NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 D 4.6810 8.2233 120.3235 52.9413 41.1189 177.1349 8 D 4.4134 8.4044 123.0482 58.0789 40.3719 174.9166 9 E 3.6227 8.5882 118.2842 59.3763 29.7972 178.6124 10 F 4.3101 8.4921 120.0671 61.0734 39.9510 177.4183 11 L 4.2237 8.1629 117.9206 57.3318 41.4533 177.9284 12 D 4.7152 8.9927 119.1490 54.6905 41.1810 177.4836 *14 E 4.1058 8.3291 119.7656 55.6025 31.4001 177.5802 15 R 3.8860 7.6856 118.1327 59.4038 29.8881 178.4379 16 K 3.9675 7.9678 118.0153 59.5736 32.0251 179.2378 17 I 3.8429 7.8129 119.4770 64.4417 36.8422 178.0235 18 D 4.2788 8.2058 119.1164 57.3638 41.1512 178.4268 19 V 3.5901 7.9010 118.8816 66.1147 31.3855 177.6976 20 T 3.8921 8.2845 116.0213 67.0047 68.3925 175.8703 21 N 4.4569 7.8643 117.8794 56.5284 38.5128 177.4773 22 K 3.9416 7.7482 119.7689 59.5050 32.0017 179.5725 23 V 3.5287 8.2201 118.6714 66.0779 31.5822 177.8296 24 V 3.4952 8.6416 118.8400 66.2741 31.4187 177.5789 25 A 3.9534 8.4705 120.4065 55.4073 18.1311 179.4828 26 E 3.9017 7.9505 116.7892 59.6889 29.4682 179.7038 27 I 3.6579 8.0703 120.1408 64.1411 37.1883 178.5416 28 L 3.7640 7.7803 119.9953 57.7167 41.4374 179.7897 29 S 4.0897 7.9036 114.7380 61.5782 62.9359 176.8324 30 K 4.0470 8.2399 121.4096 59.6589 31.6510 179.5694 31 T 3.9051 8.1118 116.1143 66.9660 68.4244 176.6895 32 T 3.8769 7.6888 117.0635 66.9631 68.2697 176.5780 33 E 4.1558 8.7974 120.5277 59.3675 29.1380 178.7097 34 Y 4.2673 7.8828 119.0739 60.6876 39.0068 177.5979 35 L 3.9811 8.1185 119.0606 56.5492 43.1187 177.9836 36 Q 4.5121 8.0007 119.9366 52.6194 28.6738 172.4350 37 P 4.4213 0.0000 0.0000 64.0507 32.1327 176.3170 38 N 4.4501 8.0335 117.2570 52.2872 38.7727 173.5060 39 P 4.2351 0.0000 0.0000 65.2882 31.0899 178.2537 40 A 3.7539 7.7567 118.5374 54.0814 18.2104 177.8770 41 Y 4.6248 7.2277 112.4491 57.4959 39.0513 177.7746 42 R 3.8275 7.4545 120.2093 59.1997 30.1907 178.6489 43 A 3.9523 7.8152 119.7258 55.1315 18.4214 179.3947 44 K 4.1041 7.2824 113.7185 58.2034 32.1575 177.9548 45 L 4.6573 7.4971 120.4145 55.9236 43.3260 176.8437 46 G 3.7798 7.8644 108.6637 45.1422 0.0000 173.8359 *48 L 4.1211 7.6769 117.5634 54.3821 43.1031 176.7013 49 N 5.1175 8.4636 119.7881 51.3758 41.7103 174.2036 50 T 4.1761 8.2932 117.5112 63.3968 69.3006 175.1244 51 V 4.1731 8.1122 119.6767 60.1296 33.0709 175.9589 52 S 4.5450 8.3318 117.2543 57.9357 64.1459 174.3506 53 K 4.9951 8.0199 120.2859 55.3170 32.6436 177.8175 54 I 3.8890 8.0246 121.4113 63.5676 37.4651 177.6416 55 R 4.5464 9.1702 114.1418 53.8696 29.7876 174.7535 56 G 4.3730 7.2964 106.4929 44.8438 0.0000 172.8228 57 Q 4.5453 7.8745 121.1857 53.5733 27.6267 173.5921 58 V 4.1117 7.7431 117.7046 60.8330 33.0183 175.5872 59 K 4.3366 8.3427 128.5618 54.7795 31.3805 176.7003 60 T 4.1174 8.0204 113.7456 61.5102 69.8071 174.4124 61 T 3.9313 8.4139 116.0636 61.8663 69.1627 175.3462 62 G 4.0138 9.6516 107.3103 45.1626 0.0000 172.2042 63 Y 4.6467 6.2462 115.8534 54.6003 40.8352 173.0126 64 P 4.4344 0.0000 0.0000 62.6229 32.6484 175.8219 65 Q 4.7744 8.0831 117.1175 53.6559 32.8884 176.7168 66 T 3.9095 8.5239 114.0927 65.5024 68.6009 176.2066 67 E 4.0663 8.3967 121.1369 59.0274 29.2121 179.6108 68 G 3.5778 7.8477 104.3517 47.8537 0.0000 175.1151 69 L 4.0621 8.0686 121.5429 57.3217 41.3206 179.0068 70 L 4.0259 8.3333 120.0511 58.6625 41.8558 179.6223 71 G 3.7756 7.8912 103.6896 47.9080 0.0000 174.9590 72 D 4.5788 8.2107 121.0576 57.3327 40.8545 179.8371 73 C 4.3790 7.5359 113.3870 60.2545 28.0327 175.8611 *75 L 4.1582 7.8553 121.6715 54.8546 43.6053 179.0124 76 K 3.6667 8.4032 119.3035 59.8723 32.0290 178.0501 77 Y 4.4789 7.9780 115.6853 59.5455 37.5706 178.1361 78 G 3.4834 7.9370 107.0573 47.6519 0.0000 175.8371 79 K 4.1015 7.8891 120.6728 58.8943 31.8621 179.1331 80 E 3.9426 7.5138 117.8351 58.9474 29.5864 178.3466 81 L 4.1921 7.9250 118.5975 