NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2920 8.2544 120.8784 56.0325 31.5206 174.3904 3 E 4.1535 8.3927 124.2493 54.0525 30.6147 170.5651 4 V 4.0787 9.1195 127.2858 63.1339 33.1101 174.9645 5 K 4.6030 9.1908 125.4689 56.0411 35.3296 175.5665 6 L 4.9525 7.7556 121.7440 53.0475 45.6821 174.9180 7 V 4.7406 8.7752 126.6619 61.2258 33.8429 174.1603 8 T 5.1471 8.8981 118.3346 59.9508 71.6405 173.1354 9 F 5.1531 9.5926 122.8152 55.7862 42.2790 174.6062 10 D 5.1260 8.9056 122.7589 53.8329 42.0527 175.2093 11 V 4.0326 8.5385 119.0902 64.2087 33.1076 175.4177 12 W 4.5774 7.7836 120.1568 58.1702 29.1221 176.2089 13 N 4.7259 9.9611 120.6655 53.8728 36.3602 174.5623 14 T 4.5222 7.9739 114.1258 64.7965 71.2511 175.4300 15 L 4.4268 8.5981 119.9462 55.5405 43.5297 176.5717 16 L 5.0340 7.2639 116.8686 52.5391 44.1731 175.1256 17 D 4.9415 8.9800 121.9052 53.6065 41.1993 176.2102 18 L 4.4495 8.8555 129.9312 58.3238 42.6040 177.8811 19 N 4.5673 8.5015 115.7532 56.5725 38.7643 177.4433 20 I 4.0944 7.9342 115.5117 62.1846 36.6412 177.6945 *22 L 4.4984 7.9743 123.1088 55.1177 43.7087 179.0699 23 D 4.3608 8.4628 118.6631 57.2860 40.5853 178.4003 24 E 4.0054 8.5314 120.1746 59.0207 29.6098 178.7500 25 F 4.2781 8.1024 120.3072 61.3986 39.5472 177.0621 26 S 3.6060 8.2067 115.0930 61.6561 62.5637 176.0634 27 H 4.0562 8.1391 120.6717 59.5133 29.7577 177.0241 28 Q 3.7205 8.1730 121.3868 58.9393 28.9055 177.9530 29 L 3.8179 8.1504 121.5610 57.9887 42.1217 178.7859 30 A 3.9174 8.0968 121.1005 54.7965 18.0345 179.4493 31 K 3.7753 7.8458 117.5747 59.6913 32.4734 178.7988 32 I 3.9514 7.4286 110.5142 62.6092 37.8659 177.0621 33 S 4.5302 7.8120 114.5039 57.8413 63.5081 174.9032 34 G 3.8398 7.7330 109.8967 46.1874 0.0000 173.3129 35 L 4.6071 7.1433 118.4280 52.4805 43.9665 176.0117 36 H 4.1663 8.4613 120.5450 55.8916 30.4638 175.9512 37 I 3.6348 8.4053 126.5086 64.3614 37.5264 177.7494 38 K 3.9930 8.2784 119.9389 59.4778 32.1547 178.4622 39 D 4.3319 8.0856 118.9395 57.2304 40.7063 178.9652 40 V 3.4958 7.6917 118.1074 65.8913 31.5383 177.7755 41 A 3.9573 8.2798 120.9295 55.2445 18.1993 179.4332 42 N 4.3036 8.4193 114.8847 56.3153 38.6032 177.5070 43 A 4.0228 8.1093 122.2651 55.0964 18.4181 179.8221 44 V 3.5419 7.7511 116.7486 66.2628 31.5617 178.3995 45 I 3.8099 7.5936 119.6693 64.2985 36.8611 178.2517 46 E 3.9697 8.3208 119.4338 59.5226 29.3024 179.6219 47 V 3.6180 8.0449 118.2455 66.0691 31.6270 178.0556 48 R 3.8540 8.4252 118.5497 59.2962 29.9117 178.3222 49 N 4.3331 8.6774 116.7911 56.2998 38.3815 176.9656 50 E 3.9599 8.0674 118.6193 59.8620 29.7256 179.4490 51 I 3.7760 7.6713 118.1314 64.1450 37.5059 178.3779 52 K 4.1182 8.0563 119.5318 59.1167 31.2327 179.5018 53 K 4.0865 7.9468 116.3291 57.4663 31.7052 178.4262 *55 R 4.2937 8.0071 118.6977 55.6667 31.9568 177.6806 56 A 4.0152 7.9137 119.4986 54.7019 18.4006 178.0689 57 Q 4.4227 7.5470 108.7939 54.9439 28.9731 175.2713 58 A 4.2706 8.0021 119.1081 52.5345 16.5522 179.0033 59 S 4.4818 8.2569 114.6417 60.7465 63.7702 174.3695 60 E 4.2567 8.0031 122.3797 54.7406 30.5563 174.6280 61 D 4.5707 8.6043 125.3678 53.5974 41.7286 174.8608 62 P 4.7485 0.0000 0.0000 65.8725 31.5040 178.6599 63 R 4.0883 8.5775 116.2048 58.0911 30.1953 177.4299 64 K 4.8886 8.6943 116.6933 55.0671 32.4829 178.1633 65 V 3.8734 7.4515 120.9601 63.4761 31.4075 176.9182 66 L 4.2814 7.6559 119.8466 56.9313 43.2508 177.9404 67 T 3.9775 7.8983 109.2534 64.8685 68.2542 176.0488 68 G 3.5870 8.3094 108.9207 47.7511 0.0000 175.6906 69 S 4.0352 7.8547 117.0315 60.9981 62.8380 176.4062 70 Q 4.1613 7.9505 121.1631 58.9047 28.5474 178.6589 71 E 4.0599 8.6612 119.6301 58.9356 29.4868 179.2952 72 A 4.0120 8.3597 121.4823 54.9444 18.4810 179.4209 73 L 3.9461 8.1876 118.6486 58.3294 42.2748 178.8540 74 A 4.1270 8.2851 120.9092 55.3576 18.0793 179.9214 75 G 3.5716 8.2788 104.0651 47.7725 0.0000 176.1299 76 K 4.0226 7.9891 120.0039 58.9282 32.2295 178.5852 77 L 4.2973 7.7569 115.8870 53.5745 42.5577 176.4265 78 K 3.8598 7.6883 117.3445 57.8058 29.7757 175.1232 79 V 4.5586 7.6901 109.4892 59.0281 36.0380 175.6464 80 D 4.5186 8.3864 120.8896 53.9806 41.7870 