NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5530 8.1627 120.2748 55.1588 33.8957 173.8577 2 K 4.8814 8.5784 125.0401 54.3971 35.3373 173.5186 3 I 4.5962 9.7051 129.8648 59.4727 40.4413 174.3630 4 D 5.1044 8.7701 126.8428 54.3558 41.9083 175.8793 5 I 4.3513 8.2633 122.2941 59.8976 41.1338 175.7669 6 L 3.6127 8.5102 124.6839 56.5065 40.0112 175.9123 7 D 4.8507 8.8815 120.8015 55.3503 40.4592 178.2665 8 K 4.5127 8.1217 114.6066 55.5535 34.5115 175.6892 9 G 4.2257 7.8523 108.4602 45.3465 0.0000 172.4151 10 F 5.3186 7.6635 112.6011 56.5149 41.7575 173.1707 11 V 4.9115 8.8909 119.1973 61.2006 34.5771 173.6980 12 E 5.1919 9.3510 128.3608 54.2121 33.0111 174.1021 13 L 4.3099 8.6612 129.5420 55.1422 42.0830 176.2765 14 V 3.9158 8.5471 127.4266 65.1010 32.5552 174.8670 15 D 4.6464 7.3929 117.5310 53.7874 44.8862 173.9384 16 V 4.4682 7.7116 117.6032 60.7313 34.0347 172.1401 17 M 4.3498 8.7303 124.6515 54.7221 34.6379 176.7564 18 G 4.2288 9.7360 114.5939 45.2275 0.0000 170.5568 19 N 4.7584 8.4067 113.3729 51.1109 39.5515 174.1243 20 D 4.5027 8.8519 116.1683 58.3940 40.8159 178.6890 21 L 4.1988 8.2034 118.7857 57.3909 41.4967 179.7023 22 S 4.1633 8.3639 115.8325 61.4731 62.6511 176.4036 23 A 4.3274 7.8707 124.8408 54.2937 18.1595 179.9505 24 V 3.4761 7.6014 116.4146 66.3123 31.7813 178.2835 25 R 3.8536 8.4271 117.9939 59.1135 29.6350 179.0156 26 A 3.8189 7.7159 119.3419 55.1577 18.5032 179.2930 27 A 4.0005 7.9394 118.1168 54.9923 18.4648 179.3689 28 R 4.0469 7.7357 114.5893 55.6370 31.4733 176.4647 29 V 3.2950 7.7509 117.3534 63.5583 29.9942 171.8181 30 S 4.8506 7.1732 111.9045 57.5926 67.9221 175.9189 31 F 3.5884 9.1562 122.2323 59.0901 37.2774 176.7716 *36 K 4.3645 8.7551 126.3047 56.5566 34.1137 176.1464 37 D 4.6197 8.8856 122.2832 51.0722 42.2320 175.1916 38 E 3.7367 8.8520 124.8927 59.3386 29.7470 177.4796 39 E 3.7898 8.2095 117.3633 59.8749 29.4172 179.3927 40 R 3.8348 7.9857 116.7070 59.5105 30.3387 178.4716 41 D 4.4004 8.5267 118.6723 57.7936 40.9688 179.3321 42 R 3.6274 7.8522 119.1274 59.4213 29.8062 178.0025 43 H 4.1989 8.0009 118.1633 59.0357 29.8292 177.0139 44 L 3.9364 8.2131 122.4130 58.2548 41.9675 178.8499 45 I 3.9887 7.9814 119.7430 64.7512 37.0115 178.2973 46 E 4.1140 8.3858 119.2997 59.4130 29.3005 178.6787 47 Y 3.8648 8.2200 119.8782 60.6463 38.7834 178.2136 48 L 4.1001 8.5610 120.2344 58.1893 41.9110 179.2577 49 M 4.0941 8.2620 118.1017 58.5649 31.9609 178.1899 50 K 3.7489 7.8105 119.1458 58.7220 32.1952 177.5812 51 H 4.6983 7.4100 114.1169 54.6640 29.1070 174.9584 52 G 3.8913 7.3126 106.2281 47.0760 0.0000 175.1962 53 H 4.7967 8.1700 119.3412 54.4440 27.6158 174.8623 54 E 4.7265 8.4420 123.8494 58.0158 30.6123 179.0094 55 T 4.2181 8.1486 108.7482 63.5263 68.7933 174.3446 56 P 4.2151 0.0000 0.0000 65.2070 31.6048 177.9266 57 F 4.5407 7.8981 115.4395 59.2274 38.7714 177.0252 58 E 4.3473 8.3459 120.5015 58.7002 29.3362 177.7911 59 H 4.6079 8.1037 114.3294 56.2107 29.3746 174.5394 60 I 4.6673 7.6999 121.7074 59.4498 39.6212 174.8843 61 V 4.8944 8.3176 125.7975 61.1486 35.0947 174.0933 62 F 5.0327 9.2153 125.1766 55.8602 42.9110 174.3867 63 T 4.8342 8.1550 117.2476 61.9697 71.6833 173.2697 64 F 5.2120 9.6166 125.3995 55.8038 43.0835 174.0576 65 H 4.8801 9.2977 120.9808 54.4358 32.0267 172.6947 66 V 4.4932 8.3160 126.0478 60.5880 34.7290 174.0284 67 K 4.6337 7.9634 127.6451 54.5657 34.4502 174.5827 68 A 5.1942 8.6090 127.7106 50.1338 23.3111 173.6888 69 P 4.1645 0.0000 0.0000 62.0503 32.1934 178.0869 70 I 3.5015 8.4670 123.2683 64.5171 36.5320 178.9370 71 F 4.2333 8.2085 