NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 G 3.9394 8.3393 109.7206 45.4001 0.0000 172.9709 10 S 4.5743 8.2889 117.7760 55.8263 66.2049 171.9342 11 I 4.8173 8.9536 124.0336 60.7663 39.0337 176.0906 12 T 4.8877 8.5506 122.9779 62.1790 70.2104 174.4767 13 L 4.4907 9.1842 128.8183 53.4140 42.2915 175.2884 14 R 4.9937 9.1858 120.5278 53.2475 31.5489 176.7768 15 G 4.0917 7.6658 109.9184 44.4761 0.0000 171.3790 16 S 4.7691 8.0661 116.0559 57.1704 65.5721 174.3896 17 A 4.0246 8.0176 121.1551 55.5829 18.2034 179.5843 18 E 3.8974 8.2740 115.0237 59.1429 29.6063 178.9858 19 I 3.7380 7.4709 117.8633 63.4099 38.5417 177.4032 20 V 3.8507 7.7960 118.7938 66.1098 31.1159 177.6456 21 A 3.9995 7.8185 119.8511 55.3039 18.3041 178.9252 22 E 3.4299 7.9709 116.8953 59.4037 29.3746 178.8826 23 F 4.3360 7.7851 117.4888 60.5882 38.9884 176.9573 24 F 4.0329 8.3417 120.2483 61.7013 39.1749 176.9831 25 S 3.8006 8.1794 112.6047 61.6637 62.0619 176.3145 26 F 4.7381 7.8501 120.2408 60.7461 38.5234 177.7152 27 G 3.6370 8.5140 105.7735 47.6063 0.0000 175.4210 28 I 3.6711 7.8565 122.0668 63.4891 37.7928 177.8813 29 N 4.3781 8.0179 116.7939 56.4252 38.5133 177.0276 30 S 4.2698 8.1996 114.4316 61.7039 62.3746 176.3862 31 I 3.4266 8.0595 122.5450 64.4049 36.9748 178.3966 32 L 4.2277 7.8582 119.8273 57.7759 41.3974 179.0700 33 Y 3.6435 8.1521 119.5219 60.6143 38.7320 177.6385 34 Q 3.7974 8.4641 117.4902 58.1476 28.6633 177.3685 35 R 4.3253 8.2279 116.1036 55.1408 30.3433 177.0564 36 G 3.9647 7.8773 105.2632 47.1807 0.0000 175.0794 37 I 3.7475 7.2351 119.7448 64.2958 37.5380 176.0758 38 Y 4.6821 7.9067 115.7347 55.7010 39.5200 174.0469 39 P 4.5610 0.0000 0.0000 62.8241 32.4184 176.7484 40 S 4.4176 8.6711 114.3996 61.7363 62.8559 176.7414 41 E 4.2874 8.1668 115.5678 58.3667 29.9006 177.9588 42 T 4.0965 8.2848 117.1140 66.2367 68.7947 174.0276 43 F 5.2553 8.2930 119.1775 56.7946 41.4244 174.7503 44 T 4.6179 8.5760 113.0134 61.4189 71.2312 172.1764 45 R 4.9330 8.3835 123.6381 55.2900 31.4496 176.6169 46 V 4.6402 8.7477 116.1631 59.4897 36.0898 174.2901 47 Q 5.4961 8.5638 121.5009 53.7192 30.7312 174.9357 48 K 4.4059 8.2301 122.1018 56.3879 35.3479 175.3186 49 Y 3.6206 8.9177 121.8526 59.1728 34.9910 170.8637 50 G 3.9339 8.4435 106.0395 45.6818 0.0000 173.8696 51 L 4.7637 7.5161 119.3834 53.3706 44.7717 175.3561 52 T 4.8948 8.2394 116.8298 62.3703 70.2435 174.4722 53 L 4.7250 8.7652 124.4782 52.9176 46.3071 175.3345 54 L 4.8697 8.3720 122.0757 53.9915 42.9399 176.4623 55 V 4.6328 8.4199 115.6805 59.9277 36.4756 174.6871 56 T 3.6183 8.2165 117.9862 61.2765 68.1723 174.4066 57 T 4.4082 7.7400 112.4990 60.3906 69.9794 173.8324 58 D 4.4373 7.6589 123.0100 53.9778 41.8073 176.1688 59 L 3.8350 8.6098 129.4353 58.4831 41.9720 178.1001 60 E 3.6834 8.3471 117.6506 59.6654 29.1418 178.9749 61 L 3.5448 7.5492 118.9240 58.1578 42.2204 178.9088 62 I 3.8268 7.3579 119.3740 64.3802 37.0777 178.0786 63 K 3.7292 7.8124 119.0522 60.0141 31.9092 178.4596 64 Y 3.7846 7.6758 119.0272 60.7498 38.8498 177.8604 65 L 3.9086 8.9504 120.9429 57.7335 41.5596 179.2550 66 N 4.1548 8.0981 117.1458 56.5532 39.0915 176.2269 67 N 4.1124 8.0983 118.5855 56.8536 38.7279 177.2182 68 V 3.7990 7.7035 120.4216 64.8559 31.4664 178.5924 69 V 3.6909 7.7055 118.8599 65.4555 31.2212 177.9716 70 E 3.8100 8.8707 119.2369 59.4049 29.4394 179.1049 71 Q 3.5124 7.8410 119.1721 58.3632 28.9174 177.9839 72 L 4.0086 7.2168 121.4944 57.7177 42.0450 178.3328 73 K 3.8211 8.2955 118.9748 59.7722 32.1903 177.7662 74 D 4.3010 7.5891 118.1509 56.7918 41.1026 178.0176 75 W 4.6951 7.7260 119.2961 60.0693 29.1249 178.5325 76 L 4.1884 8.1790 119.0707 57.3498 41.3953 178.2672 77 Y 4.4689 8.4908 117.1365 58.5243 37.5189 177.2662 78 K 4.1694 7.1396 117.1252 55.7481 34.0458 176.1384 79 C 3.9138 8.4305 115.5539 58.6611 35.8384 173.9808 80 S 4.4687 8.1232 115.3482 58.1025 63.6838 174.8187 81 V 