NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.3557 8.3193 115.2791 57.7557 63.3894 173.3334 5 P 4.2286 0.0000 0.0000 62.2792 31.6172 175.9839 6 G 3.6547 7.7682 107.3669 45.5526 0.0000 173.9436 7 V 3.6982 7.6278 120.4344 62.6349 32.2227 176.5129 8 V 4.5174 8.3235 128.7841 62.0502 32.5935 175.0332 9 I 4.4989 8.4181 129.3192 59.1961 38.8703 175.9484 10 S 4.3773 8.5585 121.9968 57.9318 63.5746 175.1896 11 D 4.4875 8.5275 120.6147 57.1539 40.6441 177.2348 12 D 4.5580 7.4967 117.1025 54.3258 40.9512 175.5100 13 E 4.4142 7.9399 121.9769 53.8901 29.9888 173.9137 14 P 4.3827 0.0000 0.0000 64.0661 32.0379 175.9592 15 G 3.7696 8.0605 104.0458 44.1273 0.0000 172.6923 16 Y 4.3544 8.7615 117.1645 57.1824 38.7648 175.5547 17 D 4.7382 8.8159 123.0812 54.2477 42.2599 177.3113 18 L 4.1823 8.7267 125.6454 57.8936 41.8211 178.4479 19 D 4.7058 8.2920 115.7741 54.3315 39.5028 176.9056 20 L 4.1284 7.8270 119.5473 55.7833 42.1218 176.0586 21 F 4.6574 7.8925 117.8404 55.9432 42.6340 173.9729 22 C 4.7500 8.8432 118.6799 54.2254 40.1915 172.6677 23 I 4.9702 8.0885 125.3626 57.4313 40.4782 173.8520 24 P 4.2739 0.0000 0.0000 62.8433 32.0207 177.0052 25 N 4.3056 8.9794 120.5685 56.8266 38.5295 176.6065 26 H 4.3624 7.8111 110.4144 57.3874 28.7172 175.0641 27 Y 5.7226 8.2482 116.7970 57.0596 38.6341 176.9453 28 A 4.0746 8.1608 124.8191 55.2354 18.3216 178.8696 29 E 4.5213 8.1551 110.9723 56.6709 30.5644 176.2310 30 D 4.8965 8.3449 118.9589 54.5274 41.4400 175.8261 31 L 5.1395 7.5344 118.0277 53.1274 45.5981 175.8367 32 E 4.4359 9.2516 120.7430 58.2521 30.1206 176.6751 33 R 4.8168 7.5530 115.8208 54.8839 35.5970 173.5694 34 V 4.2178 8.7553 121.4100 62.3922 32.0602 176.2014 35 F 4.2408 8.9625 130.4899 60.1055 40.6549 175.4872 36 I 4.3129 8.1571 120.4890 58.6131 40.6310 173.6062 37 P 4.2065 0.0000 0.0000 62.4406 32.1988 176.9627 38 H 3.9842 9.5867 121.9629 59.7729 29.6334 177.7339 39 G 3.7234 8.2158 106.5859 47.7547 0.0000 175.2068 40 L 4.0986 7.8624 122.5041 57.8731 41.9968 179.0886 41 I 3.9046 7.4919 119.4328 64.5695 36.9610 178.0057 42 M 4.2061 7.9286 119.3967 58.6350 31.7369 178.4033 43 D 4.2891 8.1389 118.8331 57.4919 40.9820 179.0848 44 R 3.7682 8.1094 118.9126 59.7867 30.0748 178.6987 45 T 3.9677 8.2893 115.8563 66.4743 68.3379 176.2368 46 E 2.8792 7.8520 121.6792 58.8855 29.4384 178.9273 47 R 3.8413 7.5740 118.8263 59.2475 30.0804 178.4211 48 L 3.9627 8.0509 118.8254 57.6059 41.6187 179.2065 49 A 3.9040 8.0351 120.7080 55.2459 18.3416 179.8918 50 R 3.8465 7.6985 115.9913 59.5858 30.2928 179.0078 51 D 4.4433 8.2952 118.8426 57.2999 40.7659 179.1021 52 V 2.9648 7.8653 118.9880 66.1947 31.4797 178.0341 53 M 4.0579 7.9773 118.3577 58.1631 31.5080 178.7241 54 K 3.9324 7.9766 118.9812 59.4691 32.5272 178.2588 55 E 4.3785 8.0960 116.5690 57.7684 30.1143 177.5279 56 M 4.8492 8.4002 117.1107 54.6645 33.1049 177.1824 57 G 3.8564 8.3445 108.5994 46.9322 0.0000 175.2769 58 G 3.6695 7.6349 108.0987 48.2578 0.0000 173.0011 59 H 5.0178 7.6024 113.8265 53.0405 32.9197 172.2236 60 H 4.2148 8.7658 119.8855 57.2214 30.6642 173.6626 61 I 4.9091 8.5035 125.9593 59.8770 39.6284 174.5392 62 V 4.7065 8.7208 126.6107 61.0406 33.8530 174.3401 63 A 4.6370 9.1417 131.6408 51.2703 19.7963 176.2163 64 L 4.5000 9.0155 124.4827 54.1838 42.3615 174.9961 65 C 4.2870 8.2913 122.5636 58.2860 29.4785 173.3141 66 V 4.3186 8.3108 125.5117 61.7869 31.2413 175.6059 67 L 4.4796 8.8908 129.8574 54.8017 41.7903 177.5526 68 K 4.6339 9.2427 121.5801 55.8494 33.9401 175.8533 69 G 3.8771 8.4531 