NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2118 8.4444 121.4808 55.3935 31.6294 175.6053 3 N 4.5930 7.7051 116.9374 51.9112 39.8971 172.9719 4 L 3.8390 8.1706 129.9424 57.5507 42.2902 179.0109 5 S 4.2122 8.1895 113.8594 60.9962 62.5953 175.8615 6 D 4.3057 8.0140 121.2559 56.8276 41.0708 178.2215 7 V 3.2280 7.6877 118.2771 65.1741 31.4692 176.4995 8 F 4.7948 8.0673 115.5939 56.2775 39.7948 175.6137 9 D 4.0216 7.2640 119.4960 55.2065 38.3666 173.5487 10 I 4.5456 7.9307 119.6875 60.3840 38.9984 176.4148 11 Y 5.6573 8.7284 124.7377 56.1427 41.8848 174.6436 12 A 5.5807 9.3697 121.5473 50.4542 22.5352 175.1041 13 I 5.4337 9.1107 121.0857 59.6633 41.3080 174.0578 14 C 4.9613 9.1826 122.4669 57.4648 33.7429 172.3662 15 A 4.8461 8.3549 119.7952 50.5465 21.2918 175.3339 16 C 5.3781 8.9146 120.4533 58.1312 32.6600 173.1638 17 C 5.7700 8.8921 116.1783 55.3582 33.2847 172.7522 18 K 5.0835 8.6930 117.9416 55.5358 32.8984 177.1084 19 V 4.4552 8.3863 123.8531 62.6651 32.4902 175.0106 20 A 4.5616 9.2541 130.8702 50.1605 19.2994 175.8001 21 P 4.5481 0.0000 0.0000 63.1390 32.0935 175.8287 22 T 4.6648 8.2196 115.1008 62.0286 71.7874 174.4728 23 S 4.5577 8.6894 118.6930 58.3860 63.7070 173.7740 24 E 4.5082 8.0923 118.8963 55.4775 32.0586 173.9068 25 G 3.9756 8.6336 108.4854 44.5838 0.0000 173.1295 26 T 4.4984 8.3343 106.9437 61.3879 68.8423 175.1726 27 K 4.4520 7.9332 119.0268 56.5471 32.7386 174.9965 28 N 4.7096 8.1705 118.1610 52.4291 39.1892 174.9296 29 E 4.5553 8.1725 126.2710 53.6192 29.3947 174.6952 30 P 3.8359 0.0000 0.0000 64.1747 31.8390 177.5840 31 F 5.0376 7.0090 117.8594 56.9534 40.1120 175.0145 32 S 4.2055 8.2097 115.1052 57.9227 62.5947 172.3416 33 P 4.3647 0.0000 0.0000 64.2094 30.7098 176.6445 34 R 4.5298 7.5282 118.4089 54.2042 30.3053 176.5291 35 T 3.8391 8.3654 120.7491 65.2720 68.7094 173.8660 36 F 5.0380 7.6808 120.0310 55.6968 39.6292 174.6754 37 R 4.9637 8.5121 119.2826 55.2648 32.3451 174.8393 38 G 4.1690 8.7696 109.2924 46.5284 0.0000 173.9277 39 L 4.5522 8.7900 129.4501 56.5429 43.5342 176.3474 40 G 4.0234 7.5052 103.3627 45.5964 0.0000 172.2299 41 N 5.0877 9.2794 118.3606 53.2283 41.4661 174.5210 42 K 3.8754 10.7800 128.7860 57.6417 29.6932 176.8718 43 G 3.8287 8.0380 103.4569 46.0833 0.0000 171.9740 44 T 4.5153 7.1185 112.9766 59.2806 70.3804 172.7434 45 L 3.8248 7.6645 122.8332 53.6679 42.0935 177.0077 46 P 4.0888 0.0000 0.0000 64.7947 31.4079 177.4743 47 W 3.9406 6.4345 111.8620 55.1479 28.3975 176.2013 48 K 3.6881 6.7071 118.7417 56.5184 30.5606 175.4599 49 C 4.8654 8.1068 120.5275 57.5971 35.5488 174.2959 50 N 4.7653 8.5857 123.7326 51.4350 40.3108 174.7768 51 S 4.1673 8.8168 124.3511 61.6420 62.8846 176.5261 52 V 3.6028 7.8569 121.2225 65.6575 31.3763 177.0718 53 D 4.6021 8.3555 117.6810 57.9558 40.9713 178.2139 54 M 4.0937 8.1874 118.9958 58.3207 31.9519 178.7519 55 K 3.9287 8.2429 119.7670 59.4953 32.3355 178.2305 56 Y 3.6757 8.4589 120.1926 60.5731 38.6935 177.5090 57 F 3.8309 9.0225 121.9611 61.2899 39.1393 176.9223 58 R 3.6250 8.2612 118.1820 59.5606 29.7958 178.2883 59 S 3.9986 7.7305 114.6161 61.6374 62.6235 176.8275 60 V 3.2056 6.9214 119.5121 66.0923 31.3215 177.6753 61 T 3.1653 6.7351 105.4994 62.6517 68.7222 174.7857 62 T 4.2831 6.9439 117.8717 64.8335 70.4702 174.7658 63 Y 4.0376 7.9639 122.3974 57.8048 39.1522 175.5276 64 V 3.5373 7.1230 125.2470 60.6411 34.7148 174.4271 65 D 4.3582 6.1776 124.8407 51.6502 41.4826 175.6021 66 E 3.7667 8.3311 126.8470 59.2177 29.6862 179.3379 67 S 4.5118 8.0682 110.0617 58.7978 62.5297 174.6192 68 K 4.6153 8.2835 119.3293 55.7178 34.2663 177.7075 69 Y 4.0129 7.9268 120.1611 60.2743 38.5343 176.9823 70 E 3.2175 8.0429 120.0466 59.0617 29.4557 178.4363 71 K 3.8023 7.7158 118.5616 59.6950 32.2304 178.3362 72 L 3.8133 7.1500 118.5585 57.5431 41.5208 179.3492 73 K 3.5118 7.7190 119.6833 59.2057 31.9166 178.7940 74 W 4.6527 7.7044 120.3696 59.2713 28.7704 178.2210 75 K 3.8607 8.2905 119.6018 59.8211 31.4510 178.8405 76 R 3.9573 