115.3140 59.6665 37.4912 177.8495 72 V 3.1417 6.4538 118.1817 65.5837 31.4481 177.6747 73 A 3.9233 7.7289 120.5062 55.1899 17.8663 179.8190 74 R 3.8096 7.9136 116.1885 59.2889 30.4529 179.0617 75 Q 4.1513 7.6664 117.6991 58.4746 28.7796 178.1763 76 W 4.2753 8.3743 129.4698 60.6907 30.6360 177.7327 77 F 3.6251 8.7773 115.0549 58.9856 38.2720 177.1285 78 R 4.3748 7.8556 117.2272 57.6644 30.2915 176.5251 79 H 4.6481 8.1561 116.1408 54.8275 27.5121 175.2405 80 R 4.2046 8.5458 124.4920 58.9119 30.5979 178.3192 81 I 4.1156 7.5907 119.6755 58.2824 35.5241 173.4525 82 A 4.3694 7.0136 122.9124 51.6543 22.5591 176.0592 83 S 4.8499 8.3762 114.9760 57.1241 65.9950 173.6297 84 Y 5.7393 8.5467 119.8654 55.5106 42.0942 175.0362 85 N 5.0065 8.9374 118.6815 52.4419 42.5936 173.0659 86 E 5.4366 8.8798 124.4322 53.6703 33.0186 175.1306 87 L 4.1417 8.7274 126.7047 55.6238 43.1521 176.2022 88 S 4.7676 8.7029 119.4696 56.4921 63.9062 174.7950 89 G 3.8858 8.7166 116.0442 47.1192 0.0000 174.5212 90 R 4.0930 7.9356 118.5892 58.2623 30.3655 177.0126 91 Y 4.4977 8.1210 112.7060 57.7380 39.5535 175.6473 92 S 4.8859 8.0032 115.2663 56.0808 65.6728 173.5999 93 K 4.3407 8.5709 125.1116 56.0187 32.6127 176.6454 94 L 4.4228 8.8889 126.9591 54.5283 42.4231 177.0062 95 S 4.7376 8.3610 117.8948 58.0801 64.1909 174.6938 96 Y 3.9560 8.1425 124.5416 56.6729 36.6662 173.4075 97 E 4.5016 7.3127 119.5633 54.2726 33.5203 174.8513 98 F 5.4027 8.7609 122.2298 55.6387 43.3479 174.1140 99 Y 5.2478 8.8696 122.8726 56.4175 39.2674 174.9478 100 I 4.0998 8.3848 128.6994 58.5017 38.3880 174.1386 101 P 4.0178 0.0000 0.0000 62.3703 31.8943 176.7359 102 S 4.5009 8.3641 116.3014 56.9355 64.4651 173.2815 103 P 4.1653 0.0000 0.0000 65.8280 30.9085 178.5362 104 E 3.9341 7.7516 117.8873 59.0551 29.2503 178.7102 105 R 3.6060 7.8577 118.2021 58.2720 30.0977 176.8864 106 L 4.5717 7.3766 116.5692 54.1806 42.0007 175.5656 107 E 4.0859 7.8836 120.2398 57.3829 29.5581 177.1214 108 G 4.0102 9.0710 111.0474 45.3205 0.0000 172.7117 109 Y 4.4683 7.4840 117.0389 55.6810 40.6427 175.7340 110 K 4.2370 8.7009 125.6351 55.8167 31.5084 175.7761 111 T 4.6428 8.1184 116.3044 60.1078 70.9083 174.5835 112 T 4.4082 8.3496 112.4986 61.6581 69.2248 174.3351 113 I 4.6372 7.1279 113.8954 58.6608 40.7271 172.8978 114 P 4.3237 0.0000 0.0000 62.2431 32.0786 175.5533 115 P 4.2830 0.0000 0.0000 66.1916 31.2100 178.7458 116 E 4.0081 8.1570 116.4445 59.2099 29.2953 179.1953 117 R 3.9252 8.4205 119.4712 59.1608 30.0176 178.6991 118 V 3.5602 7.5706 117.8391 65.9895 31.5194 178.0096 119 T 3.7648 7.7861 115.5112 66.5729 68.2479 176.1786 120 E 3.8955 8.2054 121.1325 59.2222 29.7693 179.0449 121 K 3.9414 8.1987 118.5519 59.4540 32.1276 179.4466 122 I 3.6422 7.9084 120.2716 64.4781 36.9636 178.5076 123 S 4.0410 8.2356 114.1342 61.0400 62.1410 175.7331 124 E 3.8794 8.3688 122.3007 59.3657 29.4127 178.6683 125 I 3.6311 7.5423 118.1484 63.9816 38.0268 177.8055 126 V 3.2786 7.6787 119.1176 66.0247 31.2289 177.5195 127 D 4.4981 8.3050 117.7856 57.2854 41.0657 178.3930 128 K 3.9590 8.2781 118.8125 59.3472 32.1082 179.0854 129 A 4.0243 8.3624 121.4602 55.4824 18.2397 179.0592 130 Y 4.1980 8.2678 117.9768 60.9032 38.8822 178.0972 131 R 3.8786 8.1865 119.6917 59.8423 30.0576 178.6649 132 T 3.8571 8.0138 115.5218 66.5765 68.4175 175.9532 133 Y 4.1060 8.0237 121.4398 60.8045 38.7349 178.3011 134 L 3.5774 7.8699 119.9264 57.7706 41.6921 179.4007 135 E 3.8862 8.2398 118.5371 59.3064 29.3487 179.5029 136 L 3.9315 8.1191 119.3820 57.6403 41.6486 179.5497 137 I 3.5160 7.4961 119.6858 64.4758 36.8281 