177.5962 81 V 3.8241 8.3916 125.5078 64.1422 31.3090 178.0320 82 E 3.9780 9.1034 121.2860 59.4200 29.4464 178.6105 83 L 4.0567 8.1445 119.0615 57.4869 41.6323 179.7088 84 V 3.7430 7.6823 117.9954 65.9671 31.5169 178.0448 85 K 4.0801 8.1482 118.2817 59.7177 31.9418 179.6213 86 R 4.0351 8.3577 118.1321 59.0587 29.8545 178.9691 87 A 4.1012 8.3891 121.0422 55.4243 18.4344 179.7812 88 T 3.9110 8.3407 108.1069 64.8561 68.6205 176.6457 89 A 3.7919 7.9999 123.4409 55.0975 18.4572 179.8931 90 R 3.8519 8.1881 116.4080 59.2270 30.0904 179.1847 91 A 4.0010 8.3960 121.0351 55.2470 18.1577 179.8061 92 I 3.5547 7.4617 117.3468 64.1553 37.1292 178.1897 93 L 4.1380 7.3290 118.8324 56.8972 41.6584 178.3470 94 N 4.6105 7.7951 115.4658 54.2737 38.9414 175.9366 95 V 4.0391 7.1908 113.4271 61.1267 32.6795 174.2065 96 D 4.8359 8.0739 118.1704 52.4528 41.7366 174.9353 97 E 2.9416 8.9714 118.6260 59.2154 29.3822 179.3262 98 S 4.1223 8.3385 112.4482 60.0832 63.2889 175.1754 99 L 4.0340 7.8924 124.0202 57.4787 42.1033 176.4507 100 V 3.9890 7.2088 119.7556 62.4494 31.9412 176.1910 101 L 4.2807 8.7559 128.4626 54.1663 42.9544 176.2102 102 E 4.0301 8.6919 123.1562 57.8760 30.0144 177.5749 103 G 4.1474 9.1435 113.5166 46.2746 0.0000 175.4020 104 T 3.7542 7.6737 116.7561 66.7283 68.5064 176.3531 105 K 3.8679 7.9290 120.7798 59.4429 32.1487 178.5646 106 E 3.8515 8.0115 118.4078 59.1506 29.4334 178.9392 107 A 4.0564 8.0041 120.9439 54.9679 18.4294 179.7195 108 L 3.7862 7.6456 117.3375 58.0515 41.6752 179.7515 109 Q 3.6122 7.5999 117.9011 58.5838 28.2819 178.6383 110 F 4.0499 7.9024 120.9403 61.1597 39.7265 177.1142 111 V 3.6363 7.8806 117.7319 66.1530 31.5485 178.2225 112 K 4.0464 8.1911 118.0571 59.4245 31.6464 178.9512 113 E 4.1441 8.0945 117.5792 58.2093 29.4666 178.1982 114 R 4.2832 7.3215 116.8895 55.4022 30.2470 176.9996 115 G 3.8833 7.5163 106.0824 45.8089 0.0000 174.0628 116 L 4.4115 7.5068 118.3439 53.9163 42.9742 176.5143 117 K 4.7322 8.8111 121.3133 56.0051 33.3224 176.1496 118 T 5.6603 9.9522 113.4950 59.4688 72.1964 172.6233 119 A 5.0582 8.5840 122.5118 51.1982 23.2641 174.8903 120 V 4.8417 9.0290 119.9780 61.2741 34.1323 174.7308 121 I 4.9524 9.1781 128.6725 59.5265 39.8204 174.4107 122 G 4.4156 8.8207 114.1894 44.3205 0.0000 170.7901 123 N 5.2383 8.9778 120.9223 52.7184 40.3296 173.7347 124 V 4.2628 7.7355 112.1060 60.0072 35.7646 175.7012 *126 F 4.9754 8.6290 117.6456 56.9531 40.3124 175.6229 127 W 4.7525 6.7490 115.2619 53.2649 30.5956 173.4264 128 P 4.4210 0.0000 0.0000 62.3006 31.5748 177.4645 129 G 3.1548 8.9656 106.2645 47.6485 0.0000 176.2030 130 S 4.1394 7.9196 115.8676 61.4787 62.8121 176.1645 131 Y 4.3291 8.0189 120.6415 61.3251 37.6869 178.1284 132 T 4.1650 8.0065 116.3217 66.5877 68.5590 176.6501 133 R 4.0607 8.1546 121.1601 59.1748 30.0319 178.2762 134 L 3.8694 7.7094 119.7930 58.0858 42.0778 179.0340 135 L 3.3747 7.5299 118.6045 57.5231 41.6112 179.4443 136 L 4.0073 7.8575 118.8755 57.7636 41.6384 179.2193 137 E 3.8658 8.3334 119.4163 59.3610 29.3854 178.8578 138 R 3.8180 7.8845 117.8044 58.8538 30.1141 177.4705 139 F 5.0076 7.6819 114.9120 57.0625 39.2750 176.7262 140 G 3.9873 7.9093 106.8026 45.4943 0.0000 175.0467 141 L 4.4032 7.5570 120.9595 54.4422 40.4720 178.3044 *143 E 4.1984 7.9849 119.2477 55.5006 31.3916 175.7035 144 F 4.8671 8.1441 114.9064 56.9120 39.5715 174.9133 145 I 4.6232 7.3620 121.5076 58.8142 38.8612 175.1279 146 D 4.7313 8.7570 125.9213 56.8062 41.4598 177.2076 147 K 4.8274 8.2536 115.7836 54.7949 36.9877 175.4118 148 T 4.8096 8.1830 112.5053 59.8869 71.4582 173.4302 149 F 4.5554 9.1515 123.4193 55.8797 42.3155 173.5576 150 F 5.3890 8.5697 122.4771 55.3702 41.1827 176.8515 151 A 4.7521 9.3599 126.1713 55.1420 18.3456 179.7698 152 D 4.4761 8.1494 114.0731 56.1723 39.6773 177.8350 153 E 4.2764 8.2483 118.9293 57.6784 29.8855 177.7298 154 V 4.1128 7.8346 115.5007 61.3872 33.0726 174.7364 155 L 3.5977 7.9598 116.8091 55.5328 39.3992 172.7228 156 S 4.3817 7.4132 111.3056 58.4630 65.6207 172.1322 157 Y 5.0406 7.0247 117.2010 55.4850 39.9140 174.1759 158 K 4.0830 9.2841 122.3594 56.2701 32.6053 175.2306 159 P 5.0083 0.0000 