NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 E 4.2954 8.4444 118.8064 55.8729 31.1773 175.7178 8 W 4.5331 8.3967 130.4141 55.4105 29.6841 171.5633 9 V 3.7447 8.7279 125.9045 65.4406 32.5191 177.9246 10 G 3.7423 8.4395 107.7176 47.1271 0.0000 175.2645 11 F 3.3763 6.7556 121.3116 60.7708 38.9447 176.9870 12 Q 4.1640 7.6951 116.5850 58.1806 28.6614 177.9146 13 Q 3.9713 7.1923 118.8069 57.4875 29.1227 177.0199 14 F 4.3676 6.6439 116.7608 56.9058 39.6828 173.0233 15 P 3.9283 0.0000 0.0000 62.5548 31.9351 177.0122 16 A 3.8190 8.7191 125.5685 55.2504 18.5220 179.6245 17 A 3.9221 7.8719 118.6859 55.0664 18.4703 180.0018 18 T 3.5737 7.8070 114.5876 66.7695 68.5372 176.6453 19 Q 3.1891 7.6809 119.4191 58.8855 28.6876 178.7805 20 E 3.8330 7.9368 119.7248 59.3176 29.5631 179.0984 21 K 3.3786 7.4130 118.2252 59.1503 32.0033 179.1026 22 L 3.6245 7.8559 119.5147 57.8648 41.5487 179.5102 23 I 3.5862 7.6330 119.3732 64.5092 37.0160 177.7367 24 E 3.7709 7.7923 119.7213 59.5089 29.0031 179.0980 25 F 4.4805 7.5351 117.5019 60.6763 38.9555 177.8121 26 F 4.1583 8.1146 117.9418 60.2342 38.5761 177.5912 27 G 3.8640 8.1320 105.5471 48.1351 0.0000 175.3545 28 K 3.9648 7.7089 120.9178 58.9760 32.3912 178.5920 29 L 4.2146 7.8135 118.8484 57.8865 41.6783 179.2133 30 K 4.3977 8.3840 120.0064 59.2943 31.8971 179.1854 31 Q 4.1986 8.0778 116.2593 57.9281 28.6352 177.8356 32 K 4.3698 8.2427 118.4721 55.7048 32.5411 176.9359 33 D 4.7791 8.0271 118.6544 53.2390 38.9345 174.4381 34 M 4.2122 7.8349 120.9263 55.9867 32.3856 175.8116 35 N 5.2717 8.6269 119.2522 52.6605 41.0492 173.7202 36 S 4.2386 7.4643 112.2520 57.2922 66.2198 173.1901 37 M 4.9770 8.4748 116.9472 54.4681 34.9674 173.6028 38 T 4.9465 8.8327 118.0148 62.0156 71.2806 173.3055 39 V 4.5474 8.4229 127.6805 61.2773 33.2299 174.5541 40 L 4.5987 8.8271 131.1287 54.2971 43.7784 175.3746 41 V 4.8373 8.1414 124.7020 61.2208 33.3463 174.6419 42 L 4.8773 8.4433 127.5120 52.9291 45.8204 175.8947 43 G 3.9583 8.0696 107.1161 45.6318 0.0000 172.9572 44 K 4.4592 8.7446 119.9225 55.7936 32.6913 177.4944 45 G 3.5996 8.3350 110.3516 47.0138 0.0000 174.0679 46 G 4.0660 9.0066 111.2225 45.4106 0.0000 174.3979 47 V 3.8745 7.6387 111.4871 61.4574 32.2332 176.5301 48 G 3.9319 8.1105 108.4524 46.1513 0.0000 176.1496 49 K 3.9007 8.2438 119.8145 59.5121 32.1602 179.1418 50 S 4.4224 7.9178 116.0739 61.2283 62.9145 176.8799 51 S 4.2632 8.0748 117.4893 61.6840 62.5463 176.6365 52 T 4.3569 8.0321 120.0422 66.0888 68.1504 176.8348 53 V 3.6729 7.7751 119.6630 66.2468 31.7383 177.7771 54 N 4.6659 8.2579 117.4827 55.8583 38.1041 177.6729 55 S 4.2761 7.9689 115.3088 61.5975 63.1035 176.4174 56 L 4.3149 8.1241 120.4320 58.1399 41.6861 179.5788 57 I 4.3865 8.5401 119.7287 62.4387 36.7942 178.0219 58 G 3.7572 8.7876 106.7111 45.3765 0.0000 172.6108 59 E 4.7575 7.5337 117.5895 54.7579 33.7887 174.9996 60 Q 4.5850 8.3752 120.2814 55.4694 27.1072 175.9313 61 V 4.0015 8.0771 113.8635 62.0697 33.0862 176.6225 62 V 4.3260 8.1295 117.8226 60.5652 33.6388 174.6958 63 R 4.1825 8.2139 122.7522 55.6075 30.6328 175.5261 64 V 4.3879 8.0652 123.5056 61.0160 33.6613 174.7622 65 S 4.5221 8.5866 120.0985 56.4283 65.2836 171.9403 66 P 4.3732 0.0000 0.0000 65.6422 30.6626 176.4409 67 F 4.5269 7.1465 115.7902 58.7871 39.5533 175.3593 *72 L 4.1282 7.5600 120.7608 54.7752 43.1161 176.5928 73 R 4.7761 8.1019 118.4556 53.8397 32.1613 173.0732 74 P 4.3348 0.0000 0.0000 63.2425 32.0527 175.5226 75 V 4.3307 8.2737 120.5596 61.2777 35.0554 173.7885 76 M 5.1984 8.8131 125.1663 53.8385 35.5321 175.2659 77 V 4.2889 8.5666 123.4646 61.5175 34.4417 173.8495 78 S 5.1432 8.5772 124.0258 56.8874 64.6800 174.1675 79 R 4.5326 8.4185 122.4331 54.5089 34.0780 174.6389 80 T 4.9666 8.1894 117.7175 62.2179 71.5743 173.9312 81 M 4.3420 9.7739 123.9544 55.7976 34.6487 174.8439 82 G 3.6058 9.5230 117.4946 46.9422 0.0000 173.8339 83 G 3.9474 8.6202 105.2931 44.8547 0.0000 173.1967 84 F 4.8644 7.7585 121.7304 56.3367 42.7455 174.1037 85 T 4.7102 7.1389 121.6684 61.6855 71.3412 172.7784 86 I 4.4815 8.1093 128.2478 59.8082 39.6507 173.9357 87 N 5.4539 8.9359 