178.2729 138 E 3.9008 7.9641 118.0898 59.4599 29.4018 179.0540 139 S 4.2556 7.7431 111.2120 59.4928 62.4866 174.7521 140 G 3.9191 7.8690 109.2601 45.4630 0.0000 173.7386 141 V 3.7323 7.4169 119.9961 61.4340 32.2923 174.7345 142 P 4.3048 0.0000 0.0000 62.7627 33.0701 177.4817 143 R 3.9380 8.5600 121.1841 59.5801 29.9475 179.1461 144 E 3.9894 8.1849 115.2079 59.0721 29.5088 178.5001 145 V 3.9758 7.5213 117.8365 64.9711 31.9896 177.5275 146 A 4.1502 8.5804 121.0542 54.8326 18.2848 179.0001 147 R 4.0477 8.3309 113.3537 57.4483 29.6450 178.1199 148 I 3.9900 7.5392 112.5376 62.7747 37.8787 177.0844 149 V 4.0150 7.1890 113.4155 62.0955 31.9885 176.3205 150 L 4.3150 7.5139 121.3991 53.4898 42.2707 175.3624 151 P 4.5731 0.0000 0.0000 62.3743 32.2771 177.0191 152 L 4.3244 8.5276 118.8988 56.9155 42.4036 177.9432 153 N 5.0773 8.3531 116.1071 52.7600 38.8392 174.6224 154 L 3.7306 8.0206 123.2512 55.6264 43.2430 175.5579 155 Y 4.5537 8.3230 124.2547 57.8883 38.9597 174.6102 156 T 4.7811 9.1920 117.5654 60.3121 71.7303 172.3506 157 R 5.3392 8.3479 121.1620 54.5990 34.6775 174.4811 158 F 5.6049 8.8239 116.1949 56.1382 42.1808 172.6507 159 F 5.2118 9.7385 119.0960 55.7849 41.2901 174.8634 160 W 5.3102 9.4989 133.0501 56.0139 33.6646 173.7700 161 T 4.9728 8.6213 124.6018 61.6449 70.5176 173.8508 162 V 4.5321 8.2626 125.5189 59.9504 35.1148 174.4770 163 N 5.0352 8.5569 119.8546 51.7649 38.9801 175.7143 164 A 3.7736 9.0797 121.6850 55.3300 18.4090 180.1898 165 R 3.7919 8.0556 116.4975 59.8261 30.3622 178.6149 166 S 4.1528 8.8999 113.2302 61.2136 62.3059 175.8467 167 L 3.8621 7.9834 123.5881 58.2448 41.6340 178.8977 168 M 3.5102 7.7638 118.7827 58.0005 31.8147 178.2111 169 N 4.3773 8.1093 117.0874 56.5299 39.1428 176.6515 170 F 4.0833 8.3848 122.0627 61.3325 39.4941 177.0390 171 L 3.9707 8.2341 118.5331 57.9906 41.2489 179.0842 172 N 4.5025 8.4518 115.3743 56.4879 38.5770 176.9803 173 L 4.1684 7.6429 118.6381 57.2880 41.8053 178.8603 174 R 3.9889 8.1145 117.3159 56.9342 32.0036 176.7989 175 A 4.6019 7.9492 124.5376 49.8757 17.3897 175.6083 176 D 5.0424 7.2844 120.9602 51.9919 44.7632 176.2073 177 S 4.2463 8.9942 120.3128 61.2891 63.0356 175.4196 178 H 4.3191 8.2148 117.4662 57.8535 28.7828 175.8413 179 A 4.2468 7.6965 121.6789 51.1375 19.1722 177.4955 180 Q 4.1639 8.5177 120.5444 55.9367 30.9770 177.1877 181 W 4.2835 9.1277 135.0000 61.0276 30.7903 177.9191 182 E 3.7082 8.6329 117.6535 59.6312 28.8848 179.1290 183 I 3.8841 7.6793 117.6274 63.5098 38.0933 177.5455 184 Q 4.0820 7.5651 120.5945 58.4011 28.4074 178.8558 185 Q 3.6792 7.3172 118.4744 59.1695 28.5203 178.7755 186 Y 3.8188 7.4273 116.4543 60.8703 37.8204 178.2402 187 A 4.0857 8.2100 122.0426 55.1716 18.3866 179.6877 188 L 3.9044 7.9411 117.2183 57.8592 41.5630 179.6204 189 A 3.9784 7.7150 120.8147 55.1926 18.3488 179.6769 190 I 3.5466 8.1336 118.4471 64.4785 37.1845 178.5091 191 A 4.1962 8.3335 121.7413 55.2050 18.2181 179.8574 192 R 3.7820 7.9592 116.5345 59.5561 30.1762 179.4301 193 I 3.7908 7.6147 119.4069 64.1950 37.0442 178.3129 194 F 4.3299 8.2907 121.5881 61.2986 39.0285 177.1161 195 K 3.3613 7.8646 118.2419 59.1807 31.8206 178.3004 196 E 4.0204 7.8412 118.1612 59.2538 29.4868 178.9652 197 K 4.2741 7.9960 116.9395 57.6048 34.0398 177.1771 198 C 4.9398 8.2387 116.4575 56.3658 28.8050 172.5731 199 P 4.3182 0.0000 0.0000 65.8870 31.2057 178.8011 200 W 4.5079 8.2036 118.1323 59.7673 29.0467 178.5856 201 T 4.0315 8.4261 115.8121 66.5561 67.8780 176.3516 202 F 4.0726 8.0734 122.5012 61.5585 39.3920 177.0118 203 E 3.9009 8.4852 117.7881 59.3978 29.2435 