NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 I 4.0063 8.0244 120.8071 60.5193 39.1253 175.1048 6 S 4.2916 8.3971 121.2703 57.6736 63.1292 172.6424 7 D 4.8559 9.5181 124.5412 56.5682 41.8522 175.4581 8 N 5.4408 8.1385 115.7973 51.6546 41.8562 174.3484 9 V 4.6934 9.0390 116.5433 59.6883 36.4772 174.9084 10 R 5.0075 8.8208 120.8972 54.8960 33.1391 175.5634 11 I 4.8510 8.4484 120.7477 59.4235 41.4875 174.5473 12 K 4.7809 8.8123 127.0497 54.4573 35.3768 174.5095 13 L 5.2982 8.7280 128.9827 53.5374 45.6104 174.5932 14 Y 5.1212 8.9129 121.8198 56.0828 42.9263 173.8491 *16 E 4.2687 8.5649 120.4291 56.4708 31.2531 174.6161 17 G 4.4516 7.5723 111.5465 45.7441 0.0000 172.0887 18 T 5.2839 8.0649 115.5094 61.9294 72.8496 173.4014 19 V 4.7760 9.0180 126.2988 61.4908 34.5527 175.3118 20 N 4.3372 9.7193 126.1123 54.6185 36.6376 174.2749 21 N 4.2615 8.5534 110.8657 54.3817 37.8226 172.2029 22 H 4.8305 8.5027 117.4967 54.2316 30.9735 173.0396 23 H 5.0983 8.6442 127.2023 55.8645 31.1318 174.2853 24 F 5.4022 7.7942 119.2580 56.9723 40.8597 172.6230 *26 C 5.0176 8.5606 114.9884 60.6050 29.5071 172.9844 27 E 4.9867 9.1830 120.3490 55.0647 33.1956 173.7906 28 A 5.4338 8.6236 125.3275 50.4130 23.4902 174.8042 29 E 4.9386 8.6386 117.9349 54.9895 33.8021 175.6543 30 G 4.5581 8.9017 109.7742 46.2542 0.0000 171.1736 31 E 5.2107 8.6154 115.6754 55.7370 33.0622 174.1265 32 G 3.9897 8.8907 106.9211 45.8152 0.0000 172.4823 33 K 5.1280 8.8164 119.9743 52.6514 33.2774 175.3284 34 P 4.1177 0.0000 0.0000 65.6785 31.7349 178.3382 35 Y 4.3253 7.8349 113.9224 59.3372 38.3596 176.6337 36 E 4.2166 8.3113 119.2167 56.2615 30.3978 176.8795 37 G 3.9392 8.4860 106.8677 45.8338 0.0000 172.4291 38 T 5.1759 7.2915 109.2670 60.2368 72.0569 173.6857 39 Q 4.9715 8.2076 119.0545 56.8761 32.5691 172.2260 *41 E 4.5040 8.5397 116.7672 56.9381 31.6107 175.1236 42 N 5.2582 8.9669 121.2115 52.0085 40.2780 173.6674 43 I 4.7163 8.9354 126.5158 59.7456 39.1563 174.8624 44 K 4.9419 9.3576 129.3573 54.5755 34.4441 175.2490 45 V 4.4325 8.9707 128.9935 62.6192 30.9620 175.7929 46 T 4.3043 8.7564 118.7305 62.7452 69.9740 174.9353 47 K 4.4729 7.9299 122.9512 56.4186 35.1094 176.1278 48 G 4.0865 9.2489 113.5968 45.5311 0.0000 173.2572 49 G 4.0759 7.5845 107.4765 42.9911 0.0000 172.3719 50 P 4.3644 0.0000 0.0000 61.9272 31.7230 176.7644 51 L 3.7404 8.1038 122.0542 54.0126 42.0201 175.9149 52 P 4.5785 0.0000 0.0000 62.9663 31.2277 175.4935 53 F 4.9736 6.5330 111.7039 55.0855 41.0061 174.0867 54 S 4.1960 8.7843 116.6775 58.2369 62.7337 175.1676 55 F 3.9506 8.8045 128.5590 60.7749 39.1747 176.6448 56 D 4.6210 8.1015 119.2179 57.7034 40.3762 178.5885 57 I 4.3642 7.3926 111.7787 63.0659 37.8875 177.4285 58 L 4.1931 7.8839 121.2699 56.5110 41.8820 178.6712 59 T 4.1244 7.2867 114.5609 65.8593 68.4351 173.8669 60 P 4.3771 0.0000 0.0000 64.0235 31.3488 176.2892 61 N 4.9957 8.2006 116.2431 54.5544 39.2350 175.4133 62 C 4.4788 7.8827 114.7920 60.5731 28.8264 174.2115 *66 S 4.0697 7.7028 113.9019 58.4576 62.4973 174.8815 67 V 3.4735 7.2702 111.5228 62.5389 31.7470 177.6920 68 A 4.2352 8.0138 122.3834 53.6205 18.8146 177.3426 69 I 4.3433 7.1473 116.3263 60.5970 37.4902 175.3447 70 T 4.4941 8.0952 120.4301 62.2321 73.3685 173.8061 71 K 4.4265 8.7584 127.9384 55.5967 32.9212 175.5694 72 Y 4.3586 8.7265 127.0470 57.3548 38.5711 175.6075 73 T 4.3238 8.3166 116.0418 60.0183 72.0733 174.9327 74 S 3.6607 9.5877 113.6518 59.5078 60.3975 173.6051 75 G 3.9526 8.4715 105.0699 45.9289 0.0000 174.3739 76 I 3.8399 7.7323 121.5187 59.9213 37.2753 174.3894 77 P 4.0418 0.0000 0.0000 63.3507 31.4884 175.8088 78 D 3.3700 8.1074 121.8167 52.2632 40.1458 175.5091 79 Y 3.7397 7.8252 127.2357 60.3351 38.8761 177.6419 80 F 3.6859 7.2144 117.8429 60.3661 39.1565 177.9322 81 K 4.3219 8.2980 117.9582 59.5189 31.5813 179.4591 82 Q 3.9970 7.6332 117.3403 58.5496 28.8624 178.3423 83 S 4.0587 7.5268 115.7826 59.5289 62.8166 174.3756 84 F 4.9617 6.7718 120.5812 56.2144 39.4306 174.1096 85 P 4.7074 