127.2926 51.4789 41.4265 173.6948 88 I 4.9687 8.4634 124.0169 59.5513 41.0852 174.5700 89 I 4.8219 8.5943 128.3015 58.8483 38.2003 174.8378 90 D 4.8564 8.6104 127.7565 54.3410 42.4408 174.9235 91 T 4.7516 8.1522 113.2348 58.8274 72.1145 171.6813 92 P 4.4325 0.0000 0.0000 62.3390 32.1518 176.4913 93 G 3.8338 8.7193 110.5040 46.4418 0.0000 173.0177 94 L 4.5927 8.3527 118.8617 53.9926 41.8707 176.2969 95 V 4.7652 7.6001 118.1534 61.1502 33.9305 175.3165 96 E 4.5177 8.8534 128.4870 53.5913 28.9946 174.4360 97 A 4.2998 8.1778 125.0957 51.9390 19.3126 177.8901 98 G 3.9371 8.6755 108.7161 45.4252 0.0000 172.7782 99 Y 4.7884 7.4993 114.9299 54.9670 41.7873 175.3504 100 V 3.9452 8.3813 121.1293 63.3402 32.1556 176.5030 101 N 4.6553 8.8518 126.5682 52.9064 37.7751 175.0131 102 H 4.3539 8.4335 124.1634 57.8555 28.9980 177.1768 103 Q 3.9837 8.2017 119.8799 58.9589 28.8355 177.7799 104 A 4.0618 8.1073 121.3456 55.3412 17.9527 178.9783 105 L 4.2693 8.0420 116.9245 56.4944 42.2590 177.5121 106 E 4.3200 7.6691 114.0059 56.0244 31.5870 177.6458 107 L 3.9625 8.5719 122.5562 58.4123 41.7804 178.7446 108 I 3.7183 7.6674 118.2761 64.4386 37.4619 177.7620 109 K 4.1292 7.7306 120.1738 59.5412 32.0426 178.5147 110 G 3.8521 8.2520 105.9174 48.1917 0.0000 175.3058 111 F 4.3409 8.2028 121.4466 59.6691 39.5667 175.9656 112 L 4.5383 7.9532 117.5031 54.0777 42.4918 176.7248 113 V 3.7936 6.6219 117.5962 63.4974 31.3406 176.4760 114 N 4.3996 8.4867 119.5319 53.3089 37.1044 174.6861 115 R 4.3361 7.7598 117.7928 55.3778 31.5599 175.0546 116 T 4.9686 8.1800 116.5783 62.1385 70.4281 173.9700 117 I 4.2094 8.8377 128.4271 60.2907 38.2076 176.3172 118 D 4.4728 9.0633 128.2336 56.0271 41.7600 177.3206 119 V 4.7281 7.6381 116.3045 60.8137 35.7369 173.8961 120 L 4.9829 8.5518 127.6432 53.2689 44.8356 175.1102 121 L 4.8110 9.0011 127.4376 53.5706 42.9458 175.4797 122 Y 4.5607 9.0039 127.7897 56.9952 39.5260 174.0924 123 V 4.5947 7.8030 128.0152 61.5005 33.0546 174.3563 124 D 4.7575 8.7919 126.2478 52.7766 45.5750 173.8249 125 R 4.6604 8.2683 118.9633 54.7786 30.6322 177.0506 126 L 4.2743 9.0253 125.4624 57.0891 42.9058 177.0298 127 D 3.3700 7.4867 117.7897 53.0933 39.6089 176.2110 128 V 4.4898 7.4284 117.3852 62.6589 34.5695 174.1150 129 Y 4.3223 8.7076 122.8300 57.5338 38.2214 175.3540 130 R 4.5571 7.3088 113.4511 55.7288 31.5068 174.2805 131 V 4.4389 7.6285 113.9235 59.9886 33.3308 174.8611 132 D 4.8865 8.5136 120.8664 50.7110 42.7578 175.9754 133 E 3.7483 8.6567 118.1068 59.3304 29.3603 178.1031 134 L 3.9144 8.0113 119.9782 58.3684 41.9876 178.6507 135 D 4.3953 8.1729 118.4675 56.9471 40.6820 178.6491 136 K 3.8944 7.6534 119.9745 59.4510 32.2322 178.6948 137 Q 4.0263 8.3723 118.7834 59.2687 28.7321 179.4971 138 V 3.6725 8.0665 119.0664 66.0601 31.4845 178.3419 139 V 3.8140 7.7339 117.6041 65.8725 31.1896 178.1730 140 I 4.0506 8.3566 121.1087 63.7023 36.8620 178.1902 141 A 4.1284 8.3712 121.6917 55.1103 18.1328 179.7847 142 I 3.9986 8.0162 118.4977 64.6878 36.7197 178.7578 143 T 4.0588 8.0710 116.7591 66.9328 68.1758 176.7861 144 Q 4.1052 8.3226 118.9537 59.1394 28.7178 179.0756 145 T 3.8715 7.5613 116.0039 66.1552 68.8344 176.3785 146 F 4.5437 8.2538 116.4562 56.0962 40.7128 177.1264 147 G 4.0351 8.2914 105.9764 45.5346 0.0000 175.0656 148 K 4.4827 8.5650 122.4054 59.2696 32.9326 178.1079 149 E 4.0923 8.2387 118.0517 58.8189 29.4391 178.6824 150 I 3.5831 7.6030 118.8428 63.1556 37.7265 177.2764 151 W 4.7578 7.3778 119.3358 57.8286 29.1669 177.2572 152 C 4.6058 7.6125 116.6141 59.8063 28.0047 173.7108 153 K 4.7177 7.8477 119.1735 56.0948 34.1610 175.4720 154 T 5.2105 8.0506 116.6786 61.8361 71.7408 173.1658 155 L 4.9740 8.7566 124.0395 52.8509 45.6251 175.4562 156 L 4.8230 8.7392 125.7247 54.2990 43.3054 175.2728 157 V 4.5984 8.6393 127.7202 61.4777 33.5080 174.4137 158 L 5.1408 8.3606 128.5877 53.2454 43.2294 176.5803 159 T 4.4620 8.7147 115.4133 61.1506 71.3721 174.3427 160 H 3.9398 8.7007 114.4772 56.7473 25.8523 177.2646 161 A 4.2807 7.8776 124.5548 55.1086 18.3057 179.4441 162 Q 4.1331 8.7434 116.1090 56.6939 29.4897 175.4765 163 F 4.1314 