NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 V 4.0505 7.9133 113.9763 60.5291 34.6501 174.2806 4 L 4.6262 7.8875 120.6914 52.8667 43.3208 174.6115 5 T 4.4903 9.3139 121.8786 62.0640 70.6529 172.6800 6 Q 5.1852 8.5363 127.8888 55.0176 31.0694 174.6596 7 S 4.7169 8.6667 117.0832 57.2556 66.7666 173.6914 8 P 4.8104 0.0000 0.0000 62.1449 32.9976 175.9423 9 G 3.9677 8.5975 104.5275 49.0080 0.0000 174.3918 10 T 5.1757 7.7589 115.4638 61.6317 72.9191 173.4528 11 L 4.6221 9.3335 128.0489 53.4947 44.9221 175.1508 12 S 5.2302 8.1274 123.7966 57.3348 63.8772 173.8701 13 L 4.9584 8.7930 123.3471 53.4751 46.8385 175.3775 14 S 4.9070 8.6470 115.5171 56.3469 65.6671 172.1460 15 P 4.9494 0.0000 0.0000 63.0277 29.0654 176.1080 16 G 5.0306 7.6091 125.7578 46.1753 0.0000 171.3183 17 E 4.2633 7.6350 120.2197 55.8488 30.5989 174.6005 18 T 4.7675 8.4408 108.6790 59.4740 71.3232 173.2432 19 A 4.3669 8.3407 127.5623 50.7576 20.6520 175.6946 20 I 4.6350 8.3069 123.7353 59.6196 39.4193 174.7864 21 I 4.5938 8.3652 128.2590 58.9091 40.7574 174.5506 22 S 5.4884 8.9462 123.2207 56.9406 66.8710 172.5394 23 C 5.2700 9.3211 120.5544 55.5668 44.2071 172.3793 24 R 5.2677 9.1730 128.2130 55.4570 31.3813 174.9829 25 T 4.9148 9.0862 120.3138 59.4208 70.2135 172.6291 26 S 4.2617 9.0319 121.5827 60.7135 62.4803 175.2796 27 Q 4.2294 8.0052 123.1307 54.6570 30.4258 174.7973 28 Y 5.0155 7.4975 117.8097 55.0918 40.9396 175.3051 29 G 3.8775 8.2491 111.4867 44.9743 0.0000 172.9009 30 S 4.2231 7.9441 111.5253 57.1625 61.4201 172.5292 *33 L 4.1155 7.5728 123.6983 54.6554 43.7492 175.1846 34 A 4.9483 8.3215 125.7222 49.9477 23.3227 174.5584 35 W 5.2326 9.1678 118.4460 55.1692 32.9642 174.7113 36 Y 5.4882 9.4266 119.8876 56.3819 42.0395 174.1037 37 Q 4.3208 9.3943 124.1655 54.2476 31.8140 173.9315 38 Q 4.6327 8.7119 128.6587 54.4109 31.0280 174.5942 39 R 4.5342 8.4063 125.8147 54.4540 32.1381 174.2458 40 P 4.3055 0.0000 0.0000 64.6298 31.3617 176.0745 41 G 4.0851 9.0191 112.6715 45.4944 0.0000 173.1447 42 Q 4.3314 7.6222 117.4322 54.3250 30.0194 175.2607 43 A 4.2251 8.1322 121.9166 51.2467 19.1008 175.8632 44 P 4.7137 0.0000 0.0000 63.0453 32.4267 175.8508 45 R 4.7170 8.8048 121.8663 54.2765 33.5666 173.9969 46 L 4.3368 8.9455 128.5315 55.8036 42.2727 175.6459 47 V 4.1004 8.9890 126.5045 64.3400 32.9166 175.2787 48 I 5.2385 7.6570 120.3593 59.6806 41.4577 173.5180 49 Y 4.9422 8.2401 122.4216 56.3910 41.8102 175.8238 50 S 3.8434 9.6887 112.0533 58.2081 61.6404 170.5030 51 G 4.4686 7.6947 110.8457 47.0419 0.0000 175.8662 52 S 4.6071 7.7298 108.4582 57.9361 65.4823 173.4660 53 T 4.0618 7.7394 119.9395 63.0794 69.2188 174.0490 54 R 4.2938 8.4115 127.3793 55.9769 30.9207 176.0176 55 A 4.7691 9.0350 128.1090 51.1822 20.2657 176.6073 56 A 4.0594 8.5301 122.7577 53.7199 18.7275 178.4169 57 G 3.9653 9.1213 111.2401 45.2891 0.0000 172.8474 58 I 4.2854 7.1283 120.5659 58.7902 38.6700 174.1917 59 P 4.4664 0.0000 0.0000 62.6687 31.7104 176.9654 60 D 4.6709 8.6415 120.4095 55.1416 39.7332 177.4954 61 R 4.0192 8.0080 119.9174 59.3847 31.0722 177.1194 62 F 4.5221 8.0992 116.5675 57.6360 39.7984 175.5276 63 S 4.6048 8.3024 114.1342 57.6399 66.2592 174.6507 64 G 5.1789 8.8246 108.6992 45.0078 0.0000 171.7356 65 S 5.0347 8.5594 114.5436 56.3059 67.3178 172.6274 66 R 4.4523 8.4031 119.7721 54.6058 32.5754 175.0464 67 W 5.3704 8.4731 135.0000 56.0204 32.3185 175.7957 68 G 3.5841 7.6988 116.8144 45.0257 