NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 K 4.0483 8.3144 121.7706 56.2784 33.0655 172.8724 22 S 4.4165 8.2408 111.7401 56.4485 65.1481 173.0168 23 L 4.6845 9.2144 120.1266 54.4910 43.2959 177.1216 24 L 4.6824 7.4572 121.6542 54.8325 42.2263 176.7846 25 Q 4.3862 8.7188 118.6793 58.3936 29.8387 175.9507 26 S 4.7052 7.6094 110.2652 56.5714 65.9517 174.6619 27 D 4.3169 8.8993 121.8141 57.4427 41.0420 178.9442 28 A 4.1169 8.0366 120.7143 54.6034 18.6908 179.1879 29 L 3.9457 8.3669 119.4125 58.5351 42.3174 178.6318 30 Y 3.9881 7.8925 119.5948 60.7707 38.8880 177.5552 31 Q 4.1149 8.3712 120.5803 59.2922 29.0200 178.0367 32 Y 4.1330 8.2600 120.7186 60.9332 38.7484 177.5693 33 I 3.4868 7.6179 120.1610 64.2154 36.9202 178.5148 34 L 4.1760 7.6973 119.5489 57.8988 41.4022 178.8055 35 E 3.7176 7.5770 116.7904 58.7336 30.4423 178.7094 36 T 4.3015 7.2079 109.3876 59.7073 68.8039 173.1964 37 S 4.2185 7.1900 121.4545 59.8309 67.7949 177.0712 38 V 3.6815 5.8248 113.6786 63.8433 32.7820 177.8660 39 F 3.8813 8.7829 120.5144 60.3176 39.0933 174.7808 40 P 4.2086 0.0000 0.0000 62.7365 30.2813 172.8031 41 R 3.7574 8.8043 130.3822 56.2799 29.1031 177.3525 42 E 4.6797 8.7744 122.1372 56.5314 30.0583 177.3741 *43 H 4.0899 8.6026 113.3059 54.6064 27.8155 177.5165 44 E 4.1317 8.4192 122.9843 58.2630 30.2696 175.8321 45 A 3.9523 7.8772 119.4955 55.8241 18.2400 179.2986 46 M 3.6479 7.8214 116.2168 58.2633 31.7719 179.0547 47 K 3.9412 7.6740 117.0137 59.3696 32.7474 178.3537 48 E 4.7771 8.3516 121.2710 58.6975 29.5169 178.3344 49 L 3.8984 8.2430 120.5033 58.6389 41.6870 179.3834 50 R 4.2060 8.0653 117.0392 58.9643 29.8991 178.7700 51 E 3.8650 8.0464 118.8186 59.2946 29.3737 179.1694 52 V 3.8679 7.6232 116.9731 65.2917 31.9050 177.4380 53 T 4.0466 8.1976 112.8923 64.9162 68.3204 174.9099 54 A 4.5698 7.4436 124.3232 52.6486 19.4978 178.7982 55 K 4.0901 8.5511 121.9475 57.3350 32.5392 182.9977 *56 H 4.2520 8.4599 118.5841 54.8989 27.9753 176.2340 57 P 4.0537 0.0000 0.0000 64.1953 31.8046 177.4046 58 W 4.5605 7.6665 117.3986 55.9498 28.5199 176.8520 59 N 4.7999 7.9318 116.4846 55.1195 37.7765 176.9354 60 I 3.9005 7.9001 116.3197 62.3059 37.7988 175.4748 61 M 4.7055 8.0395 118.7945 56.5704 34.0828 176.7246 62 T 4.0181 8.3920 113.7212 64.1677 69.0411 173.4338 63 T 4.1277 8.4692 120.5660 61.6728 68.3465 174.5663 64 S 4.2234 8.5644 123.1387 57.9862 65.1863 175.0557 65 A 4.4570 8.5436 127.4691 54.7033 17.4732 179.2571 66 D 4.3112 8.3261 116.0302 58.0063 41.2409 178.4637 67 E 4.0056 8.1049 119.4407 58.9730 29.7392 178.5712 68 G 3.9440 8.6441 106.4821 47.9688 0.0000 175.3855 69 Q 3.9199 8.4271 121.7583 59.0299 29.1873 177.7559 70 F 4.1045 7.7672 121.3691 61.5119 39.2743 177.1426 71 L 3.6139 7.8772 117.6415 57.8786 41.4503 179.2793 72 S 3.9386 7.6435 114.5232 62.0540 62.8218 176.8112 73 M 3.9483 7.8242 120.2990 58.5979 31.7850 178.0751 74 L 3.7060 6.9613 118.9997 57.9354 42.5126 178.6292 75 L 3.7667 7.6588 118.8397 56.9827 41.4375 179.2198 76 K 4.0532 7.4296 116.9981 58.5010 32.0866 178.3778 77 L 4.2259 7.6305 116.8840 55.6134 41.7149 177.3073 78 I 4.3469 6.7879 109.2366 58.6990 39.0616 172.9201 79 N 3.8169 7.8545 121.4612 53.2806 35.5914 173.2472 80 A 4.4714 7.9740 125.6378 50.1005 18.5828 176.8088 81 K 4.0692 8.1342 121.3603 58.6988 32.5630 175.7456 82 N 5.2051 8.6875 117.0006 52.3655 40.0748 173.5383 83 T 5.4071 7.9773 115.7889 62.9967 72.6123 172.0446 84 M 4.5877 8.0953 117.3505 55.9837 36.8789 174.9465 85 E 4.7851 7.9911 123.8210 54.9398 33.4451 173.8950 86 I 3.9934 8.3428 129.3164 62.7180 38.1838 175.6129 87 G 4.4140 9.5591 116.7862 47.4457 0.0000 170.6755 88 V 4.1129 8.2945 123.8184 59.0715 34.6447 170.7836 89 Y 3.6714 8.9209 132.5631 58.2817 39.3305 169.1427 90 T 3.4170 9.4555 128.5914 65.4246 66.7976 173.5067 91 G 4.2029 8.1459 107.0974 45.6242 0.0000 174.4729 92 Y 3.8794 8.3121 121.1899 60.6576 38.6443 178.2845 93 S 4.3727 8.4661 113.2592 60.6591 63.1961 175.1273 94 L 4.3747 7.7229 123.5372 57.2216 42.5203 177.4961 95 L 3.8290 8.9614 120.9759 58.2456 41.7236 178.9989 96 A 3.7968 