NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6412 8.3649 120.5371 53.8193 42.2887 174.9199 2 I 3.7032 8.2878 123.6005 60.4923 37.7867 170.1544 3 V 4.3405 9.8658 127.3506 61.3868 34.2929 173.9544 4 L 5.1635 8.5808 127.4222 53.4088 44.2994 175.1863 5 T 4.6948 9.0382 121.5483 61.9965 70.6983 173.3579 6 Q 5.4896 9.0244 125.8701 53.8737 30.6394 175.4220 7 S 4.8618 8.3704 116.8268 55.9381 66.7948 171.9606 8 P 4.7292 0.0000 0.0000 62.1645 32.4677 176.0731 9 A 4.3495 8.6542 121.1075 54.9692 19.1764 177.6425 10 T 5.1784 7.7027 102.4875 60.0665 72.4073 173.4670 11 L 4.7545 9.1794 124.9826 53.6754 45.6306 174.9180 12 S 5.4627 8.7610 122.2274 57.0798 64.7454 173.9622 13 V 4.5458 8.3184 122.6257 60.5542 35.2367 173.9747 14 T 4.2335 8.5399 120.4063 62.4144 69.8307 172.4826 15 P 4.5650 0.0000 0.0000 64.4048 31.8122 175.7310 16 G 4.0813 9.2848 111.0061 45.6656 0.0000 173.6610 17 N 4.6008 7.9660 116.1560 53.1335 40.0806 174.4140 18 S 5.2015 8.4308 115.9228 57.1000 65.4675 174.0311 19 V 4.5996 8.6449 115.4599 59.6859 36.1989 174.6069 20 S 5.0665 8.5124 117.2714 56.9090 65.6742 173.5413 21 L 4.7118 9.1924 125.0532 53.1117 44.3402 175.3530 22 S 5.1975 8.7372 117.5361 56.8408 64.9734 171.8943 23 C 5.5261 9.3023 126.0300 54.9725 45.5748 172.6262 24 R 5.4591 9.1457 124.7268 54.4328 32.9407 174.5744 25 A 5.3323 8.7922 125.2156 50.0770 20.5225 177.3957 26 S 4.4189 8.9860 116.9803 60.7778 63.5903 174.0908 27 Q 4.5996 7.8307 116.1651 53.6766 31.7065 174.2210 28 S 4.4243 8.6486 113.4715 58.7837 62.7545 173.5349 29 I 4.6713 8.6354 119.7628 59.8660 39.6487 176.8798 30 G 4.0794 8.0221 114.8353 47.6755 0.0000 175.0707 31 N 4.9725 8.9891 121.5869 52.5168 38.1579 174.9156 32 N 5.0652 8.3353 118.5255 52.6051 37.7611 174.6760 33 L 4.6345 6.9299 120.0033 53.7835 45.9788 175.2188 34 H 5.1912 8.4920 125.3103 53.6176 32.6534 172.1359 *36 Y 4.8421 8.3078 115.7787 58.9464 39.9003 173.8653 37 Q 4.2756 8.9491 124.1734 54.1809 31.6496 173.9050 38 Q 4.6058 8.8076 127.8742 54.2254 31.4476 174.8515 39 K 4.2478 8.4416 125.8717 54.8708 33.7902 176.6716 40 S 3.9344 8.7413 115.6862 60.3467 62.4320 174.2978 41 H 3.9799 8.8960 122.1331 56.0336 25.4705 173.2683 42 E 4.7708 7.4424 117.9470 54.9124 33.7684 175.6035 43 S 4.2599 8.3886 115.3729 57.3244 63.9214 172.3925 44 P 4.4630 0.0000 0.0000 63.0743 32.0720 175.4951 45 R 4.5844 9.0961 123.3223 54.1992 32.7903 174.3652 46 L 3.8871 8.6235 128.9258 55.2078 42.1036 175.8448 47 L 4.2538 8.2774 125.7295 55.8551 42.9834 177.0760 48 I 4.7141 7.0662 117.8812 59.2554 41.1987 174.1277 49 K 4.4176 8.3981 123.0985 55.8890 35.2879 175.1852 50 Y 4.2995 9.1968 114.4055 58.3550 35.5155 171.0035 51 A 4.3165 9.1575 129.1359 52.6970 18.6385 180.2420 52 S 4.8543 7.6744 103.2916 57.8281 65.3999 173.6974 53 Q 4.3212 8.4580 122.4795 55.1393 29.3175 175.7719 54 S 4.4666 8.5801 118.9427 58.6701 63.7819 173.5177 55 I 4.2799 7.9803 124.2845 59.0939 38.5304 175.2509 56 S 4.1875 8.5723 120.3658 60.1928 62.3587 174.2067 57 G 3.9911 9.1452 116.1526 45.0901 0.0000 172.7579 58 I 4.2908 7.1915 120.7884 58.8745 38.6910 174.0592 59 P 4.4174 0.0000 0.0000 62.9048 31.6635 177.5002 60 S 4.3915 8.6466 116.1689 60.2642 63.3305 175.3016 61 R 3.9916 7.8747 117.4696 57.6490 29.7874 175.5218 62 F 5.1910 7.8279 118.6446 56.6936 39.8064 175.4354 63 S 4.8074 9.4682 118.0523 56.6876 66.7162 173.1283 64 G 4.7625 8.8630 107.2220 43.9091 0.0000 171.4305 65 S 4.6558 9.0367 114.4494 57.2461 67.1039 172.5512 66 G 3.8766 9.0378 106.1522 44.6634 0.0000 172.5108 67 S 4.4515 7.9267 111.4672 58.3653 67.3442 179.3760 68 G 3.8834 9.2419 114.5259 46.4609 0.0000 174.6797 69 T 4.8236 8.7071 113.2718 60.9347 71.8508 174.4330 70 D 5.1068 7.5453 122.9495 52.6672 44.0332 174.3281 71 F 5.2603 9.3917 123.8773 56.1859 44.0675 174.0352 72 T 5.0951 8.9571 117.2149 61.9852 72.8825 172.6299 73 L 