NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 P 4.4002 0.0000 0.0000 62.5078 33.1979 176.9179 21 A 4.1614 8.5257 121.3450 54.0858 19.0998 175.9036 22 A 5.5953 7.3867 113.8198 49.8045 23.3871 173.6190 23 G 4.1045 8.3621 104.6473 45.4430 0.0000 171.9688 24 V 4.9350 8.5772 120.3665 60.7458 33.4650 174.7931 25 L 4.6841 8.9895 129.7829 54.8227 42.2879 177.9075 26 D 4.8945 8.3403 124.0442 52.8528 43.0158 177.0017 27 T 4.2960 8.5621 114.9486 66.9499 68.5152 176.9343 28 S 4.2419 8.5422 115.8611 61.6276 62.6607 176.8784 29 V 3.6271 7.7169 115.2163 64.0654 31.2912 177.9059 30 F 4.2522 8.2759 115.8977 58.0020 39.3425 175.4599 31 I 4.4127 6.9982 119.3263 59.1674 38.5815 175.5379 32 A 4.0065 8.2898 127.3564 52.1134 18.9570 176.8065 *38 Q 4.0760 8.2402 121.6026 55.7328 30.0544 174.9304 39 L 4.4414 8.0807 122.1853 54.2674 42.9143 177.3760 40 D 4.6155 8.5705 121.6651 53.1092 39.7267 176.6332 41 E 3.9275 8.4870 124.4583 58.6987 30.0373 179.2436 42 A 4.0004 8.0781 120.5445 54.9402 18.3398 178.0347 43 L 4.3409 7.5625 113.0571 55.3726 42.3083 177.1850 44 I 3.8347 7.3233 121.0804 60.1812 37.3798 174.3899 45 P 4.5637 0.0000 0.0000 62.4196 31.9393 176.0792 46 D 4.5730 8.0253 120.4065 56.8731 41.4375 177.6152 47 R 4.7429 8.2662 117.0160 54.2872 33.3671 175.5774 48 V 5.0830 8.4992 115.3136 59.5924 35.5092 174.3091 49 A 4.8490 8.8688 124.0856 50.7959 23.4661 174.0067 50 T 4.8390 8.7417 112.7622 60.9926 71.3556 172.2472 51 T 5.2101 8.2749 109.0467 59.3294 72.0538 174.9577 52 V 3.6631 8.2762 114.4985 64.1183 31.1713 179.2170 53 V 3.5636 7.5976 118.4101 66.3296 31.3338 178.2403 54 T 3.9372 7.8066 116.3686 65.7400 68.3376 176.0998 55 L 3.7866 7.7841 122.0074 58.2237 41.9552 178.9807 56 A 3.9350 8.1008 120.4754 55.3190 18.3550 179.5344 57 E 3.9087 8.3348 117.1447 59.5345 29.6441 179.6090 58 L 3.9727 8.2287 119.5079 57.5903 41.5913 179.6226 59 R 3.8416 7.9477 118.8316 59.4136 30.0028 178.7168 60 V 3.6914 8.1622 118.5312 65.7271 31.1105 177.9722 61 G 3.7275 8.1643 105.6463 47.9430 0.0000 175.6769 62 V 3.6222 7.3966 119.1993 65.7807 31.6736 177.9493 63 L 4.1163 7.7771 116.8753 57.0974 41.5319 178.5571 64 A 4.2694 8.0703 119.1576 52.0832 19.2341 177.5854 65 A 3.9394 7.0841 120.2642 52.6571 18.8618 177.6774 66 A 4.2639 8.6029 125.4547 53.9804 19.3869 177.9885 67 T 4.7828 7.4478 105.0417 59.1679 73.3206 174.7883 68 T 3.8173 8.4269 112.5821 65.2372 68.5734 175.7811 69 D 4.2882 8.0770 120.3017 57.1250 41.1938 178.2409 70 I 3.7216 7.4890 119.9154 64.2499 37.0218 178.3016 71 R 3.8478 8.2589 119.5681 59.4517 29.9273 178.3777 72 A 3.9688 8.6667 120.8489 55.1207 18.3564 179.3499 73 Q 3.9101 8.1001 118.0113 59.6068 29.1137 178.8797 74 R 3.9964 8.3152 119.3081 58.8875 29.9675 178.8395 75 L 3.8955 8.2974 120.4904 58.0464 42.2072 178.6667 76 A 4.2311 7.9467 122.0480 54.8941 18.0200 179.7557 77 T 3.8720 7.6406 113.0317 66.7214 68.7392 176.1886 78 L 3.9908 8.0984 122.3782 58.3818 41.6340 178.9814 79 E 4.0446 8.4963 118.6500 59.0892 29.1254 179.2737 80 S 4.3551 7.8270 113.2743 60.6053 63.3272 175.3081 81 V 4.1769 7.4163 114.7419 61.0580 31.7215 177.5757 82 A 4.0105 8.0079 124.7978 54.8817 18.2288 178.7031 83 D 4.6492 7.9180 112.8975 54.8874 41.8035 176.2589 84 M 4.2968 7.4997 119.4940 54.0585 33.1858 175.1376 85 E 4.0104 8.8424 126.2724 57.3745 30.8039 175.4005 86 T 4.8786 8.4643 117.2992 59.8727 70.4032 173.8073 87 L 4.3993 8.9307 128.5872 53.7623 42.8757 175.5965 88 P 4.7052 0.0000 0.0000 61.9949 33.1467 176.2065 89 V 3.9057 8.1843 120.5291 62.2969 31.0564 174.8413 90 D 5.1033 8.1220 129.6469 51.7346 43.2469 