8.0484 119.8381 59.4020 39.7168 174.2247 164 S 4.2149 8.0237 122.0521 55.2565 62.6499 171.8336 165 P 3.8596 0.0000 0.0000 61.7812 31.6201 174.4625 166 P 4.4622 0.0000 0.0000 63.8437 32.2445 175.5066 167 D 5.0258 9.4870 119.1424 54.6776 38.4723 176.0800 168 E 4.5751 7.7469 115.2660 54.1198 29.3162 174.6801 169 L 4.1885 7.8576 124.8838 56.2816 41.9569 178.5480 170 S 4.5736 8.3062 115.6891 57.6012 65.8588 174.4513 171 Y 4.0173 8.4997 122.3537 60.8538 38.3542 177.6396 172 E 4.1118 8.0609 120.6512 58.0764 29.9906 178.3862 173 T 3.8463 7.6180 115.6746 66.4814 68.4782 176.3771 174 F 3.8976 8.1972 122.7658 61.2678 39.4206 177.2304 175 S 4.2633 8.1586 113.7681 60.7997 63.1183 176.4740 176 S 4.2558 7.8638 117.9073 61.0771 62.8479 176.3877 177 K 3.8734 7.9833 123.3551 58.9229 31.9860 178.9003 178 R 3.6080 7.8289 119.4579 59.3815 30.1039 178.6139 179 S 4.2476 7.8669 113.0148 60.7242 63.2011 175.8517 180 D 4.3008 7.9365 122.1156 57.3599 41.0826 177.9795 181 E 3.9475 8.2845 119.2144 59.1258 29.3144 179.3942 182 L 3.9649 7.8138 118.9110 57.7518 41.8126 179.3704 183 L 3.9940 7.9353 118.8946 57.8287 41.5692 179.8245 184 K 3.7943 8.0253 118.4130 59.4264 31.7969 179.6514 185 T 3.7603 7.5667 115.8173 66.4311 68.1357 176.8049 186 I 3.0485 7.3885 120.8993 64.1599 37.1181 178.1161 187 R 3.3681 7.2161 117.8909 59.0020 29.8932 178.1774 188 A 4.0979 7.6343 120.5541 54.9078 18.1066 179.3718 189 G 3.7251 8.1925 102.6636 45.9980 0.0000 174.4668 190 S 4.6695 6.6774 113.6960 57.9290 63.2251 175.4485 191 K 4.5719 7.0130 120.0983 57.9914 29.3428 175.5196 192 M 4.3281 7.7244 118.9777 54.9953 33.4341 177.5923 193 R 4.3230 8.3712 121.3068 55.1373 32.7999 177.3642 194 K 3.9272 8.6174 124.8127 61.1112 32.1396 177.8791 195 Q 3.9680 8.3940 119.3562 59.9197 28.5075 178.4512 196 E 4.1318 8.0386 120.6261 58.9904 30.0749 179.1222 197 F 4.0717 8.2713 121.0897 61.2779 39.5408 176.9883 198 E 3.9199 8.1052 117.7840 59.5988 29.1544 178.8417 199 D 4.5119 7.5467 114.6719 55.8586 40.8833 177.4850 200 S 4.4752 8.2743 113.2393 58.7570 63.5169 174.0399 201 A 3.7199 7.3335 124.2526 50.0644 14.8255 174.6331 202 I 3.7875 7.4315 119.3732 61.3435 37.9852 175.7159 203 A 4.4163 8.6489 129.0514 51.2554 20.6891 175.7869 204 V 4.6766 8.2373 119.4098 61.3394 33.2593 175.3347 205 V 4.5702 8.4154 121.1387 59.8235 34.7582 174.3572 206 Y 5.1552 8.6506 119.8964 56.2501 40.6554 175.0645 207 A 2.8565 9.0178 124.0647 49.4386 22.5059 174.5477 208 E 4.3004 6.2072 122.8788 54.4700 30.9270 175.2912 209 N 4.9001 8.6749 124.2075 53.7192 39.3939 175.4951 210 S 4.3625 7.9838 113.9064 57.6761 63.3417 174.5234 211 G 3.7594 8.6981 115.3968 48.6225 0.0000 175.3627 212 R 4.0447 7.6359 116.1031 57.2665 29.6909 175.9514 213 C 4.6375 8.1035 119.5867 59.0207 31.9113 173.2134 214 S 3.8982 7.9059 121.4893 55.0987 62.5999 173.5895 215 K 4.9204 8.5875 125.1929 55.0222 33.8378 176.7870 216 N 4.6692 8.8280 121.9915 52.4075 38.6664 175.1311 217 D 4.6014 8.5030 116.0031 54.8412 40.5368 177.1261 218 K 4.3411 8.0643 117.1936 56.0223 32.3084 176.4477 219 D 4.5266 8.0231 116.3408 54.5201 40.4671 173.1183 220 E 4.3853 7.9729 117.4300 55.2540 31.5568 175.1242 221 K 4.3038 8.3159 122.4506 56.1429 32.7127 175.0151 222 A 5.3556 8.7542 127.1143 49.8912 21.7513 176.0409 223 L 4.3025 8.8556 120.8496 53.3236 42.7247 176.4964 224 P 4.0152 0.0000 0.0000 65.9158 31.0595 177.8119 225 N 4.3900 7.7972 113.2057 53.3727 37.6281 174.9573 226 G 3.8797 7.6839 107.1589 45.6983 0.0000 174.1969 227 E 4.1930 8.3990 120.0749 55.0264 30.6295 175.5136 228 A 4.4879 8.5160 125.8430 52.1892 18.5465 178.3745 229 W 4.4630 8.9289 122.1119 59.9076 28.2528 178.9407 230 I 3.2727 6.8191 120.3583 63.5921 36.5363 176.0130 231 P 4.3045 0.0000 0.0000 65.9910 31.1551 178.3252 232 N 4.3051 8.0910 114.6751 56.0465 38.4148 177.3125 233 L 3.9876 8.2896 121.9315 58.2824 42.2246 179.1984 234 V 3.6342 8.0519 118.5085 65.8336 31.5334 177.8067 235 K 2.7963 7.8779 119.3574 59.0351 31.9424 178.5819 236 A 4.0411 7.8632 120.8285 54.5958 18.4243 179.7471 237 I 3.6350 7.8734 118.5514 65.0360 37.0121 178.4183 238 T 4.0019 8.0941 116.7688 67.1798 68.0493 176.2667 