NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.3899 8.2929 115.2908 57.7040 63.6654 175.2473 4 K 4.0054 8.4111 129.4463 58.7455 31.5015 178.6779 5 L 4.3534 8.7715 118.6411 58.3693 41.8115 178.7768 6 I 3.7808 7.6991 119.8238 64.4207 37.1134 178.2994 7 G 3.8032 8.1874 105.8102 48.2087 0.0000 175.4606 8 K 4.0964 7.7955 119.0020 59.1362 32.0022 179.6469 9 I 3.7608 7.8404 120.1875 64.5674 36.9884 178.1243 10 C 4.1176 8.2654 117.6959 62.8890 28.0514 176.2007 11 K 4.0531 8.1907 121.0409 59.6867 31.6724 179.0398 12 S 4.3064 8.1789 115.5828 61.2256 62.6443 176.7182 13 I 3.8949 8.1146 122.8307 64.6188 36.7765 178.2169 14 R 3.4173 8.0237 118.2326 59.3558 29.7906 176.9502 15 Y 4.2727 7.5857 112.9947 56.7444 38.1844 175.6877 16 R 2.9277 8.2425 118.5315 57.0538 28.0059 177.4045 17 D 4.5133 7.8887 120.1695 53.6871 39.3124 175.7835 18 Y 4.4896 7.7450 122.3370 60.2283 38.4034 176.4996 19 E 4.0127 8.3845 119.2254 60.0696 29.6093 179.4458 20 T 3.8787 7.8542 114.3746 66.7305 68.5122 176.5495 21 A 4.1322 7.7688 121.7944 55.1020 18.3193 179.7537 22 I 3.6423 8.5394 118.7049 64.4188 37.3407 178.3123 23 F 3.9378 8.4776 121.5280 61.5115 39.0803 177.2338 24 L 4.1470 8.5622 117.0832 57.5941 41.6443 179.2110 25 A 4.1071 8.1858 120.8845 55.0339 17.9993 179.4455 26 A 3.9019 8.0927 119.5345 55.5378 18.1137 179.6950 27 C 4.1775 7.5903 114.2112 62.4584 28.5334 175.4321 28 L 4.1948 7.9477 121.6236 56.9423 41.5976 178.5620 29 L 3.9922 7.2771 119.8648 57.1155 41.9463 178.5202 30 P 4.6201 0.0000 0.0000 61.6597 29.9971 176.4506 31 C 4.7117 7.8974 110.2807 60.0242 32.6864 177.1610 32 K 3.9526 8.1146 130.5357 55.9660 28.6235 180.5270 *35 Y 4.6312 8.7692 115.0621 57.4953 38.8728 178.0960 36 R 4.2163 7.9399 122.7904 59.6379 30.1063 177.7169 37 M 3.9262 8.0306 118.0710 58.6946 32.2688 177.6262 38 L 3.9276 7.4953 120.7319 58.2513 42.2179 178.5633 39 M 3.9466 7.9547 117.6074 58.7430 32.1571 178.1074 40 S 4.0873 7.7948 115.1015 61.6432 63.0074 176.7402 41 I 3.2357 7.6921 122.4134 64.4283 36.9807 178.6690 42 V 3.5217 7.7179 118.8639 65.8588 31.1573 177.8383 43 L 3.8553 7.9351 120.2041 57.9674 41.8227 178.2673 44 Y 3.9331 8.1405 119.7407 60.8599 38.6349 178.0513 45 L 3.8341 8.2698 118.6077 57.4177 41.6500 178.1315 46 N 4.6267 7.2716 114.1196 53.2203 38.9284 175.4369 47 G 3.3921 7.6261 106.9170 46.6460 0.0000 175.3086 48 E 4.1950 7.3912 121.6898 54.6726 27.5205 176.0146 49 Y 4.2421 6.9369 120.6884 61.2025 38.5224 177.5232 50 T 3.9692 7.9170 116.2544 66.7183 68.0945 176.8758 51 R 3.9895 7.9538 119.3867 59.0797 30.1902 178.7632 52 A 4.1491 7.9927 120.7142 54.9158 18.3554 179.7152 53 L 3.7848 8.1071 117.8328 57.6127 41.4000 179.0873 54 F 3.9339 7.7768 119.4481 62.0195 39.4240 176.8233 55 H 4.4113 8.2193 114.3913 58.7081 28.4165 177.8689 56 L 4.0340 7.9775 121.0273 57.9276 41.2198 178.9521 57 H 4.2654 8.2978 115.8746 58.7605 28.6947 177.0779 58 K 4.2335 7.5710 117.5046 56.3316 32.1504 176.1242 59 L 4.8637 7.4568 119.0292 53.2989 45.3614 176.9105 60 N 4.9629 7.9875 116.1351 51.9716 39.8508 172.2801 61 T 5.1638 8.6420 114.8346 57.3330 73.8040 174.5677 62 C 3.9810 8.4739 115.7137 62.1293 29.3125 176.2009 63 T 4.0185 7.6824 117.2479 65.9936 67.9037 177.0164 64 S 4.1642 7.9278 115.8427 61.5900 63.0898 176.7967 65 K 4.0428 8.4655 122.9761 58.8223 31.7095 178.7179 66 Y 4.0754 8.2981 120.0327 61.1802 38.7632 177.9675 67 Y 3.5017 8.2825 117.4550 60.4407 37.7979 178.1440 68 E 3.7490 8.5750 120.9871 59.4150 29.7960 178.7256 69 S 4.2549 8.2495 113.2616 61.4596 62.3387 176.1460 70 L 3.8521 7.6560 121.5071 57.9385 41.4365 179.3560 71 C 4.2179 8.2474 116.7317 63.1301 28.0379 175.7260 72 Y 4.3999 8.1701 118.7438 60.9943 37.3867 178.7921 73 K 4.1020 8.2689 120.6554 59.4642 32.1353 178.8981 74 K 3.7568 7.8159 117.7596 59.1173 31.9140 178.4016 75 K 4.3115 7.5547 115.0693 55.3322 32.1920 176.9590 76 K 2.9739 7.5101 117.1444 57.2483 30.4547 176.8607 77 D 4.4128 7.6852 120.8008 53.3529 38.4523 175.9671 78 Y 4.4186 7.4560 124.1492 61.0864 38.3863 178.3035 79 K 4.0791 7.9858 124.3953 59.5677 31.7884 182.1830 80 K 3.8784 7.7799 119.1322 58.9097 31.9247 179.0300 81 A 4.1711 7.9254 121.2092 55.5137 18.3033 179.7170 82 I 