4.8079 8.9872 129.2025 54.1897 43.6953 175.1264 74 S 5.1409 9.4023 123.3229 57.0147 65.2348 173.1864 75 I 4.5116 8.4050 125.8763 59.2386 39.1567 174.7162 76 N 4.4559 9.0541 127.1626 53.6063 39.5502 175.0113 77 S 3.7365 7.7921 118.9942 57.4900 61.1877 173.3142 78 V 3.5737 8.0511 119.3229 63.7915 32.2736 174.7572 79 E 5.0045 9.6981 126.2624 54.2612 32.1893 177.1258 80 T 3.9602 8.4919 110.6337 64.7553 68.8350 176.1687 81 E 4.1244 8.4185 119.0635 59.2418 29.3418 177.4130 82 D 4.7841 8.2543 117.6026 54.6426 41.2064 176.6030 83 F 4.5186 7.9752 115.9092 56.8285 38.5474 176.0193 84 G 3.6397 7.7329 110.0058 44.7922 0.0000 171.2658 85 M 4.8419 7.9211 119.7034 53.9374 34.5211 175.0867 86 Y 4.9068 8.5866 120.0899 56.1450 41.0265 174.6629 87 F 5.6464 9.2347 123.2949 55.8368 42.0322 172.6830 88 C 5.1656 9.2100 116.9618 54.7565 41.0253 172.1956 89 Q 4.8626 8.7037 120.8833 54.8485 32.5805 173.1027 90 Q 4.8148 8.7562 125.0112 54.5053 30.9621 175.9114 91 S 3.8800 8.0432 115.2719 58.0506 63.3526 174.6120 92 N 4.5684 8.4699 121.1976 56.5934 39.6129 174.6326 93 S 4.3656 7.6937 116.9415 56.6946 64.6154 171.3099 *95 P 4.0763 0.0000 0.0000 63.2577 32.1692 176.2835 96 Y 4.5166 8.2761 118.2070 58.3236 38.4704 175.8291 97 T 4.9128 8.1207 112.0960 60.0936 72.7015 172.4304 98 F 5.2984 8.8989 121.0451 55.5607 41.5727 175.7290 99 G 4.1434 9.0948 109.9680 45.9001 0.0000 174.1299 100 G 3.8916 8.8610 108.1890 46.4623 0.0000 175.1036 101 G 3.6558 8.8250 106.0020 45.8269 0.0000 173.0311 102 T 4.7269 8.1945 117.0017 61.2303 71.9292 173.0786 103 K 4.5805 8.8737 129.0249 55.7755 33.8435 175.1195 104 L 5.0432 9.5172 130.7265 53.9377 43.7454 174.6332 105 E 5.1389 9.3172 127.0018 54.6161 32.3109 175.3204 106 I 4.7477 8.3535 123.5365 58.4301 40.6101 174.4994 107 T 4.5532 8.2203 127.0158 61.7198 67.9953 173.1767 *123 D 4.3471 8.0502 118.1195 53.7512 42.1806 175.2552 124 I 4.3506 6.8336 115.2651 59.7880 39.7565 174.6969 125 Q 4.7384 9.1484 122.9894 54.1307 31.8058 174.4843 126 L 5.3001 8.4854 122.2757 53.0043 45.3750 175.1346 127 Q 4.5447 8.6924 123.5954 54.3745 32.3586 173.8588 128 E 4.8703 8.8503 126.0268 56.0779 30.7776 176.0157 129 S 4.6384 9.3450 117.3629 56.2664 66.9746 173.3179 130 G 4.4376 8.2688 109.5264 45.2976 0.0000 170.3602 131 P 4.4544 0.0000 0.0000 62.8674 31.7832 176.9843 132 S 4.4874 8.6233 117.1231 60.9475 64.1109 173.8295 133 L 5.2013 7.6826 120.4215 53.4214 44.9362 176.0049 134 V 4.6080 8.8681 118.6445 59.4550 35.9629 175.1405 135 K 4.7987 8.8640 122.0916 54.8050 33.7947 175.1564 136 P 4.4255 0.0000 0.0000 64.2045 31.6267 177.5441 137 S 4.1010 9.2859 116.7974 58.6655 61.9847 170.1182 138 Q 4.3246 7.4756 119.2131 55.7123 30.5604 174.9390 139 T 4.7202 8.1805 116.5053 62.6640 69.6430 174.3374 140 L 4.3172 8.9011 129.9135 54.2673 43.5405 175.3283 141 S 5.3411 8.5708 121.8755 56.7547 65.5977 173.3954 142 L 5.0499 8.9899 123.9981 53.1599 45.8337 175.5821 143 T 4.9835 8.7226 117.5793 61.9084 72.4454 172.0141 144 C 5.0564 8.6997 126.2882 54.8495 42.3554 172.6101 145 S 4.7504 9.0417 123.5942 57.8892 64.0486 173.2904 146 V 4.5098 8.4260 125.2846 61.7119 32.6704 174.7668 147 T 4.4748 9.2573 125.7125 63.1409 70.3778 175.2298 148 G 3.6783 10.1468 113.3545 45.9049 0.0000 173.4800 149 D 4.4156 7.2650 115.2274 53.5360 44.8353 174.4192 150 S 4.8044 8.3784 128.8633 55.9042 61.6420 176.5142 151 I 3.2876 9.0119 110.0783 61.6871 33.9885 173.6938 152 T 3.8078 7.9687 115.5363 65.1811 67.9387 174.8607 153 S 4.3786 8.0706 115.2169 59.5209 63.0431 173.4028 154 D 5.1242 8.0238 120.9269 54.2694 41.6880 174.3779 155 Y 5.7025 8.1443 118.6569 56.1524 40.5497 175.6160 *157 S 5.4220 7.8478 113.9050 58.9459 65.7809 172.9247 *159 I 4.1727 8.1586 121.9941 62.1284 38.7527 175.1119 160 R 4.7105 8.6146 121.5574 53.9871 33.2238 174.2884 161 K 4.6537 8.3391 121.5410 54.4877 34.4846 175.8340 