239 D 4.3501 7.6968 119.0753 57.2215 41.2535 178.7044 240 V 3.7248 7.8221 118.4505 65.8525 31.3775 177.7492 241 A 4.0737 8.3017 119.8880 55.0325 18.5054 178.6983 242 T 4.4735 7.4921 111.8560 63.5788 69.2495 175.6894 243 N 4.6039 7.9186 118.3457 53.0248 37.0527 176.1770 244 Q 3.5790 7.8374 117.6255 56.6689 27.6960 174.1582 245 R 4.1828 7.8505 117.3485 55.4980 30.7430 176.4629 246 K 4.1545 8.3647 120.0968 56.1444 33.5858 176.7571 247 A 4.2214 8.4297 123.5261 52.5507 19.5986 176.3706 248 I 4.0161 8.4991 120.2316 61.9462 38.8492 173.9596 249 H 4.6419 8.9625 127.3694 54.5677 29.8653 175.2386 250 V 3.7975 9.0469 113.4861 61.7345 31.0480 170.4590 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 7 E 8.44 4.30 0.00 2.17 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 2.23 2.39 0.00 8 W 8.40 4.53 0.00 3.62 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 V 8.73 3.74 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.06 0.00 0.00 10 G 8.44 3.74 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 0.00 0.00 0.00 11 F 6.76 3.38 0.00 1.56 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 12 Q 7.70 4.16 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.78 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 13 Q 7.19 3.97 0.00 1.69 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.21 2.41 0.00 14 F 6.64 4.37 0.00 2.71 2.51 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 0.00 15 P 0.00 3.93 0.00 2.07 1.92 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.27 0.00 16 A 8.72 3.82 1.25 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 17 A 7.87 3.92 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 18 T 7.81 3.57 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 0.33 0.00 0.00 19 Q 7.68 3.19 0.00 2.07 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.87 0.00 0.00 0.00 0.00 0.00 1.58 2.40 0.00 20 E 7.94 3.83 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 21 K 7.41 3.38 0.00 1.82 1.49 0.00 1.48 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.07 7.81 22 L 7.86 3.62 0.00 1.69 1.38 1.05 0.74 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 23 I 7.63 3.59 2.07 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.72 0.88 0.00 0.00 24 E 7.79 3.77 0.00 1.83 1.51 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 2.19 2.33 0.00 25 F 7.54 4.48 0.00 2.97 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 26 F 8.11 4.16 0.00 2.86 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 27 G 8.13 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 28 K 7.71 3.96 0.00 1.80 1.97 0.00 1.86 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.56 7.81 29 L 7.81 4.21 0.00 2.05 1.99 1.20 0.97 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 30 K 8.38 4.40 0.00 2.14 1.99 0.00 1.93 0.00 0.00 1.95 0.00 0.00 3.03 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.77 1.70 7.81 31 Q 8.08 4.20 0.00 2.21 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 32 K 8.24 4.37 0.00 1.77 1.87 0.00 1.79 0.00 0.00 1.79 0.00 0.00 3.37 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.79 1.62 7.81 33 D 8.03 4.78 0.00 2.99 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 34 M 7.83 4.21 0.00 2.21 2.32 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.59 0.00 35 N 8.63 5.27 0.00 2.59 2.64 0.00 0.00 6.63 7.57 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 36 S 7.46 4.24 0.00 3.54 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 M 8.47 4.98 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.78 0.00 38 T 8.83 4.95 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 1.20 0.00 0.00 39 V 8.42 4.55 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 1.04 0.00 0.00 0.99 0.00 0.00 40 L 8.83 4.60 0.00 1.70 1.36 0.91 0.19 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 41 V 8.14 4.84 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 0.82 0.00 0.00 0.95 0.00 0.00 42 L 8.44 4.88 0.00 1.69 1.59 0.82 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.07 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 K 8.74 4.46 0.00 1.75 1.77 0.00 1.78 