3.6159 8.1321 118.2256 64.5827 37.1926 178.6879 83 K 4.0312 8.0692 119.2131 59.7635 31.6397 179.4867 84 S 4.1752 8.2133 114.5538 61.6242 63.0619 176.5303 85 L 4.1128 7.8159 121.1224 57.8565 41.3164 179.3078 86 E 3.9349 8.2383 118.4930 59.4661 29.3462 179.3432 87 S 4.0122 7.8443 114.8087 61.9165 62.8645 176.9497 88 I 3.5450 7.5311 122.0597 64.4004 36.6921 178.4564 89 L 3.9545 7.5870 118.1679 57.8498 41.6015 178.2227 90 E 4.1230 8.7976 116.2108 56.1135 29.7496 176.3976 91 G 3.8965 8.3188 107.5607 46.9810 0.0000 174.0816 92 K 4.6860 8.4392 114.4594 56.5312 33.0618 176.7057 93 V 5.0383 7.6348 111.5926 59.5744 35.0922 175.3931 94 E 4.4592 8.5576 121.9586 55.2463 31.4293 176.4919 95 R 4.1451 8.3621 120.7111 56.0104 30.7219 176.9539 96 D 4.4349 8.5048 122.1153 53.7176 41.4672 174.8039 97 P 4.3591 0.0000 0.0000 62.8539 31.9614 176.9636 98 D 4.4666 8.6744 120.6593 53.7806 39.8247 176.0623 99 V 4.6247 7.9770 116.7047 57.2281 35.9756 175.0941 100 D 4.3470 8.5980 118.3549 55.1907 42.2907 177.0339 101 A 3.9528 8.6225 127.1335 55.4535 18.1915 180.2929 102 R 3.8584 7.5709 114.4134 59.0870 30.2734 178.8884 103 I 3.8187 7.5210 121.8504 64.5812 37.3023 178.5233 104 Q 3.2972 7.8221 121.5414 60.1389 27.6416 180.7796 105 E 4.2691 7.5230 119.2464 59.2238 29.5912 177.8495 106 M 4.3604 7.6956 116.3165 55.4799 32.3134 176.1663 107 F 5.1148 8.0693 118.6587 56.4445 40.5548 175.0805 108 V 4.0960 8.4486 122.8801 61.3899 32.5051 174.7865 109 D 4.7433 8.4236 126.8135 52.4835 41.7995 174.9770 110 P 4.7238 0.0000 0.0000 64.3214 31.3957 177.1173 111 G 3.8722 8.2638 106.8191 46.4126 0.0000 174.3180 112 D 5.3174 7.9294 122.7750 52.8964 39.7127 177.5818 113 E 4.2933 7.7990 119.7711 58.6007 30.1724 178.7808 114 E 3.8505 8.0949 119.0377 59.6111 29.5438 179.1201 115 F 4.0506 7.3706 116.5372 60.4300 38.8848 177.8676 116 F 4.6100 7.4371 116.9433 60.8333 38.8798 177.5532 117 E 4.1887 8.5997 118.4111 59.2070 29.2150 179.4370 118 S 4.2546 8.3333 113.5190 61.3413 62.4585 176.0145 119 L 4.0684 8.0433 122.9681 58.1939 41.8329 178.7247 120 L 4.0296 8.6361 119.4985 57.6893 41.4611 179.9227 121 G 2.8326 8.0217 105.5967 47.5455 0.0000 175.4501 122 D 4.5729 8.0481 123.1137 56.4216 40.8920 178.9810 123 L 3.7716 8.1710 119.6254 57.9107 41.5662 179.2658 124 C 4.0550 8.0753 116.6100 63.2043 28.1293 176.1371 125 T 3.9310 7.8137 116.9778 66.9842 67.9346 176.7229 126 L 3.9143 8.1883 119.1945 56.9528 41.5765 178.5275 127 S 4.6329 7.5929 110.9487 58.0452 62.6627 174.4208 128 G 3.8869 8.1329 108.9269 46.2715 0.0000 174.1768 129 Y 4.5138 8.5150 119.5094 55.9493 37.4734 176.2932 130 R 3.9474 8.2049 126.1921 59.8207 30.7670 177.8331 131 E 3.9627 8.1531 117.6066 61.2887 29.7827 180.2682 132 E 4.1672 8.3186 120.3255 58.8534 29.5879 178.8920 133 G 3.3961 8.0272 105.6746 47.9254 0.0000 175.5032 134 I 3.9802 8.1270 123.2633 64.1311 37.0877 178.6941 135 G 3.6472 7.9090 106.3414 48.0856 0.0000 175.5432 136 H 4.3396 7.8318 118.4160 58.8549 28.2077 177.3795 137 Y 4.4038 7.9929 118.9575 61.1676 37.6865 179.0697 138 V 3.7043 8.4456 119.3859 66.1498 31.4957 178.1150 139 R 3.9438 7.9699 117.1276 59.2631 30.1113 178.1383 140 S 4.2147 8.8327 113.3699 61.5180 62.5845 176.0504 141 F 4.4789 8.2606 125.0923 60.5519 38.8195 177.1694 142 G 3.6146 8.0608 104.8328 47.0411 0.0000 174.7604 143 K 4.1547 7.6465 120.5945 57.3526 33.3854 176.4949 144 S 4.3844 6.6247 108.9459 56.9832 65.8005 174.6198 145 F 4.1864 8.9051 128.8452 58.3154 39.7841 174.9646 146 L 4.8062 7.6530 126.5571 51.7977 46.7540 177.2664 147 F 3.8083 8.5432 122.9753 61.4997 39.6210 177.6245 148 S 3.8067 7.9740 112.2654 60.6610 62.2498 174.1420 149 P 3.4251 0.0000 0.0000 65.1566 31.0784 178.5339 150 V 3.1050 6.9827 116.4227 66.1575 31.4128 178.0397 151 E 3.6831 7.7153 118.2153 59.1196 29.1127 179.0639 152 N 4.2425 7.4403 116.1848 55.7410 38.6447 177.5656 153 L 3.9171 7.8546 120.9287 57.4250 41.6099 179.4652 154 L 3.7946 7.8932 119.2617 57.6641 41.3662 178.9799 155 L 3.8934 7.4575 118.8283 58.2283 42.0221 178.1329 156 E 4.2582 7.9264 114.7740 55.4743 29.6820 175.9104 157 N 4.0076 7.8412 116.3056 54.3541 38.1228 173.9054 158 K 4.5084 7.7454 113.5325 55.8119 32.4228 176.9224 159 V 