0.0000 62.8247 31.5256 176.3078 160 R 3.8842 7.7272 118.4475 56.6156 30.6831 176.3020 161 K 4.0653 9.0584 124.4012 59.7245 32.4509 180.0558 162 E 4.0243 7.8072 117.8198 55.9154 28.8020 178.6722 *164 F 4.4666 8.2124 119.0841 58.7863 41.3167 177.6402 165 E 3.9274 8.1214 119.8934 59.3363 29.0886 179.3632 166 K 3.8837 7.9055 119.6463 59.4330 32.0548 179.0990 167 V 2.8721 7.1404 117.9008 65.6182 31.5152 177.7948 168 L 4.0679 8.0923 119.0000 58.0537 41.4788 179.3465 169 N 4.3858 8.6667 116.7812 56.3384 38.2286 177.4104 170 S 4.1469 7.9223 113.7235 60.6393 62.5524 175.2196 171 F 4.5243 7.9493 117.6193 55.8006 39.9648 174.8987 172 E 3.8106 8.1358 118.6895 57.6698 28.2582 173.7744 173 V 4.5996 7.7446 109.1604 59.4026 35.9331 176.1427 174 K 4.4602 8.9304 121.1761 54.6958 33.5858 176.5465 175 P 4.2091 0.0000 0.0000 66.0472 31.2319 178.6657 176 E 3.9990 8.0585 114.5992 58.1348 29.7614 177.0595 177 E 4.8365 8.2897 118.6921 56.0809 29.7212 175.2168 178 S 5.2896 8.0678 113.9218 56.8474 67.3552 173.3453 179 L 5.1181 9.0114 123.8021 53.7286 45.5043 174.4103 180 H 5.5134 9.3229 125.7846 53.4332 32.9636 172.1263 181 I 4.9921 8.1576 125.4219 59.2887 40.7961 174.3220 182 G 4.8482 9.1612 114.3565 45.9393 0.0000 173.2113 183 D 5.0493 8.9050 118.3676 53.6866 40.4092 177.1797 184 T 4.7073 8.3765 118.7315 62.3715 69.5586 173.9776 185 Y 3.6557 9.0172 127.0714 61.1173 38.4440 178.2172 186 A 4.5753 7.9962 121.2320 54.2150 18.6217 178.2277 187 E 4.4187 8.1048 116.4284 58.8122 30.0620 178.1561 188 D 4.7221 8.7510 118.7091 58.0688 41.1795 178.0910 189 Y 4.0466 8.0121 119.5851 60.8447 39.0032 177.7387 190 Q 3.7367 8.2844 119.0364 58.5551 28.6219 179.0402 191 G 3.7961 8.1868 106.5923 47.3790 0.0000 175.1558 192 A 2.9763 7.3890 123.8958 53.7771 18.2662 179.7208 193 R 3.5080 7.6810 117.8930 59.2068 29.9836 178.5235 194 K 4.0584 7.5748 115.5830 58.3241 32.8363 178.0906 195 V 3.8583 6.8804 118.0870 62.5788 32.9188 175.5073 196 G 3.8694 7.2449 107.2138 46.1331 0.0000 173.6454 *198 W 4.7462 7.5880 117.1811 56.4674 31.6841 176.0831 199 A 5.2028 9.5895 125.1888 50.1039 22.0018 175.0498 200 V 5.1128 9.1578 122.2389 60.9859 34.6068 173.8988 201 W 5.5696 9.6966 135.0000 56.1480 32.5298 174.8742 202 I 4.3014 8.3061 128.9301 60.5420 37.5030 175.1580 203 N 3.9776 8.2641 127.3156 51.2853 39.9532 175.1491 204 Q 4.3475 8.4145 125.5076 58.0275 29.0665 177.4258 205 E 4.2428 8.1943 115.4564 56.4778 29.6111 176.4202 206 G 4.0357 7.5378 108.4727 44.2392 0.0000 173.2651 207 D 4.6580 8.5210 118.6601 54.3627 42.6588 175.9149 208 K 4.6689 7.4759 115.3483 54.3692 35.9423 175.3287 209 V 4.0421 8.2140 119.3711 63.0550 31.9809 175.3026 210 R 4.8181 9.2644 126.5016 54.2076 34.3378 174.2655 211 K 4.1280 8.7870 124.5932 55.9327 32.2067 176.4253 212 L 4.2525 8.9102 128.8586 56.6879 42.4747 176.1613 213 E 4.6523 7.2112 113.7701 55.6944 31.8046 174.1214 214 E 4.0073 8.7305 120.0743 57.9188 29.7712 176.7822 215 R 4.1063 9.1096 123.7111 56.4252 27.6370 175.2598 216 G 5.2654 8.1122 105.2675 43.6371 0.0000 172.3544 217 F 5.6644 10.1193 122.8076 55.6934 44.1569 173.3260 218 E 5.4845 9.6320 120.9723 54.6210 32.6451 174.4406 219 I 5.0161 8.7540 119.8373 58.3380 40.8339 174.8804 220 P 4.4035 0.0000 0.0000 65.5831 31.7735 176.1051 221 S 4.5791 7.4402 111.2428 56.6320 65.7288 174.7449 222 I 3.7368 8.3268 120.6091 63.1777 37.9346 177.7470 223 A 3.9630 7.8902 122.0991 55.2827 18.4274 177.6950 224 N 4.9689 8.2112 111.2846 52.7548 39.0504 176.8435 225 L 3.8980 7.7900 122.7138 57.9553 42.1260 179.0146 226 K 3.6196 7.7548 118.1772 59.6769 31.9686 178.8493 227 D 4.1531 7.5203 120.1014 57.1494 40.9089 178.6814 228 V 3.1050 7.4177 118.1260 65.8195 31.2945 177.6911 229 I 3.5086 7.4256 118.1994 64.6758 37.2033 178.0077 230 E 4.1015 8.2006 119.1031 59.1698 28.9954 179.1596 231 L 3.9465 7.8531 120.1853 57.4820 42.1646 178.1104 232 I 4.0990 6.9584 109.6513 60.6797 37.8095 175.5813 233 S 5.1484 7.4423 120.4202 58.0789 62.2240 173.5873 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 R 8.25 4.29 0.00 1.82 2.00 0.00 3.28 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 3 E 8.39 4.15 0.00 2.18 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 