0.00 0.00 1.86 0.00 0.00 3.08 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.53 7.81 45 G 8.33 3.60 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 0.00 0.00 0.00 46 G 9.01 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 47 V 7.64 3.87 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 0.70 0.00 0.00 1.02 0.00 0.00 48 G 8.11 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.24 3.90 0.00 1.80 1.85 0.00 1.64 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.48 7.81 50 S 7.92 4.42 0.00 3.88 3.97 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 51 S 8.07 4.26 0.00 3.91 3.97 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 52 T 8.03 4.36 4.46 0.00 0.00 0.00 0.00 0.00 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 53 V 7.78 3.67 2.27 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 1.14 0.00 0.00 1.04 0.00 0.00 54 N 8.26 4.67 0.00 2.88 3.05 0.00 0.00 6.57 6.39 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 55 S 7.97 4.28 0.00 4.46 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 56 L 8.12 4.31 0.00 2.00 1.96 1.07 1.18 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 65 S 8.59 4.52 0.00 3.77 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 66 P 0.00 4.37 0.00 2.07 2.27 0.00 3.58 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 1.85 2.13 0.00 67 F 7.15 4.53 0.00 2.84 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 *72 L 7.56 4.13 0.00 1.66 1.65 0.93 0.82 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 73 R 8.10 4.78 0.00 1.69 1.81 0.00 2.97 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.64 0.00 74 P 0.00 4.33 0.00 1.24 1.87 0.00 3.55 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.85 0.00 75 V 8.27 4.33 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 0.92 0.00 0.00 0.89 0.00 0.00 76 M 8.81 5.20 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.51 0.00 77 V 8.57 4.29 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 0.89 0.00 0.00 0.94 0.00 0.00 78 S 8.58 5.14 0.00 3.69 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 R 8.42 4.53 0.00 0.67 0.73 0.00 3.28 0.00 0.00 3.06 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.24 0.00 80 T 8.19 4.97 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 1.22 0.00 0.00 81 M 9.77 4.34 0.00 2.18 2.34 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.40 0.00 82 G 9.52 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 G 8.62 3.95 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 0.00 0.00 0.00 84 F 7.76 4.86 0.00 3.08 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 T 7.14 4.71 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 1.02 0.00 0.00 86 I 8.11 4.48 1.83 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.51 0.48 0.00 0.00 87 N 8.94 5.45 0.00 2.68 2.62 0.00 0.00 6.33 7.09 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 88 I 8.46 4.97 1.89 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.73 0.99 0.00 0.00 89 I 8.59 4.82 1.93 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 1.31 2.18 1.06 0.00 0.00 90 D 8.61 4.86 0.00 2.72 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 91 T 8.15 4.75 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 1.24 0.00 0.00 92 P 0.00 4.43 0.00 2.10 2.07 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 93 G 8.72 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 F 8.20 4.34 0.00 2.97 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 0.00 112 L 7.95 4.54 0.00 1.92 1.80 1.18 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 6.62 3.79 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 0.70 0.00 0.00 0.98 0.00 0.00 114 N 8.49 4.40 0.00 2.88 3.02 0.00 0.00 7.02 7.41 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 0.00 115 R 7.76 4.34 0.00 1.84 1.76 0.00 2.99 0.00 0.00 3.03 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.51 0.00 116 T 8.18 4.97 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 0.00 117 I 8.84 4.21 1.80 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.63 0.83 0.00 0.00 118 D 9.06 4.47 0.00 2.67 2.73 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 