0.0000 0.0000 64.6610 31.8081 177.4874 86 E 4.0042 8.2782 118.9473 58.5213 29.9995 177.1293 87 G 3.7039 10.0223 105.2392 44.8550 0.0000 171.1967 88 F 5.2562 7.3806 112.4071 56.6280 41.8952 172.7923 89 T 5.4007 9.2520 108.8654 60.0747 72.5760 172.6506 90 W 5.8826 8.7338 117.9504 55.3247 32.0375 173.4020 91 E 5.1904 9.2698 118.5387 55.1241 32.8540 174.2873 92 R 5.1678 8.9418 120.2406 55.8615 34.5233 173.5410 93 T 5.1420 8.6967 120.0434 62.1228 72.7021 172.8624 94 T 4.9599 9.3166 122.9104 61.8458 71.2686 173.2769 95 I 4.3051 8.5481 128.0270 59.6666 39.3770 174.7825 96 Y 4.6720 8.5674 126.0837 56.8036 38.8923 177.1408 97 E 4.0267 9.0363 120.8707 58.7150 29.8275 177.3110 98 D 4.7414 8.1588 118.1991 53.1081 39.7754 177.3427 99 G 3.8812 8.0038 107.9039 45.6327 0.0000 174.3058 100 A 4.2258 6.9919 122.2996 51.5706 20.0653 176.2473 101 Y 5.1103 8.5917 117.0665 56.1396 42.6037 174.5179 102 L 5.3307 9.1226 124.6086 53.9377 45.7413 174.8798 103 T 5.2256 9.3658 123.3945 62.1803 71.4297 173.5730 104 T 5.1722 9.3668 121.8097 61.7634 72.8247 172.6804 105 Q 4.6749 8.7388 125.4005 54.3126 32.3924 173.7914 106 Q 4.6351 8.5293 126.5740 54.0917 33.0478 172.9400 107 E 4.9515 8.8905 125.6682 54.5978 33.1339 174.5010 108 T 5.3617 8.8330 123.1886 61.6203 71.7608 173.1837 109 K 5.0825 9.1249 124.7145 54.8970 36.7573 174.6751 110 L 4.8883 8.5832 122.3695 53.3247 44.4987 175.2165 111 D 4.7155 9.0098 126.6209 52.9607 43.0552 176.8508 112 G 3.9296 8.3439 120.0153 46.8546 0.0000 172.4878 113 N 4.9539 8.8107 120.5328 52.2938 38.5010 171.7770 114 C 5.1221 7.9364 120.5469 58.3950 34.1725 172.5491 115 L 4.5734 8.7493 127.5958 54.2223 42.9310 175.9759 116 V 4.6598 8.8606 124.2022 61.2885 34.0426 173.6281 117 Y 5.6399 8.9573 125.9447 56.4272 40.9395 174.4936 118 N 5.5101 9.1301 120.7489 51.7138 41.8236 173.3849 119 I 4.8968 9.0086 125.1747 59.2543 40.3321 175.4459 120 K 4.8580 8.9164 125.1508 54.6956 35.6172 175.3269 121 I 5.2179 8.6532 124.1703 59.5986 41.8946 174.4079 122 L 5.1665 9.1116 125.0744 53.1384 45.5577 175.7827 123 G 4.8350 9.5038 111.3679 44.8063 0.0000 171.0670 124 C 5.1824 9.5669 116.2102 56.9673 33.8159 173.4005 125 N 4.3854 8.8811 113.3353 54.2237 35.6833 174.4731 126 F 4.0741 8.6549 117.8002 56.0986 39.5814 174.0214 127 P 4.4273 0.0000 0.0000 61.9232 31.6892 175.6873 128 P 4.2920 0.0000 0.0000 65.3540 31.3244 176.7134 129 N 4.7886 8.0857 113.5977 52.6877 37.4736 174.8909 130 G 3.9668 7.8883 109.3477 43.8470 0.0000 173.4894 131 P 4.4505 0.0000 0.0000 65.7047 31.3804 178.6504 132 V 3.6430 7.2640 113.8650 63.9761 30.6358 176.9362 *134 Q 4.2632 7.9355 115.2975 54.1290 30.4694 174.8563 135 K 3.8133 7.7560 115.9859 57.7637 29.4578 175.4978 136 K 4.4196 8.3447 115.8870 56.3472 33.3371 177.6861 137 T 4.3210 7.5590 109.1755 61.5425 69.7565 174.0643 138 Q 4.4685 9.0000 120.6843 55.4373 29.6452 176.2052 139 G 3.9605 8.5964 103.4832 45.1516 0.0000 172.5798 140 W 5.1660 8.1888 117.7423 54.9178 31.0003 176.0913 141 E 4.5983 8.7164 122.5514 54.8759 30.1323 174.4056 142 P 4.8150 0.0000 0.0000 63.2521 32.5095 174.5105 143 C 4.9201 9.0857 114.7243 56.8371 33.9597 172.2557 144 C 5.0207 8.5099 118.7242 57.9220 33.1425 172.5181 145 E 4.9724 9.0335 132.6923 54.9282 32.6448 174.4365 *147 R 4.4238 8.4404 115.2407 56.4909 31.9605 174.3116 148 Y 5.1403 7.7392 119.8293 56.0602 41.6123 173.9985 149 T 4.6510 8.4699 111.2461 61.4172 70.8687 174.1089 150 R 4.4655 9.0549 121.1430 57.0061 33.5539 174.6601 151 D 4.4701 9.9388 124.4259 55.4703 38.5267 174.8014 152 G 3.9369 8.5567 104.7222 45.5509 0.0000 173.4639 153 V 4.5471 7.7397 112.3790 59.2652 36.3307 173.7105 154 L 4.4834 7.6562 123.1378 53.6601 43.8120 175.0740 155 C 5.0191 8.6282 123.6188 58.0352 31.6196 173.0364 156 G 4.5365 8.6013 107.0798 45.0490 0.0000 171.7056 157 Q 5.2758 8.5430 119.9871 54.6413 32.9604 174.4223 158 T 4.7464 8.9458 118.3377 62.3258 73.4806 173.0246 159 L 5.0715 8.6097 123.3552 52.1732 45.0737 175.6296 *161 A 4.4945 8.2086 120.7827 52.1111 20.2046 175.8044 162 L 4.3183 