162 F 4.7134 8.8108 127.2114 56.3326 39.6674 174.9112 163 P 4.2660 0.0000 0.0000 65.4750 31.3350 177.1766 164 G 4.0990 7.9764 106.4393 45.8209 0.0000 172.9635 165 N 4.2010 8.2131 111.1122 53.8497 36.6802 174.3183 166 R 4.4943 7.7588 119.3485 55.2005 31.3599 174.8791 167 L 4.5502 8.2552 126.9108 53.4378 43.0745 175.7613 168 E 4.8040 8.8743 124.6324 54.4180 32.6765 173.8453 169 Y 4.4820 9.1180 128.7386 58.0266 39.1550 174.6684 170 M 4.3886 9.0398 126.7609 56.3762 33.9675 176.5064 171 G 4.7510 7.7612 104.9254 46.9811 0.0000 170.5726 172 Y 5.5860 8.1849 117.0099 55.4779 42.0674 174.1881 173 V 4.7054 8.6153 120.1923 60.2275 34.2992 175.2007 174 S 4.3235 8.3324 120.0071 56.2116 65.6036 173.9612 175 Y 4.6959 8.2947 116.4291 59.7657 37.4055 177.5258 176 S 4.1736 6.9825 112.1648 58.5460 63.5553 174.9027 177 G 3.8809 7.9723 110.2474 44.9257 0.0000 173.9571 178 S 4.1730 7.4190 115.7085 58.4346 64.0006 173.5278 179 T 4.6698 7.7787 111.6877 59.9396 71.7358 172.6766 180 Y 4.1574 7.9531 119.9691 56.2413 41.2773 174.1590 181 Y 5.5476 8.2370 120.9948 55.7505 41.6720 175.0405 182 N 4.4620 9.3101 122.8404 53.3225 39.6376 174.1915 183 P 4.3685 0.0000 0.0000 65.5595 31.2380 178.5745 184 S 4.2328 8.1181 112.0195 61.0194 62.8667 175.6919 185 L 4.3114 8.1220 120.9801 53.7169 42.1654 176.3047 186 K 3.7871 8.7943 118.0757 57.9836 30.1140 175.1740 187 S 3.7655 8.0979 107.7997 59.6454 60.9182 174.0079 188 R 4.1121 8.1834 119.6985 57.2365 30.2411 175.7023 189 I 4.7923 7.1148 118.0950 59.2234 40.1327 174.5648 190 S 4.5047 8.8262 122.0298 56.5946 66.0125 172.4664 191 I 5.4610 9.3276 127.3789 58.8510 39.7115 175.0555 192 T 4.8929 8.6893 115.6786 60.1705 72.4995 172.9912 193 R 4.8408 8.6416 121.5002 55.0406 32.3523 175.3093 194 D 4.7707 8.5130 122.3368 53.1946 41.8303 177.4436 195 T 4.6895 8.2641 126.6826 62.6608 68.4625 175.2200 196 S 4.6638 8.5577 112.0807 58.0125 66.3318 174.6970 197 K 4.4779 7.8346 119.6360 55.4186 33.3800 174.7850 198 N 4.2848 8.6191 113.1062 53.8393 35.6413 173.1142 199 Q 5.1192 7.4233 113.1062 55.8652 32.2508 172.6157 200 Y 4.6649 8.1119 117.6497 55.7753 42.2313 173.1520 201 Y 5.3368 9.0627 116.1425 56.1275 42.5966 174.4539 202 L 5.0993 8.8926 123.1533 53.4643 45.3827 174.8069 203 D 5.3859 9.1717 125.6123 52.3819 44.4975 174.8539 204 L 4.9624 9.0056 124.4620 53.4170 44.8046 175.3594 205 N 4.7657 9.1344 124.5812 52.6457 39.7382 175.3465 206 S 3.8209 8.2806 113.9843 58.5909 60.5751 173.6309 207 V 3.9849 7.7791 113.8010 61.7454 32.4266 176.3969 208 T 4.9033 8.7016 113.0159 59.3764 71.7453 174.9986 209 T 3.8598 8.3649 110.3781 64.6993 68.5633 175.6414 210 E 4.1762 7.9547 119.5828 57.9652 29.3898 176.9138 211 D 4.9944 8.0920 118.2655 54.2801 41.4700 176.5040 212 T 4.3371 7.7742 117.3199 64.3284 68.7769 173.4449 213 A 4.4093 8.7675 126.6768 51.5746 23.7635 174.6975 214 T 4.5360 8.2280 116.5576 62.9326 70.0931 173.9532 215 Y 4.5057 8.9077 125.1721 56.5602 39.8506 174.3126 216 Y 5.2823 8.9326 122.6222 56.2383 40.5324 172.9703 217 C 5.1968 9.0515 118.2149 54.6576 43.7134 172.7576 218 A 5.1644 8.4359 120.6009 49.7896 22.4956 178.1240 219 N 5.1130 9.0398 123.6903 52.6196 36.5191 178.6085 *221 D 4.3355 8.8058 115.1528 52.6006 42.4232 176.3404 222 G 4.0763 8.1247 105.4680 45.3310 0.0000 174.1580 223 D 4.1609 7.8072 119.2720 56.4727 41.2607 175.9772 224 Y 4.7200 7.4597 114.8770 55.9061 40.9159 174.7558 *226 G 4.0725 8.1699 110.0305 45.2644 0.0000 172.8408 227 Q 4.1088 8.6258 115.8176 56.7084 29.1368 176.4101 228 G 3.3552 8.6357 106.9280 45.6688 0.0000 172.6196 229 T 4.4886 8.3256 116.0546 59.6026 70.6361 172.5507 230 L 4.5819 8.6019 131.2162 54.9315 43.1811 175.7557 231 V 4.5596 9.0335 126.5805 61.4080 34.2986 174.0116 232 T 4.8525 8.9136 124.9234 61.7756 71.0547 173.4465 233 V 4.5426 8.5128 127.3976 61.9201 32.3031 175.1507 234 S 4.6628 8.7668 122.0261 