4.6494 7.5678 120.0070 60.1423 32.7415 175.3182 82 Q 4.4142 9.3638 125.0484 57.6854 29.9336 176.0163 83 K 4.9568 7.8688 116.6664 55.3449 36.4853 174.5440 84 L 5.2638 8.6908 122.3627 53.3623 44.3777 175.6760 85 V 4.9240 8.7457 122.2631 61.2993 34.9548 174.0892 86 V 4.5843 9.1953 128.6565 61.8670 33.5549 174.8156 87 V 4.4211 8.3771 127.7629 60.6617 32.7733 172.7776 88 I 4.1670 8.1752 126.5699 60.8769 38.0068 175.0224 89 S 5.0753 8.8075 121.7764 55.8367 66.9245 173.1202 90 N 4.5539 8.7663 120.4153 54.3986 39.1851 175.7047 91 I 3.9063 8.4950 125.1323 63.1982 38.8369 176.5980 92 E 4.2451 8.3530 118.4787 58.6752 30.0294 177.0704 93 S 4.0933 7.9673 112.0793 61.7156 62.4780 173.8626 94 G 4.1932 8.2588 106.6540 45.5500 0.0000 174.2013 95 E 3.9405 8.0616 117.1838 56.2082 29.8434 176.8964 96 V 4.0860 8.2240 121.6337 63.1294 32.3124 175.1126 97 L 4.8290 8.0582 123.1888 55.2868 44.1267 176.7866 98 E 4.7766 7.4509 112.9367 55.7019 31.9512 175.4671 99 R 4.8471 8.5070 120.1324 54.2384 33.3757 175.3221 100 W 4.4302 9.3162 123.0817 55.0429 32.1144 174.1270 101 Q 4.9207 8.4082 126.6072 54.2211 31.1091 173.8553 102 F 5.4453 9.3958 125.6667 56.0331 41.4758 174.3185 103 D 5.0739 9.2474 124.7142 53.2772 42.5944 175.5482 104 I 4.7528 8.0511 123.6656 59.8350 39.2159 175.7051 105 E 4.5014 8.8899 128.1579 54.5067 29.9327 171.8767 106 C 4.7534 8.4277 123.5263 55.3520 44.4580 171.6811 107 D 5.0086 8.3926 126.7460 52.1620 42.5148 176.2814 108 K 4.2374 8.6797 123.5544 57.3243 33.0067 176.7098 109 T 4.6694 7.8802 110.2673 60.8579 71.9958 173.0488 110 A 4.5010 8.5462 127.4712 51.7492 21.6576 176.5565 111 K 3.8181 8.5672 119.2517 57.8158 29.5625 174.9383 *120 S 4.4443 7.2856 118.4207 58.3707 64.2756 175.9265 121 Q 4.1333 8.6184 116.0914 58.6917 28.9475 177.9523 122 K 3.8276 8.3239 120.2226 59.9989 31.8663 177.6811 123 A 4.0492 7.6780 120.8410 54.9287 18.3044 179.2615 124 I 3.7522 7.8180 116.3886 64.6529 37.4876 178.1611 125 Q 4.0375 8.1893 118.6106 59.5993 28.6609 179.5403 126 D 4.3977 7.9306 119.3583 57.3146 40.9458 178.4890 127 E 3.8044 7.9882 118.6744 59.5118 29.4845 179.1260 128 I 3.6988 7.7473 119.3699 64.8688 37.2383 178.1460 129 R 3.9328 7.7958 118.0830 59.7831 29.9213 178.9310 130 S 4.0085 8.2050 113.4655 61.8430 62.5712 176.7283 131 V 3.6508 7.6346 121.1241 65.8638 31.3280 177.8616 132 I 3.7556 8.0118 119.4374 64.5272 36.9567 178.3750 133 R 3.9211 8.7932 119.8056 59.8240 30.0371 178.1607 134 Q 4.0503 8.5012 117.9420 58.8788 28.7327 178.6525 135 I 4.1523 8.4393 120.7109 65.2668 37.1274 178.5343 136 T 4.0504 8.1919 114.9436 66.7880 68.8463 176.5461 137 A 4.0529 8.3070 122.5665 55.1165 18.1702 179.8805 138 T 3.9372 8.0988 114.9855 66.7876 68.7952 177.2522 139 V 3.5890 8.1371 121.0633 65.2006 30.8160 178.2750 140 T 3.8241 7.1153 114.7192 66.3770 68.3601 175.0029 141 F 4.9259 8.2768 116.8179 57.9464 39.6799 176.2604 142 L 4.3376 7.2886 120.0201 53.2630 42.1675 175.0876 143 P 4.5201 0.0000 0.0000 62.0446 32.1395 175.8624 144 L 4.1364 8.1405 121.0832 54.9250 42.6334 176.6713 145 L 4.4403 8.2655 125.0724 54.8106 42.4076 177.0588 146 E 4.6597 8.4694 114.8244 56.4811 32.3203 174.6766 147 V 4.4760 7.3616 111.7982 59.1631 35.1287 174.7083 148 S 4.6714 8.4179 117.4782 59.1468 63.7686 173.2179 149 C 5.0859 8.0933 113.9924 58.0381 33.0529 172.8799 150 S 5.3431 8.7900 115.1202 56.7854 65.8208 172.8640 151 F 4.8404 9.2171 120.8861 56.3374 41.2004 174.8857 152 D 4.9880 8.0849 120.8940 52.5996 44.4241 174.3956 153 L 4.9687 9.2048 126.9155 54.3014 44.1860 175.5499 154 L 4.9876 8.7820 125.1618 53.0716 44.9642 175.6672 155 I 4.3363 8.4695 126.5165 60.5912 38.6112 174.8309 156 Y 4.9987 8.9136 126.4887 56.8663 39.3853 175.1792 157 T 5.0471 8.2523 113.3967 59.2763 72.9901 172.8992 158 D 5.5300 8.3695 121.8404 53.6794 41.6953 177.8205 159 K 3.7005 8.6076 120.7036 60.0479 32.2275 177.5305 160 D 4.3457 8.5521 118.7963 56.9178 41.1637 175.8177 161 