179.3048 204 A 4.1639 8.2377 120.8881 54.9227 18.4536 179.3600 205 F 4.2327 8.8320 119.5776 61.7072 39.3068 177.4160 206 L 3.5862 7.5089 117.2273 57.4446 41.3708 179.2214 207 K 3.8168 7.7457 118.8255 58.6985 32.1412 177.6000 208 Y 4.6672 7.9863 114.4109 57.9194 40.0617 176.2919 209 A 4.5496 7.7935 120.0179 52.4542 21.4230 175.9511 210 Y 3.8679 7.5113 117.0554 58.3867 38.7562 176.2694 211 K 3.9873 9.5585 127.1764 56.7083 33.2682 177.0461 212 G 3.7235 5.9675 107.2108 44.3415 0.0000 172.4250 213 D 4.7528 8.0777 115.6969 55.0487 40.6260 178.2420 214 I 3.7690 7.9042 114.4799 63.8642 37.0454 177.8562 215 L 4.0067 8.2493 119.4204 57.1075 41.4207 178.8933 216 K 4.2387 7.9788 116.0489 55.9626 32.3872 177.7978 217 E 4.1625 8.5927 119.4130 55.7629 28.9864 178.2630 218 V 3.5451 8.8179 115.2616 62.4891 32.7987 176.1123 219 Q 4.0930 8.6222 125.4566 56.5956 29.7541 176.2147 220 V 3.6212 8.3877 114.1677 62.0081 31.8168 173.0804 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 1 M 8.16 4.55 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 2 K 8.58 4.88 0.00 1.68 1.54 0.00 1.54 0.00 0.00 1.42 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.14 1.31 7.81 3 I 9.71 4.60 1.90 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 1.24 0.69 0.89 0.00 0.00 4 D 8.77 5.10 0.00 2.58 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 5 I 8.26 4.35 1.09 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.63 -0.10 0.00 0.00 6 L 8.51 3.61 0.00 1.95 1.63 0.51 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.88 4.85 0.00 2.77 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 8 K 8.12 4.51 0.00 0.79 1.28 0.00 1.59 0.00 0.00 1.55 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.25 1.40 7.81 9 G 7.85 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 F 7.66 5.32 0.00 3.04 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 11 V 8.89 4.91 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 1.17 0.00 0.00 1.18 0.00 0.00 12 E 9.35 5.19 0.00 2.02 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 2.17 2.30 0.00 13 L 8.66 4.31 0.00 1.74 1.56 0.75 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 14 V 8.55 3.92 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 0.78 0.00 0.00 0.45 0.00 0.00 15 D 7.39 4.65 0.00 2.65 2.34 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 16 V 7.71 4.47 1.67 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 0.45 0.00 0.00 0.15 0.00 0.00 17 M 8.73 4.35 0.00 1.92 1.82 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 18 G 9.74 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.41 4.76 0.00 2.76 2.81 0.00 0.00 7.42 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.85 4.50 0.00 2.49 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 21 L 8.20 4.20 0.00 1.89 1.75 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.36 4.16 0.00 4.01 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.87 4.33 1.13 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 0.00 0.00 24 V 7.60 3.48 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 1.09 0.00 0.00 25 R 8.43 3.85 0.00 1.91 1.94 0.00 3.21 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 26 A 7.72 3.82 1.15 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 0.00 0.00 27 A 7.94 4.00 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 28 R 7.74 4.05 0.00 1.74 1.91 0.00 3.18 0.00 0.00 3.04 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00 29 V 7.75 3.30 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.96 0.00 0.00 30 S 7.17 4.85 0.00 3.99 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 