7.9759 117.8730 58.6789 29.6881 178.8519 77 E 4.0200 8.2872 118.6552 59.3130 29.5370 179.1334 78 R 3.8937 8.2933 119.0078 59.6120 29.9404 177.6519 79 Y 3.9900 7.4457 117.5375 60.8712 38.8354 177.9116 80 L 4.1335 8.1241 118.4092 58.5041 41.8326 178.6374 81 R 3.8072 8.4250 117.9032 59.6643 29.8968 177.3973 82 M 4.0038 8.0965 120.6338 57.3607 31.7291 176.3428 *103 N 4.4134 7.9547 117.4995 53.5863 40.2421 173.1128 104 A 3.7235 8.1227 114.5912 53.0457 16.1677 177.8303 105 D 4.7706 7.8951 118.2339 53.6010 42.6201 176.8550 106 K 3.6796 8.5714 123.3785 56.6986 32.3962 176.0868 107 L 3.9483 8.2638 128.5992 55.6584 42.2275 175.8849 108 Q 4.6636 8.4112 123.1462 54.7000 33.9587 173.7178 109 N 5.0694 8.7894 118.3344 52.7913 41.1693 173.9237 110 V 4.8807 8.8971 120.1669 61.3366 34.3368 174.6074 111 V 5.1546 8.8197 120.5504 59.5695 35.0169 174.6435 112 V 5.0460 9.0670 125.3030 61.3214 34.0514 174.2038 113 M 5.9160 8.6204 124.5389 52.2805 35.4088 174.9890 114 G 4.0702 8.4289 106.6974 45.4570 0.0000 174.8384 115 R 4.0724 8.7448 119.4080 59.5646 29.7345 178.3411 116 S 4.1306 8.0898 112.9501 62.0335 63.0587 175.9464 117 N 4.4091 8.2103 118.2337 56.2653 38.3208 177.1274 118 W 4.1443 8.2963 129.6158 60.3716 30.6611 177.2871 119 E 4.1982 8.3980 116.1364 57.4424 29.0404 177.8932 120 S 4.5021 7.3577 113.2009 57.8614 64.5405 174.7668 121 I 3.6196 6.4834 122.2308 60.5864 37.5142 174.1013 122 P 4.2042 0.0000 0.0000 62.6627 31.9781 177.2421 123 K 3.7522 8.7930 122.5151 59.7658 32.0798 177.8870 124 Q 4.2248 7.6692 113.3332 56.3396 28.8845 175.5271 125 Y 5.0096 8.4794 115.7895 57.3902 39.9478 174.8995 126 K 4.7245 7.3606 119.5339 53.9309 34.1531 174.7464 127 P 4.7570 0.0000 0.0000 61.8910 32.1958 176.0163 128 L 4.5814 9.4357 120.2424 53.9491 41.8417 176.0473 129 P 4.3351 0.0000 0.0000 63.9752 31.8446 175.9663 130 N 4.8483 8.7968 116.3298 52.8896 36.2556 174.1204 131 R 4.7536 7.3834 114.2860 54.7641 34.8708 175.3629 132 I 4.1921 8.7345 124.1493 60.8398 38.0649 174.9778 133 N 5.1450 8.7826 125.4116 52.8359 40.2969 174.6723 134 V 4.9505 8.7670 121.8202 61.1831 35.4688 174.0433 135 V 4.7582 8.8147 127.4824 61.0031 34.2897 174.1008 136 L 4.8442 8.7871 129.0605 54.4930 42.0491 176.2726 137 S 4.4987 8.7603 116.5044 57.5719 65.7850 175.4323 138 K 4.5289 8.8962 124.2867 56.3904 32.7168 176.4040 139 T 4.3638 7.9398 109.5850 63.0744 70.1670 175.3182 140 L 4.2249 7.6625 120.4319 54.6051 42.3834 176.1563 141 T 4.7226 7.8847 108.7701 59.7080 71.7596 174.9512 142 K 3.8759 8.7046 122.0476 59.7516 32.3752 179.1808 143 E 3.9625 8.2616 117.1354 59.3944 29.4259 177.8282 144 D 4.4454 7.8017 116.4390 55.0501 41.3563 176.3443 145 V 4.3058 7.1977 118.4760 60.9133 31.8374 175.4607 146 K 4.2034 8.6115 126.9806 57.8912 32.4820 177.5794 147 E 4.3614 7.9079 118.2066 55.0356 30.4952 175.9698 148 K 4.0095 8.5427 123.4435 56.5147 32.5983 176.6186 149 V 4.1745 7.3201 122.2565 61.0034 33.4006 171.9576 150 F 4.4335 8.3758 122.4933 57.2074 40.4358 174.5224 151 I 5.0142 8.3431 122.8060 59.4150 39.7091 174.9319 152 I 4.6444 8.7349 120.0207 59.1651 40.3514 176.5048 153 D 4.4221 8.8944 123.7756 57.0305 41.1823 175.9279 154 S 4.5410 7.2217 110.2924 56.2836 66.1664 175.7017 155 I 3.6958 8.2419 120.4453 64.5859 36.7221 178.1577 156 D 4.3384 7.5982 119.5559 57.6481 40.5360 178.6401 157 D 4.4081 7.8306 119.0576 56.5071 40.8131 178.5986 158 L 3.7774 7.9212 121.6498 57.8818 42.0537 178.6516 159 L 3.6950 7.7565 118.3761 57.8110 41.3983 179.0509 160 L 3.8614 7.3665 117.1251 57.8832 41.9405 179.0444 161 L 3.8871 7.8836 120.0188 58.3524 41.7373 179.0936 162 L 3.7372 7.7647 117.4879 57.5774 41.5028 179.4729 163 K 4.0082 7.7110 117.4484 57.9231 32.7711 176.8660 164 K 4.7185 7.6820 119.5309 54.5701 32.2889 175.9946 165 L 4.5373 7.5836 119.0543 53.5069 45.4365 174.3010 166 K 4.3852 8.7807 127.7684 55.9590 32.4073 174.8825 167 Y 4.5454 7.9121 123.0560 56.6995 40.5789 172.8138 168 Y 4.5440 9.1824 121.1378 58.1800 38.4554 175.4521 169 K 4.5370 9.3760 116.1165 54.4626 37.4725 