L 3.6017 7.1799 119.8696 55.0511 42.7750 177.5670 162 V 4.0157 8.0504 119.1105 59.2190 31.1618 175.0320 163 V 3.6995 8.1767 124.7715 62.2725 31.1709 173.8616 164 P 4.3958 0.0000 0.0000 62.8801 31.7287 177.4102 165 E 4.2218 8.8215 121.8426 58.1690 29.8265 177.8797 166 K 4.2130 8.0575 116.6866 58.9841 33.3717 176.6705 167 W 4.4452 8.2582 129.6970 57.4460 30.8550 178.4982 168 E 3.8366 9.0404 120.8234 55.4792 28.1480 175.7810 169 E 4.2851 9.2258 118.4894 56.1637 30.6009 174.1186 170 S 4.8505 7.7803 113.7140 56.1299 64.7285 173.8952 171 G 4.3349 8.7620 113.7673 44.3628 0.0000 171.5278 172 P 4.1082 0.0000 0.0000 63.0766 31.7136 175.6224 173 Q 5.0041 8.9440 120.0079 53.1413 30.6040 174.4627 174 F 4.9130 8.4796 118.0521 55.4694 40.2648 174.9713 175 I 4.3492 8.3120 121.2619 60.4019 39.8870 176.0207 176 T 4.5350 8.3286 120.3771 62.4461 70.2460 173.7024 177 N 4.4925 8.8413 124.3264 54.2477 39.6550 175.5581 178 S 4.1452 7.8169 113.0115 58.4526 63.4918 173.7667 179 E 4.0138 8.4586 124.8505 57.0739 29.9951 176.8623 180 E 4.0688 8.9049 117.8356 56.1292 27.4130 174.8445 181 V 4.2158 7.0374 116.7511 60.5993 34.0616 174.9767 182 R 4.0758 8.7243 126.9372 59.3546 30.8307 177.0882 183 L 4.1289 7.7323 119.1572 55.8604 42.2774 176.7205 184 R 4.7675 8.9829 122.3684 56.9103 34.0619 175.7935 185 S 4.8237 7.7671 112.6178 56.5484 66.5820 172.8336 186 F 5.3882 8.0974 126.4099 56.4659 41.8825 173.8929 187 T 5.1650 9.2129 115.6523 60.6100 71.9935 173.0639 188 T 5.5181 8.9827 121.4789 62.9027 71.9929 173.6421 189 T 5.0199 8.6410 118.5697 62.7623 73.6730 172.6882 190 I 4.5730 8.4278 126.6271 60.3776 38.9962 175.1041 191 H 4.5402 8.9849 124.6074 53.5924 30.5934 172.9546 192 K 4.5636 8.3575 123.3338 56.0441 32.6514 177.1289 193 V 4.1619 8.5308 125.6753 62.1395 34.2273 175.7049 194 N 4.0702 8.7206 127.2692 54.8518 37.7618 173.0647 195 S 4.9436 7.8826 108.8610 58.7436 65.1941 174.2070 196 M 4.7757 8.3958 120.5563 53.5026 35.2523 175.3427 197 V 4.0266 8.0891 120.5480 60.7863 34.0654 174.7382 198 A 4.1800 8.1047 130.2411 51.7126 19.3912 176.7355 199 Y 4.6226 7.8963 119.6550 55.3769 38.3072 173.3072 200 K 3.9368 8.3208 122.4484 56.1851 32.4619 176.3956 201 I 4.3162 8.3089 127.8768 58.6533 38.3350 172.2843 202 P 4.9170 0.0000 0.0000 60.7839 33.4262 175.8392 203 V 3.9656 8.1514 118.5381 63.1548 31.6868 175.1991 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 9 G 8.34 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 10 S 8.29 4.57 0.00 4.08 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 11 I 8.95 4.82 2.13 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.91 1.21 0.00 0.00 12 T 8.55 4.89 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 1.27 0.00 0.00 13 L 9.18 4.49 0.00 1.61 1.68 0.90 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 14 R 9.19 4.99 0.00 1.80 1.91 0.00 3.16 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 15 G 7.67 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 16 S 8.07 4.77 0.00 4.09 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 17 A 8.02 4.02 1.39 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 0.00 0.00 0.00 18 E 8.27 3.90 0.00 1.93 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 2.33 2.33 0.00 19 I 7.47 3.74 1.81 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.49 1.11 0.00 0.00 20 V 7.80 3.85 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 1.09 0.00 0.00 1.12 0.00 0.00 21 A 7.82 4.00 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 22 E 7.97 3.43 0.00 1.73 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.04 0.00 23 F 7.79 4.34 0.00 3.30 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 24 F 8.34 4.03 0.00 2.99 3.22 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 25 S 8.18 3.80 0.00 3.69 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 7.85 4.74 0.00 3.38 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 27 G 8.51 