112.6229 45.5609 0.0000 174.8985 70 G 4.0482 7.8451 107.7140 43.8518 0.0000 172.3916 71 Y 4.8306 7.3103 113.2126 55.5550 40.0219 177.5084 72 K 3.3834 7.0957 120.4837 59.4764 31.7999 178.3804 73 F 4.5732 7.4223 121.1443 60.8051 39.3664 176.8365 74 F 4.3227 7.5658 116.6077 60.6645 38.7433 177.3310 75 A 4.1420 8.4335 120.3555 55.3376 18.2553 179.4834 76 D 4.2857 8.5656 117.7913 57.3425 40.9433 178.6714 77 L 3.9905 8.0014 121.0252 58.3665 42.0111 179.0999 78 L 3.9916 8.0061 118.7824 57.7777 41.5046 179.3169 79 D 4.2992 8.4393 119.2722 57.6149 40.8750 178.4633 80 Y 4.1758 8.0586 117.2146 60.9215 37.8108 178.4203 81 I 3.7247 8.0366 120.8638 64.4354 37.3795 178.6006 82 K 3.9368 8.3182 119.1659 59.4915 31.6698 179.2770 83 A 4.0478 7.9096 119.8545 54.8389 18.6115 179.3102 84 L 4.0849 7.7671 118.6509 58.4397 42.3241 178.5732 85 N 4.5928 8.2989 115.0200 54.8928 38.2090 177.1266 86 R 3.9869 7.6273 120.0234 58.7435 30.2320 176.4229 87 N 4.7639 7.6811 113.6199 52.7943 37.6454 175.2894 88 S 4.3390 7.6322 114.8371 58.0454 63.6830 175.3559 89 D 4.5166 8.7117 123.0531 56.2109 40.9741 176.4232 90 R 4.6323 6.9971 118.0248 53.8022 32.5470 175.2715 91 S 4.1137 8.6337 120.4057 58.7650 63.1466 173.7617 92 I 4.2615 8.1678 126.9999 58.8097 37.6630 173.7829 93 P 4.4751 0.0000 0.0000 62.7485 32.2086 175.2451 94 M 4.8903 8.0693 118.6783 54.6571 35.6059 173.6205 95 T 4.6672 8.9126 121.4572 61.6810 71.8034 173.2842 96 V 4.5590 8.3886 125.3443 61.2921 33.4590 174.1825 97 D 5.0146 8.8443 127.8770 52.3428 44.7802 174.9661 98 F 5.1327 8.7808 119.6397 55.6424 41.5898 174.5858 99 I 5.1825 8.7036 116.1278 58.1147 41.3617 174.3470 100 R 5.0574 8.4622 120.0181 54.4740 34.0398 174.8143 101 L 5.2184 8.4044 122.0930 52.5589 45.1620 176.1916 *113 I 4.0134 7.8284 116.9561 59.7610 36.7430 173.6615 114 K 4.6500 8.0719 118.3540 55.6287 34.7685 175.1381 115 V 4.4282 8.1751 124.4162 61.1555 32.6838 175.2443 116 I 4.2094 8.1716 128.8146 60.2228 38.6029 175.1741 *121 L 4.3010 8.1781 125.4758 54.0146 41.0182 172.8078 122 S 4.1828 7.9527 119.5489 58.1767 61.2261 175.0585 123 T 4.5296 7.5937 122.2660 60.7781 68.9827 176.2111 124 L 4.1498 7.4389 116.6544 57.3127 40.6598 177.0375 125 T 4.1615 7.6632 116.5866 65.5407 68.6976 174.6344 126 G 3.8904 8.5132 113.3998 46.2794 0.0000 173.0647 127 K 4.7290 7.5452 117.1005 54.2137 37.2675 174.9671 128 N 5.1331 9.0532 119.6452 52.4153 39.8894 174.5957 129 V 4.4826 8.8441 125.6778 61.4498 33.5729 174.2724 130 L 5.0363 8.9133 131.0115 53.4574 43.9821 175.0348 131 I 4.5630 9.0079 129.0042 60.7326 38.7384 175.2404 132 V 5.1522 8.9560 127.1644 61.3021 33.7019 174.1857 133 E 5.3666 9.6364 126.1075 55.1396 33.9068 176.3773 134 D 4.2936 9.0712 121.8658 56.9028 42.2583 176.3756 135 I 4.9720 7.4903 117.0520 58.8290 40.7437 174.6410 136 I 4.2250 8.7084 130.8676 60.8818 38.5011 175.5758 137 D 4.7543 8.7196 129.1374 51.7689 41.6455 176.0868 138 T 4.1151 8.4038 109.5655 62.2143 70.1741 174.8419 139 G 3.7034 8.7323 110.6457 48.5556 0.0000 176.8578 140 K 4.0523 8.0219 125.6561 59.8011 31.7503 181.2967 141 T 4.0846 7.7967 116.1459 66.9036 68.4015 176.9068 142 M 3.9141 7.9557 120.6817 58.1396 31.8164 178.6331 143 Q 3.8614 8.6088 120.1054 59.4460 29.2606 178.3987 144 T 3.8241 7.9323 116.7476 66.5709 68.4329 176.3981 145 L 3.9586 7.9316 122.1866 58.1011 42.1326 178.9957 146 L 3.9589 7.9837 119.0291 57.6933 41.2917 179.4491 147 S 4.0642 7.9887 112.2118 61.3067 62.6309 175.8234 148 L 4.0633 7.9603 121.6460 57.9278 41.4008 179.7598 149 V 3.8537 8.0145 118.1480 66.1310 