55.7469 66.0718 175.1903 235 A 4.1717 8.6858 126.6230 52.3020 17.9092 177.3150 236 A 4.1413 8.7923 128.8991 54.2585 19.4842 177.2437 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 D 8.36 4.64 0.00 2.71 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 2 I 8.29 3.70 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.61 0.93 0.00 0.00 3 V 9.87 4.34 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 1.08 0.00 0.00 0.97 0.00 0.00 4 L 8.58 5.16 0.00 1.69 1.61 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 5 T 9.04 4.69 4.29 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 1.25 0.00 0.00 6 Q 9.02 5.49 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.75 0.00 0.00 0.00 0.00 0.00 2.50 2.27 0.00 7 S 8.37 4.86 0.00 3.84 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 8 P 0.00 4.73 0.00 2.38 2.10 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 9 A 8.65 4.35 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 10 T 7.70 5.18 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 11 L 9.18 4.75 0.00 1.63 1.47 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.76 5.46 0.00 3.79 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.32 4.55 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.91 0.00 0.00 14 T 8.54 4.23 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 1.21 0.00 0.00 15 P 0.00 4.56 0.00 2.04 2.02 0.00 3.64 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 16 G 9.28 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 17 N 7.97 4.60 0.00 2.86 2.72 0.00 0.00 6.72 6.97 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 18 S 8.43 5.20 0.00 3.68 3.69 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 19 V 8.64 4.60 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 0.68 0.00 0.00 0.80 0.00 0.00 20 S 8.51 5.07 0.00 3.68 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 21 L 9.19 4.71 0.00 1.53 1.54 0.71 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.74 5.20 0.00 3.92 3.90 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 23 C 9.30 5.53 0.00 3.06 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.15 5.46 0.00 1.83 1.83 0.00 3.17 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 25 A 8.79 5.33 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 26 S 8.99 4.42 0.00 3.92 4.06 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 27 Q 7.83 4.60 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.95 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 28 S 8.65 4.42 0.00 3.88 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 29 I 8.64 4.67 1.85 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.22 0.99 0.00 0.00 30 G 8.02 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 31 N 8.99 4.97 0.00 3.11 3.09 0.00 0.00 5.93 6.96 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 32 N 8.34 5.07 0.00 2.84 2.76 0.00 0.00 6.39 6.70 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 33 L 6.93 4.63 0.00 0.64 0.68 0.67 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 34 H 8.49 5.19 0.00 2.72 2.85 0.00 5.71 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 *36 Y 8.31 4.84 0.00 3.17 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 37 Q 8.95 4.28 0.00 1.74 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.74 0.00 0.00 0.00 0.00 0.00 1.91 1.56 0.00 38 Q 8.81 4.61 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.64 0.00 0.00 0.00 0.00 0.00 2.20 2.33 0.00 39 K 8.44 4.25 0.00 1.67 1.33 0.00 1.70 0.00 0.00 1.45 0.00 0.00 2.89 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.94 1.10 7.81 40 S 8.74 3.93 0.00 4.27 4.10 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 0.00 0.00 0.00 41 H 8.90 3.98 0.00 3.32 3.31 0.00 5.80 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 7.44 4.77 0.00 2.05 1.79 