175.7072 91 D 4.4140 8.5462 117.6294 58.1868 40.7784 178.5004 92 D 4.3977 8.2158 118.6136 57.2529 40.7884 178.5510 93 A 4.1298 8.5050 121.2625 54.9862 18.3260 179.5053 94 A 4.3182 8.3273 119.3553 55.6237 18.4376 180.1030 95 R 3.9746 8.3149 116.6585 59.5582 30.0353 178.9786 96 M 4.0413 8.1765 118.0502 58.3484 32.2495 177.8715 97 W 3.9042 8.6467 128.6812 60.4157 30.7416 177.7126 98 A 4.0534 8.0959 120.2206 55.1491 17.8959 179.4802 99 R 3.7894 7.7417 116.8262 59.7107 30.2102 178.7518 100 L 3.8894 8.0107 118.9549 57.6123 41.5606 179.4505 101 R 3.3841 7.7853 119.0239 59.3709 29.8064 178.7348 102 I 3.6598 7.6496 119.5506 64.2292 36.9917 177.5779 103 H 4.0118 8.1566 119.2662 59.5575 29.6518 177.1658 104 L 3.9440 8.1376 121.4475 57.1211 41.1345 179.4147 105 A 3.9272 7.8281 120.6944 55.1964 18.0781 179.5822 106 E 3.9002 8.1031 116.4916 59.3527 29.5356 179.2258 107 S 4.3402 7.9806 113.0310 58.5929 63.1040 175.5303 108 G 3.7921 7.3282 109.9586 46.3616 0.0000 173.6065 109 R 4.5589 7.5372 117.6636 54.3213 32.0633 175.9883 110 R 4.6724 8.0573 117.1943 54.4732 33.6975 175.4194 111 V 4.4850 7.8172 118.9157 59.8815 34.9192 175.8759 112 R 3.9290 8.4952 124.6304 56.8958 31.6642 177.9444 113 I 3.7812 8.4562 122.1764 64.4626 38.1173 178.0453 114 N 4.7801 8.2816 116.9280 56.4196 38.3828 176.9885 115 D 4.5176 8.1245 120.0299 57.1495 40.8551 178.3525 116 L 3.9204 8.0839 121.0643 57.8024 41.9987 178.9487 117 W 4.6929 8.4880 119.0062 59.9998 28.9951 178.3976 118 I 3.8706 8.1953 119.4029 64.6150 36.6678 178.3281 119 A 4.0904 8.7481 121.5191 55.1101 18.2226 179.5181 120 A 4.0177 8.7429 119.7241 55.2581 18.0458 179.9442 121 V 3.6184 8.2478 116.5663 66.1367 31.6185 177.9624 122 A 4.0148 8.2387 120.1339 55.3289 18.3243 179.3308 123 A 4.2093 8.7472 121.1400 54.7823 18.2219 179.8960 124 S 4.2813 8.2213 111.2420 60.5223 63.2006 175.7986 125 R 4.3930 7.3581 118.4660 54.4770 30.8448 175.5395 126 A 3.7998 7.8775 120.6655 53.6653 16.6637 177.2752 127 L 5.0315 7.8675 118.8449 52.8078 45.3319 176.3712 128 P 4.6233 0.0000 0.0000 62.6857 33.2891 175.0726 129 V 4.2407 8.3720 121.9565 62.3268 33.0701 174.6271 130 I 4.7345 8.6685 129.5166 60.1652 38.7854 174.6886 131 T 5.1071 8.7989 121.5281 60.5711 70.5540 174.1462 132 Q 4.1875 9.1492 127.5498 56.6933 29.8196 174.7564 133 D 5.0256 7.7088 116.7320 53.0153 43.2601 175.7258 134 D 4.9367 8.3924 117.4555 53.6718 39.5443 177.5969 135 D 4.3672 8.1693 121.0956 57.0383 41.6001 177.0004 136 F 4.3432 8.2486 115.7675 57.9926 39.8628 176.9517 137 A 4.1633 7.7049 123.7954 55.4765 17.8100 179.4322 138 A 4.0539 8.0189 117.1348 54.4243 18.7676 178.5419 139 L 4.4549 7.9709 116.1838 53.6252 42.1179 176.2264 140 D 4.5800 7.3861 120.2586 56.1393 41.0974 176.8129 141 G 3.9543 9.0100 112.4782 45.0971 0.0000 173.6751 142 A 3.8742 7.8617 122.7559 51.6862 18.9261 176.8874 143 A 4.2310 8.2495 124.0758 53.6783 18.7697 178.6502 144 S 3.8172 8.6915 115.1431 58.8254 61.3032 171.0677 145 V 4.1402 7.5860 121.1089 61.7540 32.0572 174.5972 146 E 4.6660 8.5743 127.2208 54.5388 32.8231 173.6667 147 I 4.7923 8.5011 127.2960 59.5664 39.6864 174.9998 148 I 4.3927 8.7052 127.7523 59.5843 39.7691 174.8085 149 R 4.7699 8.6034 127.0386 55.2295 31.1802 177.2623 150 V 4.0711 8.9883 117.3099 61.3894 32.2200 175.7423 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 20 P 0.00 4.40 0.00 2.25 2.26 0.00 3.65 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 21 A 8.53 4.16 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 22 A 7.39 5.60 1.17 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 23 