8.9921 123.5616 53.9371 43.3978 176.4720 163 K 4.4064 8.7995 123.3914 56.0106 33.7743 175.7407 164 C 5.0531 8.4462 120.9464 57.5682 31.0466 175.0923 165 A 3.9678 8.7899 124.7635 55.4369 18.0450 178.5434 166 D 4.4498 7.9237 112.2488 54.1880 39.6187 177.1567 167 G 3.8939 8.1857 109.0930 45.2153 0.0000 173.4426 168 N 4.8451 8.5288 117.9006 52.9934 40.4262 173.6533 169 H 5.4017 8.5642 115.7894 54.0578 33.2468 172.8946 170 L 4.9201 8.8117 123.4663 53.7019 44.2487 175.8354 171 T 5.0000 9.4925 117.5446 61.0473 71.3840 173.1416 172 C 4.9614 8.2168 115.5484 57.4841 33.5998 171.8534 173 H 5.1383 8.9971 119.2959 54.4435 32.3775 171.9154 174 L 4.9759 9.3408 126.4482 53.2946 44.0271 175.8204 175 R 4.9118 8.7698 122.2235 54.8840 33.0312 174.6200 176 T 4.9648 9.0098 121.1730 61.7666 72.4916 173.5058 177 T 4.6677 8.6429 121.1601 61.9958 71.8207 172.4123 178 Y 5.1762 9.1221 124.8050 56.5261 40.5067 175.0517 179 R 4.9205 9.5708 123.3993 54.2310 32.7484 175.2566 180 S 4.5300 9.3270 119.9168 58.3550 62.8591 174.2248 181 K 4.4097 8.6812 123.4203 56.7910 32.4083 177.3003 182 K 4.3037 7.8322 119.7847 54.7826 33.5427 176.5739 183 A 4.1337 8.2116 123.4538 51.8393 19.2776 178.7183 184 A 4.0685 8.7426 124.2540 55.1216 18.6274 180.3727 185 K 3.9732 8.0639 113.4654 59.3816 32.7623 177.4261 186 A 4.4852 7.7967 120.7453 51.7012 18.9322 176.4981 187 L 4.8274 7.7560 118.9507 53.9858 44.6594 177.4368 188 Q 4.4625 8.7974 121.1991 52.8742 30.4979 173.0058 *190 P 4.2451 0.0000 0.0000 63.6805 32.1460 174.3137 191 P 4.6824 0.0000 0.0000 61.4679 32.7486 175.2926 192 F 4.4504 8.6549 120.9916 59.3768 39.6475 173.6297 193 H 4.6606 7.6662 119.9463 55.0881 31.7709 171.9349 194 F 5.0855 9.0702 116.4360 55.8397 43.3331 174.8196 195 S 4.8023 8.9304 114.4099 57.0313 65.5087 172.5405 196 D 5.1100 9.1598 127.9465 54.0061 42.4612 175.3715 197 H 5.2176 8.9975 118.6246 54.3208 33.5714 172.7739 198 R 4.8848 8.9997 122.3767 54.0021 31.1924 170.4488 199 P 5.1740 0.0000 0.0000 62.0122 32.7820 175.7696 200 E 4.8508 9.5761 123.1304 54.6839 34.1315 174.4205 201 I 4.7799 8.6210 124.7610 60.7495 37.7157 175.9846 202 V 4.2557 8.7458 120.6180 61.6390 32.7290 176.2462 203 K 4.5273 7.6589 120.5596 55.2223 35.5809 174.0919 204 V 4.6087 8.2899 126.2965 61.1630 34.5592 174.3459 205 S 4.3403 8.5100 121.2803 56.9059 66.9181 172.9278 206 E 3.9030 9.0040 115.2947 58.1294 26.5843 174.3331 207 N 3.7910 8.6938 109.2576 54.8115 37.5843 173.3738 208 G 3.7094 8.0222 99.1290 47.0246 0.0000 174.1850 209 T 4.6167 7.2863 106.0822 60.5244 70.8371 172.7570 210 L 5.0402 7.3932 124.5899 53.4938 45.4678 174.8178 211 F 5.0689 9.2169 125.3503 55.5418 42.2921 173.8576 212 E 4.8545 9.2467 126.0110 55.2606 30.3762 174.4568 213 Q 5.2153 9.4566 129.1232 54.7103 32.1497 173.9431 214 H 5.2665 9.3897 122.9258 54.4360 32.7806 172.5430 215 E 5.6116 8.7667 119.5101 55.8323 33.6143 173.9802 216 S 5.2977 8.6751 120.2830 57.0194 67.3346 173.1107 217 S 5.0988 9.0571 118.7087 56.9802 67.6599 173.3054 218 V 4.7070 8.6470 122.8898 61.2145 34.8614 173.6754 219 A 4.8250 8.5558 130.5918 50.8357 20.7085 176.1599 220 R 4.4156 8.7205 117.5990 56.1959 33.5637 172.9750 221 Y 5.1345 8.2477 117.1777 56.3440 40.7832 175.0919 222 C 4.2560 9.1607 120.9811 59.7684 31.4998 172.8109 223 Q 4.6150 8.7427 124.3730 56.1053 28.7292 175.8892 224 T 4.3028 7.8556 108.3741 61.9553 70.3769 173.8514 225 C 4.6575 7.7340 118.7417 56.7972 28.9613 171.6525 226 P 4.3394 0.0000 0.0000 62.5154 31.6124 176.4065 227 S 4.4819 8.3462 116.1974 57.4877 63.2048 173.9482 228 K 4.2431 8.5215 126.6067 57.0841 32.4176 176.7560 229 L 4.4648 7.7208 116.9140 54.7386 41.9592 176.7888 230 G 3.8091 8.0470 105.3093 46.6102 0.0000 173.8525 231 H 4.7155 7.7270 115.6048 54.3014 30.1745 175.2117 232 N 4.3127 8.3387 117.1898 53.6550 38.3230 175.4508 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 5 I 8.02 4.01 1.77 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 1.24 1.15 0.97 0.00 0.00 6 S 8.40 4.29 0.00 3.97 3.76 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 