174.2150 170 C 4.9925 8.5301 121.7792 57.8621 33.8439 172.3692 171 F 5.3453 9.7443 127.0246 56.0084 41.1929 175.0261 172 I 4.7707 8.9842 125.3423 60.2865 38.0948 176.1155 173 I 4.8001 9.7237 120.7405 60.1144 38.6386 175.8392 174 G 4.2067 6.2839 115.3746 44.8572 0.0000 171.7303 175 G 4.2497 7.1523 109.9065 44.8038 0.0000 173.4758 176 A 3.9255 8.3351 118.8143 55.9758 18.8313 179.8664 177 Q 3.9578 7.9939 115.2643 58.5500 28.5534 179.1647 178 V 3.6030 7.7486 119.8033 65.9668 31.5206 177.7651 179 Y 4.3701 7.6713 116.1256 61.1828 37.5926 178.0324 180 R 3.9373 8.3161 119.7924 59.1507 30.2531 178.1104 181 E 4.1222 8.0971 120.2952 58.5319 29.6542 178.4046 182 C 4.2627 7.9073 116.4678 62.6243 28.0556 175.9880 183 L 4.0672 8.0354 120.9111 57.9314 41.4613 179.5054 184 S 3.8955 7.8994 113.2223 61.3582 62.8922 175.8631 185 R 4.3885 7.9660 117.3748 55.0422 30.0879 176.0891 186 N 4.2809 8.4245 115.1491 54.9191 36.5081 174.5606 187 L 4.6805 8.4269 112.3485 54.3793 42.4801 176.9869 188 I 4.7639 7.7437 119.7304 59.6010 39.1463 175.2498 189 K 4.3630 9.4839 128.4369 58.9510 33.2241 176.6239 190 Q 5.2694 8.4233 116.6334 54.2019 33.8653 174.2811 191 I 4.9314 8.6971 121.5424 60.0064 40.6691 174.6963 192 Y 4.5373 9.8234 126.9912 57.0902 38.4935 174.3689 193 F 4.7618 9.1448 128.3011 56.6833 41.3750 174.3977 194 T 4.5568 8.3422 124.0729 62.6948 70.2932 174.4850 195 R 4.6347 8.1381 125.3977 54.2756 32.0559 175.0940 196 I 3.7947 8.7167 127.0210 60.6619 38.0262 175.9960 197 N 4.8438 8.8143 129.5116 51.2033 36.8060 173.9271 198 G 4.2031 7.8818 106.8906 44.8968 0.0000 169.4848 199 A 5.1885 8.1687 123.5530 50.9293 20.1858 176.3720 200 Y 4.8849 8.7114 118.5221 55.7088 43.1523 172.8607 201 P 4.8029 0.0000 0.0000 62.9288 32.0614 175.7992 202 C 5.0092 8.7332 120.4002 58.1881 31.9547 173.4063 203 D 4.8073 8.7192 118.6138 52.4194 41.4549 174.9760 204 V 4.3059 7.0768 119.4630 61.0024 34.5835 174.0994 205 F 5.5788 8.5830 124.6161 55.2748 42.9498 174.3306 206 F 4.6334 9.3645 123.8996 57.3742 39.7255 173.7075 207 P 4.5077 0.0000 0.0000 62.4452 31.9834 175.4086 208 E 4.5030 8.4489 117.5855 55.3702 30.9005 175.3896 209 F 4.9611 7.5000 114.6947 54.7028 41.3912 174.5260 210 D 4.5288 8.7153 120.4281 54.2227 39.6214 176.0415 211 E 4.0819 8.6081 126.7110 59.1166 29.8961 179.9162 212 S 4.1879 7.9029 112.5897 61.2246 63.1395 174.9753 213 E 4.2540 8.3311 116.5031 56.1390 29.6362 175.6156 214 F 5.0323 8.3105 118.8006 55.9374 42.0354 174.0753 215 R 4.8370 8.4773 122.3047 54.0123 32.1108 175.6975 216 V 3.9170 8.5648 122.4498 63.5827 31.5833 175.4092 217 T 4.5342 8.9039 118.2848 61.7325 70.0716 174.8225 218 S 4.4959 7.5172 119.0513 57.5247 67.5144 173.0556 219 V 4.4101 8.3439 124.6947 60.8264 33.2885 175.1011 220 S 4.6084 8.6083 123.3520 57.5108 64.3828 173.3755 221 E 4.2274 8.7004 121.5299 55.4954 30.2671 175.6835 222 V 4.2022 7.8362 120.7310 62.8787 32.4840 174.3277 223 Y 4.8155 9.3574 122.5574 56.1548 42.5981 173.7507 224 N 5.2183 8.8176 118.6134 52.1660 41.6977 174.2993 225 S 4.4512 8.9691 121.2539 56.8665 63.0310 173.0040 226 K 3.7221 9.0689 128.7284 56.9093 28.9243 177.3324 227 G 3.9438 8.0918 105.6006 45.8380 0.0000 172.6473 228 T 4.3437 7.4338 117.6987 62.3568 68.9198 174.5581 229 T 4.8919 8.2149 117.3762 61.5326 71.0669 173.1767 230 L 4.9167 8.9123 121.2628 56.4683 44.3632 172.5998 231 D 4.4795 7.4750 117.8576 52.3140 43.4174 173.6627 232 F 5.0503 8.5778 116.6776 55.6840 42.0331 174.9270 233 L 5.1440 8.9754 123.4294 53.0741 45.4946 175.7930 234 V 4.7406 7.9215 119.3350 61.8552 34.8732 173.2910 235 Y 5.1873 8.9020 125.4281 56.4490 41.2297 174.8675 236 S 5.0816 8.9234 118.0595 56.3228 66.7332 173.2182 237 K 3.9496 9.0039 126.1851 56.1759 31.7363 176.9458 238 V 3.9411 7.7764 125.8544 62.8173 31.8517 175.1360 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 E 8.44 4.21 0.00 1.96 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 0.00 2.21 2.40 0.00 3 N 7.71 4.59 0.00 2.91 2.65 0.00 0.00 7.22 5.78 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 