175.1225 *51 G 4.0062 8.3734 114.2049 45.1054 0.0000 173.6771 52 R 3.9303 8.2863 117.8538 59.1804 29.6940 177.9819 53 N 4.3282 8.0857 115.3833 56.6169 38.4040 177.0065 54 T 4.0237 7.7726 116.5686 66.3112 68.6671 176.3448 55 L 4.0835 7.7652 122.0769 58.2648 41.8672 180.3815 56 D 4.4738 7.9975 116.2526 54.4143 40.8238 177.9307 *58 V 4.1065 7.7071 119.8546 62.7671 33.1256 175.9996 59 L 4.0202 8.2190 119.2750 55.0738 41.6907 176.6126 60 S 4.4427 8.0628 116.0548 57.1666 65.5160 174.6863 61 F 4.4662 8.7010 122.2506 61.0203 38.7333 176.6979 62 D 4.9611 7.7787 116.8428 53.0864 39.9689 178.0421 63 C 4.5792 8.1478 120.3262 58.8877 32.6807 172.5238 64 D 4.7977 8.4804 126.9652 51.9366 40.9669 175.9946 65 W 4.3406 9.0289 134.8741 57.6035 30.7678 173.8295 66 P 4.3618 0.0000 0.0000 62.8361 31.4608 174.8399 67 Y 4.8273 6.5262 117.4638 56.5900 39.5509 175.6169 68 S 4.6630 8.8434 118.1166 58.6962 63.9745 173.5961 69 K 4.9113 7.7025 119.3912 53.7376 35.8177 174.1455 70 P 4.4586 0.0000 0.0000 62.9577 32.8155 175.5510 71 V 4.3909 8.3818 123.1864 61.2900 33.6060 174.3582 72 F 5.2445 9.0905 128.0860 56.4749 40.7547 174.9874 73 V 4.5763 8.8620 124.1799 61.0446 33.9183 174.5471 74 L 4.9678 8.6186 128.1985 53.4058 41.7046 175.9969 75 S 4.5279 8.2627 118.1980 56.8570 64.7352 173.6475 76 N 4.5321 9.2008 127.2864 57.1240 38.8302 177.4551 77 T 4.1522 7.3711 112.3576 61.6282 67.8893 178.6692 *79 T 4.5241 7.9315 116.7763 61.1251 70.9910 176.0721 80 E 4.7516 7.6491 114.8411 55.3259 32.1364 174.5503 81 V 3.9532 8.0597 120.9250 60.9638 32.8083 174.2369 82 P 4.3790 0.0000 0.0000 62.2117 31.8468 175.3750 83 Q 4.2288 8.4904 120.7210 58.2821 29.1346 177.0633 84 G 3.7711 9.3162 113.7553 45.3970 0.0000 173.4657 85 Y 4.2030 7.7490 115.3365 57.3426 39.1489 177.2945 86 E 3.7928 8.1221 121.0934 58.5786 29.6771 177.2838 87 D 4.8902 7.7686 115.9213 52.9023 40.0654 176.5522 88 K 4.4863 7.5399 120.5989 56.8329 35.1401 176.2899 89 V 4.7356 6.8198 118.2267 60.8541 34.4325 174.8796 90 F 4.8414 9.1261 125.9804 55.5099 42.5792 174.2019 91 L 4.7498 8.8009 123.8102 54.7243 42.6000 176.7560 92 V 4.6876 9.0201 118.5516 60.1634 35.5514 175.7390 93 K 4.7354 9.0555 123.8902 53.4012 35.9552 175.3144 94 G 3.8358 8.5504 106.9124 44.0823 0.0000 173.8175 95 K 4.1726 8.5637 119.9703 55.7735 34.0315 177.5070 96 L 3.8144 8.4532 123.6878 58.0893 41.4800 180.1030 97 V 3.4972 7.5840 117.2786 66.0506 31.4379 177.5627 98 D 4.3183 7.9800 118.0187 57.4737 40.6869 178.6779 99 I 3.6491 7.9866 120.5087 64.4740 37.0177 178.6449 100 I 3.6992 8.1644 120.7854 64.2713 36.9653 178.2806 101 A 3.9718 8.2444 121.9544 55.1307 18.0259 179.2733 102 D 4.2142 8.2972 116.5498 57.4599 41.3260 178.2800 103 L 3.9595 7.9224 119.5519 58.0513 41.6224 179.2960 104 N 4.5524 8.7433 117.5935 55.8333 38.2663 177.3296 105 A 4.0372 7.9448 120.9779 54.7154 18.5363 178.8913 106 K 4.2951 7.6029 114.3949 56.6214 32.4500 177.8006 107 G 3.7590 8.0789 108.1104 45.2602 0.0000 174.7803 108 F 4.6374 8.1882 120.6771 56.1078 37.6748 175.5844 109 N 4.5465 8.6922 121.3559 53.8864 40.0198 175.0510 110 E 4.8615 8.7597 119.0040 54.8619 31.1306 175.2944 111 L 5.2185 8.5930 124.5939 53.0154 44.8554 176.0082 112 Y 5.0914 9.0162 125.6517 56.7009 39.4600 174.0439 113 I 4.4573 8.3294 128.3483 60.4812 37.9266 175.1103 114 D 4.6665 8.9559 126.9027 53.3327 44.6235 175.6328 115 G 3.9929 8.9684 111.4920 45.3745 0.0000 174.6898 116 G 3.5258 8.9111 110.4078 47.8734 0.0000 176.2161 117 V 3.6306 7.7126 120.8045 65.7224 31.5190 178.1158 118 T 3.9764 7.8212 114.9850 66.7211 68.3645 176.5122 119 I 3.6885 8.1326 122.0645 64.5958 37.1625 178.3928 120 Q 4.1145 8.3920 119.0002 59.2550 28.5174 178.9402 121 N 4.4230 8.5757 117.4973 56.2050 38.5043 177.3579 122 F 3.9907 8.8670 119.5557 60.7944 39.1139 177.7350 123 L 4.1147 8.5099 118.7009 57.8313 41.2225 179.6698 124 K 4.2050 8.2710 117.0752 58.2122 31.9718 177.5152 125 E 4.4193 7.2609 116.2583 55.1425 30.4095 175.1759 126 D 4.3542 7.8354 116.9431 55.8199 39.6189 173.7452 127 L 4.6058 8.1783 115.9481 54.5413 42.9413 177.0505 128 I 4.3951 7.7682 120.6828 60.6031 38.2196 175.0248 129 D 4.5114 8.8018 124.8817 56.1137 42.6153 175.6588 130 E 5.7051 7.6265 114.4722 54.2621 34.1429 174.4567 *132 V 4.0742 8.2345 118.9492 