7.6166 120.3497 55.5819 18.3004 179.5095 97 T 3.7109 8.0433 113.3638 66.8492 68.2034 176.4454 98 A 3.9612 7.9357 121.8917 55.3065 18.6876 179.5954 99 L 4.0050 8.1299 116.1432 57.3495 41.6435 179.6319 100 A 4.0376 7.8697 120.7554 54.0705 18.8432 178.0484 101 I 3.8054 6.5285 109.8845 60.2128 38.8384 176.9419 102 P 4.7028 0.0000 0.0000 62.6447 30.2570 177.1825 103 E 4.5324 8.8124 115.3755 55.8500 31.0836 176.0099 104 D 4.6627 8.0070 115.9958 53.9983 40.4771 176.8960 105 G 4.3888 7.7160 107.0337 46.4574 0.0000 173.2949 106 K 4.8454 8.3058 119.3534 54.7225 36.6756 175.7088 107 I 4.6426 9.2705 126.0297 59.7485 39.8500 174.8417 108 L 5.4853 7.8405 120.4724 51.8539 40.7513 176.4193 109 A 4.5172 7.9056 123.2841 52.4791 20.5278 177.0712 110 M 4.4148 8.4065 118.4896 54.0160 36.9417 173.8051 111 D 4.4762 8.1828 119.4406 53.6310 43.9106 174.7625 112 I 3.5389 9.0685 127.3696 65.2625 37.2486 176.8375 113 N 4.5863 8.4181 126.0268 53.1367 38.7853 175.5197 114 K 4.4475 8.6388 129.7863 59.4789 32.3670 177.9630 115 E 4.0350 8.3748 117.6579 59.6267 29.5752 178.7473 116 N 4.5201 8.4087 115.7688 56.4901 38.8502 176.3862 117 Y 4.3819 7.5623 120.5556 61.1965 38.9380 178.3523 118 E 3.3510 7.7471 117.5397 57.9016 29.2356 178.8505 119 L 4.0913 8.4862 121.7370 56.9229 42.3233 177.4255 120 G 3.9436 7.3886 105.5287 45.0549 0.0000 174.9044 121 L 3.7263 7.3707 123.6533 57.2766 41.8270 177.1660 122 P 4.2164 0.0000 0.0000 64.2289 31.2367 176.9101 123 V 4.2187 7.0700 116.8999 61.9025 32.4870 175.6223 124 I 4.5319 7.3727 115.9197 61.8240 43.8481 176.3225 125 K 4.1090 8.4922 122.3935 58.7148 32.5138 178.8739 126 K 3.8327 7.7115 117.7081 59.5510 32.0785 177.4724 127 A 4.2422 7.9659 117.6259 51.7628 19.4772 179.3388 128 G 3.6561 7.7172 105.0113 45.3868 0.0000 175.4274 129 V 3.2992 8.4814 122.8531 62.5210 30.5636 173.9153 130 D 4.6710 7.9657 116.9599 54.4378 39.4961 176.2880 131 H 4.8087 8.0892 114.4225 55.7811 29.0586 175.3236 132 K 4.2952 7.4125 120.7168 57.8651 34.7484 175.8532 133 I 3.9997 7.8317 120.1249 61.4034 36.1772 174.9018 134 D 4.6866 9.4685 127.8017 52.8053 40.7870 175.2482 135 F 4.8707 8.4184 126.5176 56.9618 40.3768 174.5422 136 R 4.3761 6.5773 123.2057 55.0791 33.6379 174.6465 137 E 4.3725 8.8430 124.8205 56.5941 34.4344 177.1508 138 G 3.7345 8.2517 108.1231 45.4205 0.0000 172.4435 139 P 4.1016 0.0000 0.0000 63.0503 31.6487 175.9304 140 A 4.4930 8.5777 122.5674 53.3621 20.3685 178.9844 141 L 3.9112 7.9998 118.4378 58.0710 42.0867 177.3992 142 P 4.6281 0.0000 0.0000 65.0599 31.2097 178.5776 143 V 3.6461 7.1595 114.6148 64.6747 31.2663 176.6885 144 L 4.2892 7.7277 118.8836 56.6166 42.1412 176.8490 145 D 4.5102 8.1487 118.1899 55.0709 40.8305 178.0271 146 E 3.9335 7.8910 119.3814 59.9812 28.3199 178.9419 147 M 4.3836 7.8617 121.2230 57.1712 31.9132 178.4429 148 I 3.9184 7.1671 118.8663 64.6821 37.2333 177.6227 149 K 4.3731 7.7239 119.5572 57.1826 32.1068 175.9946 150 D 4.3022 7.8591 125.4610 55.2866 41.0379 178.4626 151 E 3.8272 8.8335 121.2513 57.8813 29.6659 174.0124 152 K 4.4297 7.1632 114.9843 55.0279 32.3548 174.8199 153 N 4.7895 7.8048 127.9744 53.8929 40.8752 174.3129 154 H 5.2830 7.4363 114.8974 53.3932 26.9747 173.8799 155 G 4.2266 8.7841 109.2712 45.5098 0.0000 173.2655 156 S 4.2768 7.8850 111.4856 59.1494 62.7001 173.4806 157 Y 4.7853 8.5102 119.5353 56.7854 40.4664 175.7249 158 D 4.6916 8.9949 123.4945 55.2274 43.0355 176.8342 159 F 4.9950 8.1719 120.3622 56.4144 42.7255 173.6901 160 I 4.6177 7.9141 125.9551 59.3476 40.9292 174.0355 161 F 4.8184 8.2998 130.2204 56.3992 40.8169 174.9514 162 V 3.3339 7.4368 128.1941 62.2780 32.1610 174.6456 163 D 4.8739 8.7724 128.8736 54.7617 42.9584 174.8757 164 A 4.7663 8.5915 133.0497 52.0112 25.3520 179.3155 165 D 4.7514 9.2675 124.7995 52.8593 41.2005 176.4568 166 K 3.1126 8.4678 111.4415 57.5010 37.7141 178.1960 167 D 3.8220 8.0688 117.3855 56.1197 39.1590 176.8291 168 N 4.3794 8.2206 114.6546 53.8308 39.0978 176.2623 169 Y 4.4715 8.2004 118.0928 61.3582 37.7841 178.3453 170 L 3.9711 7.9368 118.8201 58.0436 42.4671 178.0200 171 N 