57.6211 42.3891 176.2728 82 G 3.8469 6.9134 104.3205 43.2733 0.0000 173.9309 83 E 3.8815 8.5784 125.1980 58.6736 29.7145 177.5135 84 D 4.5860 7.9021 116.5298 55.6612 41.9944 177.3001 85 S 4.2955 8.1419 115.2095 58.4273 63.7556 174.8743 86 T 3.9846 8.5089 125.7935 66.7214 68.4585 176.9557 87 F 4.5670 8.3455 122.3030 61.3132 39.4198 177.2740 88 G 3.4711 8.0376 106.5591 47.0605 0.0000 175.5862 89 N 4.3247 8.1142 118.1906 55.9778 38.4498 177.4459 90 A 4.0072 8.3739 122.6115 55.1237 18.5302 179.5810 91 L 3.8287 7.9347 117.7693 57.8814 41.5615 180.0512 92 I 3.6639 7.8546 119.7741 64.4322 37.1866 178.2687 93 E 4.1362 7.8698 119.4960 59.5150 29.0530 179.6980 94 V 3.7529 8.0692 117.8808 65.7504 31.6190 178.0698 95 G 3.7127 7.8825 105.0346 47.6247 0.0000 175.2477 96 E 4.1780 8.0149 120.0543 59.1120 29.7911 181.2416 97 S 4.2346 7.7826 115.2351 58.3779 63.1426 176.6692 *99 K 4.2296 8.1326 122.8528 56.5627 33.9840 177.0219 100 L 4.1199 7.8462 118.7508 55.1729 41.9807 179.0785 *102 A 4.2420 8.1946 122.3282 52.2857 20.0906 179.3752 103 E 4.0246 7.9238 115.9716 59.5984 29.2584 179.2598 104 V 3.9963 7.9234 119.0897 64.9125 31.8574 177.6971 105 K 4.1776 7.9812 119.2135 59.5946 32.1674 178.2101 106 D 4.3770 8.6781 119.8206 57.5352 40.6032 179.0637 107 S 4.2144 7.7900 113.4547 60.8711 63.0836 176.4134 108 L 3.9650 7.8289 124.4585 58.0584 41.7561 178.3507 109 D 4.3796 8.0043 118.3036 57.6552 40.8285 178.2470 110 I 3.7212 7.9323 119.9165 65.0500 37.2556 178.2992 111 N 4.3149 8.3804 116.8689 56.3145 38.3093 177.6864 112 V 3.9423 8.1366 119.7589 65.3487 31.6377 178.1211 113 K 3.9577 8.3487 119.6778 59.5851 31.9056 178.9406 114 Q 4.1556 8.6932 117.5049 58.8429 28.8615 177.9818 115 T 4.5402 7.7934 106.8872 61.6484 69.4511 174.4935 116 F 5.0206 7.8362 121.8403 59.6489 42.7123 176.5488 117 I 3.4367 8.2613 121.3256 64.2779 36.8875 178.1136 118 D 4.3145 8.3989 120.0481 57.0521 40.7933 177.1152 119 P 4.2319 0.0000 0.0000 65.5099 30.9362 178.3299 120 L 4.0381 7.6567 119.1787 57.8015 41.9280 178.9308 121 Q 3.7742 8.0901 118.4030 58.5376 28.4098 178.1308 122 L 3.9471 7.8625 121.0335 57.9728 42.4090 178.5281 123 L 4.1207 7.7739 119.7754 58.2102 41.9168 178.5014 124 Q 4.0099 7.5676 118.3413 58.3081 28.6696 177.5439 125 D 4.5290 8.1495 120.2350 56.7774 41.5793 177.0059 126 K 4.3991 8.5104 118.7406 56.1960 34.7913 177.3999 127 D 4.3115 8.4056 117.0315 57.8254 41.2978 178.9783 128 L 3.7388 7.7184 118.9165 56.9313 41.5082 179.4748 129 K 3.8072 7.7869 119.3114 59.6559 32.3717 178.3183 130 E 3.8504 8.4757 119.1991 59.7086 29.4387 179.7180 131 I 3.7705 7.3637 118.5455 64.1637 37.3873 178.6301 132 G 3.6093 8.1939 106.8758 47.9039 0.0000 175.6003 133 H 4.2245 8.3203 118.5198 59.1225 28.8422 177.4323 134 H 4.2782 7.9828 117.8815 58.9607 28.5419 177.8442 135 L 4.1011 7.8949 120.3894 57.7533 41.0583 179.4228 136 K 4.6764 7.9184 120.4854 59.0276 31.8496 178.6882 137 K 4.0558 8.3966 120.1537 59.3719 32.0492 178.5040 138 L 4.0912 8.0757 120.7175 57.7950 42.0244 178.6358 139 E 4.2061 8.4327 119.0703 59.1796 29.3566 179.4714 140 G 3.6023 7.8288 104.4562 47.9630 0.0000 175.7832 141 R 4.0275 7.7609 121.1684 59.0438 30.0559 179.2816 142 R 3.9201 8.7700 118.6630 59.0634 29.8272 178.1551 143 L 4.0802 8.1152 120.0217 57.4713 42.4221 178.0941 144 D 4.4160 8.7219 118.5538 57.3525 41.2013 177.0863 145 Y 4.1219 9.0820 120.6556 61.2655 38.4853 178.1778 146 D 3.7940 7.4594 117.4572 56.4225 41.0612 178.0478 147 Y 4.0565 8.1853 121.1886 60.5955 38.9788 177.4852 148 K 3.9218 8.0655 118.8570 59.1660 31.9303 179.1257 149 K 3.7532 7.7105 119.6935 59.1870 32.1098 178.3833 150 K 4.2415 7.1546 114.4267 56.8935 32.0981 177.1993 151 R 4.6011 7.7959 119.1079 55.6735 31.5493 175.5070 152 V 3.8160 7.7518 111.1551 62.7271 32.0445 177.0786 153 G 3.9698 9.0302 112.4182 45.3110 0.0000 173.9594 154 K 4.4748 7.5756 117.1587 55.8677 32.7046 175.2216 