7 D 9.52 4.86 0.00 2.81 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 8 N 8.14 5.44 0.00 2.60 2.69 0.00 0.00 6.75 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 9 V 9.04 4.69 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 0.68 0.00 0.00 0.93 0.00 0.00 10 R 8.82 5.01 0.00 1.63 1.76 0.00 3.20 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 11 I 8.45 4.85 1.77 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 0.96 0.78 0.52 0.00 0.00 12 K 8.81 4.78 0.00 1.69 1.49 0.00 1.41 0.00 0.00 1.44 0.00 0.00 2.80 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.28 0.96 7.81 13 L 8.73 5.30 0.00 1.75 1.41 1.17 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.91 5.12 0.00 3.13 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 *16 E 8.56 4.27 0.00 2.05 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 17 G 7.57 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 0.00 0.00 0.00 0.00 18 T 8.06 5.28 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 1.31 0.00 0.00 19 V 9.02 4.78 1.73 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 0.36 0.00 0.00 0.91 0.00 0.00 20 N 9.72 4.34 0.00 2.92 2.94 0.00 0.00 7.04 7.27 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 21 N 8.55 4.26 0.00 2.91 2.98 0.00 0.00 7.03 7.89 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 22 H 8.50 4.83 0.00 3.33 3.58 0.00 5.63 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.64 5.10 0.00 3.10 3.18 0.00 5.99 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 7.79 5.40 0.00 3.34 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 *26 C 8.56 5.02 0.00 3.12 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 27 E 9.18 4.99 0.00 2.02 1.72 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 2.00 2.07 0.00 28 A 8.62 5.43 1.26 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 0.00 0.00 0.00 29 E 8.64 4.94 0.00 1.84 1.75 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 2.20 2.21 0.00 30 G 8.90 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.62 5.21 0.00 2.06 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 0.00 2.25 2.31 0.00 32 G 8.89 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 33 K 8.82 5.13 0.00 1.71 1.80 0.00 1.95 0.00 0.00 1.84 0.00 0.00 2.88 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.55 1.24 7.81 34 P 0.00 4.12 0.00 1.65 1.88 0.00 3.74 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.09 0.00 35 Y 7.83 4.33 0.00 3.17 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 36 E 8.31 4.22 0.00 1.99 2.16 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 2.29 2.34 0.00 37 G 8.49 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 0.00 0.00 0.00 38 T 7.29 5.18 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 1.29 0.00 0.00 39 Q 8.21 4.97 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.60 0.00 0.00 0.00 0.00 0.00 2.35 2.17 0.00 *41 E 8.54 4.50 0.00 2.06 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 2.34 2.42 0.00 42 N 8.97 5.26 0.00 2.78 2.76 0.00 0.00 6.88 7.28 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 43 I 8.94 4.72 1.99 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.85 1.18 0.00 0.00 44 K 9.36 4.94 0.00 1.83 1.79 0.00 1.72 0.00 0.00 1.55 0.00 0.00 3.12 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.43 7.81 45 V 8.97 4.43 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 0.95 0.00 0.00 1.15 0.00 0.00 46 T 8.76 4.30 4.30 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 1.27 0.00 0.00 47 K 7.93 4.47 0.00 1.81 1.68 0.00 1.79 0.00 0.00 1.88 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.49 7.81 48 G 9.25 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 0.00 0.00 0.00 49 G 7.58 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 50 P 0.00 4.36 0.00 2.00 1.95 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.15 0.00 51 L 8.10 3.74 0.00 1.21 0.13 0.57 0.58 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 52 P 0.00 4.58 0.00 2.16 2.05 