4 V 9.12 4.08 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 0.87 0.00 0.00 0.77 0.00 0.00 5 K 9.19 4.60 0.00 1.68 1.79 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.54 7.81 6 L 7.76 4.95 0.00 1.48 1.34 0.05 0.68 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 7 V 8.78 4.74 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 0.41 0.00 0.00 0.88 0.00 0.00 8 T 8.90 5.15 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 1.18 0.00 0.00 9 F 9.59 5.15 0.00 2.93 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 D 8.91 5.13 0.00 3.09 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.54 4.03 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 0.42 0.00 0.00 1.07 0.00 0.00 12 W 7.78 4.58 0.00 3.52 3.36 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 13 N 9.96 4.73 0.00 3.27 3.21 0.00 0.00 6.87 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 14 T 7.97 4.52 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 15 L 8.60 4.43 0.00 1.55 1.62 0.89 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 16 L 7.26 5.03 0.00 0.86 1.35 0.54 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.98 4.94 0.00 2.75 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 18 L 8.86 4.45 0.00 2.08 2.04 0.71 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.50 4.57 0.00 2.87 2.92 0.00 0.00 7.13 7.26 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 20 I 7.93 4.09 1.97 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.87 0.95 0.00 0.00 *22 L 7.97 4.50 0.00 1.89 1.88 1.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.46 4.36 0.00 2.90 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 24 E 8.53 4.01 0.00 2.16 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 25 F 8.10 4.28 0.00 3.02 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.21 3.61 0.00 3.81 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 27 H 8.14 4.06 0.00 3.21 3.58 0.00 5.78 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 28 Q 8.17 3.72 0.00 2.35 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 29 L 8.15 3.82 0.00 1.25 1.36 0.86 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.10 3.92 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 31 K 7.85 3.78 0.00 1.63 1.90 0.00 1.75 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.41 7.81 32 I 7.43 3.95 1.86 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 1.84 0.68 0.89 0.00 0.00 33 S 7.81 4.53 0.00 4.03 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 34 G 7.73 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 35 L 7.14 4.61 0.00 1.59 1.58 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 36 H 8.46 4.17 0.00 3.16 3.37 0.00 5.69 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 8.41 3.63 1.81 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 1.50 1.29 0.84 0.00 0.00 38 K 8.28 3.99 0.00 1.99 1.79 0.00 1.67 0.00 0.00 1.83 0.00 0.00 3.18 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.58 7.81 39 D 8.09 4.33 0.00 2.87 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 40 V 7.69 3.50 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 0.88 0.00 0.00 0.88 0.00 0.00 41 A 8.28 3.96 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 42 N 8.42 4.30 0.00 2.92 2.88 0.00 0.00 6.89 6.71 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 43 A 8.11 4.02 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 44 V 7.75 3.54 2.18 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 0.99 0.00 0.00 0.66 0.00 0.00 45 I 7.59 3.81 2.04 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.58 0.95 0.00 0.00 46 E 8.32 3.97 0.00 2.23 2.03 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 2.35 2.49 0.00 47 V 8.04 3.62 2.41 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 1.14 0.00 0.00 1.07 0.00 0.00 48 R 8.43 3.85 0.00 2.21 2.19 0.00 3.27 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 49 N 8.68 4.33 0.00 2.91 2.87 0.00 0.00 6.99 7.34 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 50 E 8.07 3.96 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 2.36 2.51 0.00 51 I 7.67 3.78 1.77 