31.5569 178.0793 150 R 4.1420 8.1756 117.0296 58.4104 29.6596 178.3936 151 Q 4.0989 7.6369 116.6676 57.6209 28.7430 176.6580 152 Y 4.4934 7.6064 116.6037 56.5513 39.3545 174.8116 153 N 4.1769 8.0551 117.4079 53.7347 36.4494 172.1940 154 P 4.7590 0.0000 0.0000 62.7923 32.9747 177.5959 155 K 4.3226 8.7924 124.1068 58.6056 32.0825 177.8900 156 M 4.7510 7.6631 115.3856 54.3170 34.5213 174.0690 157 V 4.9145 8.3287 118.9315 61.3954 34.3826 174.5228 158 K 5.0777 9.3501 126.8765 54.5994 36.5237 175.2303 159 V 5.1215 9.5064 122.0309 61.1742 34.7111 174.0799 160 A 5.6312 9.5439 129.2285 50.3523 22.1630 174.8101 161 S 5.6810 9.2946 116.4846 55.4419 65.7043 174.2242 162 L 3.6065 8.3769 129.2807 57.5888 42.7461 176.3588 163 L 5.4011 8.3064 118.2134 52.8331 45.7152 175.8230 164 V 4.6146 8.5818 121.0436 61.2954 34.6321 174.1368 165 K 4.8928 8.7177 127.2421 55.1044 33.6704 177.7840 166 R 4.3444 8.4745 125.2856 55.1285 28.0856 175.9274 167 T 4.0246 7.8421 116.0656 60.8883 68.4023 172.8053 168 P 4.3810 0.0000 0.0000 65.5633 32.0439 178.4788 169 R 4.2780 7.3124 118.3533 55.4848 30.4279 181.5808 170 S 4.2741 8.5579 109.5754 59.9728 63.2798 174.2072 171 V 3.5763 8.2203 121.1266 62.7342 31.2584 176.2592 172 G 3.9182 8.4195 116.6846 44.8771 0.0000 171.7676 173 Y 4.2634 8.3507 119.9025 57.3867 39.2118 175.6013 174 K 4.1118 6.9315 124.5925 53.6273 31.8856 174.6472 175 P 4.4663 0.0000 0.0000 62.4227 32.0241 176.7829 176 D 4.2877 8.4631 120.6993 56.4596 41.6066 177.0703 177 F 4.8596 8.0704 116.7576 55.5475 42.7229 174.1700 178 V 4.5817 8.4541 123.2959 61.1838 34.1687 175.5768 179 G 3.7485 9.3656 116.9308 48.3060 0.0000 172.7167 180 F 5.4207 9.4681 119.1858 54.7779 43.9724 172.9792 181 E 5.0544 9.5306 124.7665 54.7944 31.0288 174.7096 182 I 5.1356 8.8828 121.1400 58.1127 41.2536 173.3051 183 P 4.7699 0.0000 0.0000 62.1840 32.4303 176.7509 184 D 4.6635 8.2754 120.2819 53.2983 38.3257 175.0604 185 K 4.4523 7.5172 119.5700 53.8708 35.5269 176.6781 186 F 4.2598 8.4216 124.1030 58.0274 39.2624 174.2678 187 V 4.8380 8.0085 118.5439 59.7604 34.0666 175.3785 188 V 4.5201 8.7597 115.9296 60.0281 36.8433 175.4965 189 G 4.4792 8.7712 107.0258 47.5540 0.0000 171.2426 190 Y 3.8163 9.0707 120.5001 57.8170 38.9439 171.0636 191 A 4.3668 7.5737 120.6206 51.8104 20.4378 176.4882 192 L 4.6743 7.7758 120.5908 54.2411 42.3426 176.2220 193 D 5.0880 8.2040 121.6863 52.7621 40.3950 176.3818 194 Y 4.8028 8.7288 120.8176 56.5373 40.0600 174.7641 195 N 3.7366 9.7151 126.7412 54.7259 37.4563 174.4915 196 E 3.8181 8.6911 112.5020 56.4076 27.9948 174.1744 197 Y 4.1261 7.9197 117.5843 57.4900 40.0283 176.4085 198 F 3.8501 8.7361 118.0294 58.0916 37.1265 177.7268 199 R 4.0533 7.9945 121.0363 58.9367 29.9967 177.1936 200 D 4.5690 8.1746 114.8283 53.7505 40.2119 175.6953 201 L 4.5133 7.8772 123.7321 54.3685 42.1942 176.8851 202 N 4.5723 8.7842 124.2456 55.7347 39.2765 175.1506 203 H 4.8272 7.8565 114.8330 54.5568 31.4242 174.3360 204 V 4.4756 8.4716 123.5333 63.0084 32.6254 174.8226 205 C 5.5368 9.1692 125.9086 53.7054 43.4359 169.5124 206 V 4.2973 8.3251 119.1872 62.8368 32.1881 175.5690 207 I 4.2263 8.0428 128.8354 60.8899 38.7726 175.1171 208 S 4.6214 8.3711 121.8793 56.8072 65.3874 175.0497 209 E 3.8137 8.6339 119.6430 59.6161 28.9763 179.8173 210 T 3.8746 7.8304 115.5543 66.6539 68.6026 176.7532 211 G 3.5585 8.0948 107.5688 47.5038 0.0000 175.5201 212 K 3.6178 7.9512 121.1940 59.1607 32.2955 178.5345 213 A 4.1139 7.9497 120.8741 54.9802 18.2013 179.3467 214 K 3.5227 7.8309 117.5495 59.4422 