0.00 2.91 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.68 0.00 53 F 6.53 4.97 0.00 2.83 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 54 S 8.78 4.20 0.00 3.86 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 55 F 8.80 3.95 0.00 2.62 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 56 D 8.10 4.62 0.00 2.60 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 0.00 0.00 0.00 0.00 57 I 7.39 4.36 1.92 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.29 0.81 0.00 0.00 58 L 7.88 4.19 0.00 0.48 1.32 0.62 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 59 T 7.29 4.12 4.68 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 1.38 0.00 0.00 60 P 0.00 4.38 0.00 1.90 1.68 0.00 3.76 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.55 0.00 61 N 8.20 5.00 0.00 2.96 3.06 0.00 0.00 6.97 8.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 C 7.88 4.48 0.00 3.27 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 *66 S 7.70 4.07 0.00 4.07 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 67 V 7.27 3.47 0.67 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 0.14 0.00 0.00 0.05 0.00 0.00 68 A 8.01 4.24 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 I 7.15 4.34 2.23 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.75 0.99 0.00 0.00 70 T 8.10 4.49 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 71 K 8.76 4.43 0.00 1.95 1.70 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.45 7.81 72 Y 8.73 4.36 0.00 2.94 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 73 T 8.32 4.32 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 74 S 9.59 3.66 0.00 3.95 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 75 G 8.47 3.95 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 0.00 0.00 0.00 76 I 7.73 3.84 1.96 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.34 0.75 0.00 0.00 77 P 0.00 4.04 0.00 2.25 2.05 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.98 0.00 78 D 8.11 3.37 0.00 2.25 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 0.00 0.00 0.00 0.00 79 Y 7.83 3.74 0.00 2.48 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 0.00 0.00 0.00 80 F 7.21 3.69 0.00 3.13 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 81 K 8.30 4.32 0.00 1.83 2.00 0.00 1.74 0.00 0.00 1.34 0.00 0.00 2.16 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.55 1.73 7.81 82 Q 7.63 4.00 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.99 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 83 S 7.53 4.06 0.00 3.75 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 0.00 84 F 6.77 4.96 0.00 3.08 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 85 P 0.00 4.71 0.00 2.24 2.24 0.00 3.83 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 86 E 8.28 4.00 0.00 2.13 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 2.32 2.39 0.00 87 G 10.02 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 0.00 0.00 0.00 88 F 7.38 5.26 0.00 3.39 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 89 T 9.25 5.40 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 90 W 8.73 5.88 0.00 3.40 3.46 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 91 E 9.27 5.19 0.00 2.02 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 2.39 2.23 0.00 92 R 8.94 5.17 0.00 2.03 2.10 0.00 3.13 0.00 0.00 3.10 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 93 T 8.70 5.14 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 1.37 0.00 0.00 94 T 9.32 4.96 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 95 I 8.55 4.31 1.71 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.63 0.43 0.00 0.00 96 Y 8.57 4.67 0.00 2.83 2.91 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 97 E 9.04 4.03 0.00 2.09 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 2.52 2.28 0.00 98 D 8.16 4.74 0.00 2.77 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 99 G 8.00 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 0.00 100 A 6.99 4.23 -0.27 