155 I 4.4393 7.1600 111.2664 58.8059 40.4754 171.8722 156 P 4.3979 0.0000 0.0000 62.6706 31.8805 177.1025 157 D 4.4286 8.5354 117.6906 57.1728 41.3911 177.4870 158 E 4.2939 8.0583 116.7812 57.5682 29.6402 178.1824 159 E 3.9355 7.8824 119.7741 58.9230 29.3977 178.2580 160 V 4.2051 7.6293 116.9686 64.6397 32.0758 177.5816 161 R 3.9472 7.8342 118.2339 59.5252 29.8962 178.6043 162 Q 4.0120 8.0494 117.4438 58.8892 28.1292 178.2745 163 A 4.1687 7.6424 122.1383 54.9811 18.1881 180.0910 164 V 3.6746 7.6106 110.6911 64.5246 31.3601 177.8783 165 E 3.9841 7.8571 118.1039 59.9706 28.2775 179.7020 166 K 4.3936 8.3248 117.9600 58.9217 32.1535 178.9174 167 F 4.6623 7.5798 117.8893 60.4336 39.5000 177.1467 168 E 3.6856 8.6903 118.4149 58.7020 29.4405 178.4602 169 E 4.0289 9.3052 117.3564 58.1779 29.5975 178.5096 170 S 4.4017 7.1449 113.9358 60.3128 63.0986 175.7606 171 K 3.5701 7.4315 121.4949 60.2391 31.7968 178.4400 172 E 4.0063 8.2076 119.9872 58.4473 29.6049 178.5699 173 L 3.8912 8.0503 120.8544 58.0836 41.9911 178.7937 174 A 4.1747 7.9439 118.9999 54.7232 18.4601 178.9704 175 E 4.0612 8.1570 117.5057 59.6909 30.3498 178.7216 176 R 4.1357 8.3759 119.0796 59.1756 30.1822 177.7457 177 S 4.4327 7.8756 111.1018 58.7218 62.3082 175.4689 *179 F 4.6571 7.9740 122.4362 57.8859 41.1177 176.3793 180 N 4.4105 8.3345 117.4046 56.5066 37.9289 176.9970 181 F 4.1589 7.8347 120.5185 61.5051 39.2870 176.9850 182 L 3.8748 7.4405 114.8896 56.5541 41.5017 178.1140 183 E 4.0458 7.5804 118.2919 57.0979 29.8913 176.7361 184 N 4.8416 7.2440 115.1396 52.9448 39.2212 176.0751 185 D 4.9471 7.6950 124.2578 55.2389 39.1896 178.0935 186 V 3.4987 7.7238 120.0272 66.4479 31.2945 177.4746 187 E 4.0160 8.7058 118.1470 59.3009 29.1596 179.4514 188 Q 4.0427 8.4867 118.6774 58.8804 28.9947 178.7508 189 V 3.6844 7.7294 112.8907 64.3822 31.4078 178.4035 190 S 4.1416 7.9908 113.0685 61.3576 62.0695 176.1918 191 Q 4.1171 7.9057 120.6119 58.7246 28.4093 178.4603 192 L 3.8656 8.2329 120.0883 57.4180 41.7291 179.2630 193 A 3.9469 7.8689 120.7988 54.8501 18.1250 179.8233 194 V 3.6075 7.5038 117.2594 65.7230 31.5627 178.2112 195 F 4.1413 7.6163 120.7360 61.3861 39.1022 177.2981 196 I 3.1252 7.6142 119.5660 64.0466 36.7304 177.9641 197 E 3.7528 7.9973 119.6647 59.0769 29.4016 178.8648 198 A 3.9544 7.6455 120.4281 55.2293 18.5643 179.4829 199 A 4.0320 7.7641 119.2687 55.0638 18.3452 179.3413 200 L 3.8429 8.4558 119.4402 58.4411 42.1646 178.4796 201 D 4.3278 8.4075 118.0877 57.8377 40.6260 177.6761 202 Y 4.1499 8.1194 119.6523 61.2288 38.6646 178.0663 203 H 3.7277 8.2177 116.9609 58.5296 28.8077 178.0147 204 R 3.8568 7.7409 119.4847 59.4934 30.1116 179.2670 205 Q 4.4277 7.9448 118.7802 58.1381 28.5000 179.1237 206 S 4.0367 7.4117 115.7173 61.7380 62.8943 176.6076 207 T 3.7986 8.1595 118.8602 66.4380 68.0887 176.2329 208 E 3.8893 8.5399 121.6295 59.3200 29.7184 178.9889 209 I 3.7501 7.5834 119.2695 64.3758 37.2021 178.0460 210 L 3.9218 7.9711 119.9628 58.0884 41.4573 179.4868 211 Q 3.8899 8.0288 118.9045 59.2319 29.0050 177.5995 212 E 3.8725 7.8305 120.2749 59.4991 29.5361 178.7761 213 L 3.9137 7.8252 119.7487 58.3031 42.3518 178.6108 214 Q 4.0932 8.4088 119.8638 59.2088 28.6117 178.7166 215 S 4.1029 8.0567 115.6220 61.6289 63.0346 176.4114 216 K 4.1126 7.6190 119.2535 59.4008 32.0180 179.1164 217 L 4.2140 8.4156 119.7350 57.7591 41.4292 179.7350 218 Q 3.9996 7.7149 113.6833 57.1432 28.6317 178.6260 *220 R 4.3131 7.8463 120.2456 56.4798 31.7585 178.0295 221 I 3.7577 8.1315 118.8344 64.2683 36.8494 178.5260 222 S 3.9381 8.8771 114.3033 61.4642 62.1730 176.1348 223 A 3.9701 8.0402 121.2651 54.5339 18.1989 178.2933 224 A 4.3292 7.5801 116.7001 53.0054 19.1778 177.8683 225 S 4.6020 7.2524 112.1116 59.5922 64.9274 175.1123 226 S 4.5719 8.1486 115.7860 58.9829 62.7058 174.3255 227 V 4.4560 7.0474 112.7638 59.9693 34.4580 176.6401 