32.1427 177.1098 215 Y 4.4619 7.6262 115.4090 57.9392 37.9692 176.6287 216 K 4.1535 7.8949 121.5230 53.6634 32.3678 181.0137 217 A 4.2390 8.4738 124.1187 52.1008 18.2432 177.4713 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 4 S 8.32 4.36 0.00 3.81 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 5 P 0.00 4.23 0.00 2.27 2.09 0.00 3.82 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.99 0.00 6 G 7.77 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 7 V 7.63 3.70 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 0.93 0.00 0.00 0.60 0.00 0.00 8 V 8.32 4.52 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 0.92 0.00 0.00 0.97 0.00 0.00 9 I 8.42 4.50 1.93 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.85 0.54 0.00 0.00 10 S 8.56 4.38 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.53 4.49 0.00 2.70 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 12 D 7.50 4.56 0.00 2.51 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 13 E 7.94 4.41 0.00 1.81 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 1.87 1.89 0.00 14 P 0.00 4.38 0.00 2.24 2.17 0.00 3.72 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 15 G 8.06 3.77 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 0.00 0.00 0.00 16 Y 8.76 4.35 0.00 3.12 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.82 4.74 0.00 2.76 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 18 L 8.73 4.18 0.00 1.82 1.80 1.02 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.29 4.71 0.00 2.83 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.83 4.13 0.00 1.96 1.34 1.11 0.67 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 21 F 7.89 4.66 0.00 2.91 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 22 C 8.84 4.75 0.00 2.73 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 23 I 8.09 4.97 1.99 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 1.56 1.48 1.12 0.00 0.00 24 P 0.00 4.27 0.00 1.95 1.72 0.00 3.94 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.22 0.00 25 N 8.98 4.31 0.00 2.69 2.87 0.00 0.00 6.89 8.16 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 26 H 7.81 4.36 0.00 3.06 3.35 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 8.25 5.72 0.00 3.37 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.16 4.07 1.38 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 29 E 8.16 4.52 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 30 D 8.34 4.90 0.00 3.30 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 31 L 7.53 5.14 0.00 1.63 1.58 1.02 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 32 E 9.25 4.44 0.00 1.87 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 2.35 2.36 0.00 33 R 7.55 4.82 0.00 1.78 2.01 0.00 3.35 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 34 V 8.76 4.22 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 0.50 0.00 0.00 0.83 0.00 0.00 35 F 8.96 4.24 0.00 2.92 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 36 I 8.16 4.31 1.48 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.45 0.01 0.00 0.00 37 P 0.00 4.21 0.00 2.04 1.57 0.00 3.53 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.15 0.00 38 H 9.59 3.98 0.00 3.17 3.36 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 G 8.22 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 40 L 7.86 4.10 0.00 1.83 1.84 1.01 1.20 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 41 I 7.49 3.90 1.62 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.36 0.33 0.00 0.00 42 M 7.93 4.21 0.00 2.28 2.34 