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 28 I 7.86 3.67 1.24 0.00 0.00 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 1.62 1.37 0.62 0.00 0.00 29 N 8.02 4.38 0.00 3.19 3.05 0.00 0.00 6.46 7.20 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 30 S 8.20 4.27 0.00 4.12 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 31 I 8.06 3.43 1.71 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.51 -0.09 0.00 0.00 32 L 7.86 4.23 0.00 2.12 2.08 0.93 0.63 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 33 Y 8.15 3.64 0.00 2.94 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 34 Q 8.46 3.80 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.72 0.00 0.00 0.00 0.00 0.00 2.53 2.72 0.00 35 R 8.23 4.33 0.00 2.00 2.05 0.00 3.57 0.00 0.00 3.49 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.87 0.00 36 G 7.88 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 0.00 0.00 0.00 37 I 7.24 3.75 2.21 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.41 0.93 0.00 0.00 38 Y 7.91 4.68 0.00 3.60 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 39 P 0.00 4.56 0.00 2.17 2.26 0.00 3.96 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 2.12 2.36 0.00 40 S 8.67 4.42 0.00 3.96 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 41 E 8.17 4.29 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 42 T 8.28 4.10 5.16 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 1.34 0.00 0.00 43 F 8.29 5.26 0.00 2.69 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 44 T 8.58 4.62 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 1.18 0.00 0.00 45 R 8.38 4.93 0.00 1.70 1.79 0.00 3.18 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 46 V 8.75 4.64 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.91 0.00 0.00 47 Q 8.56 5.50 0.00 2.27 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.67 0.00 0.00 0.00 0.00 0.00 2.20 2.13 0.00 48 K 8.23 4.41 0.00 1.81 1.83 0.00 1.92 0.00 0.00 2.35 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.12 1.18 7.81 49 Y 8.92 3.62 0.00 3.20 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 50 G 8.44 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 51 L 7.52 4.76 0.00 1.70 1.54 0.95 1.13 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 52 T 8.24 4.89 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 1.16 0.00 0.00 53 L 8.77 4.72 0.00 1.20 1.14 -0.64 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.37 4.87 0.00 1.40 1.53 0.78 0.05 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 55 V 8.42 4.63 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.86 0.00 0.00 56 T 8.22 3.62 3.26 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 0.83 0.00 0.00 57 T 7.74 4.41 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 58 D 7.66 4.44 0.00 2.79 2.40 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 59 L 8.61 3.83 0.00 1.75 1.61 0.86 0.93 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 60 E 8.35 3.68 0.00 1.89 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 2.55 2.44 0.00 61 L 7.55 3.54 0.00 1.45 1.48 0.97 0.26 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 62 I 7.36 3.83 1.75 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.71 0.81 0.00 0.00 63 K 7.81 3.73 0.00 1.89 1.77 0.00 1.57 0.00 0.00 1.49 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.38 7.81 64 Y 7.68 3.78 0.00 2.63 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 65 L 8.95 3.91 0.00 1.61 1.64 0.86 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 66 N 8.10 4.15 0.00 2.96 2.79 0.00 0.00 6.67 6.12 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 67 N 8.10 4.11 0.00 2.76 2.62 0.00 0.00 7.09 7.19 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 68 V 7.70 3.80 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.16 0.00 0.00 69 V 7.71 3.69 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.03 0.00 