NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 Y 4.7112 8.1449 118.9136 56.3107 39.3248 174.4490 5 I 3.6859 8.3966 122.3135 61.2994 37.4171 174.8489 6 R 4.5423 8.7719 122.6127 55.7122 32.0739 174.9825 7 D 4.9425 7.7904 118.8496 52.4039 42.9846 176.8307 8 G 3.6567 8.6678 114.5269 47.8184 0.0000 174.7492 9 Q 4.0600 8.2953 121.0847 58.7607 29.1300 177.8618 10 A 4.0474 8.1320 121.4689 55.0765 18.5967 179.5880 11 I 3.6758 8.0356 118.4337 64.7207 36.8781 177.5084 12 Y 4.0301 8.0315 120.2082 61.3128 38.4261 178.0688 13 D 4.6122 8.7829 119.5400 57.5576 40.9711 179.0302 14 R 3.9418 8.1443 119.4250 59.3645 30.0275 178.7610 15 S 4.0076 7.8972 113.8666 61.4688 62.9691 176.5308 16 F 4.0931 7.6105 120.8146 59.8906 38.5596 177.5955 17 A 3.9855 7.7912 120.6239 55.3840 18.0253 179.6624 18 I 3.6750 7.8916 118.3885 64.6056 37.0345 178.7777 19 I 3.7285 7.9778 120.7038 64.5668 36.7552 178.7969 20 R 3.9437 7.8347 117.3544 58.9657 29.8986 178.6549 21 A 4.1644 7.9074 120.0623 54.1418 18.4352 177.9108 22 E 4.3708 7.5711 115.0741 57.2606 31.4617 176.8303 23 A 4.1120 8.0668 121.2290 51.7413 18.9933 177.0720 24 D 4.6158 8.4678 121.5660 53.4656 40.4693 175.4819 25 L 4.7620 8.0578 125.3473 54.3379 42.3505 179.2314 26 R 3.9059 8.2530 123.2037 59.8845 29.9800 178.0838 *27 H 4.7558 8.1310 111.3858 54.1078 28.2625 176.8995 28 I 4.4635 7.4031 121.4339 59.8461 37.8538 174.2718 29 P 4.4276 0.0000 0.0000 62.0077 32.0948 177.0332 30 A 3.9424 8.6200 122.4146 55.4444 18.4666 179.2279 31 D 4.5251 7.9623 113.2587 54.6882 40.0351 177.0916 32 L 4.6257 7.8965 119.3200 54.0140 43.3124 177.8387 33 E 3.8640 7.9758 121.3172 59.2606 29.4095 178.9121 34 K 3.9500 7.8720 118.1387 59.0382 32.1346 178.9104 35 L 3.8781 7.8194 120.0195 58.0769 42.0682 178.7268 36 A 3.9707 8.0822 120.7330 55.2920 18.2725 179.8172 37 V 3.6072 7.7791 116.7966 66.1556 31.7232 178.2460 38 R 4.1108 8.3556 118.7591 59.2402 29.8307 178.6478 39 V 3.6983 8.1149 118.4440 65.7890 31.4183 178.1897 40 I 3.8199 7.8497 119.8122 64.5387 36.7357 177.6462 41 H 3.8981 8.3324 118.0663 59.4030 29.6618 176.8491 42 A 4.1563 7.8134 121.2973 54.1528 18.2934 178.2552 43 C 4.6876 7.5889 108.9866 57.3128 31.2120 175.2846 44 G 3.7640 8.3405 109.2277 45.6009 0.0000 173.1664 45 M 4.5813 7.4879 119.2369 52.9530 33.2500 176.7965 46 V 3.7649 8.2676 118.9842 63.7563 31.7676 177.2599 47 D 4.7226 7.9315 117.2116 54.1660 39.5233 178.2251 48 V 3.7312 7.8380 121.5852 64.6447 31.3776 178.0440 49 A 4.0336 7.8312 121.7629 54.8831 17.9277 179.1304 50 N 4.4404 7.9946 114.2761 55.4949 38.8718 175.3991 51 D 4.9323 8.0488 118.6958 53.8148 42.5793 176.1985 52 L 4.8790 7.6463 120.0407 54.7175 42.3218 176.4292 53 A 4.5371 8.8049 123.9411 50.4740 22.9153 174.6799 54 F 4.7307 7.4309 113.0289 55.7762 40.4831 173.7901 55 S 4.3314 7.4117 114.9210 57.2783 64.8259 173.5355 56 E 3.9467 8.6219 121.0955 58.3125 29.5773 177.3791 57 G 3.8284 9.0505 111.5751 46.3389 0.0000 174.8466 58 A 4.0868 7.7781 124.7792 54.5442 18.1702 181.0502 59 G 3.6982 8.4754 106.0919 47.3610 0.0000 176.2440 60 K 4.0322 8.1735 120.9772 59.1191 32.8382 178.8321 61 A 4.0639 8.0952 122.4059 55.1984 18.3029 179.8990 62 G 3.5248 7.8850 103.7493 47.7724 0.0000 176.0771 63 R 4.1761 7.8809 122.4743 58.7740 29.9925 178.3711 64 N 4.3309 8.6358 116.5737 56.1970 38.4378 177.3368 65 A 3.9883 7.8753 121.7235 55.1220 18.5243 179.6971 66 L 4.0154 7.9637 117.5494 57.9647 41.4575 179.6824 67 L 4.0023 7.8371 117.7425 57.4930 41.6424 178.6333 68 A 4.3519 7.5100 118.0962 52.3103 18.7375 178.0077 69 G 3.8093 7.9159 105.4316 44.2198 0.0000 173.6657 70 A 4.1826 7.7242 120.9653 51.7270 18.8706 176.7956 71 P 4.6253 0.0000 0.0000 62.5561 33.8100 175.0350 72 I 4.6760 8.7246 121.9670 59.7015 39.5764 174.6650 73 L 