228 P 4.0647 0.0000 0.0000 63.6917 31.6996 175.9208 229 R 4.1428 7.9564 120.3696 57.0207 30.0422 173.8755 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 D 8.22 4.68 0.00 2.92 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 8 D 8.40 4.41 0.00 2.91 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 9 E 8.59 3.62 0.00 2.01 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 0.00 2.37 2.38 0.00 10 F 8.49 4.31 0.00 2.93 3.28 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 11 L 8.16 4.22 0.00 1.82 1.78 0.99 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.99 4.72 0.00 2.71 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *14 E 8.33 4.11 0.00 1.85 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 2.25 2.25 0.00 15 R 7.69 3.89 0.00 2.01 2.02 0.00 3.16 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 16 K 7.97 3.97 0.00 1.85 1.83 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.75 1.61 7.81 17 I 7.81 3.84 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.77 0.80 0.00 0.00 18 D 8.21 4.28 0.00 2.85 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 19 V 7.90 3.59 2.20 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 0.90 0.00 0.00 1.01 0.00 0.00 20 T 8.28 3.89 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 21 N 7.86 4.46 0.00 2.80 2.84 0.00 0.00 7.12 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 K 7.75 3.94 0.00 1.93 1.87 0.00 2.02 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.51 7.81 23 V 8.22 3.53 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.00 0.00 0.00 24 V 8.64 3.50 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 0.90 0.00 0.00 0.99 0.00 0.00 25 A 8.47 3.95 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 26 E 7.95 3.90 0.00 2.22 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 2.34 2.50 0.00 27 I 8.07 3.66 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.83 0.74 0.00 0.00 28 L 7.78 3.76 0.00 1.82 1.61 0.83 0.32 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 29 S 7.90 4.09 0.00 3.88 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 30 K 8.24 4.05 0.00 1.73 1.87 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.71 1.63 7.81 31 T 8.11 3.91 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 32 T 7.69 3.88 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 1.19 0.00 0.00 33 E 8.80 4.16 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.60 0.00 34 Y 7.88 4.27 0.00 3.03 3.32 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 35 L 8.12 3.98 0.00 1.80 1.71 1.02 1.18 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 36 Q 8.00 4.51 0.00 1.81 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.91 0.00 0.00 0.00 0.00 0.00 2.01 2.53 0.00 37 P 0.00 4.42 0.00 2.08 2.13 0.00 3.76 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.20 0.00 38 N 8.03 4.45 0.00 2.80 2.72 0.00 0.00 7.21 7.71 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 39 P 0.00 4.24 0.00 2.10 2.03 0.00 3.54 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 2.06 2.11 0.00 40 A 7.76 3.75 0.48 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 41 Y 7.23 4.62 0.00 2.61 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 7.45 3.83 0.00 1.92 1.94 0.00 3.08 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 43 A 7.82 3.95 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 K 7.28 4.10 0.00 1.83 2.16 0.00 2.00 0.00 0.00 2.05 0.00 0.00 3.09 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.60 1.55 7.81 45 L 7.50 4.66 0.00 1.64 1.91 0.91 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.86 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *48 L 7.68 4.12 0.00 1.73 1.71 1.06 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 49 N 8.46 5.12 0.00 2.67 2.70 0.00 0.00 7.15 7.54 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 50 T 8.29 4.18 