4 L 8.17 3.84 0.00 1.77 1.81 1.01 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.19 4.21 0.00 4.28 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 6 D 8.01 4.31 0.00 2.80 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 7.69 3.23 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 -0.52 0.00 0.00 0.66 0.00 0.00 8 F 8.07 4.79 0.00 3.15 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 D 7.26 4.02 0.00 2.54 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 0.00 0.00 0.00 0.00 10 I 7.93 4.55 2.05 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.91 0.95 0.00 0.00 11 Y 8.73 5.66 0.00 2.71 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 12 A 9.37 5.58 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 13 I 9.11 5.43 2.09 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.46 1.29 0.00 0.00 14 C 9.18 4.96 0.00 2.89 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 15 A 8.35 4.85 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 C 8.91 5.38 0.00 2.73 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 17 C 8.89 5.77 0.00 3.51 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 18 K 8.69 5.08 0.00 1.84 1.67 0.00 1.56 0.00 0.00 1.49 0.00 0.00 2.48 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.07 0.95 7.81 19 V 8.39 4.46 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 1.03 0.00 0.00 1.20 0.00 0.00 20 A 9.25 4.56 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 21 P 0.00 4.55 0.00 2.14 2.00 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 22 T 8.22 4.66 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 23 S 8.69 4.56 0.00 3.97 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 24 E 8.09 4.51 0.00 2.04 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 25 G 8.63 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 0.00 0.00 0.00 26 T 8.33 4.50 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 1.22 0.00 0.00 27 K 7.93 4.45 0.00 1.76 1.83 0.00 1.74 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.37 7.81 28 N 8.17 4.71 0.00 2.71 2.69 0.00 0.00 6.97 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 29 E 8.17 4.56 0.00 1.92 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 2.22 2.14 0.00 30 P 0.00 3.84 0.00 0.92 1.74 0.00 3.60 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.63 0.00 31 F 7.01 5.04 0.00 2.86 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 32 S 8.21 4.21 0.00 3.77 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 0.00 33 P 0.00 4.36 0.00 2.08 2.09 0.00 3.68 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 34 R 7.53 4.53 0.00 1.83 1.95 0.00 3.15 0.00 0.00 3.11 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 35 T 8.37 3.84 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 0.61 0.00 0.00 36 F 7.68 5.04 0.00 3.45 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 37 R 8.51 4.96 0.00 2.08 2.29 0.00 2.96 0.00 0.00 3.55 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.80 0.00 38 G 8.77 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 0.00 0.00 0.00 39 L 8.79 4.55 0.00 1.85 1.86 1.24 1.32 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 40 G 7.51 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 0.00 0.00 0.00 41 N 9.28 5.09 0.00 2.66 2.53 0.00 0.00 7.16 6.06 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 42 K 10.78 3.88 0.00 1.88 1.79 0.00 1.85 0.00 0.00 1.68 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.33 7.81 43 G 8.04 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 0.00 0.00 0.00 44 T 7.12 4.52 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 1.13 0.00 0.00 45 L 7.66 3.82 0.00 1.27 0.50 0.54 0.84 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 46 P 0.00 4.09 0.00 1.98 2.13 0.00 2.20 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.80 0.00 47 W 6.43 3.94 0.00 3.00 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 0.00 0.00 0.00 48 K 6.71 3.69 0.00 2.01 1.82 