4.4288 8.5463 128.5813 53.2767 43.0188 175.5381 74 C 5.7784 8.7087 122.0732 57.0124 30.1453 174.3361 75 D 5.0495 9.3052 122.7477 55.5319 40.2906 176.3666 76 A 4.9144 7.9572 121.3737 49.2446 22.5454 176.5240 77 R 2.8358 8.5567 121.0377 59.6469 29.7622 179.0628 78 M 4.0306 7.7508 116.9369 57.8037 32.3060 178.5062 79 V 3.6852 7.6595 118.0432 65.8470 31.9697 177.6365 80 A 3.9166 7.6497 119.9856 55.4247 18.0333 179.5761 81 E 4.0506 8.1034 115.6087 58.9518 29.5658 178.4932 82 G 3.7798 7.6624 106.0165 46.2680 0.0000 173.7035 83 I 4.0495 7.3407 121.7936 60.8408 37.7131 175.8186 84 T 4.1926 9.0168 123.3459 62.8004 68.2773 175.8817 85 R 3.9272 8.5979 127.4533 59.0389 30.3119 179.1501 86 S 4.3290 7.9725 110.5207 59.9457 63.3230 174.8091 87 R 4.3040 7.7245 119.1893 56.5922 30.6355 176.5370 88 L 4.1726 7.5165 119.1537 53.8846 41.8302 175.3302 89 P 4.5150 0.0000 0.0000 64.0387 31.9804 176.7503 90 A 4.5536 7.4485 122.3816 51.6086 19.1070 175.1856 91 D 4.4361 8.4272 115.6512 56.7703 38.6092 174.3039 92 N 4.4937 7.9937 116.0465 53.4589 40.0104 174.9766 93 R 4.0705 8.6001 122.8565 56.0061 31.7007 175.5159 94 V 4.5337 8.3531 124.1457 61.7687 32.5257 174.7128 95 I 4.5301 8.8400 129.7950 59.7624 39.6367 174.5934 96 Y 5.1734 8.4947 127.4604 56.8416 41.1558 174.3352 97 T 4.3927 8.5609 115.3016 61.0210 70.4413 175.5345 98 L 3.6794 6.9063 124.0594 57.8228 42.0313 177.3364 99 S 4.5866 7.2306 110.4853 57.7329 63.5334 173.4619 100 D 4.4440 8.0080 122.5582 53.7529 41.3555 175.5296 101 P 4.3856 0.0000 0.0000 65.0940 31.8271 177.8098 102 S 4.3892 9.1749 114.5162 59.5912 63.1686 176.3386 103 V 3.5420 7.5859 123.0171 65.7405 30.8624 176.0108 104 P 4.2811 0.0000 0.0000 66.1605 31.1707 179.1254 105 E 4.0322 8.0682 116.8007 60.8409 29.6875 181.0000 106 L 4.0661 7.8009 119.1404 57.8791 41.7797 179.1985 107 A 4.0133 8.3477 122.9731 56.2343 17.8071 180.5737 108 K 3.9812 7.6700 121.2530 59.6602 31.5688 181.2678 109 K 4.2325 7.7270 120.2603 59.0608 32.3363 178.3823 110 I 4.0354 8.0548 110.9083 60.4236 38.5091 175.4392 111 G 3.8204 7.6920 107.3734 46.7129 0.0000 171.9489 112 N 4.8304 7.9996 116.6844 51.3600 42.4556 173.6915 113 T 4.3104 8.1466 108.1851 61.3237 71.4044 175.4343 114 R 3.9412 8.3242 119.9049 59.3988 29.8477 179.4855 115 S 4.1159 7.9521 113.6672 61.3540 63.2442 176.0768 116 A 3.9643 7.8714 123.3505 54.9362 18.2663 179.5904 117 A 3.8908 8.0421 118.9840 54.9482 18.4081 179.5930 118 A 3.9373 7.7035 118.6521 54.6992 18.3395 179.4745 119 L 2.5738 7.2496 116.7967 56.7295 41.1762 179.0300 120 D 4.3321 7.8073 119.3187 56.7825 40.4964 177.6954 121 L 4.4544 7.5451 117.1821 55.5359 42.2169 178.2587 122 W 4.6399 8.3023 119.6089 58.6524 28.9107 178.1902 123 L 4.0551 7.4632 117.5204 57.5170 41.1306 176.8454 124 P 4.4330 0.0000 0.0000 64.2967 31.3644 176.2922 125 H 4.9020 8.4734 113.7752 55.3932 30.8376 174.8734 126 I 3.8110 7.7816 119.7624 63.2663 38.1986 175.1285 127 E 4.2150 8.0897 121.5298 57.4633 29.4712 176.6637 128 G 3.9285 9.0610 115.0590 45.4656 0.0000 173.1662 129 S 4.5246 7.8541 115.1353 58.1844 65.0383 173.0614 130 I 4.7124 8.4316 121.5460 59.8974 38.7037 175.1350 131 V 4.3614 8.7517 128.2305 61.4946 33.3253 174.4323 132 A 4.9134 9.1838 130.1503 50.4270 21.4440 174.8464 133 I 4.7484 9.0659 124.0376 60.7768 39.1059 176.6670 134 G 4.2290 9.6821 114.2798 45.9678 0.0000 174.0401 135 N 4.7071 8.8494 114.5584 53.2441 41.5957 173.7510 136 A 4.5898 8.4782 121.9547 49.4273 19.6999 174.5832 137 P 4.0631 0.0000 0.0000 66.9494 31.4195 178.8464 138 T 4.0498 7.9986 107.4236 64.5092 68.5491 176.2928 139 A 3.7917 7.8111 124.1102 54.7281 18.4496 179.3256 140 L 3.4726 7.4243 118.2572 58.1495 41.7755 178.6386 141 F 4.1884 7.6271 118.0228 60.7781 38.9078 177.7817 142 R 3.8604 8.0020 