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.76 0.00 43 D 8.14 4.29 0.00 2.90 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.11 3.77 0.00 1.78 2.07 0.00 2.95 0.00 0.00 2.80 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.48 0.00 45 T 8.29 3.97 4.52 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 1.41 0.00 0.00 46 E 7.85 2.88 0.00 1.16 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.94 0.00 47 R 7.57 3.84 0.00 1.83 1.99 0.00 3.16 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.82 0.00 48 L 8.05 3.96 0.00 1.92 1.73 1.17 0.97 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 49 A 8.04 3.90 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 50 R 7.70 3.85 0.00 1.99 1.98 0.00 3.10 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 51 D 8.30 4.44 0.00 2.93 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 52 V 7.87 2.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 -0.16 0.00 0.00 53 M 7.98 4.06 0.00 2.07 2.08 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 2.71 2.78 0.00 54 K 7.98 3.93 0.00 1.87 2.01 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.50 7.81 55 E 8.10 4.38 0.00 2.29 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 0.00 2.39 2.57 0.00 56 M 8.40 4.85 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.63 0.00 57 G 8.34 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 0.00 0.00 0.00 58 G 7.63 3.67 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 0.00 0.00 0.00 0.00 59 H 7.60 5.02 0.00 3.13 3.20 0.00 5.72 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 H 8.77 4.21 0.00 3.24 3.15 0.00 5.67 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 I 8.50 4.91 1.87 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 1.28 0.84 0.92 0.00 0.00 62 V 8.72 4.71 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 0.92 0.00 0.00 0.83 0.00 0.00 63 A 9.14 4.64 1.08 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 64 L 9.02 4.50 0.00 1.65 1.56 0.81 0.72 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 65 C 8.29 4.29 0.00 1.90 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.31 4.32 2.21 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 0.85 0.00 0.00 1.01 0.00 0.00 67 L 8.89 4.48 0.00 1.67 1.76 1.01 1.21 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 68 K 9.24 4.63 0.00 1.78 1.81 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.72 7.81 69 G 8.45 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 7.85 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 0.00 0.00 0.00 71 Y 7.31 4.83 0.00 3.25 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 7.10 3.38 0.00 0.79 0.79 0.00 1.49 0.00 0.00 1.53 0.00 0.00 2.81 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.41 1.01 7.81 73 F 7.42 4.57 0.00 3.13 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 74 F 7.57 4.32 0.00 3.50 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.43 4.14 1.55 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 0.00 0.00 76 D 8.57 4.29 0.00 3.01 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.00 3.99 0.00 1.12 1.39 0.86 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.01 3.99 0.00 1.83 1.71 0.90 0.89 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 79 D 8.44 4.30 0.00 2.69 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 80 Y 8.06 4.18 0.00 3.26 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 81 I 8.04 3.72 2.02 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.76 0.89 0.00 0.00 82 K 8.32 3.94 0.00 