0.00 70 E 8.87 3.81 0.00 1.88 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 2.43 2.38 0.00 71 Q 7.84 3.51 0.00 2.07 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 72 L 7.22 4.01 0.00 1.94 1.83 1.06 0.15 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 73 K 8.30 3.82 0.00 1.79 1.95 0.00 1.88 0.00 0.00 1.91 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.42 7.81 74 D 7.59 4.30 0.00 2.63 2.28 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 75 W 7.73 4.70 0.00 3.54 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 76 L 8.18 4.19 0.00 2.06 1.77 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 8.49 4.47 0.00 3.29 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 78 K 7.14 4.17 0.00 1.57 1.19 0.00 1.65 0.00 0.00 1.48 0.00 0.00 3.39 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.04 1.43 7.81 79 C 8.43 3.91 0.00 3.05 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.12 4.47 0.00 3.84 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 7.57 4.65 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.99 0.00 0.00 82 Q 9.36 4.41 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 83 K 7.87 4.96 0.00 1.93 1.80 0.00 1.26 0.00 0.00 1.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.15 1.36 7.81 84 L 8.69 5.26 0.00 1.70 1.56 -0.34 0.64 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 85 V 8.75 4.92 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 1.00 0.00 0.00 1.01 0.00 0.00 86 V 9.20 4.58 2.29 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 0.54 0.00 0.00 1.22 0.00 0.00 87 V 8.38 4.42 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 0.91 0.00 0.00 0.94 0.00 0.00 88 I 8.18 4.17 1.92 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 0.85 0.10 1.03 0.00 0.00 89 S 8.81 5.08 0.00 4.12 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 90 N 8.77 4.55 0.00 2.82 2.74 0.00 0.00 6.99 7.12 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 91 I 8.50 3.91 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.81 0.91 0.00 0.00 92 E 8.35 4.25 0.00 1.99 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 0.00 2.26 2.28 0.00 93 S 7.97 4.09 0.00 3.93 3.92 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 94 G 8.26 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 0.00 0.00 0.00 95 E 8.06 3.94 0.00 2.15 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 0.00 2.37 2.32 0.00 96 V 8.22 4.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.92 0.00 0.00 97 L 8.06 4.83 0.00 1.71 1.67 0.98 0.73 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 98 E 7.45 4.78 0.00 1.76 1.93 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 2.20 2.36 0.00 99 R 8.51 4.85 0.00 1.55 1.78 0.00 3.10 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.55 0.00 100 W 9.32 4.43 0.00 3.13 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 0.00 101 Q 8.41 4.92 0.00 2.04 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.87 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 102 F 9.40 5.45 0.00 3.00 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 0.00 103 D 9.25 5.07 0.00 2.62 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 I 8.05 4.75 2.10 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.58 0.93 0.00 0.00 105 E 8.89 4.50 0.00 2.19 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.26 0.00 106 C 8.43 4.75 0.00 3.03 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 0.00 107 D 8.39 5.01 0.00 2.68 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 0.00 108 K 8.68 4.24 0.00 1.61 1.70 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.42 7.81 109 T 7.88 4.67 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 1.26 0.00 0.00 110 A 8.55 4.50 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 K 8.57 3.82 0.00 1.84 1.93 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.36 1.43 7.81 *120 S 7.29 4.44 0.00 4.06 