4.4565 7.9848 116.4944 55.6684 38.7513 176.5135 172 Y 4.2616 8.8465 118.6045 61.8464 38.0566 178.3094 173 H 4.7274 8.4643 119.8733 59.1765 29.6643 176.6321 174 K 3.7593 7.9456 120.6448 59.2699 32.1861 177.6921 175 R 4.4992 7.6957 114.8780 55.8344 29.6998 176.5381 176 L 4.6379 7.3907 118.2139 54.2851 43.5636 177.9035 177 I 3.7623 8.1515 118.5858 63.8669 38.1651 176.4158 178 D 4.8770 7.9790 118.8008 53.9600 40.9699 177.3176 179 L 4.6916 7.6042 120.2018 54.9673 43.7837 179.0712 180 V 4.4551 7.9328 110.1929 62.0716 32.3706 175.6212 181 K 3.4358 7.8690 118.2456 57.4783 31.6142 176.1388 182 V 3.0231 8.4268 116.8479 63.3307 32.6619 174.7608 183 G 3.9841 8.4086 108.5028 49.0688 0.0000 174.2447 184 G 4.0392 7.5805 104.2623 43.7486 0.0000 172.0748 185 V 4.4271 9.2933 122.2206 60.2983 28.5101 172.6811 186 I 3.5969 8.0079 120.6152 60.8758 34.3998 173.0875 187 G 4.1175 7.8770 112.4249 44.4355 0.0000 170.5085 188 Y 4.5441 8.4388 125.8955 56.7129 38.5285 175.2546 189 D 4.8713 8.4962 125.0061 54.8677 42.3620 175.7427 190 N 4.7050 9.7054 119.8766 54.5409 36.5747 176.2537 191 T 4.3055 8.2441 103.9501 62.7624 68.2141 174.4329 192 L 4.4722 7.2756 118.9781 55.7270 43.5327 178.2877 193 W 4.3042 9.6863 125.7085 60.7277 28.9272 175.5568 194 N 3.7349 9.2576 130.0531 54.4742 39.4943 178.1614 195 G 3.7959 8.0662 100.6884 44.0133 0.0000 172.8665 196 S 4.1463 7.9379 119.5370 60.8042 63.7107 175.4029 197 V 4.0406 7.2832 122.1517 60.4337 30.5440 175.4301 198 V 3.8907 7.2059 119.6266 60.6971 33.1628 175.6694 199 A 3.9622 8.3370 123.5440 51.2786 18.6313 175.2810 200 P 4.4789 0.0000 0.0000 61.9040 31.6755 175.6959 201 P 4.1927 0.0000 0.0000 65.2836 31.2149 176.9417 202 D 4.5041 7.9887 116.3337 54.7899 40.7518 176.5382 203 A 4.5300 8.2250 124.8405 49.3174 18.2442 173.6477 204 P 4.4869 0.0000 0.0000 63.0269 29.9870 176.0060 205 L 4.5609 7.6117 121.1617 53.4100 42.9342 177.3203 206 R 4.2278 8.0809 118.9714 55.5820 31.5504 177.2089 207 K 4.1887 8.9695 120.8196 58.2983 31.6102 177.5566 208 Y 4.4949 9.5919 117.3563 60.6569 38.5379 179.1914 209 V 4.1132 6.8454 120.1418 64.7998 31.3284 178.2712 210 R 3.9789 7.9042 118.3563 59.4533 29.7286 176.9997 211 Y 4.2173 8.2770 120.2964 60.1038 38.7637 176.8280 212 Y 4.0575 9.0995 117.9891 60.9156 38.0423 178.8454 213 R 3.9140 8.0858 119.6766 59.9879 29.6516 177.6724 214 D 4.1365 7.4061 116.8703 57.6141 40.5013 179.3433 215 F 4.3576 7.3138 117.2168 60.1349 39.1703 177.7088 216 V 3.4843 7.6374 117.8604 66.2848 31.3294 177.8421 217 L 4.0196 8.1147 118.7342 57.9839 41.3254 179.4371 218 E 3.9076 7.7406 118.3120 58.8887 29.5659 178.1971 219 L 3.8444 9.2598 120.4155 58.3657 42.0524 178.7336 220 N 4.4514 8.6501 116.2443 56.4884 38.3858 177.4869 221 K 3.8680 7.8172 117.9726 58.9119 32.2605 178.0284 222 A 4.5344 7.6605 119.5986 53.1544 20.2754 178.2006 223 L 3.7442 8.6855 118.6643 57.0590 42.2194 177.2414 224 A 4.7585 7.6008 119.9540 52.1634 19.0803 177.1485 225 V 4.2731 7.8763 117.1828 63.4308 33.2827 175.1004 226 D 4.4539 8.0087 119.3130 53.9900 40.6687 174.5118 227 P 4.5279 0.0000 0.0000 64.0946 31.2214 177.0279 228 R 4.7427 8.4278 117.4205 55.9603 31.1609 175.5263 229 I 5.7658 7.4069 111.1816 59.9974 40.1547 174.3257 230 E 4.4900 9.1429 121.7167 55.7714 31.0311 176.8506 231 I 3.6400 7.8350 111.2005 60.0898 38.2897 172.4394 232 C 4.8786 7.7354 114.4018 59.1590 34.5553 172.6474 233 M 4.6553 9.0119 127.8575 54.9334 31.9396 176.1721 234 L 4.5654 8.2611 126.1693 51.2241 43.4530 177.6063 235 P 4.3933 0.0000 0.0000 62.0062 30.1309 176.8312 236 V 4.0633 7.6095 118.5839 63.1876 34.2992 175.7328 237 G 4.0804 9.6311 118.4338 46.5695 0.0000 173.2050 238 D 4.8001 9.3839 119.2962 53.3037 43.4202 173.9574 239 G 4.3041 8.6670 106.1037 46.0467 0.0000 173.9668 240 I 4.7254 8.0156 119.3828 60.9052 40.7075 173.8684 241 T 4.7411 8.7887 126.2176 62.8844 69.4557 174.0777 242 I 4.6566 8.7136 121.6307 59.9087 39.3461 174.9204 243 C 5.3490 8.7028 122.8414 57.8580 32.6554 172.6111 244 R 4.7562 8.1851 118.6899 54.6011 33.2823 173.7629 245 R 4.6063 8.9292 126.9255 56.9785 29.7365 175.0874 246 