1.92 1.85 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.75 7.81 83 A 7.91 4.05 1.40 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 84 L 7.77 4.08 0.00 2.12 1.77 0.95 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 85 N 8.30 4.59 0.00 2.77 2.83 0.00 0.00 6.73 7.18 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 86 R 7.63 3.99 0.00 2.07 2.12 0.00 3.25 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 87 N 7.68 4.76 0.00 2.80 2.83 0.00 0.00 7.04 6.85 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 88 S 7.63 4.34 0.00 3.98 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 89 D 8.71 4.52 0.00 2.69 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 90 R 7.00 4.63 0.00 1.81 1.75 0.00 3.26 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 91 S 8.63 4.11 0.00 3.89 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 92 I 8.17 4.26 1.85 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 1.45 0.73 0.87 0.00 0.00 93 P 0.00 4.48 0.00 1.98 1.98 0.00 3.70 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 1.79 1.89 0.00 94 M 8.07 4.89 0.00 1.96 1.86 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.54 0.00 95 T 8.91 4.67 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 1.21 0.00 0.00 96 V 8.39 4.56 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 0.51 0.00 0.00 0.87 0.00 0.00 97 D 8.84 5.01 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.69 0.93 0.00 0.00 *121 L 8.18 4.30 0.00 1.69 1.55 0.92 0.91 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 0.00 122 S 7.95 4.18 0.00 2.79 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 0.00 123 T 7.59 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 1.20 0.00 0.00 124 L 7.44 4.15 0.00 1.69 1.67 0.98 0.59 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 0.00 125 T 7.66 4.16 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 1.29 0.00 0.00 126 G 8.51 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 0.00 127 K 7.55 4.73 0.00 1.75 1.79 0.00 1.50 0.00 0.00 1.48 0.00 0.00 2.72 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.57 7.81 128 N 9.05 5.13 0.00 2.68 2.81 0.00 0.00 6.97 8.27 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 0.00 129 V 8.84 4.48 2.11 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 0.99 0.00 0.00 0.93 0.00 0.00 130 L 8.91 5.04 0.00 1.76 1.49 1.06 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 131 I 9.01 4.56 1.94 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 1.12 0.43 0.95 0.00 0.00 132 V 8.96 5.15 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 1.38 0.00 0.00 0.95 0.00 0.00 133 E 9.64 5.37 0.00 2.06 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 2.38 2.40 0.00 134 D 9.07 4.29 0.00 2.60 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 I 7.49 4.97 1.84 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 1.20 0.75 0.91 0.00 0.00 136 I 8.71 4.22 1.98 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 1.17 1.35 0.98 0.00 0.00 137 D 8.72 4.75 0.00 2.81 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 8.40 4.12 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 1.22 0.00 0.00 139 G 8.73 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.02 4.05 0.00 1.77 1.83 0.00 1.80 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 7.81 141 T 7.80 4.08 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 142 M 7.96 3.91 0.00 1.14 1.89 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.95 0.00 143 Q 8.61 3.86 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 