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 2.25 2.45 0.00 43 S 8.39 4.26 0.00 3.91 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.46 0.00 1.54 1.74 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.78 0.00 45 R 9.10 4.58 0.00 1.74 1.78 0.00 3.05 0.00 0.00 2.91 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.45 0.00 46 L 8.62 3.89 0.00 1.71 1.40 0.19 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.28 4.25 0.00 1.46 1.37 0.81 0.03 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 48 I 7.07 4.71 1.81 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.98 0.00 0.00 49 K 8.40 4.42 0.00 1.51 1.62 0.00 1.48 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.25 1.43 7.81 50 Y 9.20 4.30 0.00 3.13 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 9.16 4.32 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 7.67 4.85 0.00 3.95 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 53 Q 8.46 4.32 0.00 2.33 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.01 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 54 S 8.58 4.47 0.00 3.86 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 55 I 7.98 4.28 1.78 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 1.27 0.74 0.81 0.00 0.00 56 S 8.57 4.19 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 57 G 9.15 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 58 I 7.19 4.29 1.96 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.78 0.87 0.00 0.00 59 P 0.00 4.42 0.00 2.40 2.08 0.00 3.81 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.20 0.00 60 S 8.65 4.39 0.00 3.99 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 R 7.87 3.99 0.00 1.95 2.11 0.00 2.94 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.97 0.00 62 F 7.83 5.19 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.47 4.81 0.00 3.84 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 64 G 8.86 4.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 S 9.04 4.66 0.00 3.88 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 66 G 9.04 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 67 S 7.93 4.45 0.00 3.88 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 68 G 9.24 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 69 T 8.71 4.82 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 1.29 0.00 0.00 70 D 7.55 5.11 0.00 2.62 2.30 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 71 F 9.39 5.26 0.00 3.12 2.88 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 72 T 8.96 5.10 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 1.29 0.00 0.00 73 L 8.99 4.81 0.00 1.81 1.55 1.03 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 74 S 9.40 5.14 0.00 3.75 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 75 I 8.41 4.51 1.67 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.67 0.34 0.00 0.00 76 N 9.05 4.46 0.00 2.67 2.59 0.00 0.00 7.46 7.64 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 77 S 7.79 3.74 0.00 3.89 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 78 V 8.05 3.57 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 1.06 0.00 0.00 0.87 0.00 0.00 79 E 9.70 5.00 0.00 2.05 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 2.23 2.30 0.00 80 T 8.49 3.96 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 1.24 0.00 0.00 81 E 8.42 4.12 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 82 D 8.25 4.78 0.00 2.92 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 7.98 4.52 0.00 3.18 3.12 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 84 G 7.73 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 M 7.92 4.84 0.00 1.24 1.81 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.60 0.00 86 Y 8.59 4.91 0.00 2.88 2.87 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 87 F 9.23 5.65 0.00 3.06 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 