I 4.3162 8.6333 123.1667 62.2012 39.5037 176.8014 247 K 4.2242 7.8763 127.2812 54.1629 32.5292 177.2974 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 21 K 8.31 4.05 0.00 1.66 1.73 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 1.34 7.81 22 S 8.24 4.42 0.00 3.12 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 9.21 4.68 0.00 1.71 1.67 0.98 0.95 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 24 L 7.46 4.68 0.00 1.77 1.62 1.10 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 8.72 4.39 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.71 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 26 S 7.61 4.71 0.00 3.96 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 27 D 8.90 4.32 0.00 2.72 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 28 A 8.04 4.12 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 29 L 8.37 3.95 0.00 1.74 1.77 0.96 0.86 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 30 Y 7.89 3.99 0.00 3.06 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 31 Q 8.37 4.11 0.00 2.53 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.60 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 32 Y 8.26 4.13 0.00 3.11 3.16 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 0.00 33 I 7.62 3.49 1.72 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 1.50 1.26 0.78 0.00 0.00 34 L 7.70 4.18 0.00 1.73 1.39 1.36 1.07 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 35 E 7.58 3.72 0.00 1.97 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 2.57 2.37 0.00 36 T 7.21 4.30 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 1.19 0.00 0.00 37 S 7.19 4.22 0.00 3.64 3.86 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 38 V 5.82 3.68 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 0.74 0.00 0.00 1.31 0.00 0.00 39 F 8.78 3.88 0.00 3.01 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 40 P 0.00 4.21 0.00 2.06 2.06 0.00 4.01 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 41 R 8.80 3.76 0.00 1.94 1.98 0.00 3.30 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 42 E 8.77 4.68 0.00 1.93 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 2.09 2.31 0.00 *43 H 8.60 4.09 0.00 3.13 3.15 0.00 7.31 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.42 4.13 0.00 2.16 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 2.16 2.22 0.00 45 A 7.88 3.95 1.24 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 0.00 0.00 46 M 7.82 3.65 0.00 1.59 2.18 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.48 0.00 47 K 7.67 3.94 0.00 1.90 1.86 0.00 1.72 0.00 0.00 1.50 0.00 0.00 2.45 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.67 1.40 7.81 48 E 8.35 4.78 0.00 1.98 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 0.00 2.29 2.18 0.00 49 L 8.24 3.90 0.00 1.80 1.90 0.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.07 4.21 0.00 2.14 2.00 0.00 3.09 0.00 0.00 2.97 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.29 0.00 51 E 8.05 3.86 0.00 2.18 2.02 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 60 I 7.90 3.90 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.74 0.99 0.00 0.00 61 M 8.04 4.71 0.00 2.14 2.23 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 62 T 8.39 4.02 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 1.10 0.00 0.00 63 T 8.47 4.13 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 1.48 0.00 0.00 64 S 8.56 4.22 0.00 4.26 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 A 8.54 4.46 1.29 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 0.00 0.00 66 D 8.33 4.31 0.00 2.70 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 67 E 8.10 4.01 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 2.47 2.47 0.00 68 G 8.64 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 69 Q 8.43 3.92 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.67 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 70 F 7.77 4.10 0.00 3.08 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 71 L 7.88 3.61 0.00 1.81 1.49 0.43 