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.52 7.81 49 C 8.11 4.87 0.00 2.90 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 N 8.59 4.77 0.00 2.81 2.72 0.00 0.00 6.82 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 51 S 8.82 4.17 0.00 4.13 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 0.00 52 V 7.86 3.60 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 1.13 0.00 0.00 1.01 0.00 0.00 53 D 8.36 4.60 0.00 2.82 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 54 M 8.19 4.09 0.00 2.12 2.25 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 2.95 2.58 0.00 55 K 8.24 3.93 0.00 1.96 2.01 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.44 7.81 56 Y 8.46 3.68 0.00 2.63 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 57 F 9.02 3.83 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 58 R 8.26 3.63 0.00 2.02 2.08 0.00 3.15 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 59 S 7.73 4.00 0.00 3.73 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 60 V 6.92 3.21 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 0.03 0.00 0.00 -0.19 0.00 0.00 61 T 6.74 3.17 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 -0.18 0.00 0.00 62 T 6.94 4.28 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 63 Y 7.96 4.04 0.00 2.92 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 64 V 7.12 3.54 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.89 0.00 0.00 65 D 6.18 4.36 0.00 2.62 2.47 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 0.00 66 E 8.33 3.77 0.00 1.93 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.12 0.00 67 S 8.07 4.51 0.00 3.99 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 68 K 8.28 4.62 0.00 2.17 2.01 0.00 1.90 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.43 1.56 7.81 69 Y 7.93 4.01 0.00 3.02 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 70 E 8.04 3.22 0.00 1.70 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 71 K 7.72 3.80 0.00 1.85 1.90 0.00 1.80 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.63 7.81 72 L 7.15 3.81 0.00 1.70 1.47 0.90 0.40 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 73 K 7.72 3.51 0.00 0.79 1.31 0.00 1.55 0.00 0.00 1.39 0.00 0.00 3.35 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.36 7.81 74 W 7.70 4.65 0.00 3.64 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 75 K 8.29 3.86 0.00 1.81 1.91 0.00 1.52 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.29 1.44 7.81 76 R 7.98 3.96 0.00 2.07 2.12 0.00 3.17 0.00 0.00 3.30 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.52 0.00 77 E 8.29 4.02 0.00 2.31 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 2.41 2.51 0.00 78 R 8.29 3.89 0.00 2.05 1.95 0.00 3.05 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 79 Y 7.45 3.99 0.00 2.92 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 80 L 8.12 4.13 0.00 1.89 1.80 1.15 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.42 3.81 0.00 1.91 2.00 0.00 3.24 0.00 0.00 3.25 8.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 82 M 8.10 4.00 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.74 0.00 *103 N 7.95 4.41 0.00 2.76 3.34 0.00 0.00 7.00 7.96 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 0.00 104 A 8.12 3.72 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 0.00 105 D 7.90 4.77 0.00 2.65 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.57 3.68 0.00 1.68 1.71 0.00 1.73 0.00 0.00 1.54 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.36 7.81 107 L 8.26 3.95 0.00 1.36 1.33 0.45 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 108 Q 8.41 4.66 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.64 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 109 N 8.79 5.07 0.00 2.96 3.13 0.00 0.00 6.27 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 0.00 110 V 8.90 4.88 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 0.81 0.00 0.00 0.64 0.00 0.00 111 V 8.82 5.15 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 