C 9.21 5.17 0.00 2.96 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 89 Q 8.70 4.86 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.83 0.00 0.00 0.00 0.00 0.00 1.76 1.16 0.00 90 Q 8.76 4.81 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.53 0.00 0.00 0.00 0.00 0.00 2.21 2.39 0.00 91 S 8.04 3.88 0.00 3.12 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 92 N 8.47 4.57 0.00 2.68 2.99 0.00 0.00 6.83 7.62 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 93 S 7.69 4.37 0.00 3.86 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *95 P 0.00 4.08 0.00 2.27 2.14 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.11 0.00 96 Y 8.28 4.52 0.00 2.40 2.49 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 97 T 8.12 4.91 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 98 F 8.90 5.30 0.00 2.90 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 99 G 9.09 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 0.00 100 G 8.86 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 0.00 0.00 0.00 101 G 8.83 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 0.00 0.00 0.00 102 T 8.19 4.73 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 1.25 0.00 0.00 103 K 8.87 4.58 0.00 1.86 1.71 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.43 7.81 104 L 9.52 5.04 0.00 1.87 1.78 0.85 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 105 E 9.32 5.14 0.00 1.94 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 2.30 2.26 0.00 106 I 8.35 4.75 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.88 1.06 0.00 0.00 107 T 8.22 4.55 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 *123 D 8.05 4.35 0.00 2.74 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 6.83 4.35 1.74 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 -0.04 0.22 0.61 0.00 0.00 125 Q 9.15 4.74 0.00 1.90 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.21 2.42 0.00 126 L 8.49 5.30 0.00 1.67 1.57 0.97 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 8.69 4.54 0.00 2.08 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.97 0.00 0.00 0.00 0.00 0.00 2.21 2.30 0.00 128 E 8.85 4.87 0.00 1.80 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 129 S 9.35 4.64 0.00 3.77 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 0.00 130 G 8.27 4.44 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 0.00 131 P 0.00 4.45 0.00 2.13 2.02 0.00 3.76 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.92 0.00 132 S 8.62 4.49 0.00 3.78 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 L 7.68 5.20 0.00 1.55 1.46 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.87 4.61 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 0.79 0.00 0.00 0.90 0.00 0.00 135 K 8.86 4.80 0.00 1.68 1.70 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.55 7.81 136 P 0.00 4.43 0.00 2.03 1.99 0.00 3.74 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 2.03 2.11 0.00 137 S 9.29 4.10 0.00 4.02 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 Q 7.48 4.32 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.92 0.00 0.00 0.00 0.00 0.00 2.49 2.30 0.00 139 T 8.18 4.72 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 1.23 0.00 0.00 140 L 8.90 4.32 0.00 1.59 1.40 0.31 0.38 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 0.00 141 S 8.57 5.34 0.00 3.68 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 L 8.99 5.05 0.00 1.46 1.41 0.57 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 143 T 8.72 4.98 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 1.14 0.00 0.00 144 C 8.70 5.06 0.00 2.28 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 S 9.04 4.75 0.00 3.74 3.74 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 0.00 146 V 8.43 4.51 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 