0.0000 172.6676 69 P 4.4372 0.0000 0.0000 63.5810 31.7264 174.5918 70 D 5.1829 7.7825 119.0639 53.1145 42.5362 175.3107 71 Y 5.0049 9.0804 121.4725 56.6200 41.1110 174.4628 72 N 5.3149 9.0841 118.5740 51.3798 42.6521 173.1424 73 L 4.5792 8.4777 125.6201 53.2400 44.3927 174.8557 74 T 5.5070 8.4217 120.5360 59.2055 70.8293 172.2302 75 I 3.9970 7.7938 128.2222 59.7863 39.1355 176.6088 76 S 3.9449 8.1010 123.9274 61.2802 63.5555 174.7126 77 N 4.7284 7.6622 121.1778 51.0678 40.3930 172.5169 78 L 4.1568 8.1020 123.6706 55.4073 42.9048 176.2787 79 E 5.1205 8.4230 121.1801 54.6873 33.2935 176.6755 80 S 4.4289 9.1770 115.0882 61.0830 62.9794 175.3469 81 G 4.1460 8.0350 106.7022 45.5116 0.0000 173.7574 82 D 4.7582 7.7362 118.3196 55.4462 41.2590 176.8006 83 F 4.5686 8.2405 118.4264 56.1156 40.7048 176.8207 84 G 4.0414 7.1423 110.3748 46.1640 0.0000 171.3939 85 V 4.8788 7.6625 121.8460 60.0301 34.5845 174.7941 86 Y 5.7599 8.8772 121.9551 55.7348 40.6422 174.2997 87 Y 5.6493 9.0091 120.5755 56.4557 41.9118 173.4436 88 C 4.7597 9.0931 116.6510 53.8755 45.8084 172.2118 89 Q 4.6371 8.2607 121.0892 54.4562 32.6179 173.7662 90 Q 4.1750 8.4135 126.2799 54.4583 32.0919 175.5497 91 Y 3.5188 8.0992 128.6279 59.4038 36.2608 172.3561 *96 E 4.5255 8.9259 126.8410 56.4495 31.3632 174.9157 97 F 5.0479 7.6013 119.3984 56.2671 41.3611 174.9431 98 F 5.2514 9.1451 120.2892 55.7724 42.4591 174.4672 99 G 4.4159 8.7316 107.5432 44.7031 0.0000 174.6429 100 Q 4.2579 8.8858 118.2202 57.4482 28.8319 177.5824 101 G 3.9452 9.2377 103.4826 45.6104 0.0000 172.8712 102 T 4.7693 8.3799 114.6580 61.7141 72.8615 173.1717 103 K 4.7581 8.7596 128.3982 55.5338 33.8859 175.5779 104 V 5.4899 9.4908 122.2025 59.2600 33.3832 175.0094 105 Q 5.1109 8.6659 123.1442 53.8793 32.1826 175.4009 106 V 4.0549 7.8963 113.5127 62.2975 32.5610 176.0295 107 D 4.7827 8.5150 123.0891 52.7949 43.0898 174.6482 108 I 3.7281 8.5307 126.8027 61.2465 37.3196 176.8288 109 K 4.9253 8.7182 124.7227 56.2667 33.8666 177.9232 110 R 4.4644 7.3317 121.8428 55.9466 33.5640 178.1546 111 T 4.6624 8.2353 103.6525 58.9678 71.3596 173.3287 112 V 3.8978 8.6713 123.0701 64.0119 31.9522 174.5849 113 A 5.0162 9.0664 126.3189 50.2441 23.3033 174.1395 114 A 4.6923 8.4387 120.3567 49.5750 21.0266 174.9236 115 P 4.9021 0.0000 0.0000 61.6975 32.2993 176.8261 116 S 4.2055 8.8487 120.9584 58.0445 63.4918 173.2920 117 V 4.3681 7.9241 125.4593 62.5612 32.3484 175.3575 118 F 4.9449 8.2934 126.0767 58.0461 42.3313 173.8008 119 I 4.1385 7.2621 116.1369 61.3816 40.9668 175.3372 120 F 4.6948 8.4382 126.4169 54.9304 41.7668 172.7761 121 P 4.4874 0.0000 0.0000 61.3493 32.1204 174.7649 122 P 4.3031 0.0000 0.0000 62.8668 31.7207 175.6358 123 S 4.8001 8.1352 113.5249 56.8116 65.3100 174.4168 124 D 4.4314 8.4577 118.8816 55.2015 40.8709 177.2127 125 E 4.2844 7.9350 119.5207 57.4386 30.4544 177.2755 126 Q 3.8110 7.7832 119.3567 58.2455 29.1058 177.3793 127 L 4.0899 7.4375 119.5693 56.7907 41.5378 178.5585 128 K 4.1937 7.5053 116.8577 57.5487 32.2743 177.9848 129 S 4.6675 8.5900 113.4253 55.8754 64.2426 172.2415 130 G 3.9326 7.7409 111.1289 44.4307 0.0000 176.7391 131 T 3.9760 8.9491 110.0300 61.5892 68.9205 173.4431 132 A 4.6032 8.1496 122.5202 50.2365 21.8572 175.3789 133 S 4.9999 7.8636 118.3878 56.0717 65.5967 173.9718 134 V 4.3513 7.8568 120.8705 61.0539 35.0063 174.2874 135 V 5.3048 8.2060 125.1192 60.3415 34.8229 173.6468 136 C 4.9938 9.0262 