117.7823 59.3810 29.9059 177.8880 143 L 3.8571 7.6916 120.1586 58.5045 41.8914 178.8781 144 F 4.5554 7.5800 117.0465 60.8713 38.9657 177.5400 145 E 4.0402 7.9060 116.7828 59.5859 29.2418 179.4794 146 L 4.0642 8.0160 118.9137 57.7589 41.6077 179.6808 147 L 4.0662 8.2303 119.0674 57.8563 41.4066 179.1395 148 D 4.4430 8.2441 117.7156 56.8843 40.8279 177.8108 149 A 4.4378 7.5400 118.3584 52.0070 19.0332 177.7993 150 G 3.9969 7.8952 105.7910 44.5985 0.0000 173.9811 151 A 4.1893 7.9135 121.2187 51.3638 18.8911 176.6600 152 P 4.3939 0.0000 0.0000 62.9616 32.4467 176.0470 153 K 4.4522 8.5544 122.1402 54.9444 33.5235 174.9929 154 P 5.0044 0.0000 0.0000 62.7025 31.6969 176.3727 155 A 4.2427 8.9987 123.4002 54.6921 19.0765 177.8710 156 L 4.6013 7.5163 114.3000 54.3531 45.8738 173.5438 157 I 4.8326 8.7877 126.5699 59.7689 40.1055 174.7542 158 I 4.6083 9.4430 129.9886 60.2183 38.0579 175.0403 159 G 4.1676 9.0436 116.6228 43.9991 0.0000 171.9106 160 M 5.4226 8.9589 133.0873 53.7827 32.5587 173.9007 161 P 4.8623 0.0000 0.0000 62.8481 32.7283 176.8081 162 V 4.3142 8.2744 121.0259 61.0887 33.8095 174.4354 163 G 3.6827 7.7107 107.0672 44.4679 0.0000 173.3689 164 F 4.5865 8.8627 116.1263 57.0269 40.7855 175.5165 165 V 4.2048 7.7725 119.2382 62.8334 32.3023 174.9535 166 G 4.1732 8.7468 116.5817 45.6370 0.0000 173.9622 167 A 3.8553 7.9515 121.2415 55.2483 18.5077 179.2359 168 A 4.1481 7.8074 119.7865 54.8157 18.6024 179.5835 169 E 4.0268 8.1539 116.8298 59.5362 29.7631 179.5538 170 S 3.8236 8.3068 114.6639 61.1324 62.9143 176.7851 171 K 4.0132 7.8745 121.6500 59.3015 31.8356 179.0826 172 D 4.4224 8.4022 121.6830 57.9608 40.6663 179.3898 173 E 3.9067 8.1219 118.5305 60.6599 29.4863 181.6566 174 L 3.9201 7.4666 119.4961 58.0410 42.2935 178.6684 175 A 2.8206 7.3932 119.1575 54.7195 18.3349 179.1930 176 A 4.2689 7.6322 118.4016 54.0187 19.0555 177.3374 177 N 4.5787 8.1478 116.5465 52.9239 39.9870 173.3646 178 S 4.5183 8.4463 117.4520 57.0881 63.5901 175.1104 179 R 3.8734 8.9615 117.7889 57.6553 27.7894 177.3154 180 G 3.9410 8.6441 103.9319 45.3550 0.0000 173.9009 181 V 4.3053 7.4051 119.4275 60.1556 32.9602 173.8127 182 P 4.6128 0.0000 0.0000 63.5261 32.4775 174.7066 183 Y 5.4830 8.5034 120.1361 55.5923 42.2058 174.0527 184 V 5.1796 9.0272 120.2438 61.3850 35.4240 174.2276 185 I 5.4460 9.2190 120.0970 58.0784 41.7700 174.0683 186 V 4.7500 8.1778 121.9826 60.9909 32.8885 175.4679 187 R 3.9488 9.0001 128.2039 57.4684 30.8249 178.4483 188 G 3.8160 8.7836 107.4818 45.1988 0.0000 174.2278 189 R 4.2542 8.2640 116.1613 57.1233 30.9381 176.8641 190 R 4.4538 7.6648 116.5073 55.0786 31.6438 177.3474 191 G 3.7808 9.0176 106.7779 47.0677 0.0000 170.3178 192 G 3.9351 8.3270 109.8715 44.6987 0.0000 174.5296 193 S 4.0923 8.8413 113.6350 61.4743 62.6887 176.8577 194 A 3.9808 7.8941 122.9595 55.5489 18.2650 179.5018 195 M 4.0868 7.9757 116.7355 58.7490 31.5437 179.0565 196 T 3.9316 8.0076 115.8847 66.4692 68.5824 176.8425 197 A 4.0346 8.3863 122.8526 54.9105 18.3871 179.4919 198 A 3.9504 8.0928 119.1670 55.2608 18.2472 179.6492 199 A 3.9377 7.7378 118.0967 55.3402 18.8835 179.7481 200 V 3.6682 7.6231 116.2723 66.3051 31.4413 178.0247 201 N 4.3609 8.5924 116.3746 56.2514 38.0909 177.2855 202 A 3.9891 7.9255 121.5666 54.5758 18.5523 178.8285 203 L 4.2339 7.7331 115.0686 55.7038 41.8284 178.5047 204 A 4.1721 7.3872 120.6770 52.8524 19.3157 177.3008 205 S 4.6469 7.0620 108.8833 56.3606 65.7064 173.7836 206 E 3.9520 8.5476 123.9902 57.7078 29.6612 177.1792 207 R 4.1455 8.2720 124.0849 56.3475 31.8958 174.8595 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 4 Y 8.14 4.71 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 3.69 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.70 