0.83 0.00 0.00 1.13 0.00 0.00 147 T 9.26 4.47 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 148 G 10.15 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 0.00 149 D 7.26 4.42 0.00 2.53 2.44 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 0.00 150 S 8.38 4.80 0.00 3.88 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 0.00 151 I 9.01 3.29 1.91 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 0.39 0.95 0.00 0.00 152 T 7.97 3.81 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 153 S 8.07 4.38 0.00 4.00 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 0.00 154 D 8.02 5.12 0.00 2.75 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 0.00 155 Y 8.14 5.70 0.00 2.83 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 *157 S 7.85 5.42 0.00 4.07 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 *159 I 8.16 4.17 1.62 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 -0.36 0.55 0.00 0.00 160 R 8.61 4.71 0.00 0.76 1.11 0.00 2.21 0.00 0.00 2.74 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.50 0.00 161 K 8.34 4.65 0.00 1.66 1.62 0.00 1.51 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.22 1.15 7.81 162 F 8.81 4.71 0.00 3.10 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 P 0.00 4.27 0.00 2.09 2.20 0.00 3.90 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 164 G 7.98 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 165 N 8.21 4.20 0.00 3.00 3.18 0.00 0.00 7.05 7.66 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 0.00 166 R 7.76 4.49 0.00 1.95 2.03 0.00 3.13 0.00 0.00 3.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 167 L 8.26 4.55 0.00 0.75 0.20 -1.05 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 168 E 8.87 4.80 0.00 2.19 1.71 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 2.32 2.39 0.00 169 Y 9.12 4.48 0.00 3.35 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 0.00 170 M 9.04 4.39 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.57 0.00 171 G 7.76 4.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 8.18 5.59 0.00 3.14 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 V 8.62 4.71 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 0.74 0.00 0.00 0.93 0.00 0.00 174 S 8.33 4.32 0.00 2.72 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 0.00 175 Y 8.29 4.70 0.00 3.14 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 S 6.98 4.17 0.00 3.80 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 G 7.97 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 0.00 178 S 7.42 4.17 0.00 3.49 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 T 7.78 4.67 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 180 Y 7.95 4.16 0.00 1.89 2.50 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 0.00 181 Y 8.24 5.55 0.00 2.81 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 0.00 182 N 9.31 4.46 0.00 3.18 2.83 0.00 0.00 7.10 7.92 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 0.00 183 P 0.00 4.37 0.00 2.24 2.13 0.00 3.73 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 2.16 2.20 0.00 184 S 8.12 4.23 0.00 4.12 4.09 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 0.00 185 L 8.12 4.31 0.00 1.87 1.74 0.99 1.08 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 0.00 186 K 8.79 3.79 0.00 1.86 1.84 0.00 1.88 0.00 0.00 1.72 0.00 0.00 3.18 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.59 1.55 7.81 187 S 8.10 3.77 0.00 4.01 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 R 8.18 4.11 0.00 1.90 2.06 0.00 3.33 0.00 0.00 3.10 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 189 I 7.11 4.79 1.72 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.67 0.42 0.00 0.00 190 S 8.83 4.50 0.00 3.80 3.58 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 0.00 191 I 9.33 5.46 2.18 