144 T 7.93 3.82 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 1.20 0.00 0.00 145 L 7.93 3.96 0.00 1.74 1.75 0.93 0.48 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 0.00 146 L 7.98 3.96 0.00 1.86 1.69 0.83 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 147 S 7.99 4.06 0.00 3.84 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 0.00 148 L 7.96 4.06 0.00 1.91 1.73 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 149 V 8.01 3.85 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 1.11 0.00 0.00 1.04 0.00 0.00 150 R 8.18 4.14 0.00 2.03 1.96 0.00 3.18 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.91 0.00 151 Q 7.64 4.10 0.00 1.68 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.91 0.00 0.00 0.00 0.00 0.00 2.53 2.38 0.00 152 Y 7.61 4.49 0.00 3.09 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 0.00 153 N 8.06 4.18 0.00 3.00 2.86 0.00 0.00 6.74 8.04 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 0.00 154 P 0.00 4.76 0.00 2.36 2.09 0.00 3.81 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 155 K 8.79 4.32 0.00 1.54 1.77 0.00 1.85 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.27 7.81 156 M 7.66 4.75 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.91 0.00 157 V 8.33 4.91 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 0.88 0.00 0.00 0.97 0.00 0.00 158 K 9.35 5.08 0.00 1.91 1.96 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.71 7.81 159 V 9.51 5.12 2.43 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 1.18 0.00 0.00 1.05 0.00 0.00 160 A 9.54 5.63 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 S 9.29 5.68 0.00 3.99 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 L 8.38 3.61 0.00 0.27 1.25 0.90 0.50 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 0.00 163 L 8.31 5.40 0.00 1.60 1.50 0.86 0.56 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 0.00 164 V 8.58 4.61 2.11 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 0.87 0.00 0.00 0.96 0.00 0.00 165 K 8.72 4.89 0.00 1.66 1.69 0.00 1.72 0.00 0.00 1.79 0.00 0.00 2.75 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.41 7.81 166 R 8.47 4.34 0.00 1.70 1.89 0.00 3.18 0.00 0.00 3.16 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 167 T 7.84 4.02 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 0.00 168 P 0.00 4.38 0.00 2.21 2.16 0.00 3.86 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 1.98 1.95 0.00 169 R 7.31 4.28 0.00 1.82 1.80 0.00 3.29 0.00 0.00 3.27 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.44 0.00 170 S 8.56 4.27 0.00 3.98 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 0.00 171 V 8.22 3.58 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.93 0.00 0.00 172 G 8.42 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 Y 8.35 4.26 0.00 2.88 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 0.00 174 K 6.93 4.11 0.00 1.38 1.48 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.21 1.24 7.81 175 P 0.00 4.47 0.00 2.07 2.13 0.00 3.58 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 2.10 2.31 0.00 176 D 8.46 4.29 0.00 2.37 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 0.00 0.00 0.00 177 F 8.07 4.86 0.00 3.09 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 0.00 178 V 8.45 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 1.07 0.00 0.00 0.93 0.00 0.00 179 G 9.37 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 F 9.47 5.42 0.00 2.86 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 