3.5864 7.4558 119.0126 60.7318 31.9637 173.8372 160 P 4.4538 0.0000 0.0000 62.3212 31.7704 175.6942 161 Q 4.8628 8.4838 124.0991 54.3555 32.6506 177.9249 162 K 4.7027 8.2463 128.1604 54.4061 30.8329 180.0854 163 R 4.4550 8.4292 114.7496 57.7141 30.3165 175.5770 *175 G 3.7162 7.8696 104.7668 44.9460 0.0000 173.9180 176 I 3.7610 8.0005 120.3585 63.7174 38.0498 178.0648 177 E 3.8906 7.8988 118.3239 59.3397 29.4910 178.8366 178 E 4.2385 8.0116 119.0037 58.9316 29.5221 178.6560 179 E 4.0458 8.4722 119.7963 59.3051 29.6695 178.1576 180 Y 4.5019 8.0753 121.1278 60.1263 38.7998 178.3347 181 V 3.4322 8.2098 119.2240 65.9609 31.6748 178.0178 182 S 4.1591 8.1651 114.9133 61.9841 62.7708 176.5513 183 D 4.4768 8.4613 121.5949 57.5364 40.6599 179.1523 184 S 4.0286 8.0339 115.6414 61.4939 62.6035 176.6998 185 I 3.6329 8.0663 122.9119 64.3637 36.9520 178.1082 186 E 4.0187 8.3731 120.0790 59.4000 29.5420 178.6839 187 F 4.1771 8.9398 121.0203 61.2486 39.1572 176.4537 188 H 3.8684 8.1055 119.6394 59.5356 29.7838 176.9498 189 E 4.3953 7.5889 115.4922 58.2868 30.1049 178.2667 190 S 4.6905 7.3650 109.8764 57.6129 64.8700 174.2758 191 L 2.4400 7.7096 119.4661 54.6129 39.7972 174.7260 192 S 4.1738 7.7710 112.4564 58.6080 63.1020 172.4206 193 P 4.5768 0.0000 0.0000 65.3337 31.1982 178.7896 194 S 4.2464 8.1674 113.1742 61.1706 63.0131 176.4906 195 L 4.0077 7.8786 122.3790 57.6188 41.4464 179.3340 196 V 3.8071 8.0159 120.2129 66.8516 29.8819 178.9126 197 K 4.0865 8.1715 123.3073 59.4682 31.3011 180.6812 198 K 4.1326 7.8825 119.8741 59.5979 32.4241 177.9117 199 Y 4.2328 7.9113 114.9194 59.1955 37.8577 177.2594 200 M 4.2202 7.8034 121.4946 59.0153 32.4284 178.0541 201 E 4.1164 7.5527 115.9470 59.4850 31.1141 180.1601 202 H 5.0845 7.8881 114.9386 55.7605 28.8429 174.9066 203 V 4.5789 7.2642 117.4803 60.3026 33.8725 173.1193 204 P 4.4345 0.0000 0.0000 62.3116 32.6659 177.3613 205 G 3.7783 8.0814 107.4725 45.0595 0.0000 174.1385 206 I 4.0452 8.5894 119.3871 64.3672 37.9043 179.1219 207 G 4.3803 8.5181 108.0505 47.2529 0.0000 175.8553 208 S 3.7763 8.0327 117.4858 61.5241 62.6749 176.3152 209 Y 4.1609 7.7446 118.7323 61.0555 37.8244 177.6943 210 F 3.7804 8.4698 121.3416 61.7705 39.3306 177.3251 211 I 3.7598 8.4411 119.3794 64.4688 36.3297 178.7546 212 S 4.1301 7.9254 115.6446 61.5896 62.6514 176.4313 213 N 4.2825 8.7072 119.3465 56.0264 38.1516 176.9942 214 A 3.6629 7.9121 122.3704 55.3383 18.4421 179.4303 215 A 4.1553 8.2337 119.1435 55.4849 18.3398 179.9414 216 R 3.8519 7.6334 116.2636 59.4690 29.9860 178.6032 217 R 3.7541 7.7992 117.3795 59.6811 30.4663 177.6474 218 Y 4.5012 8.2404 119.1326 61.7342 37.8860 179.3781 *219 F 4.0903 8.0503 120.8120 62.1994 38.0142 179.0092 220 N 4.7946 7.9166 115.8062 55.4932 38.3929 176.3645 221 L 4.4753 7.5971 117.6571 54.0616 42.3004 177.5444 222 G 4.0057 8.5764 108.1470 46.2544 0.0000 175.5582 223 M 4.4253 7.5471 120.6155 54.7379 28.9142 176.2421 224 N 4.4542 8.0614 120.1417 55.8219 39.2512 176.4671 225 D 4.3420 8.1041 122.6591 58.0811 40.9738 179.4342 226 K 3.7949 7.7048 123.5436 59.3957 31.6086 180.7234 227 S 4.4918 7.9140 116.0592 62.2917 62.2503 177.3450 228 K 4.0541 8.1569 125.9334 59.3745 31.3781 180.4863 229 A 4.1950 7.8786 121.7601 55.5340 18.1703 179.4326 230 C 4.1317 8.4597 117.4659 63.6747 28.2163 177.1290 *231 F 4.1287 8.2141 124.3906 62.5833 37.7283 179.5380 232 E 4.1846 8.7163 119.7277 60.8498 29.3631 180.4731 233 L 4.1079 8.0699 121.5783 58.3521 42.1116 179.4145 234 V 3.5741 7.7578 120.1477 66.6289 31.3273 178.6591 235 R 4.0480 8.5816 123.2776 61.7696 28.8353 181.4724 236 R 4.3544 7.5282 118.5758 60.8316 30.1789 181.5926 237 K 4.4588 8.0881 116.8525 57.1620 33.6664 177.1822 238 D 4.7224 8.0664 117.2628 52.8153 42.6956 174.3693 239 P 4.4843 0.0000 0.0000 65.0481 32.0191 177.6215 240 M 4.3176 7.8933 114.8961 55.0941 32.4559 175.6419 241 F 4.0612 8.2827 122.5243 60.3410 40.1317 175.5082 242 L 3.2963 6.2662 123.7667 54.4584 40.4156 175.1450 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 3 S 8.29 4.39 0.00 3.88 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 4 K 8.41 4.01 0.00 1.88 1.81 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.44 