0.99 0.00 0.00 6 R 8.77 4.54 0.00 1.68 1.87 0.00 2.98 0.00 0.00 3.00 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.32 0.00 7 D 7.79 4.94 0.00 2.69 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 8 G 8.67 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 8.30 4.06 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 10 A 8.13 4.05 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 11 I 8.04 3.68 2.11 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.33 0.94 0.00 0.00 12 Y 8.03 4.03 0.00 3.35 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 13 D 8.78 4.61 0.00 2.82 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 14 R 8.14 3.94 0.00 1.99 2.11 0.00 3.11 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 15 S 7.90 4.01 0.00 3.79 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 16 F 7.61 4.09 0.00 3.12 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 17 A 7.79 3.99 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 18 I 7.89 3.68 1.96 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 1.51 0.84 0.89 0.00 0.00 19 I 7.98 3.73 2.06 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.78 0.94 0.00 0.00 20 R 7.83 3.94 0.00 1.95 2.01 0.00 3.18 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.91 0.00 21 A 7.91 4.16 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 22 E 7.57 4.37 0.00 2.01 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 2.25 2.35 0.00 23 A 8.07 4.11 1.29 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 0.00 0.00 24 D 8.47 4.62 0.00 2.66 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 25 L 8.06 4.76 0.00 1.73 1.62 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.25 3.91 0.00 1.93 2.01 0.00 3.16 0.00 0.00 3.70 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 *27 H 8.13 4.76 0.00 2.92 2.93 0.00 7.19 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 7.40 4.46 1.95 0.00 0.00 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 1.41 1.31 0.77 0.00 0.00 29 P 0.00 4.43 0.00 2.43 2.17 0.00 2.97 0.00 0.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.19 0.00 30 A 8.62 3.94 1.29 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 0.00 0.00 31 D 7.96 4.53 0.00 2.77 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 32 L 7.90 4.63 0.00 1.33 1.29 -0.13 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 33 E 7.98 3.86 0.00 1.92 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 2.28 2.47 0.00 34 K 7.87 3.95 0.00 1.77 1.75 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.42 7.81 35 L 7.82 3.88 0.00 1.64 1.76 0.89 0.95 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 36 A 8.08 3.97 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 N 8.00 4.83 0.00 2.61 2.64 0.00 0.00 7.06 7.05 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 0.00 113 T 8.15 4.31 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 114 R 8.32 3.94 0.00 1.87 1.99 0.00 3.13 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 115 S 7.95 4.12 0.00 3.82 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 0.00 116 A 7.87 3.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 A 8.04 3.89 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 0.00 118 A 7.70 3.94 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 0.00 119 L 7.25 2.57 0.00 1.48 1.23 0.05 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 120 D 7.81 4.33 0.00 2.89 2.68 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 0.00 121 L 7.55 4.45 0.00 1.88 1.81 0.91 0.86 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 0.00 122 W 8.30 4.64 0.00 3.56 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.46 4.06 0.00 1.79 1.78 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.43 