0.00 181 E 9.53 5.05 0.00 2.16 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 2.25 2.25 0.00 182 I 8.88 5.14 2.05 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 1.47 0.62 1.10 0.00 0.00 183 P 0.00 4.77 0.00 2.09 2.38 0.00 4.11 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.21 0.00 184 D 8.28 4.66 0.00 2.69 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 0.00 185 K 7.52 4.45 0.00 1.33 1.39 0.00 1.23 0.00 0.00 1.34 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.20 1.19 7.81 186 F 8.42 4.26 0.00 3.02 2.67 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 0.00 187 V 8.01 4.84 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 0.46 0.00 0.00 0.80 0.00 0.00 188 V 8.76 4.52 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 0.66 0.00 0.00 -0.14 0.00 0.00 189 G 8.77 4.48 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 0.00 0.00 0.00 190 Y 9.07 3.82 0.00 3.22 2.94 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 0.00 191 A 7.57 4.37 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 L 7.78 4.67 0.00 1.78 1.55 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 193 D 8.20 5.09 0.00 2.98 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 0.00 194 Y 8.73 4.80 0.00 3.32 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 0.00 195 N 9.72 3.74 0.00 2.41 2.77 0.00 0.00 7.34 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 0.00 196 E 8.69 3.82 0.00 1.92 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 2.15 2.32 0.00 197 Y 7.92 4.13 0.00 2.75 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 0.00 0.00 0.00 198 F 8.74 3.85 0.00 3.34 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 0.00 199 R 7.99 4.05 0.00 1.83 2.02 0.00 3.19 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 200 D 8.17 4.57 0.00 2.89 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 0.00 201 L 7.88 4.51 0.00 2.05 1.97 1.09 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 202 N 8.78 4.57 0.00 2.60 2.76 0.00 0.00 7.15 8.16 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 0.00 203 H 7.86 4.83 0.00 3.12 3.21 0.00 5.80 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 V 8.47 4.48 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.81 0.00 0.00 205 C 9.17 5.54 0.00 2.47 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 0.00 206 V 8.33 4.30 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 0.71 0.00 0.00 0.64 0.00 0.00 207 I 8.04 4.23 1.38 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.71 0.00 0.00 0.00 208 S 8.37 4.62 0.00 3.96 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 E 8.63 3.81 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 210 T 7.83 3.87 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 1.15 0.00 0.00 211 G 8.09 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 K 7.95 3.62 0.00 1.57 1.84 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.15 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.35 0.82 7.81 213 A 7.95 4.11 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 0.00 214 K 7.83 3.52 0.00 1.42 0.98 0.00 0.61 0.00 0.00 1.37 0.00 0.00 2.80 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.66 1.07 7.81 215 Y 7.63 4.46 0.00 3.20 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 0.00 216 K 7.89 4.15 0.00 1.72 1.60 0.00 1.78 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.39 1.22 7.81 217 A 8.47 4.24 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 * Residues marked with a * may have inaccurate shift predictions.