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.64 3.94 0.00 3.92 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 73 M 7.82 3.95 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 74 L 6.96 3.71 0.00 1.06 1.35 0.79 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.66 3.77 0.00 1.61 1.41 -0.28 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 76 K 7.43 4.05 0.00 1.82 1.76 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.51 7.81 77 L 7.63 4.23 0.00 1.66 1.64 0.83 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 78 I 6.79 4.35 1.85 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 1.44 0.57 0.93 0.00 0.00 79 N 7.85 3.82 0.00 2.89 2.88 0.00 0.00 6.81 7.24 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 80 A 7.97 4.47 1.21 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 81 K 8.13 4.07 0.00 1.77 1.75 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.36 7.81 82 N 8.69 5.21 0.00 2.65 2.56 0.00 0.00 6.88 8.47 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 83 T 7.98 5.41 4.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 84 M 8.10 4.59 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.18 0.00 85 E 7.99 4.79 0.00 2.13 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.70 0.00 86 I 8.34 3.99 1.38 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.14 0.40 0.00 0.00 87 G 9.56 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.29 4.11 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 0.97 0.00 0.00 1.06 0.00 0.00 89 Y 8.92 3.67 0.00 3.13 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 90 T 9.46 3.42 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 1.14 0.00 0.00 91 G 8.15 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 92 Y 8.31 3.88 0.00 3.05 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 93 S 8.47 4.37 0.00 4.36 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 7.72 4.37 0.00 1.95 1.96 0.98 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.96 3.83 0.00 1.65 1.57 0.80 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 96 A 7.62 3.80 1.22 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 0.00 0.00 97 T 8.04 3.71 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 98 A 7.94 3.96 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.13 4.01 0.00 1.50 1.68 0.83 0.75 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 0.00 100 A 7.87 4.04 1.21 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 0.00 101 I 6.53 3.81 1.83 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 1.53 0.59 1.00 0.00 0.00 102 P 0.00 4.70 0.00 2.18 1.90 0.00 3.68 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.92 0.00 103 E 8.81 4.53 0.00 1.90 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 2.19 2.36 0.00 104 D 8.01 4.66 0.00 2.81 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 7.72 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.31 4.85 0.00 1.66 1.63 0.00 1.56 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.50 7.81 107 I 9.27 4.64 1.91 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 1.29 0.86 0.98 0.00 0.00 108 L 7.84 5.49 0.00 1.56 1.62 1.01 0.97 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 0.00 109 A 7.91 4.52 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 0.00 110 M 8.41 4.41 0.00 1.74 1.77 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.30 0.00 111 D 8.18 4.48 0.00 2.91 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 0.00 112 I 9.07 3.54 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 1.30 0.65 0.90 0.00 0.00 113 N 8.42 4.59 0.00 2.77 2.84 0.00 0.00 7.01 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 K 8.64 4.45 0.00 2.52 1.98 0.00 2.11 0.00 0.00 1.99 0.00 0.00 3.31 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.94 2.22 7.81 115 E 8.37 4.03 0.00 2.19 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 2.38 2.49 0.00 116 N 8.41 4.52 0.00 3.17 3.17 0.00 0.00 6.62 8.18 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 0.00 117 Y 7.56 4.38 0.00 2.62 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 0.00 