G 8.36 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 0.00 0.00 0.00 24 V 8.58 4.93 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 1.02 0.00 0.00 0.94 0.00 0.00 25 L 8.99 4.68 0.00 1.71 1.57 0.83 0.92 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 26 D 8.34 4.89 0.00 3.09 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 27 T 8.56 4.30 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 28 S 8.54 4.24 0.00 4.36 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 0.00 29 V 7.72 3.63 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 0.80 0.00 0.00 0.66 0.00 0.00 30 F 8.28 4.25 0.00 3.24 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.00 4.41 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.82 0.95 0.00 0.00 32 A 8.29 4.01 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 *38 Q 8.24 4.08 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.98 0.00 0.00 0.00 0.00 0.00 2.22 2.38 0.00 39 L 8.08 4.44 0.00 1.89 1.54 0.82 1.03 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 40 D 8.57 4.62 0.00 2.66 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 41 E 8.49 3.93 0.00 2.02 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 2.52 2.24 0.00 42 A 8.08 4.00 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 43 L 7.56 4.34 0.00 1.81 1.70 0.91 0.76 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 44 I 7.32 3.83 1.94 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 1.24 0.43 0.87 0.00 0.00 45 P 0.00 4.56 0.00 2.18 2.15 0.00 3.65 0.00 0.00 3.79 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 46 D 8.03 4.57 0.00 2.90 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 8.27 4.74 0.00 1.81 1.78 0.00 3.23 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.71 0.00 48 V 8.50 5.08 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 0.68 0.00 0.00 0.92 0.00 0.00 49 A 8.87 4.85 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 8.74 4.84 4.48 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 1.24 0.00 0.00 51 T 8.27 5.21 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 1.29 0.00 0.00 52 V 8.28 3.66 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 0.75 0.00 0.00 0.93 0.00 0.00 53 V 7.60 3.56 2.18 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 1.13 0.00 0.00 1.01 0.00 0.00 54 T 7.81 3.94 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 55 L 7.78 3.79 0.00 1.72 1.82 0.85 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.10 3.93 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 57 E 8.33 3.91 0.00 2.03 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 2.35 2.53 0.00 58 L 8.23 3.97 0.00 1.52 1.60 0.23 0.61 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 59 R 7.95 3.84 0.00 1.99 2.01 0.00 3.06 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 60 V 8.16 3.69 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.94 0.00 0.00 61 G 8.16 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.40 3.62 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.95 0.00 0.00 63 L 7.78 4.12 0.00 1.79 1.71 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.07 4.27 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 65 A 7.08 3.94 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 66 A 8.60 4.26 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 67 T 7.45 4.78 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 68 T 8.43 3.82 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 69 D 8.08 4.29 0.00 2.81 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 70 I 7.49 3.72 