0.87 0.00 0.00 1.11 0.00 0.00 112 V 9.07 5.05 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 0.98 0.00 0.00 0.89 0.00 0.00 113 M 8.62 5.92 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.61 0.00 114 G 8.43 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 8.74 4.07 0.00 1.90 1.98 0.00 3.23 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.78 0.00 116 S 8.09 4.13 0.00 3.86 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 8.21 4.41 0.00 2.93 2.90 0.00 0.00 6.65 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 0.00 118 W 8.30 4.14 0.00 3.48 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 0.00 119 E 8.40 4.20 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.63 0.00 120 S 7.36 4.50 0.00 3.92 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 I 6.48 3.62 1.45 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.57 0.86 0.00 0.00 122 P 0.00 4.20 0.00 2.20 1.90 0.00 3.76 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 2.33 2.14 0.00 123 K 8.79 3.75 0.00 1.67 1.81 0.00 1.60 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.35 7.81 124 Q 7.67 4.22 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.80 0.00 0.00 0.00 0.00 0.00 1.44 1.93 0.00 125 Y 8.48 5.01 0.00 3.04 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 0.00 126 K 7.36 4.72 0.00 1.20 1.32 0.00 1.41 0.00 0.00 1.49 0.00 0.00 2.62 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.28 7.81 127 P 0.00 4.76 0.00 2.37 2.50 0.00 3.86 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.08 0.00 128 L 9.44 4.58 0.00 1.72 1.76 1.11 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 129 P 0.00 4.34 0.00 2.20 2.01 0.00 3.76 0.00 0.00 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 130 N 8.80 4.85 0.00 2.84 2.86 0.00 0.00 7.06 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 R 7.38 4.75 0.00 1.54 1.84 0.00 3.14 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 132 I 8.73 4.19 2.06 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.68 1.15 0.00 0.00 133 N 8.78 5.14 0.00 2.76 2.87 0.00 0.00 6.44 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 0.00 134 V 8.77 4.95 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 0.98 0.00 0.00 0.93 0.00 0.00 135 V 8.81 4.76 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.33 0.00 0.00 136 L 8.79 4.84 0.00 1.50 1.57 0.88 0.68 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 0.00 137 S 8.76 4.50 0.00 3.76 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 0.00 138 K 8.90 4.53 0.00 1.75 1.77 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.37 7.81 139 T 7.94 4.36 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 1.21 0.00 0.00 140 L 7.66 4.22 0.00 1.58 1.58 0.94 0.76 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 0.00 141 T 7.88 4.72 4.61 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 1.19 0.00 0.00 142 K 8.70 3.88 0.00 1.80 1.87 0.00 1.63 0.00 0.00 1.78 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.43 7.81 143 E 8.26 3.96 0.00 1.92 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 2.31 2.39 0.00 144 D 7.80 4.45 0.00 2.64 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 V 7.20 4.31 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 0.98 0.00 0.00 0.99 0.00 0.00 146 K 8.61 4.20 0.00 1.82 1.86 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.41 7.81 147 E 7.91 4.36 0.00 2.29 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 2.58 2.45 0.00 148 K 8.54 4.01 0.00 1.64 1.70 0.00 1.52 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.31 1.29 7.81 149 V 7.32 4.17 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 0.56 0.00 0.00 150 F 8.38 4.43 0.00 3.01 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.34 5.01 1.80 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.45 0.87 0.00 0.00 152 I 8.73 4.64 1.82 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 1.31 1.29 0.85 0.00 0.00 153 D 8.89 4.42 0.00 2.88 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 