118 E 7.75 3.35 0.00 2.08 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 2.01 2.39 0.00 119 L 8.49 4.09 0.00 1.70 1.80 0.92 1.02 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 0.00 120 G 7.39 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 0.00 121 L 7.37 3.73 0.00 1.28 1.49 0.72 0.61 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 0.00 122 P 0.00 4.22 0.00 2.14 2.05 0.00 3.55 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 123 V 7.07 4.22 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 0.95 0.00 0.00 0.89 0.00 0.00 124 I 7.37 4.53 1.93 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 1.25 0.57 0.92 0.00 0.00 125 K 8.49 4.11 0.00 1.97 1.76 0.00 1.50 0.00 0.00 1.52 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.40 7.81 126 K 7.71 3.83 0.00 1.89 1.81 0.00 1.82 0.00 0.00 1.88 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.37 7.81 127 A 7.97 4.24 1.24 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 0.00 0.00 128 G 7.72 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 V 8.48 3.30 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.92 0.00 0.00 130 D 7.97 4.67 0.00 2.88 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 0.00 131 H 8.09 4.81 0.00 3.30 3.43 0.00 5.49 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 K 7.41 4.30 0.00 1.64 1.85 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.38 1.03 7.81 133 I 7.83 4.00 1.96 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 1.27 0.50 0.92 0.00 0.00 134 D 9.47 4.69 0.00 2.79 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 F 8.42 4.87 0.00 2.66 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 0.00 136 R 6.58 4.38 0.00 1.50 1.36 0.00 3.23 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.60 0.00 137 E 8.84 4.37 0.00 1.81 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 0.00 2.15 2.25 0.00 138 G 8.25 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 0.00 0.00 0.00 139 P 0.00 4.10 0.00 2.03 2.03 0.00 3.63 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 140 A 8.58 4.49 1.29 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 0.00 0.00 141 L 8.00 3.91 0.00 1.64 1.64 0.70 0.99 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 0.00 142 P 0.00 4.63 0.00 2.18 2.06 0.00 3.93 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 143 V 7.16 3.65 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 0.79 0.00 0.00 0.96 0.00 0.00 144 L 7.73 4.29 0.00 2.06 1.86 0.76 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 145 D 8.15 4.51 0.00 2.85 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 0.00 146 E 7.89 3.93 0.00 2.19 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 2.53 2.41 0.00 147 M 7.86 4.38 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.68 0.00 148 I 7.17 3.92 1.99 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 1.74 0.87 0.90 0.00 0.00 149 K 7.72 4.37 0.00 1.86 1.78 0.00 1.89 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.48 1.66 7.81 150 D 7.86 4.30 0.00 2.71 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 0.00 151 E 8.83 3.83 0.00 1.98 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 2.24 1.93 0.00 152 K 7.16 4.43 0.00 1.72 1.76 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.46 7.81 153 N 7.80 4.79 0.00 2.77 2.91 0.00 0.00 7.12 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 H 7.44 5.28 0.00 3.18 3.32 0.00 5.81 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 G 8.78 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 0.00 0.00 0.00 0.00 156 S 7.89 4.28 0.00 3.92 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 0.00 157 Y 8.51 4.79 0.00 3.21 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 0.00 158 D 8.99 4.69 0.00 2.63 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 F 8.17 4.99 0.00 3.03 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 0.00 160 I 7.91 4.62 1.63 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.59 0.59 0.00 0.00 161 F 8.30 4.82 0.00 2.57 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 0.00 