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 0.00 101 Y 8.59 5.11 0.00 2.90 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 L 9.12 5.33 0.00 2.10 1.76 1.03 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 103 T 9.37 5.23 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 1.29 0.00 0.00 104 T 9.37 5.17 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 105 Q 8.74 4.67 0.00 2.04 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.16 2.18 0.00 106 Q 8.53 4.64 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.53 0.00 0.00 0.00 0.00 0.00 2.09 2.01 0.00 107 E 8.89 4.95 0.00 1.99 1.70 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 2.16 2.22 0.00 108 T 8.83 5.36 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 1.25 0.00 0.00 109 K 9.12 5.08 0.00 1.83 1.89 0.00 1.27 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.37 7.81 110 L 8.58 4.89 0.00 0.86 1.36 0.67 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 111 D 9.01 4.72 0.00 2.67 2.48 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 0.00 0.00 0.00 0.00 112 G 8.34 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.81 4.95 0.00 2.74 2.96 0.00 0.00 5.36 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 0.00 114 C 7.94 5.12 0.00 2.95 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 0.00 115 L 8.75 4.57 0.00 1.34 1.28 1.01 0.54 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 0.00 116 V 8.86 4.66 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 1.13 0.00 0.00 0.98 0.00 0.00 117 Y 8.96 5.64 0.00 2.95 2.76 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 0.00 118 N 9.13 5.51 0.00 2.64 2.70 0.00 0.00 6.51 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 I 9.01 4.90 1.92 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.67 0.85 0.00 0.00 120 K 8.92 4.86 0.00 1.57 1.60 0.00 1.55 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.32 7.81 121 I 8.65 5.22 1.95 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 1.30 0.73 1.07 0.00 0.00 122 L 9.11 5.17 0.00 1.58 1.55 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 123 G 9.50 4.83 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 0.00 124 C 9.57 5.18 0.00 2.98 3.07 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 0.00 125 N 8.88 4.39 0.00 3.04 2.97 0.00 0.00 6.96 7.45 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 0.00 126 F 8.65 4.07 0.00 3.08 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 0.00 127 P 0.00 4.43 0.00 2.23 2.20 0.00 3.67 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.01 0.00 128 P 0.00 4.29 0.00 2.22 2.27 0.00 3.77 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 2.01 2.02 0.00 129 N 8.09 4.79 0.00 2.73 2.87 0.00 0.00 6.88 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 G 7.89 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 0.00 131 P 0.00 4.45 0.00 2.18 2.30 0.00 3.70 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 2.05 1.95 0.00 132 V 7.26 3.64 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 0.66 0.00 0.00 0.80 0.00 0.00 *134 Q 7.94 4.26 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.32 6.61 0.00 0.00 0.00 0.00 0.00 2.49 2.34 0.00 135 K 7.76 3.81 0.00 1.86 1.85 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.33 1.43 7.81 136 K 8.34 4.42 0.00 1.66 1.80 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.51 7.81 137 T 7.56 4.32 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 138 Q 9.00 4.47 0.00 1.92 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.46 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 139 G 8.60 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 W 8.19 5.17 0.00 3.31 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 E 8.72 4.60 0.00 2.10 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 2.34 2.35 0.00 142 P 0.00 4.81 0.00 2.12 2.07 0.00 3.82 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 143 C 9.09 4.92 0.00 2.92 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 0.00 144 C 8.51 5.02 0.00 2.90 