1.16 7.81 5 L 8.77 4.35 0.00 1.69 1.77 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 6 I 7.70 3.78 1.96 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 1.46 0.84 0.99 0.00 0.00 7 G 8.19 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.80 4.10 0.00 2.05 1.89 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.64 7.81 9 I 7.84 3.76 2.03 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 1.57 0.76 0.95 0.00 0.00 10 C 8.27 4.12 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 11 K 8.19 4.05 0.00 2.03 1.99 0.00 1.62 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.61 1.71 7.81 12 S 8.18 4.31 0.00 4.12 4.17 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 13 I 8.11 3.89 2.13 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.16 1.09 0.00 0.00 14 R 8.02 3.42 0.00 1.76 2.25 0.00 3.06 0.00 0.00 3.14 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.39 0.00 15 Y 7.59 4.27 0.00 2.93 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 16 R 8.24 2.93 0.00 1.68 1.57 0.00 3.35 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.60 0.00 17 D 7.89 4.51 0.00 2.72 2.65 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 0.00 0.00 0.00 0.00 18 Y 7.75 4.49 0.00 3.04 2.86 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 0.00 0.00 0.00 19 E 8.38 4.01 0.00 1.99 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 0.00 2.45 2.39 0.00 20 T 7.85 3.88 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 1.23 0.00 0.00 21 A 7.77 4.13 1.52 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 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.54 3.64 2.07 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 1.39 0.84 0.91 0.00 0.00 23 F 8.48 3.94 0.00 3.09 3.19 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 24 L 8.56 4.15 0.00 1.69 1.79 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.19 4.11 1.41 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 0.00 0.00 26 A 8.09 3.90 1.19 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 27 C 7.59 4.18 0.00 3.11 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 28 L 7.95 4.19 0.00 1.94 1.74 0.92 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 29 L 7.28 3.99 0.00 1.83 1.75 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.62 0.00 2.03 2.06 0.00 3.73 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 31 C 7.90 4.71 0.00 3.28 2.86 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 0.00 0.00 0.00 32 K 8.11 3.95 0.00 1.90 1.23 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.78 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.25 1.23 7.81 *35 Y 8.77 4.63 0.00 2.26 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 0.00 0.00 0.00 0.00 36 R 7.94 4.22 0.00 1.90 1.96 0.00 3.23 0.00 0.00 3.43 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.78 0.00 37 M 8.03 3.93 0.00 2.30 1.96 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.16 0.00 38 L 7.50 3.93 0.00 1.99 1.86 0.92 0.85 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 39 M 7.95 3.95 0.00 2.26 1.97 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 40 S 7.79 4.09 0.00 4.07 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 41 I 7.69 3.24 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.49 0.81 0.00 0.00 42 V 7.72 3.52 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 1.01 0.00 0.00 0.96 0.00 0.00 43 L 7.94 3.86 0.00 2.08 1.68 0.86 0.62 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 44 Y 8.14 3.93 0.00 3.28 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 45 L 8.27 3.83 0.00 1.00 0.80 0.93 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 46 N 7.27 4.63 0.00 2.71 2.66 0.00 0.00 7.32 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 47 G 7.63 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 0.00 0.00 0.00 48 E 7.39 4.19 0.00 1.93 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 2.09 2.28 0.00 49 Y 6.94 4.24 0.00 3.04 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 50 T 7.92 3.97 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 1.27 0.00 0.00 51 R 7.95 3.99 0.00 1.95 1.95 0.00 3.07 0.00 0.00 3.54 