162 V 7.44 3.33 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.24 0.00 0.00 163 D 8.77 4.87 0.00 1.58 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 0.00 0.00 0.00 164 A 8.59 4.77 1.12 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 0.00 0.00 165 D 9.27 4.75 0.00 2.90 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 0.00 166 K 8.47 3.11 0.00 1.04 1.15 0.00 0.73 0.00 0.00 0.61 0.00 0.00 2.43 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.31 7.81 167 D 8.07 3.82 0.00 1.98 1.54 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 0.00 168 N 8.22 4.38 0.00 2.93 1.66 0.00 0.00 7.15 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 Y 8.20 4.47 0.00 2.99 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 0.00 170 L 7.94 3.97 0.00 1.62 1.68 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 171 N 7.98 4.46 0.00 2.57 2.58 0.00 0.00 7.13 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 8.85 4.26 0.00 3.05 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 0.00 173 H 8.46 4.73 0.00 3.37 3.56 0.00 5.84 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 0.00 174 K 7.95 3.76 0.00 1.76 1.80 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.16 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.43 7.81 175 R 7.70 4.50 0.00 1.82 1.90 0.00 3.30 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 1.58 1.52 0.00 176 L 7.39 4.64 0.00 1.78 1.63 0.69 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 177 I 8.15 3.76 1.88 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 1.30 1.40 0.85 0.00 0.00 178 D 7.98 4.88 0.00 2.61 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 0.00 179 L 7.60 4.69 0.00 1.49 1.45 0.96 0.81 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 0.00 180 V 7.93 4.46 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 0.84 0.00 0.00 0.98 0.00 0.00 181 K 7.87 3.44 0.00 2.02 1.79 0.00 1.89 0.00 0.00 1.66 0.00 0.00 3.29 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.41 1.73 7.81 182 V 8.43 3.02 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 0.76 0.00 0.00 0.95 0.00 0.00 183 G 8.41 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 0.00 184 G 7.58 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 0.00 0.00 0.00 185 V 9.29 4.43 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 0.75 0.00 0.00 1.28 0.00 0.00 186 I 8.01 3.60 1.81 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 0.80 0.28 0.00 0.00 187 G 7.88 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 0.00 0.00 0.00 188 Y 8.44 4.54 0.00 3.02 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 0.00 189 D 8.50 4.87 0.00 2.61 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 0.00 190 N 9.71 4.70 0.00 3.08 3.36 0.00 0.00 6.95 6.93 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 0.00 191 T 8.24 4.31 4.59 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 1.45 0.00 0.00 192 L 7.28 4.47 0.00 2.05 1.76 0.96 0.92 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 0.00 193 W 9.69 4.30 0.00 3.33 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 N 9.26 3.73 0.00 2.28 1.69 0.00 0.00 7.03 8.49 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 0.00 195 G 8.07 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 0.00 196 S 7.94 4.15 0.00 4.04 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 0.00 197 V 7.28 4.04 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 0.81 0.00 0.00 0.93 0.00 0.00 198 V 7.21 3.89 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 0.75 0.00 0.00 0.91 0.00 0.00 199 A 8.34 3.96 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 P 0.00 4.48 0.00 2.45 2.03 0.00 3.62 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 2.10 2.10 0.00 201 P 0.00 4.19 0.00 2.03 2.12 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 202 D 7.99 4.50 0.00 2.66 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 A 8.22 4.53 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 0.00 204 P 0.00 4.49 0.00 2.04 2.06 0.00 3.66 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 