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 0.00 145 E 9.03 4.97 0.00 2.07 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 2.23 2.12 0.00 *147 R 8.44 4.42 0.00 1.17 1.54 0.00 3.11 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.44 0.00 148 Y 7.74 5.14 0.00 3.17 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.47 4.65 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 1.15 0.00 0.00 150 R 9.05 4.47 0.00 1.95 1.76 0.00 3.31 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 1.56 1.64 0.00 151 D 9.94 4.47 0.00 2.82 2.71 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 0.00 152 G 8.56 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 0.00 0.00 0.00 153 V 7.74 4.55 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.98 0.00 0.00 154 L 7.66 4.48 0.00 0.27 0.62 0.61 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 155 C 8.63 5.02 0.00 1.63 2.24 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 0.00 156 G 8.60 4.54 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 0.00 0.00 0.00 157 Q 8.54 5.28 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.66 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 158 T 8.95 4.75 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 1.22 0.00 0.00 159 L 8.61 5.07 0.00 1.48 1.55 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 *161 A 8.21 4.49 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 0.00 162 L 8.99 4.32 0.00 1.46 1.25 0.67 -0.47 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 0.00 163 K 8.80 4.41 0.00 1.64 1.64 0.00 1.69 0.00 0.00 1.87 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.48 7.81 164 C 8.45 5.05 0.00 3.03 2.76 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 0.00 165 A 8.79 3.97 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 0.00 166 D 7.92 4.45 0.00 2.79 2.78 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 0.00 167 G 8.19 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 0.00 168 N 8.53 4.85 0.00 2.80 2.75 0.00 0.00 6.67 7.97 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 0.00 169 H 8.56 5.40 0.00 2.99 3.17 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 L 8.81 4.92 0.00 1.74 1.50 1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 171 T 9.49 5.00 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 0.00 172 C 8.22 4.96 0.00 2.36 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 0.00 0.00 0.00 173 H 9.00 5.14 0.00 3.08 3.04 0.00 5.57 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 L 9.34 4.98 0.00 1.55 1.45 0.74 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 175 R 8.77 4.91 0.00 1.68 1.77 0.00 2.98 0.00 0.00 3.11 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.31 0.00 176 T 9.01 4.96 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177 T 8.64 4.67 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 178 Y 9.12 5.18 0.00 2.89 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 R 9.57 4.92 0.00 1.82 1.94 0.00 3.19 0.00 0.00 3.15 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 180 S 9.33 4.53 0.00 2.89 3.53 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 0.00 181 K 8.68 4.41 0.00 1.86 1.84 0.00 1.90 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.46 7.81 182 K 7.83 4.30 0.00 1.63 1.66 0.00 1.72 0.00 0.00 1.65 0.00 0.00 3.20 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.50 7.81 183 A 8.21 4.13 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 A 8.74 4.07 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 0.00 185 K 8.06 3.97 0.00 1.88 1.96 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.43 7.81 186 A 7.80 4.49 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 0.00 187 L 7.76 4.83 0.00 1.74 1.49 0.70 0.58 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 0.00 188 Q 8.80 4.46 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.50 0.00 0.00 0.00 0.00 0.00 2.24 2.15 0.00 *190 P 0.00 4.25 0.00 2.19 2.29 0.00 3.66 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.87 