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 51 V 8.11 4.17 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 0.72 0.00 0.00 0.95 0.00 0.00 52 S 8.33 4.54 0.00 3.97 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 53 K 8.02 5.00 0.00 1.72 1.87 0.00 1.80 0.00 0.00 0.61 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.37 7.81 54 I 8.02 3.89 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 1.47 0.46 0.91 0.00 0.00 55 R 9.17 4.55 0.00 1.86 1.95 0.00 3.08 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 56 G 7.30 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 0.00 0.00 0.00 0.00 57 Q 7.87 4.55 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 58 V 7.74 4.11 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 0.81 0.00 0.00 0.91 0.00 0.00 59 K 8.34 4.34 0.00 1.74 1.74 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.39 7.81 60 T 8.02 4.12 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 61 T 8.41 3.93 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 0.96 0.00 0.00 62 G 9.65 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 6.25 4.65 0.00 1.80 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 64 P 0.00 4.43 0.00 2.17 2.05 0.00 3.20 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.01 0.00 65 Q 8.08 4.77 0.00 2.03 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.88 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 66 T 8.52 3.91 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 1.27 0.00 0.00 67 E 8.40 4.07 0.00 2.10 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 2.45 2.49 0.00 68 G 7.85 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 0.00 0.00 0.00 69 L 8.07 4.06 0.00 1.95 1.74 1.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 70 L 8.33 4.03 0.00 1.88 1.72 0.95 1.08 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 71 G 7.89 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.21 4.58 0.00 2.90 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 73 C 7.54 4.38 0.00 3.24 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 L 7.86 4.16 0.00 1.85 1.71 0.93 0.54 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 76 K 8.40 3.67 0.00 1.64 1.76 0.00 1.43 0.00 0.00 1.38 0.00 0.00 2.71 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.47 1.13 7.81 77 Y 7.98 4.48 0.00 3.11 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 78 G 7.94 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 0.00 0.00 0.00 79 K 7.89 4.10 0.00 1.73 1.83 0.00 1.68 0.00 0.00 1.53 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.48 7.81 80 E 7.51 3.94 0.00 2.13 2.22 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 2.40 2.37 0.00 81 L 7.93 4.19 0.00 1.86 1.77 0.92 0.88 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 82 G 6.91 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.58 3.88 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 84 D 7.90 4.59 0.00 2.72 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 85 S 8.14 4.30 0.00 3.91 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 86 T 8.51 3.98 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 1.26 0.00 0.00 87 F 8.35 4.57 0.00 3.03 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.04 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 N 8.11 4.32 0.00 3.10 2.88 0.00 0.00 6.89 6.47 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 90 A 8.37 4.01 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 91 L 7.93 3.83 0.00 1.54 1.51 0.67 -0.08 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 92 I 7.85 3.66 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.08 0.91 0.00 0.00 93 E 7.87 4.14 0.00 2.05 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 2.32 2.31 0.00 94 V 8.07 3.75 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 0.82 0.00 0.00 0.98 0.00 0.00 95 G 7.88 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 