31 F 9.16 3.59 0.00 3.02 2.39 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 *36 K 8.76 4.36 0.00 1.97 1.86 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.36 7.81 37 D 8.89 4.62 0.00 2.60 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.85 3.74 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.02 0.00 39 E 8.21 3.79 0.00 1.99 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 2.36 2.38 0.00 40 R 7.99 3.83 0.00 1.92 1.94 0.00 3.28 0.00 0.00 3.30 7.54 0.00 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0.00 0.00 0.00 49 M 8.26 4.09 0.00 2.26 2.30 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.86 0.00 50 K 7.81 3.75 0.00 0.79 1.34 0.00 1.27 0.00 0.00 1.29 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.82 1.03 7.81 51 H 7.41 4.70 0.00 2.68 2.92 0.00 5.83 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 G 7.31 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 53 H 8.17 4.80 0.00 3.25 3.32 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 8.44 4.73 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 55 T 8.15 4.22 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 1.26 0.00 0.00 56 P 0.00 4.22 0.00 1.49 2.06 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 57 F 7.90 4.54 0.00 3.42 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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 66 V 8.32 4.49 0.67 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 0.33 0.00 0.00 0.40 0.00 0.00 67 K 7.96 4.63 0.00 0.79 0.74 0.00 1.55 0.00 0.00 1.51 0.00 0.00 2.37 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.17 1.14 7.81 68 A 8.61 5.19 0.58 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 69 P 0.00 4.16 0.00 1.24 1.74 0.00 3.00 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.00 0.00 70 I 8.47 3.50 1.98 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 1.42 0.77 0.80 0.00 0.00 71 F 8.21 4.23 0.00 3.31 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 6.45 3.14 1.64 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 0.73 0.00 0.00 -0.02 0.00 0.00 73 A 7.73 3.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 R 7.91 3.81 0.00 1.72 1.95 0.00 3.10 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 75 Q 7.67 4.15 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 76 W 8.37 4.28 0.00 3.60 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 F 8.78 3.63 0.00 2.64 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 78 R 7.86 4.37 0.00 2.06 1.98 0.00 3.33 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.82 0.00 79 H 8.16 4.65 0.00 3.72 3.66 0.00 5.66 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 R 8.55 4.20 0.00 1.88 2.08 0.00 3.24 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.92 0.00 81 I 7.59 4.12 1.95 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.82 0.94 0.00 0.00 82 A 7.01 4.37 1.19 0.00 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0.00 0.00 0.00 99 Y 8.87 5.25 0.00 2.80 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 0.00 100 I 8.38 4.10 1.82 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 1.32 1.01 0.82 0.00 0.00 101 P 0.00 4.02 0.00 1.88 1.90 0.00 3.40 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.58 0.00 102 S 8.36 4.50 0.00 4.01 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 0.00 103 P 0.00 4.17 0.00 2.16 2.13 0.00 3.59 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 104 E 7.75 3.93 0.00 1.84 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 2.23 2.29 0.00 105 R 7.86 3.61 0.00 1.68 2.01 0.00 2.75 