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 Q 8.62 4.13 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.83 0.00 0.00 0.00 0.00 0.00 2.50 2.58 0.00 122 K 8.32 3.83 0.00 1.93 1.85 0.00 1.69 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.62 7.81 123 A 7.68 4.05 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 0.00 124 I 7.82 3.75 1.90 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.85 0.64 0.00 0.00 125 Q 8.19 4.04 0.00 2.36 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.80 0.00 0.00 0.00 0.00 0.00 2.50 2.68 0.00 126 D 7.93 4.40 0.00 2.78 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 0.00 127 E 7.99 3.80 0.00 2.06 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 2.29 2.40 0.00 128 I 7.75 3.70 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 2.12 1.04 1.02 0.00 0.00 129 R 7.80 3.93 0.00 2.07 2.01 0.00 3.16 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 130 S 8.20 4.01 0.00 4.06 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 0.00 131 V 7.63 3.65 2.28 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 1.28 0.00 0.00 0.88 0.00 0.00 132 I 8.01 3.76 1.91 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.83 0.95 0.00 0.00 133 R 8.79 3.92 0.00 1.93 2.14 0.00 3.12 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 134 Q 8.50 4.05 0.00 2.44 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.43 0.00 0.00 0.00 0.00 0.00 2.44 2.78 0.00 135 I 8.44 4.15 2.14 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.02 0.84 0.00 0.00 136 T 8.19 4.05 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 1.23 0.00 0.00 137 A 8.31 4.05 1.34 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 0.00 0.00 0.00 138 T 8.10 3.94 4.72 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 0.82 0.00 0.00 139 V 8.14 3.59 2.33 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 1.20 0.00 0.00 0.99 0.00 0.00 140 T 7.12 3.82 3.92 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 0.44 0.00 0.00 141 F 8.28 4.93 0.00 3.00 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 0.00 142 L 7.29 4.34 0.00 1.78 1.64 1.08 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 143 P 0.00 4.52 0.00 2.19 2.07 0.00 3.79 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 144 L 8.14 4.14 0.00 1.62 1.62 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 145 L 8.27 4.44 0.00 1.71 1.61 1.08 0.96 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 0.00 146 E 8.47 4.66 0.00 2.02 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 0.00 2.18 2.33 0.00 147 V 7.36 4.48 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 0.78 0.00 0.00 0.94 0.00 0.00 148 S 8.42 4.67 0.00 3.75 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 0.00 149 C 8.09 5.09 0.00 3.12 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 0.00 150 S 8.79 5.34 0.00 3.96 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 0.00 151 F 9.22 4.84 0.00 2.29 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 D 8.08 4.99 0.00 2.67 2.60 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 0.00 153 L 9.20 4.97 0.00 2.36 1.94 1.48 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.78 4.99 0.00 1.68 1.14 0.92 0.73 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 0.00 155 I 8.47 4.34 1.61 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.89 0.84 0.00 0.00 156 Y 8.91 5.00 0.00 3.16 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 0.00 157 T 8.25 5.05 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 0.75 0.00 0.00 158 D 8.37 5.53 0.00 2.58 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.61 3.70 0.00 1.75 1.82 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.46 7.81 160 D 8.55 4.35 0.00 2.67 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 0.00 161 L 7.18 3.60 0.00 1.42 1.35 1.03 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 162 V 8.05 4.