2.00 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 1.41 0.81 0.92 0.00 0.00 71 R 8.26 3.85 0.00 1.99 2.09 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 72 A 8.67 3.97 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 73 Q 8.10 3.91 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 74 R 8.32 4.00 0.00 1.94 1.96 0.00 3.25 0.00 0.00 3.08 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 75 L 8.30 3.90 0.00 1.83 1.82 0.91 1.17 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 76 A 7.95 4.23 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 77 T 7.64 3.87 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 1.39 0.00 0.00 78 L 8.10 3.99 0.00 1.69 1.81 0.85 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.50 4.04 0.00 2.19 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 2.33 2.37 0.00 80 S 7.83 4.36 0.00 4.17 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 0.00 81 V 7.42 4.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.85 0.00 0.00 82 A 8.01 4.01 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 83 D 7.92 4.65 0.00 2.69 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 M 7.50 4.30 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.53 0.00 85 E 8.84 4.01 0.00 2.15 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 0.00 2.40 2.41 0.00 86 T 8.46 4.88 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 1.26 0.00 0.00 87 L 8.93 4.40 0.00 1.62 1.66 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 88 P 0.00 4.71 0.00 2.05 2.03 0.00 3.77 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 1.98 1.95 0.00 89 V 8.18 3.91 1.81 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 0.66 0.00 0.00 0.73 0.00 0.00 90 D 8.12 5.10 0.00 2.97 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 91 D 8.55 4.41 0.00 2.73 2.79 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 92 D 8.22 4.40 0.00 2.73 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.50 4.13 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.33 4.32 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 95 R 8.31 3.97 0.00 1.93 2.05 0.00 3.18 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.89 0.00 96 M 8.18 4.04 0.00 2.38 2.12 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 2.63 2.72 0.00 97 W 8.65 3.90 0.00 3.20 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.10 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 99 R 7.74 3.79 0.00 1.86 2.06 0.00 3.09 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 100 L 8.01 3.89 0.00 1.44 1.52 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 101 R 7.79 3.38 0.00 0.67 1.47 0.00 2.59 0.00 0.00 2.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.37 0.00 102 I 7.65 3.66 1.81 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 1.35 0.66 0.88 0.00 0.00 103 H 8.16 4.01 0.00 3.28 3.46 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.14 3.94 0.00 1.72 1.78 0.72 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.83 3.93 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 0.00 106 E 8.10 3.90 0.00 2.02 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 2.31 2.45 0.00 107 S 7.98 4.34 0.00 3.94 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 0.00 108 G 7.33 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 0.00 0.00 0.00 109 R 7.54 4.56 0.00 1.76 1.80 0.00 3.08 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 110 R 8.06 4.67 0.00 1.69 1.72 0.00 3.12 0.00 0.00 3.12 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 111 V 7.82 4.48 