0.00 0.00 2.64 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 106 L 7.38 4.57 0.00 1.70 1.61 0.82 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 107 E 7.88 4.09 0.00 2.04 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 108 G 9.07 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 0.00 109 Y 7.48 4.47 0.00 2.99 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 0.00 110 K 8.70 4.24 0.00 1.70 1.78 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.50 7.81 111 T 8.12 4.64 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 1.22 0.00 0.00 112 T 8.35 4.41 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 113 I 7.13 4.64 1.86 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 1.40 0.55 0.90 0.00 0.00 114 P 0.00 4.32 0.00 2.19 2.01 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 115 P 0.00 4.28 0.00 2.13 2.25 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 116 E 8.16 4.01 0.00 2.04 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 2.39 2.42 0.00 117 R 8.42 3.93 0.00 1.88 1.97 0.00 3.13 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 118 V 7.57 3.56 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.88 0.00 0.00 119 T 7.79 3.76 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 1.18 0.00 0.00 120 E 8.21 3.90 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 121 K 8.20 3.94 0.00 1.94 1.80 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.73 7.81 122 I 7.91 3.64 1.91 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.88 0.82 0.00 0.00 123 S 8.24 4.04 0.00 3.85 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 0.00 124 E 8.37 3.88 0.00 2.05 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 2.29 2.31 0.00 125 I 7.54 3.63 1.84 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 1.39 1.58 0.95 0.00 0.00 126 V 7.68 3.28 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 -0.14 0.00 0.00 0.70 0.00 0.00 127 D 8.30 4.50 0.00 3.01 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 0.00 128 K 8.28 3.96 0.00 2.00 1.85 0.00 1.72 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.65 7.81 129 A 8.36 4.02 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 0.00 130 Y 8.27 4.20 0.00 3.51 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 0.00 131 R 8.19 3.88 0.00 2.03 2.12 0.00 3.16 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 132 T 8.01 3.86 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 1.23 0.00 0.00 133 Y 8.02 4.11 0.00 3.01 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 L 7.87 3.58 0.00 1.73 1.56 0.99 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.24 3.89 0.00 2.11 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 2.29 2.51 0.00 136 L 8.12 3.93 0.00 1.73 1.65 0.94 0.96 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 0.00 137 I 7.50 3.52 1.67 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.11 0.75 0.00 0.00 138 E 7.96 3.90 0.00 1.95 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 2.30 2.32 0.00 139 S 7.74 4.26 0.00 3.85 4.10 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 0.00 140 G 7.87 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 0.00 141 V 7.42 3.73 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 0.77 0.00 0.00 0.90 0.00 0.00 142 P 0.00 4.30 0.00 2.16 1.92 0.00 3.64 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 143 R 8.56 3.94 0.00 1.95 2.21 0.00 3.12 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 144 E 8.18 3.99 0.00 2.08 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 2.23 2.36 0.00 145 V 7.52 3.98 