0.00 119 V 7.64 4.73 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.02 0.00 0.00 120 L 8.55 4.98 0.00 1.60 1.37 0.82 0.22 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 0.00 121 L 9.00 4.81 0.00 1.60 1.63 0.99 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 122 Y 9.00 4.56 0.00 3.36 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 0.00 123 V 7.80 4.59 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 0.70 0.00 0.00 0.87 0.00 0.00 124 D 8.79 4.76 0.00 2.68 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 0.00 0.00 0.00 0.00 125 R 8.27 4.66 0.00 1.64 1.88 0.00 3.21 0.00 0.00 3.32 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.38 0.00 126 L 9.03 4.27 0.00 1.75 1.93 1.14 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 127 D 7.49 3.37 0.00 1.77 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 0.00 0.00 0.00 0.00 128 V 7.43 4.49 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 0.92 0.00 0.00 0.88 0.00 0.00 129 Y 8.71 4.32 0.00 3.04 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 0.00 130 R 7.31 4.56 0.00 1.86 1.89 0.00 3.02 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 131 V 7.63 4.44 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 0.69 0.00 0.00 0.88 0.00 0.00 132 D 8.51 4.89 0.00 2.83 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 0.00 133 E 8.66 3.75 0.00 2.08 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 134 L 8.01 3.91 0.00 1.69 1.87 0.94 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 135 D 8.17 4.40 0.00 2.91 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 0.00 136 K 7.65 3.89 0.00 1.82 1.91 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.39 7.81 137 Q 8.37 4.03 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.56 2.60 0.00 138 V 8.07 3.67 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.03 0.00 0.00 139 V 7.73 3.81 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 0.57 0.00 0.00 0.61 0.00 0.00 140 I 8.36 4.05 2.06 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 1.44 1.36 0.97 0.00 0.00 141 A 8.37 4.13 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 0.00 142 I 8.02 4.00 2.20 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.97 0.75 0.00 0.00 143 T 8.07 4.06 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 1.45 0.00 0.00 144 Q 8.32 4.11 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.97 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 145 T 7.56 3.87 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 0.19 0.00 0.00 146 F 8.25 4.54 0.00 2.93 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 0.00 147 G 8.29 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 0.00 148 K 8.56 4.48 0.00 1.91 1.91 0.00 1.83 0.00 0.00 2.09 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.68 1.84 7.81 149 E 8.24 4.09 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 150 I 7.60 3.58 1.65 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.04 0.03 0.00 0.00 151 W 7.38 4.76 0.00 3.30 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 0.00 152 C 7.61 4.61 0.00 3.09 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 0.00 153 K 7.85 4.72 0.00 1.76 1.69 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.50 7.81 154 T 8.05 5.21 4.49 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 1.51 0.00 0.00 155 L 8.76 4.97 0.00 1.59 1.54 0.98 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 156 L 8.74 4.82 0.00 1.86 1.56 1.17 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 0.00 157 V 8.64 4.60 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 0.93 0.00 0.00 0.95 0.00 0.00 158 L 8.36 5.14 0.00 1.32 1.55 0.88 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 159 T 8.71 4.46 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 160 H 8.70 3.94 0.00 3.32 3.45 0.00 5.63 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 A 7.88 4.28 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 Q 8.74 4.13 0.00 2.09 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 163 F 8.05 4.13 0.00 3.03 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 