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 52 A 7.99 4.15 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.11 3.78 0.00 1.84 1.48 0.64 -0.07 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 54 F 7.78 3.93 0.00 3.03 3.25 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 55 H 8.22 4.41 0.00 3.44 3.39 0.00 5.67 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 7.98 4.03 0.00 1.74 1.69 0.98 0.90 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 57 H 8.30 4.27 0.00 2.92 3.27 0.00 5.65 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 7.57 4.23 0.00 1.72 1.79 0.00 1.56 0.00 0.00 1.60 0.00 0.00 2.44 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.23 1.53 7.81 59 L 7.46 4.86 0.00 1.64 1.52 0.90 0.77 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 N 7.99 4.96 0.00 2.65 2.61 0.00 0.00 6.37 7.22 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 61 T 8.64 5.16 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 1.13 0.00 0.00 62 C 8.47 3.98 0.00 3.15 3.19 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 63 T 7.68 4.02 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 1.36 0.00 0.00 64 S 7.93 4.16 0.00 4.07 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 65 K 8.47 4.04 0.00 1.85 2.10 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.57 1.58 7.81 66 Y 8.30 4.08 0.00 3.24 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 67 Y 8.28 3.50 0.00 3.21 2.93 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 68 E 8.58 3.75 0.00 2.27 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 2.25 2.20 0.00 69 S 8.25 4.25 0.00 4.01 3.79 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 70 L 7.66 3.85 0.00 1.51 1.55 -0.12 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 71 C 8.25 4.22 0.00 2.93 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 72 Y 8.17 4.40 0.00 3.19 3.10 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 73 K 8.27 4.10 0.00 2.03 2.00 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.71 7.81 74 K 7.82 3.76 0.00 1.28 1.07 0.00 1.35 0.00 0.00 1.49 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.24 0.21 7.81 75 K 7.55 4.31 0.00 1.95 1.87 0.00 1.96 0.00 0.00 1.88 0.00 0.00 3.15 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.52 1.59 7.81 76 K 7.51 2.97 0.00 1.69 1.39 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.31 7.81 77 D 7.69 4.41 0.00 2.66 2.52 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 0.00 0.00 0.00 0.00 78 Y 7.46 4.42 0.00 3.08 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 79 K 7.99 4.08 0.00 1.76 1.82 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.10 7.81 80 K 7.78 3.88 0.00 0.79 0.74 0.00 1.38 0.00 0.00 1.07 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.11 1.28 7.81 81 A 7.93 4.17 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 8.13 3.62 1.98 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 1.49 1.16 0.83 0.00 0.00 83 K 8.07 4.03 0.00 1.94 1.83 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.53 7.81 84 S 8.21 4.18 0.00 4.09 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.82 4.11 0.00 1.88 1.71 1.04 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.24 3.93 0.00 2.12 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 2.28 2.49 0.00 87 S 7.84 4.01 0.00 4.01 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 88 I 7.53 3.54 1.46 0.00 0.00 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 1.37 0.81 0.40 0.00 0.00 89 L 7.59 3.95 0.00 1.57 1.72 1.02 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.80 4.12 0.00 1.94 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 91 G 8.32 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 0.00 0.00 0.00 92 K 8.44 4.69 0.00 1.66 1.85 0.00 1.52 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.38 7.81 93 V 7.63 5.04 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 1.11 0.00 0.00 0.91 0.00 0.00 94 E 8.56 4.46 0.00 1.89 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.41 0.00 95 R 8.36 4.15 0.00 1.80 1.88 0.00 3.23 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 96 D 8.50 4.43 0.00 2.62 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 