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.46 0.71 0.00 0.00 52 K 8.06 4.12 0.00 2.03 1.87 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.61 7.81 53 K 7.95 4.09 0.00 1.95 1.93 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.49 7.81 *55 R 8.01 4.29 0.00 1.81 1.87 0.00 2.89 0.00 0.00 2.75 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.44 0.00 56 A 7.91 4.02 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 57 Q 7.55 4.42 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.52 2.44 0.00 58 A 8.00 4.27 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 59 S 8.26 4.48 0.00 3.90 3.94 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 60 E 8.00 4.26 0.00 1.85 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.22 0.00 61 D 8.60 4.57 0.00 2.74 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 62 P 0.00 4.75 0.00 2.22 2.17 0.00 3.68 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 2.03 2.04 0.00 63 R 8.58 4.09 0.00 1.93 2.00 0.00 3.12 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 64 K 8.69 4.89 0.00 1.82 1.82 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.30 7.81 65 V 7.45 3.87 2.32 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 0.99 0.00 0.00 0.91 0.00 0.00 66 L 7.66 4.28 0.00 1.67 1.59 0.77 0.67 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 67 T 7.90 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 1.20 0.00 0.00 68 G 8.31 3.59 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 0.00 0.00 0.00 69 S 7.85 4.04 0.00 3.35 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 70 Q 7.95 4.16 0.00 2.33 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.85 0.00 0.00 0.00 0.00 0.00 2.56 2.56 0.00 71 E 8.66 4.06 0.00 2.07 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 2.35 2.42 0.00 72 A 8.36 4.01 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 73 L 8.19 3.95 0.00 2.17 2.01 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 74 A 8.29 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 75 G 8.28 3.57 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 0.00 0.00 0.00 76 K 7.99 4.02 0.00 1.93 1.90 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.50 1.72 7.81 77 L 7.76 4.30 0.00 1.63 1.68 0.85 0.92 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 78 K 7.69 3.86 0.00 1.88 1.89 0.00 1.66 0.00 0.00 1.83 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.54 7.81 79 V 7.69 4.56 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 0.69 0.00 0.00 0.94 0.00 0.00 80 D 8.39 4.52 0.00 2.69 2.54 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 81 V 8.39 3.82 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 0.77 0.00 0.00 1.01 0.00 0.00 82 E 9.10 3.98 0.00 2.18 2.03 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 2.33 2.43 0.00 83 L 8.14 4.06 0.00 1.96 1.71 0.99 0.63 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 84 V 7.68 3.74 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 1.36 0.00 0.00 1.03 0.00 0.00 85 K 8.15 4.08 0.00 2.09 1.91 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.72 7.81 86 R 8.36 4.04 0.00 2.05 2.02 0.00 3.15 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.84 0.00 87 A 8.39 4.10 1.55 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 0.00 0.00 88 T 8.34 3.91 4.50 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 1.33 0.00 0.00 89 A 8.00 3.79 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.19 3.85 0.00 2.02 2.07 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.87 0.00 91 A 8.40 4.00 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 92 I 7.46 3.55 1.70 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.54 0.60 0.00 0.00 93 L 7.33 4.14 0.00 1.66 1.67 0.86 1.20 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 94 N 7.80 4.61 0.00 2.77 2.88 0.00 0.00 7.03 7.84 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 95 V 7.19 4.04 2.20 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 0.70 0.00 0.00 1.09 0.00 0.00 96 D 8.07 4.84 0.00 2.89 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 97 E 8.97 2.94 0.00 1.94 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 2.20 