0.00 164 S 8.02 4.21 0.00 3.70 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 P 0.00 3.86 0.00 2.15 1.61 0.00 3.50 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.76 0.00 166 P 0.00 4.46 0.00 2.21 2.09 0.00 3.70 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 2.03 2.15 0.00 167 D 9.49 5.03 0.00 2.79 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 0.00 168 E 7.75 4.58 0.00 2.01 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 2.17 2.28 0.00 169 L 7.86 4.19 0.00 1.84 1.79 1.08 0.92 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 0.00 170 S 8.31 4.57 0.00 4.12 4.06 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 0.00 0.00 0.00 171 Y 8.50 4.02 0.00 2.99 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 0.00 172 E 8.06 4.11 0.00 2.21 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 2.38 2.32 0.00 173 T 7.62 3.85 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 174 F 8.20 3.90 0.00 3.05 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 0.00 175 S 8.16 4.26 0.00 4.02 3.68 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 0.00 0.00 0.00 0.00 176 S 7.86 4.26 0.00 4.07 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 0.00 177 K 7.98 3.87 0.00 1.80 1.71 0.00 1.44 0.00 0.00 1.34 0.00 0.00 2.82 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.33 7.81 178 R 7.83 3.61 0.00 1.51 1.75 0.00 3.06 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.62 0.00 179 S 7.87 4.25 0.00 4.08 4.16 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 0.00 180 D 7.94 4.30 0.00 2.96 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 0.00 181 E 8.28 3.95 0.00 2.18 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 2.25 2.36 0.00 182 L 7.81 3.96 0.00 1.71 1.71 0.93 0.53 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 0.00 183 L 7.94 3.99 0.00 1.74 1.91 0.97 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 184 K 8.03 3.79 0.00 1.92 1.72 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.37 7.81 185 T 7.57 3.76 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 1.11 0.00 0.00 186 I 7.39 3.05 1.76 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.29 0.12 0.00 0.00 187 R 7.22 3.37 0.00 0.98 1.51 0.00 3.04 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 188 A 7.63 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 189 G 8.19 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 0.00 190 S 6.68 4.67 0.00 3.17 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 0.00 191 K 7.01 4.57 0.00 1.81 1.69 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.60 1.52 7.81 192 M 7.72 4.33 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.74 0.00 193 R 8.37 4.32 0.00 1.94 1.81 0.00 3.27 0.00 0.00 3.40 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 194 K 8.62 3.93 0.00 2.01 2.11 0.00 1.61 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.51 7.81 195 Q 8.39 3.97 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.93 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 196 E 8.04 4.13 0.00 2.06 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 2.36 2.42 0.00 197 F 8.27 4.07 0.00 3.17 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 0.00 198 E 8.11 3.92 0.00 2.14 1.99 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 2.38 2.56 0.00 199 D 7.55 4.51 0.00 2.68 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 0.00 200 S 8.27 4.48 0.00 4.02 3.46 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.33 3.72 1.25 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 0.00 202 I 7.43 3.79 1.79 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.37 0.96 0.00 0.00 203 A 8.65 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 V 8.24 4.68 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 0.47 0.00 0.00 0.90 0.00 0.00 205 V 8.42 4.57 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 0.78 0.00 0.00 0.93 0.00 0.00 206 Y 8.65 5.16 0.00 2.88 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 0.00 207 A 9.02 2.86 0.56 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 0.00 208 E 6.21 4.30 0.00 1.76 1.73 