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.81 0.00 0.00 112 R 8.50 3.93 0.00 1.94 1.86 0.00 3.19 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 113 I 8.46 3.78 2.02 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.72 1.09 0.00 0.00 114 N 8.28 4.78 0.00 2.96 3.04 0.00 0.00 7.16 8.08 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 0.00 115 D 8.12 4.52 0.00 2.62 1.84 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 0.00 116 L 8.08 3.92 0.00 1.59 1.72 0.66 -0.15 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 0.00 117 W 8.49 4.69 0.00 3.76 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 8.20 3.87 2.43 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.95 1.03 0.00 0.00 119 A 8.75 4.09 1.62 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 0.00 0.00 120 A 8.74 4.02 1.69 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 0.00 0.00 121 V 8.25 3.62 2.36 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 1.07 0.00 0.00 1.19 0.00 0.00 122 A 8.24 4.01 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 0.00 123 A 8.75 4.21 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 0.00 124 S 8.22 4.28 0.00 4.17 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 0.00 125 R 7.36 4.39 0.00 1.97 2.00 0.00 3.34 0.00 0.00 3.25 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 126 A 7.88 3.80 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 0.00 127 L 7.87 5.03 0.00 1.50 1.54 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 128 P 0.00 4.62 0.00 2.07 2.43 0.00 3.77 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 2.04 1.94 0.00 129 V 8.37 4.24 1.68 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 0.16 0.00 0.00 0.75 0.00 0.00 130 I 8.67 4.73 1.80 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 1.20 0.72 0.85 0.00 0.00 131 T 8.80 5.11 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 132 Q 9.15 4.19 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.43 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 133 D 7.71 5.03 0.00 2.80 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 D 8.39 4.94 0.00 2.82 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 D 8.17 4.37 0.00 2.52 2.37 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 0.00 136 F 8.25 4.34 0.00 3.13 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 0.00 137 A 7.70 4.16 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 0.00 138 A 8.02 4.05 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 0.00 139 L 7.97 4.45 0.00 1.94 1.73 0.98 0.84 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 0.00 140 D 7.39 4.58 0.00 2.71 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 G 9.01 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.86 3.87 1.16 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 0.00 0.00 143 A 8.25 4.23 1.22 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 0.00 0.00 0.00 144 S 8.69 3.82 0.00 4.07 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 0.00 145 V 7.59 4.14 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 0.75 0.00 0.00 0.93 0.00 0.00 146 E 8.57 4.67 0.00 2.01 1.70 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 2.23 2.29 0.00 147 I 8.50 4.79 1.88 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 1.37 1.26 0.92 0.00 0.00 148 I 8.71 4.39 1.82 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 1.20 0.75 0.94 0.00 0.00 149 R 8.60 4.77 0.00 1.70 1.88 0.00 3.17 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 150 V 8.99 4.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.