2.13 0.00 98 S 8.34 4.12 0.00 3.96 3.94 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 99 L 7.89 4.03 0.00 1.92 1.58 1.09 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 100 V 7.21 3.99 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 0.74 0.00 0.00 0.52 0.00 0.00 101 L 8.76 4.28 0.00 1.71 1.57 0.98 0.53 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 0.00 102 E 8.69 4.03 0.00 1.95 1.84 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 2.27 2.31 0.00 103 G 9.14 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 0.00 0.00 0.00 104 T 7.67 3.75 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 1.16 0.00 0.00 105 K 7.93 3.87 0.00 1.83 1.76 0.00 1.79 0.00 0.00 2.05 0.00 0.00 3.22 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.35 1.53 7.81 106 E 8.01 3.85 0.00 2.19 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 2.35 2.38 0.00 107 A 8.00 4.06 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 0.00 108 L 7.65 3.79 0.00 1.56 1.59 0.85 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 109 Q 7.60 3.61 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.38 0.00 110 F 7.90 4.05 0.00 3.06 3.30 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 0.00 111 V 7.88 3.64 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 1.07 0.00 0.00 1.32 0.00 0.00 112 K 8.19 4.05 0.00 1.92 1.96 0.00 1.94 0.00 0.00 1.90 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.76 1.89 7.81 113 E 8.09 4.14 0.00 2.00 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 2.33 2.44 0.00 114 R 7.32 4.28 0.00 1.68 1.76 0.00 2.21 0.00 0.00 2.63 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.01 0.00 115 G 7.52 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 0.00 116 L 7.51 4.41 0.00 1.67 1.58 0.87 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 117 K 8.81 4.73 0.00 1.61 1.44 0.00 1.95 0.00 0.00 1.91 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.71 7.81 118 T 9.95 5.66 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 1.43 0.00 0.00 119 A 8.58 5.06 1.50 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 0.00 120 V 9.03 4.84 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 0.67 0.00 0.00 1.01 0.00 0.00 121 I 9.18 4.95 1.90 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 1.11 0.76 0.60 0.00 0.00 122 G 8.82 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 0.00 0.00 0.00 0.00 123 N 8.98 5.24 0.00 2.69 2.78 0.00 0.00 6.77 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 0.00 124 V 7.74 4.26 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 0.88 0.00 0.00 0.84 0.00 0.00 *126 F 8.63 4.98 0.00 2.50 2.54 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 0.00 127 W 6.75 4.75 0.00 3.32 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 0.00 128 P 0.00 4.42 0.00 2.05 2.03 0.00 3.11 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.32 0.00 129 G 8.97 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 0.00 0.00 0.00 130 S 7.92 4.14 0.00 4.14 4.16 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 0.00 131 Y 8.02 4.33 0.00 3.37 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 0.00 132 T 8.01 4.16 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 1.44 0.00 0.00 133 R 8.15 4.06 0.00 2.05 2.10 0.00 3.16 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 134 L 7.71 3.87 0.00 1.97 1.78 0.85 0.47 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 0.00 135 L 7.53 3.37 0.00 1.82 1.57 1.20 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 136 L 7.86 4.01 0.00 1.89 1.75 1.07 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 137 E 8.33 3.87 0.00 2.09 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 2.26 2.30 0.00 138 R 7.88 3.82 0.00 1.61 1.42 0.00 3.13 0.00 0.00 2.81 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.55 0.00 139 F 7.68 5.01 0.00 3.08 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 0.00 140 G 7.91 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 0.00 0.00 0.00 141 L 7.56 4.40 0.00 1.91 1.73 1.00 0.95 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 *143 E 7.98 4.20 0.00 1.54 1.12 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 