125.9167 54.8227 46.4574 171.6024 137 L 4.9010 8.7918 128.6537 54.5737 43.5111 175.2934 138 L 4.9135 8.9592 127.0760 52.5574 42.4846 175.7133 139 N 4.9272 9.4247 122.6071 53.7816 40.2959 173.1695 140 N 4.1723 8.0227 114.9018 51.5381 38.6040 174.1673 141 F 4.8264 8.0429 117.2551 56.6970 41.6458 171.9516 142 Y 4.9036 8.2942 115.9251 56.7771 41.7873 172.7301 143 P 3.4189 0.0000 0.0000 61.6130 33.0289 175.8133 144 R 3.8261 8.2731 118.2128 59.9567 30.0286 177.5132 145 E 3.7205 7.8795 115.0545 57.1867 29.6568 176.7785 146 A 4.4403 8.0573 124.0020 51.7077 21.2857 175.7556 147 K 4.0790 8.3122 126.1190 56.7912 32.9807 175.7195 148 V 4.5508 8.1433 127.6345 60.3772 33.4451 174.6183 149 Q 4.5209 8.0651 127.2200 54.3093 32.6154 173.5518 150 W 5.2050 8.8296 124.9983 55.7042 31.8714 175.8620 151 K 4.9397 8.6916 120.5120 54.3461 36.0417 176.0164 152 V 4.2249 8.8015 125.4538 62.0356 31.1785 174.6065 153 D 4.1165 8.4771 127.7691 55.8355 38.6927 174.6729 154 N 4.1274 7.8510 116.4553 52.8970 36.1601 174.3535 155 A 4.5045 7.0550 118.9045 50.6036 22.6703 175.9824 156 L 4.1816 8.5715 124.4924 55.2956 42.7390 176.4187 157 Q 4.6741 8.2034 123.8463 54.2750 32.5989 174.2712 158 S 4.5359 8.5895 113.8063 58.7744 64.7718 176.3836 159 G 4.2049 10.2885 108.9687 45.1734 0.0000 174.3197 160 N 4.8462 7.9224 115.6800 52.1777 37.6245 174.0003 161 S 5.7000 8.3166 114.0554 57.4750 66.3981 174.4065 162 Q 4.4127 8.4032 120.3085 54.8135 32.2166 174.7094 163 E 4.6806 8.7956 123.9829 55.1957 31.1525 177.4339 164 S 4.7816 7.7838 109.2475 57.9285 62.7745 174.9795 165 V 4.1975 7.9336 122.0303 63.4900 32.5894 176.4391 166 T 4.5803 8.3569 118.2889 60.6127 71.4162 173.7796 167 E 4.2401 8.6228 120.5091 55.9452 30.2636 176.3968 168 Q 3.5250 8.0043 123.3510 55.5536 29.1644 175.7899 169 D 4.4250 7.9364 126.3298 54.9262 41.3923 177.7782 170 S 4.4352 8.4117 114.7501 59.0642 63.4624 173.8267 171 K 4.3889 7.4200 117.4211 58.1657 34.5006 176.8821 172 D 4.3241 7.9206 117.7413 53.9161 40.5162 176.0556 173 S 3.7873 8.0896 115.0320 58.8469 60.2789 171.3669 174 T 4.6987 6.9081 108.6691 60.3055 72.9453 174.6399 175 Y 4.5993 7.6322 120.5736 57.1387 41.4802 174.4777 176 S 5.2277 8.3309 114.4507 58.0130 67.7414 173.8315 177 L 5.3926 9.2674 126.8104 53.5658 45.4892 175.4719 178 S 5.0883 8.3407 117.4837 57.9840 65.9543 173.5670 179 S 5.6925 8.8889 120.4932 56.9961 66.0429 173.1543 180 T 5.5360 8.3174 116.3969 61.7872 72.7142 172.7807 181 L 4.6051 8.2267 127.0460 52.6509 44.6351 174.7107 182 T 4.6620 8.3760 123.1551 63.4855 70.3523 172.1010 183 L 4.8500 8.3460 124.0602 54.6853 44.0028 177.8008 184 S 4.5021 8.6321 117.7958 56.8109 66.0256 176.8970 185 K 4.1368 8.4390 120.6455 59.2098 31.5835 178.4681 186 A 4.1113 7.8872 120.1955 54.9303 18.7154 178.6829 187 D 4.5132 7.8436 115.7975 56.4560 41.1508 177.4989 188 Y 4.4498 7.7073 118.9143 59.1752 39.6377 175.4965 189 E 4.2796 7.8504 119.2565 56.2192 29.1179 177.0424 190 K 4.4894 7.6393 114.6059 55.8041 35.0205 175.6911 191 H 4.9548 7.6412 113.5218 53.6978 32.7840 172.4650 192 K 4.1288 8.2695 115.0445 58.1183 34.5722 175.8549 193 V 4.3843 7.0309 120.1805 60.7288 33.2584 174.1706 194 Y 5.4597 7.5252 123.5089 56.8265 41.9011 174.3895 195 A 4.8549 8.5478 118.2420 51.5836 23.4249 172.7694 196 C 4.6098 8.7624 115.6357 53.5728 42.8557 173.2133 197 E 4.2164 8.7680 125.4903 54.5486 29.9124 175.0324 198 V 4.3338 8.1520 128.8833 61.8027 32.9578 174.5267 199 T 4.6760 8.1442 