97 P 0.00 4.36 0.00 2.13 2.02 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 98 D 8.67 4.47 0.00 2.69 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 99 V 7.98 4.62 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 1.13 0.00 0.00 0.77 0.00 0.00 100 D 8.60 4.35 0.00 2.72 2.52 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 0.00 0.00 0.00 0.00 101 A 8.62 3.95 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 0.00 102 R 7.57 3.86 0.00 2.00 1.97 0.00 3.16 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 103 I 7.52 3.82 1.81 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 1.42 0.88 0.59 0.00 0.00 104 Q 7.82 3.30 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 105 E 7.52 4.27 0.00 1.99 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 2.32 2.41 0.00 106 M 7.70 4.36 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.47 0.00 107 F 8.07 5.11 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 0.00 108 V 8.45 4.10 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 0.84 0.00 0.00 0.64 0.00 0.00 109 D 8.42 4.74 0.00 2.74 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 0.00 110 P 0.00 4.72 0.00 2.13 2.11 0.00 3.77 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 2.05 2.11 0.00 111 G 8.26 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 D 7.93 5.32 0.00 2.66 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 0.00 113 E 7.80 4.29 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.64 0.00 114 E 8.09 3.85 0.00 1.49 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 2.26 2.37 0.00 115 F 7.37 4.05 0.00 2.65 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 0.00 116 F 7.44 4.61 0.00 3.23 3.04 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 0.00 117 E 8.60 4.19 0.00 2.02 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 2.58 2.52 0.00 118 S 8.33 4.25 0.00 3.95 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 0.00 119 L 8.04 4.07 0.00 2.17 1.92 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 120 L 8.64 4.03 0.00 1.71 1.27 0.81 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.02 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 0.00 0.00 0.00 122 D 8.05 4.57 0.00 2.93 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 8.17 3.77 0.00 1.74 1.70 0.97 0.93 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 0.00 124 C 8.08 4.05 0.00 3.02 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 T 7.81 3.93 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 126 L 8.19 3.91 0.00 0.83 0.76 0.71 0.90 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 0.00 127 S 7.59 4.63 0.00 4.05 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.13 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 0.00 129 Y 8.52 4.51 0.00 2.96 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 0.00 130 R 8.20 3.95 0.00 1.91 1.92 0.00 3.28 0.00 0.00 3.42 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 131 E 8.15 3.96 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.94 0.00 132 E 8.32 4.17 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 133 G 8.03 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 0.00 0.00 0.00 134 I 8.13 3.98 2.06 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 1.54 0.61 0.94 0.00 0.00 135 G 7.91 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 H 7.83 4.34 0.00 3.11 3.42 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 Y 7.99 4.40 0.00 3.14 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.45 3.70 2.31 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 1.05 0.00 0.00 1.01 0.00 0.00 139 R 7.97 3.94 0.00 1.99 2.12 0.00 3.57 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 140 S 8.83 4.21 0.00 3.94 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 F 8.26 4.48 0.00 3.11 3.05 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 0.00 142 G 8.06 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 0.00 0.00 0.00 143 K 7.65 4.15 0.00 1.71 1.87 0.00 1.83 0.00 0.00 1.61 0.00 0.00 3.14 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.34 1.39 7.81 144 S 6.62 4.38 0.00 3.89 3.48 