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 1.06 0.00 0.00 0.92 0.00 0.00 146 A 8.58 4.15 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 0.00 147 R 8.33 4.05 0.00 2.04 2.29 0.00 2.85 0.00 0.00 3.22 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.04 0.00 148 I 7.54 3.99 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.62 0.95 0.00 0.00 149 V 7.19 4.01 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 0.75 0.00 0.00 1.12 0.00 0.00 150 L 7.51 4.32 0.00 1.80 1.73 0.32 1.18 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 0.00 151 P 0.00 4.57 0.00 2.44 2.21 0.00 3.98 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 2.41 1.93 0.00 152 L 8.53 4.32 0.00 1.66 1.90 0.93 0.55 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 0.00 153 N 8.35 5.08 0.00 3.19 3.25 0.00 0.00 5.90 6.67 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 0.00 154 L 8.02 3.73 0.00 1.88 1.51 0.36 0.79 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 0.00 155 Y 8.32 4.55 0.00 2.86 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 T 9.19 4.78 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 1.22 0.00 0.00 157 R 8.35 5.34 0.00 1.84 1.85 0.00 3.35 0.00 0.00 3.46 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.60 0.00 158 F 8.82 5.60 0.00 3.47 3.26 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 0.00 159 F 9.74 5.21 0.00 3.04 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 0.00 160 W 9.50 5.31 0.00 3.20 3.03 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 0.00 161 T 8.62 4.97 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 1.10 0.00 0.00 162 V 8.26 4.53 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 0.59 0.00 0.00 163 N 8.56 5.04 0.00 3.21 2.94 0.00 0.00 6.04 7.78 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 0.00 164 A 9.08 3.77 1.64 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 0.00 0.00 165 R 8.06 3.79 0.00 2.03 2.19 0.00 3.45 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 166 S 8.90 4.15 0.00 3.88 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 0.00 167 L 7.98 3.86 0.00 1.46 1.27 0.09 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 168 M 7.76 3.51 0.00 1.34 1.91 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.38 0.00 169 N 8.11 4.38 0.00 2.95 3.10 0.00 0.00 6.81 7.22 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 0.00 170 F 8.38 4.08 0.00 3.23 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 0.00 171 L 8.23 3.97 0.00 2.15 1.97 1.12 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 172 N 8.45 4.50 0.00 3.01 2.95 0.00 0.00 7.11 8.61 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 0.00 173 L 7.64 4.17 0.00 1.56 1.65 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 174 R 8.11 3.99 0.00 0.73 1.31 0.00 2.94 0.00 0.00 2.90 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.50 0.00 175 A 7.95 4.60 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 0.00 176 D 7.28 5.04 0.00 2.71 2.45 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 0.00 177 S 8.99 4.25 0.00 4.01 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 0.00 178 H 8.21 4.32 0.00 3.27 3.42 0.00 5.85 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 A 7.70 4.25 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 0.00 180 Q 8.52 4.16 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.88 2.62 0.00 181 W 9.13 4.28 0.00 3.52 3.37 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 0.00 182 E 8.63 3.71 0.00 2.27 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 2.56 2.52 0.00 183 I 7.68 3.88 1.76 