118.5515 60.2584 71.5397 172.8822 200 H 4.7928 8.3674 123.3444 54.8287 33.6484 173.4778 201 Q 4.0328 8.1356 121.1067 58.2913 29.0438 176.8425 202 G 3.8292 8.2166 104.3578 45.6706 0.0000 173.1700 203 L 4.5665 7.0815 119.3750 52.5719 42.0015 176.2693 204 R 4.0461 8.7305 121.8071 58.0992 29.5790 177.3430 205 S 4.7022 7.5978 111.5092 55.1526 64.9244 171.8713 206 P 4.6082 0.0000 0.0000 62.3266 30.3381 175.5605 207 V 3.8157 8.0762 124.6448 63.1988 32.8021 174.6433 208 T 4.7565 8.1630 122.3432 62.3353 73.0485 173.9447 209 K 4.3148 8.5915 125.2305 55.5905 33.6870 176.0163 210 S 4.9215 7.9224 114.9741 57.1247 66.2870 173.5861 211 F 4.8472 8.0237 115.1002 56.5697 40.3772 172.1321 212 N 4.8669 8.6004 116.7585 50.8318 42.4653 174.6787 213 R 3.9527 8.1816 120.3069 56.4956 29.1154 175.6266 214 G 3.6793 8.9299 116.6783 45.4840 0.0000 172.5236 215 E 4.5302 7.8911 115.5916 55.2077 32.8916 175.9901 216 C 4.4854 8.7115 118.0780 58.1834 29.8340 173.8643 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 3 V 7.91 4.05 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 0.44 0.00 0.00 0.60 0.00 0.00 4 L 7.89 4.63 0.00 1.62 1.58 0.94 0.47 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 5 T 9.31 4.49 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 6 Q 8.54 5.19 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.73 0.00 0.00 0.00 0.00 0.00 2.45 2.75 0.00 7 S 8.67 4.72 0.00 3.96 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 8 P 0.00 4.81 0.00 2.22 2.08 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 9 G 8.60 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 10 T 7.76 5.18 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 1.23 0.00 0.00 11 L 9.33 4.62 0.00 1.68 1.52 0.90 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.13 5.23 0.00 3.90 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 13 L 8.79 4.96 0.00 1.60 1.54 0.92 1.05 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 14 S 8.65 4.91 0.00 3.90 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 15 P 0.00 4.95 0.00 2.02 2.21 0.00 3.89 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.32 0.00 16 G 7.61 5.03 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 0.00 0.00 0.00 17 E 7.64 4.26 0.00 2.05 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 2.34 2.27 0.00 18 T 8.44 4.77 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 1.18 0.00 0.00 19 A 8.34 4.37 1.06 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 0.00 0.00 20 I 8.31 4.63 1.80 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 1.12 0.63 0.84 0.00 0.00 21 I 8.37 4.59 1.80 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 2.00 0.56 0.00 0.00 22 S 8.95 5.49 0.00 4.15 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 23 C 9.32 5.27 0.00 3.30 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.17 5.27 0.00 2.00 1.83 0.00 3.10 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 25 T 9.09 4.91 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 1.54 0.00 0.00 26 S 9.03 4.26 0.00 3.90 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 8.01 4.23 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.73 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 28 Y 7.50 5.02 0.00 3.16 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 29 G 8.25 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 30 S 7.94 4.22 0.00 3.74 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 *33 L 7.57 4.12 0.00 1.10 0.81 -0.09 -0.13 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 34 A 8.32 4.95 1.01 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 35 W 9.17 5.23 0.00 3.20 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 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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 0.00 53 T 7.74 4.06 3.64 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 0.79 0.00 0.00 54 R 8.41 4.29 0.00 1.80 1.81 0.00 3.27 0.00 0.00 3.55 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 55 A 9.04 4.77 1.48 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 56 A 8.53 4.06 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 57 G 9.12 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 58 I 7.13 4.29 1.99 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.04 0.76 0.00 0.00 59 P 0.00 4.47 0.00 2.41 2.08 0.00 3.79 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.20 0.00 60 D 8.64 4.67 0.00 2.79 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 61 R 8.01 4.02 0.00 1.55 1.75 0.00 3.00 0.00 0.00 3.28 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 62 F 8.10 4.52 0.00 3.03 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.30 4.60 0.00 3.75 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 64 G 8.82 5.18 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 0.00 65 S 8.56 5.03 0.00 3.85 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 66 R 8.40 4.45 0.00 1.68 1.74 0.00 3.19 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.85 0.00 67 W 8.47 5.37 0.00 3.09 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 68 G 7.70 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 0.00 0.00 0.00 69 P 0.00 4.44 0.00 2.19 2.30 0.00 3.37 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 2.01 2.01 0.00 70 D 7.78 5.18 0.00 2.66 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 Y 9.08 5.00 0.00 3.22 3.25 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 72 N 9.08 5.31 0.00 2.73 2.62 0.00 0.00 6.64 6.79 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 73 L 8.48 4.58 0.00 0.27 0.28 0.54 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.42 5.51 4.09 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 1.15 0.00 0.00 75 I 7.79 4.00 1.52 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 -0.27 0.34 0.00 0.00 76 S 8.10 3.94 0.00 3.57 3.81 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 77 N 7.66 4.73 0.00 2.70 2.54 0.00 0.00 7.11 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0.00 0.87 0.00 0.00 0.50 0.00 0.00 86 Y 8.88 5.76 0.00 3.00 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 87 Y 9.01 5.65 0.00 3.23 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 C 9.09 4.76 0.00 1.76 1.93 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 89 Q 8.26 4.64 0.00 1.68 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.79 0.00 0.00 0.00 0.00 0.00 1.75 1.16 0.00 90 Q 8.41 4.18 0.00 1.89 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 5.51 0.00 0.00 0.00 0.00 0.00 2.31 2.03 0.00 91 Y 8.10 3.52 0.00 3.37 2.24 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 *96 E 8.93 4.53 0.00 1.85 1.93 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 1.47 1.60 0.00 97 F 7.60 5.05 0.00 3.01 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 98 F 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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 -0.43 0.00 0.00 0.77 0.00 0.00 107 D 8.51 4.78 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 I 8.53 3.73 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.63 0.86 0.00 0.00 109 K 8.72 4.93 0.00 1.78 1.78 0.00 1.87 0.00 0.00 2.49 0.00 0.00 3.12 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.65 1.50 7.81 110 R 7.33 4.46 0.00 1.65 0.68 0.00 2.64 0.00 0.00 2.87 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.86 0.00 111 T 8.24 4.66 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 112 V 8.67 3.90 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 0.90 0.00 0.00 1.03 0.00 0.00 113 A 9.07 5.02 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 0.00 114 A 8.44 4.69 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 0.00 115 P 0.00 4.90 0.00 1.74 1.64 0.00 3.64 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 1.67 1.47 0.00 116 S 8.85 4.21 0.00 3.76 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 0.00 117 V 7.92 4.37 1.93 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 0.72 0.00 0.00 0.85 0.00 0.00 118 F 8.29 4.94 0.00 2.81 2.55 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 0.00 119 I 7.26 4.14 1.81 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 0.99 0.49 0.78 0.00 0.00 120 F 8.44 4.69 0.00 2.94 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.49 0.00 2.01 2.18 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.70 0.00 122 P 0.00 4.30 0.00 1.90 1.72 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.85 0.00 123 S 8.14 4.80 0.00 3.97 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 0.00 124 D 8.46 4.43 0.00 2.70 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 E 7.93 4.28 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 2.31 2.27 0.00 126 Q 7.78 3.81 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.60 0.00 0.00 0.00 0.00 0.00 2.46 2.34 0.00 127 L 7.44 4.09 0.00 1.63 1.71 0.97 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 128 K 7.51 4.19 0.00 1.87 1.85 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.58 7.81 129 S 8.59 4.67 0.00 3.96 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 0.00 130 G 7.74 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 0.00 131 T 8.95 3.98 4.18 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 1.27 0.00 0.00 132 A 8.15 4.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 S 7.86 5.00 0.00 3.81 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 V 7.86 4.35 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 0.57 0.00 0.00 0.58 0.00 0.00 135 V 8.21 5.30 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 1.30 0.00 0.00 0.90 0.00 0.00 136 C 9.03 4.99 0.00 3.12 2.97 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 0.00 137 L 8.79 4.90 0.00 2.20 2.00 1.13 0.59 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 0.00 138 L 8.96 4.91 0.00 1.60 1.30 0.90 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 139 N 9.42 4.93 0.00 3.07 3.02 0.00 0.00 7.17 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 0.00 140 N 8.02 4.17 0.00 2.88 2.76 0.00 0.00 7.16 8.13 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 0.00 141 F 8.04 4.83 0.00 2.95 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 0.00 142 Y 8.29 4.90 0.00 3.12 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 0.00 143 P 0.00 3.42 0.00 1.94 1.39 0.00 3.58 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 