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.02 0.00 0.00 163 V 8.18 3.70 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.77 0.00 0.00 164 P 0.00 4.40 0.00 2.51 2.12 0.00 4.13 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 165 E 8.82 4.22 0.00 1.98 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 2.34 2.28 0.00 166 K 8.06 4.21 0.00 1.94 1.98 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.50 7.81 167 W 8.26 4.45 0.00 3.53 3.39 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 0.00 168 E 9.04 3.84 0.00 2.36 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 1.85 2.00 0.00 169 E 9.23 4.29 0.00 2.17 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 0.00 2.27 2.33 0.00 170 S 7.78 4.85 0.00 3.92 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 0.00 171 G 8.76 4.33 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 0.00 172 P 0.00 4.11 0.00 1.94 1.89 0.00 2.27 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.48 0.00 173 Q 8.94 5.00 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.79 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 174 F 8.48 4.91 0.00 3.08 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 I 8.31 4.35 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.89 0.95 0.00 0.00 176 T 8.33 4.53 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 1.24 0.00 0.00 177 N 8.84 4.49 0.00 2.66 2.83 0.00 0.00 7.26 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 S 7.82 4.15 0.00 4.02 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 0.00 179 E 8.46 4.01 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 2.39 0.00 180 E 8.90 4.07 0.00 2.19 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 2.18 2.23 0.00 181 V 7.04 4.22 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 0.18 0.00 0.00 0.60 0.00 0.00 182 R 8.72 4.08 0.00 2.00 1.97 0.00 3.22 0.00 0.00 3.31 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 183 L 7.73 4.13 0.00 1.50 1.28 0.77 1.06 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 0.00 184 R 8.98 4.77 0.00 1.69 1.83 0.00 3.27 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 185 S 7.77 4.82 0.00 3.75 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 0.00 186 F 8.10 5.39 0.00 2.70 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 0.00 0.00 0.00 187 T 9.21 5.16 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 188 T 8.98 5.52 4.98 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 1.52 0.00 0.00 189 T 8.64 5.02 4.37 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 1.29 0.00 0.00 190 I 8.43 4.57 1.70 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 0.91 0.17 0.61 0.00 0.00 191 H 8.98 4.54 0.00 2.13 2.98 0.00 5.81 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 K 8.36 4.56 0.00 1.59 1.84 0.00 1.86 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.28 1.32 7.81 193 V 8.53 4.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.14 0.00 0.00 194 N 8.72 4.07 0.00 2.91 2.80 0.00 0.00 6.65 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 0.00 195 S 7.88 4.94 0.00 3.90 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 0.00 196 M 8.40 4.78 0.00 1.92 1.91 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 197 V 8.09 4.03 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.92 0.00 0.00 198 A 8.10 4.18 1.10 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 0.00 199 Y 7.90 4.62 0.00 2.95 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 0.00 200 K 8.32 3.94 0.00 1.72 1.76 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.44 7.81 201 I 8.31 4.32 1.90 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.08 0.94 0.00 0.00 202 P 0.00 4.92 0.00 2.19 2.01 0.00 3.51 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.05 0.00 203 V 8.15 3.97 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 0.82 0.00 0.00 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.