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 0.00 145 F 8.91 4.19 0.00 3.33 2.93 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 0.00 146 L 7.65 4.81 0.00 1.48 1.36 0.31 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 147 F 8.54 3.81 0.00 3.06 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 0.00 148 S 7.97 3.81 0.00 4.03 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 0.00 149 P 0.00 3.43 0.00 2.11 2.32 0.00 3.55 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.28 0.00 150 V 6.98 3.11 1.61 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 1.09 0.00 0.00 0.51 0.00 0.00 151 E 7.72 3.68 0.00 1.37 1.63 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 1.47 1.47 0.00 152 N 7.44 4.24 0.00 1.93 2.52 0.00 0.00 6.93 6.03 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 0.00 153 L 7.85 3.92 0.00 1.41 1.47 0.83 0.52 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 0.00 154 L 7.89 3.79 0.00 1.52 1.58 0.76 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 155 L 7.46 3.89 0.00 1.66 1.85 0.89 0.81 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 0.00 156 E 7.93 4.26 0.00 1.95 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 2.46 2.46 0.00 157 N 7.84 4.01 0.00 2.58 2.74 0.00 0.00 7.05 6.24 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 0.00 158 K 7.75 4.51 0.00 1.74 1.76 0.00 1.62 0.00 0.00 1.85 0.00 0.00 3.14 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.38 1.37 7.81 159 V 7.46 3.59 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 0.59 0.00 0.00 0.61 0.00 0.00 160 P 0.00 4.45 0.00 2.21 2.10 0.00 3.59 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 2.22 2.15 0.00 161 Q 8.48 4.86 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.99 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 162 K 8.25 4.70 0.00 1.78 1.36 0.00 1.84 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 0.99 7.81 163 R 8.43 4.46 0.00 1.87 1.97 0.00 3.04 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 *175 G 7.87 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 0.00 0.00 0.00 176 I 8.00 3.76 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.32 0.84 0.00 0.00 177 E 7.90 3.89 0.00 1.16 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.47 0.00 178 E 8.01 4.24 0.00 2.06 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 2.41 2.33 0.00 179 E 8.47 4.05 0.00 2.09 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 0.00 2.41 2.37 0.00 180 Y 8.08 4.50 0.00 3.21 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 0.00 181 V 8.21 3.43 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 0.99 0.00 0.00 1.40 0.00 0.00 182 S 8.17 4.16 0.00 4.11 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 0.00 183 D 8.46 4.48 0.00 2.83 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 0.00 184 S 8.03 4.03 0.00 3.77 3.62 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 0.00 185 I 8.07 3.63 2.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.30 0.92 0.00 0.00 186 E 8.37 4.02 0.00 2.09 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 0.00 2.38 2.35 0.00 187 F 8.94 4.18 0.00 3.29 3.05 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 0.00 188 H 8.11 3.87 0.00 3.29 3.39 0.00 5.99 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 E 7.59 4.40 0.00 2.15 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 190 S 7.36 4.69 0.00 3.93 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 0.00 191 L 7.71 2.44 0.00 1.57 1.66 0.68 0.84 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 0.00 192 S 7.77 4.17 0.00 4.00 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 0.00 193 P 0.00 4.58 0.00 2.28 2.19 0.00 3.74 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 194 S 8.17 4.25 0.00 4.08 4.17 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 0.00 195 L 7.88 4.01 0.00 2.22 2.03 1.00 1.48 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 0.00 196 V 8.02 3.81 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 1.11 0.00 0.00 1.21 0.00 0.00 197 K 8.17 4.09 0.00 1.83 1.80 0.00 1.87 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.31 7.81 198 K 7.88 4.13 0.00 1.73 2.06 0.00 1.61 