2.81 0.00 0.00 0.00 0.00 1.60 1.64 7.81 106 D 8.68 4.38 0.00 2.86 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.79 4.21 0.00 4.13 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 7.83 3.96 0.00 1.58 1.64 0.90 0.15 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 0.00 109 D 8.00 4.38 0.00 3.06 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 I 7.93 3.72 1.89 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 0.89 0.93 0.00 0.00 111 N 8.38 4.31 0.00 2.98 2.93 0.00 0.00 6.80 7.83 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 0.00 112 V 8.14 3.94 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 1.23 0.00 0.00 113 K 8.35 3.96 0.00 2.06 2.08 0.00 1.74 0.00 0.00 1.86 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.87 7.81 114 Q 8.69 4.16 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.62 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 115 T 7.79 4.54 4.33 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 1.27 0.00 0.00 116 F 7.84 5.02 0.00 3.02 3.29 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 0.00 117 I 8.26 3.44 2.00 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 1.25 0.44 0.82 0.00 0.00 118 D 8.40 4.31 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 0.00 119 P 0.00 4.23 0.00 2.21 2.15 0.00 3.70 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.18 0.00 120 L 7.66 4.04 0.00 1.74 1.39 0.93 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 121 Q 8.09 3.77 0.00 2.35 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.27 0.00 122 L 7.86 3.95 0.00 1.72 1.86 0.92 1.17 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 0.00 123 L 7.77 4.12 0.00 2.02 1.84 1.15 0.83 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 0.00 124 Q 7.57 4.01 0.00 2.31 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.55 0.00 0.00 0.00 0.00 0.00 2.33 2.55 0.00 125 D 8.15 4.53 0.00 2.63 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 0.00 126 K 8.51 4.40 0.00 1.86 1.51 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.42 7.81 127 D 8.41 4.31 0.00 2.91 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 7.72 3.74 0.00 1.56 1.62 1.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 129 K 7.79 3.81 0.00 1.95 1.94 0.00 1.72 0.00 0.00 1.90 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.49 7.81 130 E 8.48 3.85 0.00 2.22 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 2.32 2.39 0.00 131 I 7.36 3.77 1.81 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.19 0.82 0.00 0.00 132 G 8.19 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 0.00 133 H 8.32 4.22 0.00 3.36 3.32 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 H 7.98 4.28 0.00 3.24 3.36 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 7.89 4.10 0.00 1.90 1.78 0.93 0.62 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 0.00 136 K 7.92 4.68 0.00 2.09 1.98 0.00 1.86 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.38 7.81 137 K 8.40 4.06 0.00 2.00 2.07 0.00 1.60 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.53 7.81 138 L 8.08 4.09 0.00 2.00 1.95 0.69 0.66 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 0.00 139 E 8.43 4.21 0.00 2.25 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 2.40 2.65 0.00 140 G 7.83 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 0.00 141 R 7.76 4.03 0.00 2.25 2.25 0.00 3.44 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 142 R 8.77 3.92 0.00 2.39 2.22 0.00 3.30 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 2.12 0.00 143 L 8.12 4.08 0.00 1.91 1.69 0.95 1.11 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 0.00 144 D 8.72 4.42 0.00 2.90 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 0.00 145 Y 9.08 4.12 0.00 3.09 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 0.00 146 D 7.46 3.79 0.00 2.67 