0.00 1.75 2.01 0.00 3.78 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 125 H 8.47 4.90 0.00 3.16 3.24 0.00 5.85 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 0.00 126 I 7.78 3.81 2.16 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.48 1.07 0.00 0.00 127 E 8.09 4.21 0.00 1.99 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 2.31 2.33 0.00 128 G 9.06 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 0.00 129 S 7.85 4.52 0.00 3.94 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 0.00 130 I 8.43 4.71 1.81 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.95 0.89 0.00 0.00 131 V 8.75 4.36 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 1.15 0.00 0.00 1.02 0.00 0.00 132 A 9.18 4.91 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 0.00 133 I 9.07 4.75 1.91 0.00 0.00 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 1.35 0.84 0.95 0.00 0.00 134 G 9.68 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 0.00 135 N 8.85 4.71 0.00 2.77 2.85 0.00 0.00 6.70 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 0.00 136 A 8.48 4.59 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 0.00 137 P 0.00 4.06 0.00 2.23 2.14 0.00 3.62 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.13 0.00 138 T 8.00 4.05 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 1.31 0.00 0.00 139 A 7.81 3.79 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 0.00 140 L 7.42 3.47 0.00 1.48 1.00 0.81 0.76 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 0.00 141 F 7.63 4.19 0.00 3.03 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 R 8.00 3.86 0.00 1.95 1.94 0.00 3.26 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.56 0.00 143 L 7.69 3.86 0.00 1.76 1.58 1.03 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 144 F 7.58 4.56 0.00 3.37 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 0.00 145 E 7.91 4.04 0.00 2.23 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 2.39 2.60 0.00 146 L 8.02 4.06 0.00 1.87 1.75 0.85 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 147 L 8.23 4.07 0.00 1.94 1.79 1.10 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 148 D 8.24 4.44 0.00 2.94 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 0.00 149 A 7.54 4.44 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 0.00 150 G 7.90 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.91 4.19 1.29 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 0.00 0.00 152 P 0.00 4.39 0.00 1.99 2.04 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 153 K 8.55 4.45 0.00 1.75 1.77 0.00 1.80 0.00 0.00 1.86 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.50 7.81 154 P 0.00 5.00 0.00 1.99 2.11 0.00 3.75 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 155 A 9.00 4.24 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 L 7.52 4.60 0.00 1.74 1.46 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 157 I 8.79 4.83 2.03 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.83 1.01 0.00 0.00 158 I 9.44 4.61 2.01 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 1.19 0.80 0.94 0.00 0.00 159 G 9.04 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 0.00 0.00 0.00 0.00 160 M 8.96 5.42 0.00 1.90 2.01 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 161 P 0.00 4.86 0.00 2.03 2.01 0.00 3.79 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.86 0.00 162 V 8.27 4.31 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 0.73 0.00 0.00 0.95 0.00 0.00 163 G 7.71 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 0.00 164 F 8.86 4.59 0.00 3.03 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 0.00 165 V 7.77 4.20 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 