0.00 0.00 1.39 0.00 0.00 2.39 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.83 1.23 7.81 199 Y 7.91 4.23 0.00 2.89 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 0.00 200 M 7.80 4.22 0.00 2.09 2.33 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 201 E 7.55 4.12 0.00 2.12 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 2.26 2.22 0.00 202 H 7.89 5.08 0.00 3.20 3.28 0.00 5.53 0.00 0.00 0.00 0.00 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 V 7.26 4.58 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 0.77 0.00 0.00 0.99 0.00 0.00 204 P 0.00 4.43 0.00 2.10 2.13 0.00 3.75 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 2.32 0.00 205 G 8.08 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 0.00 0.00 0.00 206 I 8.59 4.05 1.94 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.25 1.05 0.00 0.00 207 G 8.52 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 0.00 0.00 0.00 0.00 208 S 8.03 3.78 0.00 2.92 2.63 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 0.00 209 Y 7.74 4.16 0.00 3.27 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 0.00 210 F 8.47 3.78 0.00 2.89 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 0.00 211 I 8.44 3.76 1.89 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 1.82 0.86 0.96 0.00 0.00 212 S 7.93 4.13 0.00 4.19 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 0.00 213 N 8.71 4.28 0.00 2.53 2.66 0.00 0.00 6.90 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 A 7.91 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 A 8.23 4.16 1.52 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 0.00 0.00 0.00 0.00 0.00 0.00 216 R 7.63 3.85 0.00 1.93 2.14 0.00 3.10 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 217 R 7.80 3.75 0.00 1.68 1.96 0.00 3.14 0.00 0.00 2.74 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.37 0.00 218 Y 8.24 4.50 0.00 3.26 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *219 F 8.05 4.09 0.00 2.30 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 0.00 0.00 0.00 0.00 220 N 7.92 4.79 0.00 2.80 2.92 0.00 0.00 7.09 8.01 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 0.00 221 L 7.60 4.48 0.00 1.83 1.71 0.83 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 222 G 8.58 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 0.00 0.00 0.00 223 M 7.55 4.43 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.67 0.00 224 N 8.06 4.45 0.00 2.73 2.87 0.00 0.00 7.00 8.08 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 0.00 225 D 8.10 4.34 0.00 2.64 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 0.00 226 K 7.70 3.79 0.00 1.76 1.82 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 1.06 7.81 227 S 7.91 4.49 0.00 4.15 4.12 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 0.00 228 K 8.16 4.05 0.00 1.82 1.80 0.00 1.88 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.37 1.32 7.81 229 A 7.88 4.20 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 0.00 230 C 8.46 4.13 0.00 3.31 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 *231 F 8.21 4.13 0.00 2.30 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 0.00 232 E 8.72 4.18 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.20 0.00 233 L 8.07 4.11 0.00 1.75 1.92 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 234 V 7.76 3.57 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 0.77 0.00 0.00 0.86 0.00 0.00 235 R 8.58 4.05 0.00 1.83 1.94 0.00 3.31 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 236 R 7.53 4.35 0.00 1.94 1.86 0.00 3.23 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 237 K 8.09 4.46 0.00 1.69 2.02 0.00 1.72 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.58 7.81 238 D 8.07 4.72 0.00 2.63 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 P 0.00 4.48 0.00 2.10 2.18 0.00 3.80 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.29 0.00 240 M 7.89 4.32 0.00 2.25 2.08 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.08 0.00 241 F 8.28 4.06 0.00 3.37 3.05 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 0.00 242 L 6.27 3.30 0.00 1.79 1.42 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.