63.6066 33.1468 174.8147 133 I 4.8646 8.6812 128.9950 59.8628 40.2241 174.7721 134 T 4.8556 8.6486 124.5202 62.1328 70.0776 173.5141 135 R 5.1750 9.1206 128.6767 54.8879 31.8532 174.9983 136 F 4.8086 9.3513 126.1367 54.8905 40.5646 174.7292 137 P 4.7564 0.0000 0.0000 62.6643 29.8820 176.3026 138 I 4.5282 7.5124 118.8501 59.9456 41.3645 173.4154 139 L 4.8105 8.4477 127.5449 53.6112 41.7789 176.5483 140 L 3.8704 8.9760 125.6509 55.5901 41.8000 178.7204 141 G 3.8429 8.4504 104.9846 44.2480 0.0000 173.2419 142 G 3.8289 7.2100 110.2601 44.4550 0.0000 173.1094 143 G 3.2358 6.9914 106.3274 44.5487 0.0000 172.8850 144 V 4.3625 8.1419 124.5301 60.6392 32.7796 175.1239 145 P 4.6190 0.0000 0.0000 62.8559 31.5840 176.3426 146 L 3.8744 8.7528 126.1588 57.8062 42.1729 177.0884 147 F 5.1639 7.8770 114.9191 55.7037 42.2062 175.6049 148 G 4.1362 8.3681 112.5065 45.4482 0.0000 172.2923 149 E 4.6804 8.6967 123.4468 55.0303 31.6042 175.0948 150 L 4.7849 7.8613 118.9604 53.0206 45.9285 176.2981 151 E 4.0944 8.8914 122.6143 59.1088 29.8109 177.1230 152 S 4.7053 7.5049 111.2910 56.3760 67.0885 173.8166 153 S 4.2374 8.4763 116.7629 58.4657 63.2600 173.7052 154 L 4.5806 8.2465 121.6051 53.1365 44.0404 176.1564 155 S 4.8393 8.2034 119.5834 57.4253 64.9374 173.2559 156 F 5.3343 8.6578 120.2521 55.9665 43.2043 173.7719 157 N 5.0022 9.7083 118.5506 52.0851 40.9396 174.6435 158 V 4.1604 8.3097 122.2425 62.3056 31.6794 175.5007 159 I 4.0996 8.5500 130.1702 63.6454 38.1179 176.5055 160 K 4.4670 7.4980 119.6646 55.5947 35.4660 174.3296 161 S 5.1683 8.4630 120.2710 56.9253 65.4176 172.6311 162 E 4.7669 8.9482 123.7403 54.7990 33.4439 174.1317 163 V 4.3558 8.2977 121.2095 62.6636 32.6139 175.5029 164 V 4.3502 8.5344 120.8869 59.9784 35.0082 175.7546 165 L 3.6092 9.3231 121.1236 55.6813 39.2828 176.0751 166 D 4.8480 8.4451 122.3420 55.1221 39.8063 174.6882 167 S 4.6977 7.7938 110.3655 57.5234 63.4437 172.6973 168 L 4.9494 7.8057 117.5407 52.4281 45.2825 175.4397 169 T 4.8566 8.1661 112.5051 60.1219 71.5583 173.2356 170 Q 4.9899 9.0931 125.7749 54.7849 31.9618 173.8773 171 T 4.9409 8.7418 123.2923 61.9359 72.0814 173.2661 172 T 4.7135 8.6975 122.8794 62.1069 71.0121 172.8299 173 Y 5.3008 8.6239 124.1199 56.5816 40.8517 174.3343 174 H 5.5415 8.9477 120.7537 53.6679 31.7957 173.9498 175 R 3.5154 8.6889 123.8147 56.1053 30.5533 176.2752 176 K 4.0574 8.2793 126.6041 56.6114 32.5762 177.4827 177 R 4.1141 8.5359 123.3677 56.3876 30.2266 176.3714 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 E 8.44 4.21 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 -5 N 8.76 3.94 0.00 3.10 2.89 0.00 0.00 7.13 5.85 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 -4 L 7.83 4.36 0.00 1.72 1.75 0.93 0.95 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 -3 Y 7.89 4.22 0.00 2.87 2.61 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 -2 F 7.53 4.74 0.00 3.36 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 -1 Q 7.61 4.52 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.84 0.00 0.00 0.00 0.00 0.00 2.63 2.55 0.00 0 G 7.76 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 0.00 0.00 0.00 -4 A 7.91 4.34 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 -3 N 8.17 4.41 0.00 2.67 2.38 0.00 0.00 7.70 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 -2 I 7.23 4.29 1.87 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 1.53 2.07 0.91 0.00 0.00 -1 V 7.32 4.30 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 0.81 0.00 0.00 0.93 0.00 0.00 0 F 7.73 4.37 0.00 2.93 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 7 I 8.43 4.73 1.92 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.16 0.86 0.00 0.00 8 A 8.55 5.29 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 9 T 8.96 5.09 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 1.28 0.00 0.00 10 S 8.58 4.66 0.00 3.86 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.67 3.96 0.00 1.84 1.93 0.94 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.04 4.56 0.00 2.80 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 G 8.21 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.60 4.93 0.00 2.75 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 15 I 8.87 4.41 1.93 