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 0.00 147 Y 8.19 4.06 0.00 3.10 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 0.00 148 K 8.07 3.92 0.00 1.86 1.83 0.00 1.97 0.00 0.00 1.98 0.00 0.00 3.09 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.82 1.66 7.81 149 K 7.71 3.75 0.00 0.85 1.45 0.00 1.41 0.00 0.00 1.53 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.25 1.28 7.81 150 K 7.15 4.24 0.00 1.66 1.63 0.00 1.60 0.00 0.00 1.63 0.00 0.00 3.10 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.35 1.51 7.81 151 R 7.80 4.60 0.00 1.71 1.69 0.00 2.33 0.00 0.00 2.75 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.29 0.00 152 V 7.75 3.82 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 0.71 0.00 0.00 0.89 0.00 0.00 153 G 9.03 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 0.00 0.00 0.00 154 K 7.58 4.47 0.00 1.83 1.77 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.28 7.81 155 I 7.16 4.44 2.05 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.35 0.91 0.00 0.00 156 P 0.00 4.40 0.00 2.21 2.06 0.00 3.89 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 2.13 2.09 0.00 157 D 8.54 4.43 0.00 2.76 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 E 8.06 4.29 0.00 2.05 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 2.41 2.25 0.00 159 E 7.88 3.94 0.00 2.22 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 0.00 2.33 2.40 0.00 160 V 7.63 4.21 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 1.05 0.00 0.00 0.97 0.00 0.00 161 R 7.83 3.95 0.00 2.01 2.00 0.00 3.16 0.00 0.00 3.62 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.70 0.00 162 Q 8.05 4.01 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 163 A 7.64 4.17 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 V 7.61 3.67 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 1.04 0.00 0.00 1.02 0.00 0.00 165 E 7.86 3.98 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.55 0.00 166 K 8.32 4.39 0.00 1.89 1.92 0.00 1.68 0.00 0.00 1.60 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.49 7.81 167 F 7.58 4.66 0.00 3.24 3.12 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 0.00 168 E 8.69 3.69 0.00 1.93 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.53 0.00 169 E 9.31 4.03 0.00 1.96 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 0.00 2.32 2.45 0.00 170 S 7.14 4.40 0.00 4.24 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 0.00 171 K 7.43 3.57 0.00 1.38 1.38 0.00 0.61 0.00 0.00 1.23 0.00 0.00 2.41 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.22 1.14 7.81 172 E 8.21 4.01 0.00 1.99 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 2.27 2.27 0.00 173 L 8.05 3.89 0.00 1.81 1.78 0.78 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 174 A 7.94 4.17 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 0.00 0.00 0.00 0.00 0.00 175 E 8.16 4.06 0.00 2.55 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 176 R 8.38 4.14 0.00 2.13 1.95 0.00 3.14 0.00 0.00 3.07 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 177 S 7.88 4.43 0.00 4.14 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 *179 F 7.97 4.66 0.00 3.31 3.29 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 0.00 180 N 8.33 4.41 0.00 2.92 2.95 0.00 0.00 6.75 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 F 7.83 4.16 0.00 3.16 3.06 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 0.00 182 L 7.44 3.87 0.00 1.66 1.57 0.92 0.91 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 0.00 183 E 7.58 4.05 0.00 1.45 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 2.15 2.26 0.00 184 N 7.24 4.84 0.00 2.70 2.86 0.00 0.00 6.57 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 0.00 185 D 7.69 4.95 0.00 2.71 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 0.00 186 V 7.72 3.50 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 1.03 