2.03 2.09 0.00 205 L 7.61 4.56 0.00 1.68 1.61 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 206 R 8.08 4.23 0.00 1.86 2.18 0.00 3.42 0.00 0.00 3.47 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.65 0.00 207 K 8.97 4.19 0.00 2.02 1.87 0.00 1.71 0.00 0.00 1.93 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.66 7.81 208 Y 9.59 4.49 0.00 3.70 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 0.00 209 V 6.85 4.11 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 0.68 0.00 0.00 0.62 0.00 0.00 210 R 7.90 3.98 0.00 1.93 2.28 0.00 3.29 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 211 Y 8.28 4.22 0.00 3.08 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 Y 9.10 4.06 0.00 2.76 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 0.00 0.00 0.00 213 R 8.09 3.91 0.00 2.14 2.12 0.00 3.08 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 214 D 7.41 4.14 0.00 1.97 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 0.00 0.00 0.00 215 F 7.31 4.36 0.00 3.03 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 0.00 216 V 7.64 3.48 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 1.03 0.00 0.00 0.66 0.00 0.00 217 L 8.11 4.02 0.00 1.77 1.69 0.88 0.92 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 0.00 218 E 7.74 3.91 0.00 2.02 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 2.32 2.31 0.00 219 L 9.26 3.84 0.00 1.75 1.82 0.88 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 220 N 8.65 4.45 0.00 2.71 2.85 0.00 0.00 7.11 6.82 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 0.00 221 K 7.82 3.87 0.00 1.98 1.89 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.61 7.81 222 A 7.66 4.53 1.29 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 0.00 0.00 223 L 8.69 3.74 0.00 1.47 1.65 0.58 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 224 A 7.60 4.76 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 V 7.88 4.27 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 0.80 0.00 0.00 0.98 0.00 0.00 226 D 8.01 4.45 0.00 2.86 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 0.00 227 P 0.00 4.53 0.00 2.09 2.09 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 228 R 8.43 4.74 0.00 2.06 1.94 0.00 3.11 0.00 0.00 3.22 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 229 I 7.41 5.77 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.95 1.03 0.00 0.00 230 E 9.14 4.49 0.00 1.91 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 2.27 2.32 0.00 231 I 7.84 3.64 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.88 1.04 0.00 0.00 232 C 7.74 4.88 0.00 3.05 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 0.00 233 M 9.01 4.66 0.00 1.98 2.06 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 2.64 2.62 0.00 234 L 8.26 4.57 0.00 1.28 1.32 0.60 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 235 P 0.00 4.39 0.00 2.20 2.15 0.00 3.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 236 V 7.61 4.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.49 0.00 0.00 237 G 9.63 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 D 9.38 4.80 0.00 2.78 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 0.00 239 G 8.67 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 I 8.02 4.73 1.95 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 1.68 1.08 1.17 0.00 0.00 241 T 8.79 4.74 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 1.31 0.00 0.00 242 I 8.71 4.66 2.04 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.98 1.20 0.00 0.00 243 C 8.70 5.35 0.00 2.93 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 0.00 244 R 8.19 4.76 0.00 1.88 1.75 0.00 3.21 0.00 0.00 3.52 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 245 R 8.93 4.61 0.00 1.95 2.07 0.00 3.49 0.00 0.00 3.30 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 246 I 8.63 4.32 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.82 0.98 0.00 0.00 247 K 7.88 4.22 0.00 1.75 1.55 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.23 0.95 7.81 * Residues marked with a * may have inaccurate shift predictions.