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.34 0.81 0.00 0.00 184 Q 7.57 4.08 0.00 2.03 1.97 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 2.54 2.43 0.00 185 Q 7.32 3.68 0.00 1.72 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 186 Y 7.43 3.82 0.00 3.23 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 0.00 187 A 8.21 4.09 1.19 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 0.00 0.00 188 L 7.94 3.90 0.00 1.82 1.69 0.87 0.79 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 0.00 189 A 7.71 3.98 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 0.00 190 I 8.13 3.55 2.08 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.04 0.72 0.00 0.00 191 A 8.33 4.20 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 0.00 192 R 7.96 3.78 0.00 1.98 1.94 0.00 3.11 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 1.47 1.93 0.00 193 I 7.61 3.79 2.25 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.86 1.15 0.00 0.00 194 F 8.29 4.33 0.00 2.89 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 K 7.86 3.36 0.00 0.79 1.45 0.00 1.35 0.00 0.00 1.42 0.00 0.00 3.28 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.19 1.13 7.81 196 E 7.84 4.02 0.00 2.24 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 2.28 2.47 0.00 197 K 8.00 4.27 0.00 2.08 1.88 0.00 1.60 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.71 1.74 7.81 198 C 8.24 4.94 0.00 2.55 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 0.00 199 P 0.00 4.32 0.00 2.31 2.34 0.00 3.64 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.85 0.00 200 W 8.20 4.51 0.00 3.59 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 0.00 201 T 8.43 4.03 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 202 F 8.07 4.07 0.00 2.71 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 0.00 203 E 8.49 3.90 0.00 2.17 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 2.75 2.63 0.00 204 A 8.24 4.16 1.60 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 0.00 205 F 8.83 4.23 0.00 3.08 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 0.00 206 L 7.51 3.59 0.00 1.48 1.44 0.66 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 207 K 7.75 3.82 0.00 1.63 1.63 0.00 1.55 0.00 0.00 1.51 0.00 0.00 3.01 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.30 1.02 7.81 208 Y 7.99 4.67 0.00 3.02 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 0.00 209 A 7.79 4.55 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 0.00 210 Y 7.51 3.87 0.00 1.43 2.41 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 0.00 211 K 9.56 3.99 0.00 1.51 1.67 0.00 1.73 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.47 7.81 212 G 5.97 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 0.00 213 D 8.08 4.75 0.00 2.98 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 0.00 214 I 7.90 3.77 1.93 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 1.86 1.17 0.96 0.00 0.00 215 L 8.25 4.01 0.00 0.81 1.45 0.72 0.88 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 0.00 216 K 7.98 4.24 0.00 1.98 1.88 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.62 7.81 217 E 8.59 4.16 0.00 2.10 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 2.50 2.51 0.00 218 V 8.82 3.55 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 0.70 0.00 0.00 1.02 0.00 0.00 219 Q 8.62 4.09 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.15 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 220 V 8.39 3.62 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 0.66 0.00 0.00 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.