1.93 1.59 0.00 144 R 8.27 3.83 0.00 0.83 1.64 0.00 2.80 0.00 0.00 3.02 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.06 0.00 145 E 7.88 3.72 0.00 1.90 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 2.28 2.37 0.00 146 A 8.06 4.44 1.06 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 0.00 0.00 147 K 8.31 4.08 0.00 1.98 1.68 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.36 7.81 148 V 8.14 4.55 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 0.61 0.00 0.00 0.78 0.00 0.00 149 Q 8.07 4.52 0.00 2.07 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.66 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 150 W 8.83 5.20 0.00 3.27 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 0.00 151 K 8.69 4.94 0.00 1.61 1.72 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.29 7.81 152 V 8.80 4.22 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 0.62 0.00 0.00 1.12 0.00 0.00 153 D 8.48 4.12 0.00 2.86 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 N 7.85 4.13 0.00 2.82 2.84 0.00 0.00 6.99 7.35 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 0.00 155 A 7.06 4.50 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 0.00 156 L 8.57 4.18 0.00 1.63 1.62 0.96 0.70 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 0.00 157 Q 8.20 4.67 0.00 2.36 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.70 0.00 0.00 0.00 0.00 0.00 2.57 2.42 0.00 158 S 8.59 4.54 0.00 3.97 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 0.00 159 G 10.29 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 N 7.92 4.85 0.00 2.72 2.97 0.00 0.00 6.02 7.64 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 0.00 161 S 8.32 5.70 0.00 3.91 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 0.00 162 Q 8.40 4.41 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.92 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 163 E 8.80 4.68 0.00 1.91 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 2.36 2.21 0.00 164 S 7.78 4.78 0.00 3.87 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 V 7.93 4.20 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 0.89 0.00 0.00 1.02 0.00 0.00 166 T 8.36 4.58 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 1.32 0.00 0.00 167 E 8.62 4.24 0.00 1.99 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 2.34 2.24 0.00 168 Q 8.00 3.52 0.00 1.35 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.04 1.52 0.00 169 D 7.94 4.43 0.00 2.70 2.56 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 0.00 170 S 8.41 4.44 0.00 3.93 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 0.00 171 K 7.42 4.39 0.00 1.65 1.75 0.00 1.59 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.29 1.40 7.81 172 D 7.92 4.32 0.00 2.73 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 0.00 173 S 8.09 3.79 0.00 3.78 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 T 6.91 4.70 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 1.24 0.00 0.00 175 Y 7.63 4.60 0.00 1.78 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 S 8.33 5.23 0.00 3.86 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 0.00 177 L 9.27 5.39 0.00 1.99 1.54 1.02 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 178 S 8.34 5.09 0.00 3.96 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 0.00 179 S 8.89 5.69 0.00 4.20 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 0.00 180 T 8.32 5.54 