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.67 0.86 0.00 0.00 16 A 7.57 5.12 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.69 4.87 0.00 2.82 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 18 K 8.32 4.02 0.00 1.80 1.83 0.00 1.41 0.00 0.00 1.54 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.30 1.39 7.81 19 R 8.14 4.32 0.00 1.94 1.97 0.00 3.29 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 20 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 21 K 8.61 4.55 0.00 2.15 1.76 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.55 7.81 22 L 7.92 4.21 0.00 1.39 1.06 0.75 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.23 4.37 0.00 2.76 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 24 W 8.21 4.27 0.00 3.55 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 6.33 2.92 0.00 1.17 1.28 0.43 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 26 H 7.92 4.84 0.00 3.22 3.30 0.00 5.66 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 8.26 4.32 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 28 V 7.16 4.40 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.93 0.00 0.00 29 P 0.00 4.44 0.00 2.22 2.05 0.00 3.78 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 30 N 8.33 5.03 0.00 2.76 2.68 0.00 0.00 6.93 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 31 P 0.00 4.25 0.00 2.21 2.17 0.00 3.81 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 32 N 8.13 4.70 0.00 2.73 2.87 0.00 0.00 6.97 8.00 0.00 0.00 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 N 7.91 4.17 0.00 2.89 2.88 0.00 0.00 6.82 7.04 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 34 V 8.09 3.67 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 0.73 0.00 0.00 0.93 0.00 0.00 35 D 8.58 4.77 0.00 2.69 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 36 T 8.49 4.66 4.31 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 1.23 0.00 0.00 37 G 8.32 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 F 8.43 3.64 0.00 2.93 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 39 V 7.67 3.51 2.05 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.84 4.66 0.00 4.04 4.03 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 69 K 7.70 4.91 0.00 1.71 1.97 0.00 1.87 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.57 7.81 70 P 0.00 4.46 0.00 1.21 1.57 0.00 3.88 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 71 V 8.38 4.39 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 0.99 0.00 0.00 0.83 0.00 0.00 72 F 9.09 5.24 0.00 3.12 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 73 V 8.86 4.58 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 0.99 0.00 0.00 0.95 0.00 0.00 74 L 8.62 4.97 0.00 1.64 1.69 1.05 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.26 4.53 0.00 3.82 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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3.98 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 119 I 8.13 3.69 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.77 0.93 0.00 0.00 120 Q 8.39 4.11 0.00 2.35 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.54 2.61 0.00 121 N 8.58 4.42 0.00 3.06 2.92 0.00 0.00 7.05 8.18 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 0.00 122 F 8.87 3.99 0.00 3.22 3.20 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 0.00 123 L 8.51 4.11 0.00 1.97 1.84 1.20 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 124 K 8.27 4.21 0.00 1.90 1.89 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.29 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.60 1.74 7.81 125 E 7.26 4.42 0.00 1.96 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 2.19 2.15 0.00 126 D 7.84 4.35 0.00 2.76 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 0.00 127 L 8.18 4.61 0.00 1.83 1.77 0.51 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 128 I 7.77 4.40 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.94 1.16 0.00 0.00 129 D 8.80 4.51 0.00 2.62 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 E 7.63 5.71 0.00 1.89 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 2.00 2.17 0.00 *132 V 8.23 4.07 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 0.99 0.00 0.00 