1.47 1.97 0.00 144 F 8.14 4.87 0.00 3.06 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 0.00 145 I 7.36 4.62 1.90 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 1.41 1.30 1.01 0.00 0.00 146 D 8.76 4.73 0.00 3.15 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 0.00 147 K 8.25 4.83 0.00 2.10 1.49 0.00 1.20 0.00 0.00 1.23 0.00 0.00 2.75 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.31 1.36 7.81 148 T 8.18 4.81 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 149 F 9.15 4.56 0.00 2.93 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 0.00 150 F 8.57 5.39 0.00 3.06 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 A 9.36 4.75 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.15 4.48 0.00 2.84 2.80 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 0.00 0.00 0.00 0.00 153 E 8.25 4.28 0.00 2.20 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 0.00 2.37 2.42 0.00 154 V 7.83 4.11 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 0.94 0.00 0.00 1.19 0.00 0.00 155 L 7.96 3.60 0.00 1.86 1.72 0.93 0.90 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 0.00 156 S 7.41 4.38 0.00 3.70 3.57 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 0.00 157 Y 7.02 5.04 0.00 3.31 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 0.00 158 K 9.28 4.08 0.00 1.81 2.14 0.00 1.96 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.67 1.12 7.81 159 P 0.00 5.01 0.00 2.25 2.52 0.00 4.09 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 160 R 7.73 3.88 0.00 1.64 1.99 0.00 2.21 0.00 0.00 3.01 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.94 0.00 161 K 9.06 4.07 0.00 1.77 1.80 0.00 1.69 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.66 1.45 7.81 162 E 7.81 4.02 0.00 2.10 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 0.00 2.26 2.20 0.00 *164 F 8.21 4.47 0.00 3.06 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 0.00 165 E 8.12 3.93 0.00 2.01 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 2.60 0.00 166 K 7.91 3.88 0.00 1.89 1.67 0.00 1.55 0.00 0.00 1.61 0.00 0.00 3.22 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.42 1.36 7.81 167 V 7.14 2.87 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 1.02 0.00 0.00 -0.15 0.00 0.00 168 L 8.09 4.07 0.00 1.86 1.90 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 169 N 8.67 4.39 0.00 2.87 2.87 0.00 0.00 6.69 7.77 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 0.00 170 S 7.92 4.15 0.00 4.11 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 0.00 171 F 7.95 4.52 0.00 3.03 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 E 8.14 3.81 0.00 2.12 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 2.26 2.29 0.00 173 V 7.74 4.60 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 0.88 0.00 0.00 1.04 0.00 0.00 174 K 8.93 4.46 0.00 2.00 1.70 0.00 1.58 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.44 7.81 175 P 0.00 4.21 0.00 2.08 2.14 0.00 3.56 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 2.06 2.08 0.00 176 E 8.06 4.00 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.23 0.00 177 E 8.29 4.84 0.00 2.20 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 2.31 2.29 0.00 178 S 8.07 5.29 0.00 3.87 3.70 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 0.00 179 L 9.01 5.12 0.00 1.68 1.39 0.77 1.10 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 0.00 180 H 9.32 5.51 0.00 3.26 3.08 0.00 5.81 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 0.00 181 I 8.16 4.99 1.75 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.54 0.72 0.00 0.00 182 G 9.16 4.85 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 0.00 0.00 0.00 183 D 8.91 5.05 0.00 2.89 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 0.00 184 T 8.38 4.71 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 185 Y 9.02 3.66 0.00 2.25 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 0.00 186 A 8.00 4.58 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 0.00 187 E 8.10 4.42 0.00 2.17 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 0.00 2.43 2.48 0.00 188 D 8.75 4.72 0.00 3.07 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 0.00 189 Y 8.01 4.05 0.00 3.04 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 0.00 190 Q 8.28 3.74 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.19 1.86 0.00 191 G 8.19 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 A 7.39 2.