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 181 L 8.23 4.61 0.00 0.68 0.92 0.72 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 182 T 8.38 4.66 4.19 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 1.16 0.00 0.00 183 L 8.35 4.85 0.00 1.62 1.36 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 184 S 8.63 4.50 0.00 3.95 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 0.00 185 K 8.44 4.14 0.00 2.13 1.86 0.00 1.93 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.56 1.56 7.81 186 A 7.89 4.11 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 D 7.84 4.51 0.00 2.67 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 Y 7.71 4.45 0.00 3.14 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 0.00 189 E 7.85 4.28 0.00 2.05 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 2.69 2.51 0.00 190 K 7.64 4.49 0.00 1.60 1.62 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.30 1.59 7.81 191 H 7.64 4.95 0.00 3.01 3.19 0.00 5.60 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 K 8.27 4.13 0.00 1.70 1.83 0.00 1.38 0.00 0.00 1.64 0.00 0.00 2.76 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.21 1.18 7.81 193 V 7.03 4.38 1.86 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 0.85 0.00 0.00 0.79 0.00 0.00 194 Y 7.53 5.46 0.00 3.43 3.14 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 0.00 195 A 8.55 4.85 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 0.00 196 C 8.76 4.61 0.00 2.12 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 0.00 197 E 8.77 4.22 0.00 2.05 1.82 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 2.24 2.08 0.00 198 V 8.15 4.33 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 0.75 0.00 0.00 0.77 0.00 0.00 199 T 8.14 4.68 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 200 H 8.37 4.79 0.00 3.06 3.10 0.00 5.66 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 Q 8.14 4.03 0.00 1.92 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 202 G 8.22 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 0.00 0.00 203 L 7.08 4.57 0.00 1.74 1.78 0.86 0.86 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 0.00 204 R 8.73 4.05 0.00 1.91 2.07 0.00 3.16 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 205 S 7.60 4.70 0.00 3.96 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 0.00 206 P 0.00 4.61 0.00 2.05 2.05 0.00 3.71 0.00 0.00 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.91 0.00 207 V 8.08 3.82 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 0.90 0.00 0.00 0.94 0.00 0.00 208 T 8.16 4.76 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 1.29 0.00 0.00 209 K 8.59 4.31 0.00 1.75 1.76 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.66 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.32 1.30 7.81 210 S 7.92 4.92 0.00 3.85 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 0.00 211 F 8.02 4.85 0.00 3.20 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 0.00 212 N 8.60 4.87 0.00 2.65 2.62 0.00 0.00 6.91 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 0.00 213 R 8.18 3.95 0.00 1.77 1.82 0.00 3.55 0.00 0.00 3.04 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 214 G 8.93 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 0.00 0.00 0.00 215 E 7.89 4.53 0.00 1.96 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 2.22 2.30 0.00 216 C 8.71 4.49 0.00 3.08 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.