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.96 1.19 0.00 0.00 192 T 8.69 4.89 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 193 R 8.64 4.84 0.00 1.76 1.92 0.00 3.33 0.00 0.00 3.09 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 194 D 8.51 4.77 0.00 2.83 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 T 8.26 4.69 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 196 S 8.56 4.66 0.00 3.95 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 K 7.83 4.48 0.00 1.84 1.84 0.00 1.81 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.51 7.81 198 N 8.62 4.28 0.00 2.97 2.90 0.00 0.00 6.60 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 Q 7.42 5.12 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.71 0.00 0.00 0.00 0.00 0.00 2.23 1.97 0.00 200 Y 8.11 4.66 0.00 3.14 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 Y 9.06 5.34 0.00 2.94 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 0.00 202 L 8.89 5.10 0.00 1.80 1.47 0.99 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 203 D 9.17 5.39 0.00 2.54 2.46 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 0.00 204 L 9.01 4.96 0.00 1.64 1.42 0.94 0.70 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 0.00 205 N 9.13 4.77 0.00 2.60 2.70 0.00 0.00 7.15 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 0.00 206 S 8.28 3.82 0.00 3.98 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 0.00 207 V 7.78 3.98 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 0.73 0.00 0.00 0.97 0.00 0.00 208 T 8.70 4.90 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 1.22 0.00 0.00 209 T 8.36 3.86 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 1.22 0.00 0.00 210 E 7.95 4.18 0.00 1.99 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 0.00 2.33 2.39 0.00 211 D 8.09 4.99 0.00 2.89 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 T 7.77 4.34 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 213 A 8.77 4.41 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 T 8.23 4.54 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 0.60 0.00 0.00 215 Y 8.91 4.51 0.00 2.75 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 0.00 216 Y 8.93 5.28 0.00 2.71 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 0.00 217 C 9.05 5.20 0.00 3.08 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 0.00 218 A 8.44 5.16 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 0.00 219 N 9.04 5.11 0.00 3.03 2.53 0.00 0.00 7.15 7.36 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 *221 D 8.81 4.34 0.00 2.87 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 0.00 222 G 8.12 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 0.00 223 D 7.81 4.16 0.00 1.97 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 0.00 0.00 0.00 224 Y 7.46 4.72 0.00 3.07 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 *226 G 8.17 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 0.00 227 Q 8.63 4.11 0.00 2.21 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 5.55 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 228 G 8.64 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 0.00 0.00 0.00 229 T 8.33 4.49 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 1.14 0.00 0.00 230 L 8.60 4.58 0.00 1.65 1.54 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 231 V 9.03 4.56 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 0.83 0.00 0.00 0.75 0.00 0.00 232 T 8.91 4.85 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 1.23 0.00 0.00 233 V 8.51 4.54 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 0.69 0.00 0.00 1.05 0.00 0.00 234 S 8.77 4.66 0.00 3.92 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 0.00 235 A 8.69 4.17 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 A 8.79 4.14 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.