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 2.18 2.39 0.00 209 N 8.67 4.90 0.00 2.81 2.93 0.00 0.00 6.71 7.57 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 0.00 210 S 7.98 4.36 0.00 3.94 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 0.00 211 G 8.70 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 R 7.64 4.04 0.00 1.79 2.00 0.00 3.34 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 213 C 8.10 4.64 0.00 3.23 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 0.00 214 S 7.91 3.90 0.00 3.85 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 0.00 215 K 8.59 4.92 0.00 1.63 1.72 0.00 1.75 0.00 0.00 1.93 0.00 0.00 3.04 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.41 1.44 7.81 216 N 8.83 4.67 0.00 2.93 3.09 0.00 0.00 6.88 8.79 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 0.00 217 D 8.50 4.60 0.00 2.66 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 0.00 218 K 8.06 4.34 0.00 1.80 1.74 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.30 7.81 219 D 8.02 4.53 0.00 2.80 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 0.00 220 E 7.97 4.39 0.00 1.90 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 2.21 2.24 0.00 221 K 8.32 4.30 0.00 1.36 1.89 0.00 1.79 0.00 0.00 1.89 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.45 7.81 222 A 8.75 5.36 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.86 4.30 0.00 1.99 1.57 1.07 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 224 P 0.00 4.02 0.00 1.30 1.61 0.00 3.41 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.69 0.00 225 N 7.80 4.39 0.00 2.82 2.91 0.00 0.00 6.15 7.00 0.00 0.00 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 G 7.68 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 0.00 227 E 8.40 4.19 0.00 2.10 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 2.41 2.33 0.00 228 A 8.52 4.49 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 0.00 229 W 8.93 4.46 0.00 3.79 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 I 6.82 3.27 1.23 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.51 0.00 0.00 231 P 0.00 4.30 0.00 2.17 2.17 0.00 3.44 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.98 0.00 232 N 8.09 4.31 0.00 3.09 2.95 0.00 0.00 6.68 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 0.00 233 L 8.29 3.99 0.00 2.15 1.94 1.01 1.24 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 0.00 234 V 8.05 3.63 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 1.14 0.00 0.00 1.07 0.00 0.00 235 K 7.88 2.80 0.00 0.79 1.51 0.00 1.56 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.15 0.88 7.81 236 A 7.86 4.04 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 0.00 237 I 7.87 3.63 2.10 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.54 1.00 0.00 0.00 238 T 8.09 4.00 4.36 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 1.29 0.00 0.00 239 D 7.70 4.35 0.00 2.77 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 0.00 240 V 7.82 3.72 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 1.03 0.00 0.00 1.05 0.00 0.00 241 A 8.30 4.07 1.43 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 0.00 0.00 0.00 242 T 7.49 4.47 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 1.24 0.00 0.00 243 N 7.92 4.60 0.00 2.95 3.27 0.00 0.00 6.91 6.83 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 0.00 244 Q 7.84 3.58 0.00 2.26 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.70 6.94 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 245 R 7.85 4.18 0.00 2.00 1.87 0.00 3.33 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 246 K 8.36 4.15 0.00 1.87 1.81 0.00 1.60 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.44 7.81 247 A 8.43 4.22 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 0.00 248 I 8.50 4.02 1.87 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 1.06 0.76 0.99 0.00 0.00 249 H 8.96 4.64 0.00 3.11 3.06 0.00 5.72 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 V 9.05 3.80 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 0.75 0.00 0.00 0.96 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.