0.88 0.00 0.00 1.03 0.00 0.00 166 G 8.75 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 0.00 0.00 0.00 0.00 167 A 7.95 3.86 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 0.00 168 A 7.81 4.15 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 0.00 169 E 8.15 4.03 0.00 2.45 2.26 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 2.50 2.50 0.00 170 S 8.31 3.82 0.00 3.06 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 0.00 171 K 7.87 4.01 0.00 1.96 1.89 0.00 1.84 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.52 7.81 172 D 8.40 4.42 0.00 2.85 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 0.00 173 E 8.12 3.91 0.00 2.01 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 2.24 2.18 0.00 174 L 7.47 3.92 0.00 1.97 1.90 1.10 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 175 A 7.39 2.82 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 0.00 176 A 7.63 4.27 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 N 8.15 4.58 0.00 2.45 2.46 0.00 0.00 7.20 7.51 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 0.00 178 S 8.45 4.52 0.00 4.25 4.13 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 0.00 179 R 8.96 3.87 0.00 2.06 2.10 0.00 3.45 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 180 G 8.64 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 V 7.41 4.31 2.32 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 0.93 0.00 0.00 1.05 0.00 0.00 182 P 0.00 4.61 0.00 2.26 1.97 0.00 3.65 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.12 0.00 183 Y 8.50 5.48 0.00 3.06 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 0.00 184 V 9.03 5.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.92 0.00 0.00 185 I 9.22 5.45 1.98 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 1.42 1.71 1.04 0.00 0.00 186 V 8.18 4.75 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.97 0.00 0.00 187 R 9.00 3.95 0.00 1.76 1.84 0.00 3.21 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 188 G 8.78 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 R 8.26 4.25 0.00 1.65 1.49 0.00 3.00 0.00 0.00 2.81 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.47 0.00 190 R 7.66 4.45 0.00 1.78 1.83 0.00 3.30 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 191 G 9.02 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 0.00 192 G 8.33 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 S 8.84 4.09 0.00 3.88 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 0.00 194 A 7.89 3.98 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 M 7.98 4.09 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.64 0.00 196 T 8.01 3.93 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 197 A 8.39 4.03 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 0.00 198 A 8.09 3.95 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 A 7.74 3.94 1.37 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 0.00 200 V 7.62 3.67 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 1.00 0.00 0.00 0.99 0.00 0.00 201 N 8.59 4.36 0.00 2.93 2.88 0.00 0.00 6.95 7.20 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 0.00 202 A 7.93 3.99 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 0.00 203 L 7.73 4.23 0.00 1.83 1.67 0.89 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 204 A 7.39 4.17 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 0.00 205 S 7.06 4.65 0.00 3.90 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 E 8.55 3.95 0.00 1.97 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 2.28 2.26 0.00 207 R 8.27 4.15 0.00 1.68 2.16 0.00 3.04 0.00 0.00 3.10 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.39 0.00 * Residues marked with a * may have inaccurate shift predictions.