0.00 191 P 0.00 4.68 0.00 2.38 2.23 0.00 3.85 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 2.26 2.19 0.00 192 F 8.65 4.45 0.00 3.07 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 0.00 193 H 7.67 4.66 0.00 3.12 3.10 0.00 5.55 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 F 9.07 5.09 0.00 2.95 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 0.00 195 S 8.93 4.80 0.00 3.68 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 0.00 196 D 9.16 5.11 0.00 2.50 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 0.00 197 H 9.00 5.22 0.00 2.95 3.03 0.00 5.56 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 0.00 198 R 9.00 4.88 0.00 1.84 1.76 0.00 3.10 0.00 0.00 3.24 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 199 P 0.00 5.17 0.00 2.19 2.29 0.00 3.81 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.87 0.00 200 E 9.58 4.85 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 201 I 8.62 4.78 2.02 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.71 1.13 0.00 0.00 202 V 8.75 4.26 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 0.59 0.00 0.00 1.04 0.00 0.00 203 K 7.66 4.53 0.00 1.79 1.58 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.72 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.35 1.38 7.81 204 V 8.29 4.61 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 0.47 0.00 0.00 0.99 0.00 0.00 205 S 8.51 4.34 0.00 3.75 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 E 9.00 3.90 0.00 2.06 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 2.24 2.18 0.00 207 N 8.69 3.79 0.00 2.75 2.78 0.00 0.00 7.27 7.98 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 0.00 208 G 8.02 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 0.00 209 T 7.29 4.62 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 1.24 0.00 0.00 210 L 7.39 5.04 0.00 1.75 1.43 0.93 0.63 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 0.00 211 F 9.22 5.07 0.00 2.57 2.71 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 0.00 212 E 9.25 4.85 0.00 2.05 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 2.37 2.29 0.00 213 Q 9.46 5.22 0.00 2.26 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.46 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 214 H 9.39 5.27 0.00 3.15 3.21 0.00 5.88 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 E 8.77 5.61 0.00 2.07 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 0.00 2.23 2.15 0.00 216 S 8.68 5.30 0.00 3.78 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 0.00 217 S 9.06 5.10 0.00 3.69 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 0.00 218 V 8.65 4.71 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 0.77 0.00 0.00 0.89 0.00 0.00 219 A 8.56 4.83 -0.04 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 0.00 220 R 8.72 4.42 0.00 1.82 1.95 0.00 2.74 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00 221 Y 8.25 5.13 0.00 3.01 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 0.00 222 C 9.16 4.26 0.00 3.08 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 0.00 223 Q 8.74 4.61 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.67 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 224 T 7.86 4.30 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 0.00 225 C 7.73 4.66 0.00 2.95 2.91 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 0.00 226 P 0.00 4.34 0.00 2.04 1.99 0.00 3.67 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 2.03 2.08 0.00 227 S 8.35 4.48 0.00 3.85 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 0.00 228 K 8.52 4.24 0.00 1.72 1.78 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.49 7.81 229 L 7.72 4.46 0.00 1.56 1.46 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 230 G 8.05 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 H 7.73 4.72 0.00 3.13 3.15 0.00 5.70 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 N 8.34 4.31 0.00 2.12 1.42 0.00 0.00 6.78 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.