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 R 7.68 3.51 0.00 1.15 1.46 0.00 3.19 0.00 0.00 2.70 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.33 0.00 194 K 7.57 4.06 0.00 1.85 1.79 0.00 1.58 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.57 1.32 7.81 195 V 6.88 3.86 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.88 0.00 0.00 196 G 7.24 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 *198 W 7.59 4.75 0.00 3.43 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 0.00 199 A 9.59 5.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 9.16 5.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.03 0.00 0.00 201 W 9.70 5.57 0.00 3.42 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 0.00 202 I 8.31 4.30 1.80 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.69 0.80 0.00 0.00 203 N 8.26 3.98 0.00 1.44 2.00 0.00 0.00 6.80 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 Q 8.41 4.35 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 7.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 205 E 8.19 4.24 0.00 2.09 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 2.29 2.27 0.00 206 G 7.54 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 0.00 207 D 8.52 4.66 0.00 2.59 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 0.00 208 K 7.48 4.67 0.00 1.84 1.72 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.41 7.81 209 V 8.21 4.04 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 0.83 0.00 0.00 0.89 0.00 0.00 210 R 9.26 4.82 0.00 1.81 1.81 0.00 3.19 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 211 K 8.79 4.13 0.00 1.80 1.70 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.20 0.84 7.81 212 L 8.91 4.25 0.00 1.84 1.74 0.84 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 213 E 7.21 4.65 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 2.28 2.16 0.00 214 E 8.73 4.01 0.00 1.89 1.83 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 2.10 2.26 0.00 215 R 9.11 4.11 0.00 1.78 1.59 0.00 2.21 0.00 0.00 2.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.04 0.00 216 G 8.11 5.27 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 0.00 217 F 10.12 5.66 0.00 3.00 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 0.00 218 E 9.63 5.48 0.00 2.21 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 219 I 8.75 5.02 1.83 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 1.29 0.51 0.92 0.00 0.00 220 P 0.00 4.40 0.00 2.18 2.39 0.00 3.67 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 2.02 1.91 0.00 221 S 7.44 4.58 0.00 3.94 3.91 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 0.00 222 I 8.33 3.74 1.91 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.44 0.91 0.00 0.00 223 A 7.89 3.96 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 N 8.21 4.97 0.00 2.83 2.76 0.00 0.00 6.55 6.26 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 0.00 225 L 7.79 3.90 0.00 1.80 1.73 0.84 0.79 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 0.00 226 K 7.75 3.62 0.00 0.79 0.74 0.00 0.96 0.00 0.00 1.51 0.00 0.00 2.62 0.00 0.00 2.16 0.00 0.00 0.00 0.00 1.27 1.15 7.81 227 D 7.52 4.15 0.00 2.66 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 0.00 228 V 7.42 3.10 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 0.20 0.00 0.00 0.65 0.00 0.00 229 I 7.43 3.51 2.02 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.04 0.96 0.00 0.00 230 E 8.20 4.10 0.00 2.13 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 2.51 2.68 0.00 231 L 7.85 3.95 0.00 1.59 1.65 0.92 1.22 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 0.00 232 I 6.96 4.10 1.14 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.33 0.30 0.00 0.00 233 S 7.44 5.15 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 * Residues marked with a * may have inaccurate shift predictions.