1.11 0.00 0.00 133 I 8.68 4.86 2.08 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.97 0.99 0.00 0.00 134 T 8.65 4.86 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 1.13 0.00 0.00 135 R 9.12 5.18 0.00 1.91 1.84 0.00 3.12 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 136 F 9.35 4.81 0.00 3.24 3.20 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 0.00 137 P 0.00 4.76 0.00 2.12 2.14 0.00 3.87 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 138 I 7.51 4.53 2.01 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.71 1.01 0.00 0.00 139 L 8.45 4.81 0.00 1.67 1.61 0.93 1.03 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 0.00 140 L 8.98 3.87 0.00 1.34 1.44 -0.16 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.45 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 7.21 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 0.00 143 G 6.99 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 0.00 0.00 0.00 144 V 8.14 4.36 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 0.99 0.00 0.00 0.95 0.00 0.00 145 P 0.00 4.62 0.00 2.25 1.95 0.00 3.88 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 146 L 8.75 3.87 0.00 1.30 1.31 0.54 0.04 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 0.00 147 F 7.88 5.16 0.00 3.03 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 0.00 148 G 8.37 4.14 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 0.00 0.00 0.00 149 E 8.70 4.68 0.00 1.96 1.89 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 2.24 2.38 0.00 150 L 7.86 4.78 0.00 1.56 1.60 0.91 0.96 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 0.00 151 E 8.89 4.09 0.00 1.92 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 2.28 2.33 0.00 152 S 7.50 4.71 0.00 3.81 3.66 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 0.00 153 S 8.48 4.24 0.00 3.95 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.25 4.58 0.00 1.68 1.44 1.01 0.87 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 0.00 155 S 8.20 4.84 0.00 3.67 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 F 8.66 5.33 0.00 2.88 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 N 9.71 5.00 0.00 2.69 2.78 0.00 0.00 6.94 5.23 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 0.00 158 V 8.31 4.16 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 0.70 0.00 0.00 0.97 0.00 0.00 159 I 8.55 4.10 1.86 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.47 0.86 0.00 0.00 160 K 7.50 4.47 0.00 1.75 1.53 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.35 1.38 7.81 161 S 8.46 5.17 0.00 3.76 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 0.00 162 E 8.95 4.77 0.00 2.03 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 2.16 2.23 0.00 163 V 8.30 4.36 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 0.83 0.00 0.00 0.91 0.00 0.00 164 V 8.53 4.35 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 0.83 0.00 0.00 0.86 0.00 0.00 165 L 9.32 3.61 0.00 1.69 1.69 0.88 1.09 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 0.00 166 D 8.45 4.85 0.00 2.82 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 0.00 167 S 7.79 4.70 0.00 3.74 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 L 7.81 4.95 0.00 1.56 1.21 0.41 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 169 T 8.17 4.86 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 1.19 0.00 0.00 170 Q 9.09 4.99 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.79 0.00 0.00 0.00 0.00 0.00 2.21 2.23 0.00 171 T 8.74 4.94 4.03 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 0.61 0.00 0.00 172 T 8.70 4.71 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 1.28 0.00 0.00 173 Y 8.62 5.30 0.00 2.76 2.81 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 0.00 174 H 8.95 5.54 0.00 3.22 3.22 0.00 5.82 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 R 8.69 3.52 0.00 1.74 1.61 0.00 2.56 0.00 0.00 2.53 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.35 0.00 176 K 8.28 4.06 0.00 1.74 1.68 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.48 1.43 7.81 177 R 8.54 4.11 0.00 1.91 1.94 0.00 3.38 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 * Residues marked with a * may have inaccurate shift predictions.