0.00 0.00 0.91 0.00 0.00 187 E 8.71 4.02 0.00 2.06 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 2.31 2.39 0.00 188 Q 8.49 4.04 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 189 V 7.73 3.68 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 0.97 0.00 0.00 0.96 0.00 0.00 190 S 7.99 4.14 0.00 3.91 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 Q 7.91 4.12 0.00 2.39 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.45 2.75 0.00 192 L 8.23 3.87 0.00 1.89 1.72 0.96 0.77 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 0.00 193 A 7.87 3.95 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 0.00 194 V 7.50 3.61 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.04 0.00 0.00 195 F 7.62 4.14 0.00 1.51 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 I 7.61 3.13 1.72 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.86 0.75 0.00 0.00 197 E 8.00 3.75 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 198 A 7.65 3.95 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 A 7.76 4.03 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 0.00 0.00 200 L 8.46 3.84 0.00 1.95 1.75 0.89 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 201 D 8.41 4.33 0.00 2.82 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 0.00 202 Y 8.12 4.15 0.00 3.12 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 H 8.22 3.73 0.00 3.35 3.23 0.00 5.67 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 R 7.74 3.86 0.00 1.95 1.95 0.00 3.11 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 1.81 0.00 205 Q 7.94 4.43 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 206 S 7.41 4.04 0.00 3.81 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 0.00 207 T 8.16 3.80 4.35 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 1.18 0.00 0.00 208 E 8.54 3.89 0.00 2.12 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 2.29 2.34 0.00 209 I 7.58 3.75 1.97 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.91 0.90 0.00 0.00 210 L 7.97 3.92 0.00 1.85 1.73 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 211 Q 8.03 3.89 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.70 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 212 E 7.83 3.87 0.00 2.13 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 2.31 2.34 0.00 213 L 7.83 3.91 0.00 1.82 1.85 0.92 0.71 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 0.00 214 Q 8.41 4.09 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 215 S 8.06 4.10 0.00 4.08 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 K 7.62 4.11 0.00 1.86 1.99 0.00 1.71 0.00 0.00 1.91 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.67 7.81 217 L 8.42 4.21 0.00 1.81 1.73 0.95 0.90 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 0.00 218 Q 7.71 4.00 0.00 2.28 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.39 0.00 0.00 0.00 0.00 0.00 2.39 2.69 0.00 *220 R 7.85 4.31 0.00 2.11 2.03 0.00 3.43 0.00 0.00 3.35 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.99 0.00 221 I 8.13 3.76 2.02 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 1.43 0.99 0.92 0.00 0.00 222 S 8.88 3.94 0.00 3.91 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 A 8.04 3.97 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 0.00 224 A 7.58 4.33 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 S 7.25 4.60 0.00 3.74 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 0.00 226 S 8.15 4.57 0.00 3.85 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 0.00 227 V 7.05 4.46 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 0.86 0.00 0.00 0.96 0.00 0.00 228 P 0.00 4.06 0.00 2.06 2.06 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 229 R 7.96 4.14 0.00 1.90 1.89 0.00 3.10 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.34 0.00 * Residues marked with a * may have inaccurate shift predictions.