0.00 154 S 7.22 4.54 0.00 3.91 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 0.00 155 I 8.24 3.70 1.97 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 1.73 0.96 0.90 0.00 0.00 156 D 7.60 4.34 0.00 2.85 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 0.00 157 D 7.83 4.41 0.00 2.75 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 0.00 158 L 7.92 3.78 0.00 1.65 1.76 0.75 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 159 L 7.76 3.69 0.00 1.92 1.63 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 160 L 7.37 3.86 0.00 1.76 1.68 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 161 L 7.88 3.89 0.00 1.55 1.59 0.15 0.25 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 0.00 162 L 7.76 3.74 0.00 1.21 1.26 0.68 0.06 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 0.00 163 K 7.71 4.01 0.00 1.81 1.92 0.00 1.70 0.00 0.00 1.62 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.38 1.42 7.81 164 K 7.68 4.72 0.00 1.64 1.66 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.41 7.81 165 L 7.58 4.54 0.00 1.50 1.49 0.95 0.30 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 0.00 166 K 8.78 4.39 0.00 1.83 1.74 0.00 1.85 0.00 0.00 1.69 0.00 0.00 2.48 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.19 1.37 7.81 167 Y 7.91 4.55 0.00 3.15 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 0.00 168 Y 9.18 4.54 0.00 2.84 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 9.38 4.54 0.00 1.32 0.86 0.00 1.23 0.00 0.00 0.98 0.00 0.00 2.46 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.80 1.41 7.81 170 C 8.53 4.99 0.00 2.66 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 F 9.74 5.35 0.00 3.11 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 0.00 172 I 8.98 4.77 2.21 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.34 0.96 0.00 0.00 173 I 9.72 4.80 2.08 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 1.44 0.70 1.28 0.00 0.00 174 G 6.28 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 G 7.15 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 A 8.34 3.93 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 0.00 177 Q 7.99 3.96 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.86 0.00 0.00 0.00 0.00 0.00 2.45 2.36 0.00 178 V 7.75 3.60 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 0.94 0.00 0.00 0.89 0.00 0.00 179 Y 7.67 4.37 0.00 3.14 2.61 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 0.00 180 R 8.32 3.94 0.00 1.92 1.94 0.00 3.29 0.00 0.00 3.12 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 181 E 8.10 4.12 0.00 2.27 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 2.32 2.22 0.00 182 C 7.91 4.26 0.00 3.12 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 0.00 183 L 8.04 4.07 0.00 1.77 1.81 0.82 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 184 S 7.90 3.90 0.00 4.04 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 0.00 185 R 7.97 4.39 0.00 1.98 2.02 0.00 3.37 0.00 0.00 3.32 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 186 N 8.42 4.28 0.00 2.80 2.87 0.00 0.00 6.75 6.73 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 0.00 187 L 8.43 4.68 0.00 1.77 1.70 0.95 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 188 I 7.74 4.76 2.14 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 1.42 0.97 1.11 0.00 0.00 189 K 9.48 4.36 0.00 2.23 2.25 0.00 1.51 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.63 1.58 7.81 190 Q 8.42 5.27 0.00 1.56 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.62 0.00 0.00 0.00 0.00 0.00 2.36 2.22 0.00 191 I 8.70 4.93 1.70 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 0.97 0.36 0.82 0.00 0.00 192 Y 9.82 4.54 0.00 3.17 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 0.00 193 F 9.14 4.76 0.00 3.17 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 0.00 194 T 8.34 4.56 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 0.89 0.00 0.00 195 R 8.14 4.63 0.00 1.27 0.66 0.00 2.23 0.00 0.00 2.87 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.49 0.00 196 I 8.72 3.79 1.47 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 -0.36 0.55 0.00 0.00 197 N 8.81 4.84 0.00 2.86 2.79 0.00 0.00 7.05 8.84 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 0.00 198 G 7.88 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 0.00 0.00 0.00 199 A 8.17 5.19 1.11 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 0.00 0.00 200 Y 8.71 4.88 0.00 3.10 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 P 0.00 4.80 0.00 1.98 2.03 0.00 3.77 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 2.08 2.16 0.00 202 C 8.73 5.01 0.00 3.04 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 D 8.72 4.81 0.00 2.68 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 0.00 204 V 7.08 4.31 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 0.99 0.00 0.00 0.85 0.00 0.00 205 F 8.58 5.58 0.00 3.05 3.18 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 0.00 206 F 9.36 4.63 0.00 3.18 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 P 0.00 4.51 0.00 2.13 1.97 0.00 2.34 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.69 0.00 208 E 8.45 4.50 0.00 2.02 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 2.24 2.37 0.00 209 F 7.50 4.96 0.00 3.20 3.02 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 0.00 210 D 8.72 4.53 0.00 2.82 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 0.00 211 E 8.61 4.08 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.08 0.00 212 S 7.90 4.19 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 E 8.33 4.25 0.00 2.00 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 2.57 2.38 0.00 214 F 8.31 5.03 0.00 3.26 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 0.00 215 R 8.48 4.84 0.00 1.95 2.08 0.00 2.79 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 216 V 8.56 3.92 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 0.53 0.00 0.00 0.63 0.00 0.00 217 T 8.90 4.53 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 1.29 0.00 0.00 218 S 7.52 4.50 0.00 3.65 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 0.00 219 V 8.34 4.41 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.84 0.00 0.00 220 S 8.61 4.61 0.00 4.21 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 0.00 221 E 8.70 4.23 0.00 1.91 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 2.19 2.28 0.00 222 V 7.84 4.20 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 0.81 0.00 0.00 0.90 0.00 0.00 223 Y 9.36 4.82 0.00 2.86 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 0.00 224 N 8.82 5.22 0.00 2.66 2.67 0.00 0.00 6.70 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 0.00 225 S 8.97 4.45 0.00 3.80 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 K 9.07 3.72 0.00 2.06 1.86 0.00 1.82 0.00 0.00 1.86 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.45 7.81 227 G 8.09 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 0.00 228 T 7.43 4.34 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 1.31 0.00 0.00 229 T 8.21 4.89 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 230 L 8.91 4.92 0.00 1.35 1.52 0.54 1.19 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 0.00 231 D 7.48 4.48 0.00 2.62 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 0.00 232 F 8.58 5.05 0.00 2.71 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 L 8.98 5.14 0.00 1.50 1.16 0.74 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 234 V 7.92 4.74 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 0.33 0.00 0.00 0.68 0.00 0.00 235 Y 8.90 5.19 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 0.00 236 S 8.92 5.08 0.00 3.76 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 0.00 237 K 9.00 3.95 0.00 1.44 1.61 0.00 1.40 0.00 0.00 1.30 0.00 0.00 2.75 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.20 0.80 7.81 238 V 7.78 3.94 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 0.84 0.00 0.00 0.97 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.