NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 T 4.3283 8.0327 117.3784 63.2308 70.3190 174.4427 10 S 3.8026 8.5511 118.0532 60.8754 62.3596 174.1530 11 P 4.0555 0.0000 0.0000 65.5452 31.3760 177.9968 12 E 4.3291 8.2403 116.9988 59.5761 29.4425 179.4047 13 R 4.0200 8.1244 118.1994 59.1759 30.0108 179.1653 14 L 4.0889 8.0368 118.7161 57.7273 41.6953 179.2252 15 A 4.1590 8.7566 121.0154 55.3206 18.3396 179.5979 16 A 4.0299 8.3691 119.0269 55.1267 18.3444 179.8108 17 A 4.0051 8.1624 119.4758 55.1628 18.4375 179.5184 18 L 3.8998 8.3960 119.3448 58.3042 42.0660 179.0275 19 F 3.9918 8.4451 120.5243 61.2480 38.8579 176.4785 20 D 4.3552 8.3532 117.7173 57.3718 40.9377 178.5156 21 V 3.5242 8.0734 118.5848 66.0414 31.6223 177.8761 22 A 3.8172 8.1617 120.6856 55.0367 17.8910 179.4602 23 A 3.6074 7.6295 118.5262 54.5982 18.3743 179.4917 24 E 4.1786 7.4124 116.2842 58.6101 29.6674 177.8640 25 S 4.4595 7.9489 110.2146 57.0842 64.3126 174.6921 26 G 4.0037 8.1030 108.7623 45.7117 0.0000 174.6158 27 L 3.8278 7.8764 119.0005 57.2188 42.3943 178.6111 28 E 4.0284 8.2869 118.1818 59.1573 29.4795 178.2745 29 G 3.9564 8.1836 104.4993 45.0648 0.0000 173.7674 30 A 4.7366 7.5094 123.9068 51.3277 19.1331 178.0279 31 S 4.3818 7.7453 116.8307 58.6660 65.4145 174.3679 32 V 3.6231 8.4250 122.0775 66.4605 31.0474 178.3660 33 R 3.9124 7.9191 117.6893 59.4841 30.0320 178.1665 34 E 3.9821 8.2279 118.4846 59.3195 29.3538 179.5605 35 V 3.5937 8.1644 118.2216 65.9229 31.6571 177.7756 36 A 4.0203 8.3743 120.9354 55.0974 18.0788 179.4306 37 K 3.8561 8.3810 118.3170 59.8227 32.1007 178.9929 38 R 3.9016 8.0118 117.3537 59.3564 30.1089 178.0158 39 A 4.2081 8.3120 119.5642 52.5490 18.6931 177.1839 40 G 3.7658 7.8085 105.1710 47.0910 0.0000 173.5286 41 V 4.5598 7.7491 110.8867 58.2008 35.8130 176.5159 42 S 4.4771 8.2270 115.6646 57.9303 65.0951 175.0231 43 I 3.8152 8.4239 123.9671 64.7474 36.8502 178.6237 44 G 3.6999 8.2098 105.5814 47.9477 0.0000 175.0831 45 A 3.9828 8.0697 123.1981 54.9137 18.2825 180.0026 46 V 3.5344 7.5447 116.6058 66.4405 31.5268 178.4446 47 Q 4.3237 8.1327 117.6759 58.2903 28.4940 177.9403 48 H 4.1247 7.9098 119.0747 59.5803 29.9609 176.6351 49 H 4.2082 7.2980 116.2025 56.2541 28.5197 175.5904 50 F 5.1854 7.6271 119.9891 55.5057 40.8858 176.3270 51 S 4.1799 9.0962 123.2539 61.2260 62.6037 174.5061 52 T 4.7179 7.5250 112.5051 59.7410 70.3917 174.1266 53 K 3.8985 8.5615 126.0727 59.2964 32.7354 177.7727 54 D 4.3520 8.3498 118.8417 57.3209 41.2563 179.0697 55 E 4.3059 7.7590 117.6848 56.5328 29.1470 178.4218 *57 F 4.9048 8.2925 117.2157 57.1876 41.1612 177.3670 58 A 3.8941 8.5553 122.5533 55.1178 18.1441 179.3748 59 F 3.8851 8.4803 119.2366 61.3266 39.4658 177.1782 60 A 3.9996 7.9691 119.8496 55.0011 18.2393 179.0714 61 L 3.2224 7.7124 119.1590 58.1759 42.0030 179.2290 62 R 3.7523 7.8176 118.0489 59.6417 30.0815 179.1084 63 T 3.6190 7.5187 115.1979 66.3380 68.4118 176.4630 64 L 3.8434 7.7658 122.0404 58.3724 42.1421 179.4569 65 V 3.6143 8.0072 112.7349 64.1787 31.3717 178.0443 66 D 4.2481 8.1051 117.9111 57.2591 41.1691 178.3888 67 K 3.8670 7.7409 118.3775 59.4800 32.0846 179.2955 68 L 3.9356 7.8319 118.9063 57.9681 41.6073 179.6804 69 L 4.0004 8.2399 118.9290 57.6305 41.3318 179.5043 70 A 3.9827 8.1310 120.9058 55.1815 18.0693 179.9281 71 R 3.8734 7.6859 115.4705 59.3794 30.1745 178.9954 72 L 4.1323 8.0178 119.1283 57.6484 41.3832 179.5564 73 S 4.2090 8.0669 113.1424 60.7447 63.1934 175.5997 74 E 4.2206 7.7158 120.7053 56.2882 29.6525 177.0469 75 V 3.5791 6.8815 120.1348 62.6458 31.9485 175.2249 76 E 4.2006 8.6604 127.1844 56.1385 28.9395 176.8569 77 R 4.0941 8.8191 124.6265 57.1782 31.5649 178.1445 78 G 3.8384 7.7990 106.9207 47.1616 0.0000 173.9704 79 G 3.9304 8.7665 112.3277 44.7537 0.0000 172.2818 80 D 4.7638 7.5259 120.6374 51.2884 42.6278 174.3428 81 P 4.2666 0.0000 0.0000 65.6874 31.3543 178.1166 82 A 3.9793 8.0165 120.0993 54.9025 18.2773 179.3969 83 R 3.8389 8.6277 117.2013 59.5196 30.1106 178.6214 84 A 4.0081 8.0858 120.5203 55.2041 18.1861 179.6007 85 L 3.9284 8.0272 116.6393 57.7951 41.7558 179.2380 86 F 4.1379 8.3560 119.5470 61.2168 39.4528 176.6155 87 A 4.1873 8.2528 119.1073 55.1060 18.5016 179.5469 88 A 4.0109 8.0461 115.5487 53.5149 18.1181 179.2767 *90 S 4.1094 8.0149 118.1188 59.7341 64.7485 176.0815 91 Q 4.1061 7.8736 117.5913 57.6629 28.5182 176.7265 92 L 4.6019 7.7533 115.9705 54.1047 42.2412 175.6840 93 L 4.7499 7.3118 118.9705 52.2848 44.0975 175.8069 94 P 4.5299 0.0000 0.0000 62.1966 29.5426 176.1507 95 L 4.3126 7.6463 120.3696 56.6834 42.8118 176.6017 96 D 4.7111 7.5110 117.7511 50.8851 43.5441 175.2264 97 E 3.8936 8.8125 118.6245 59.4861 29.4607 178.3174 98 A 4.0538 7.9954 120.0932 55.5172 18.4850 179.7093 99 R 4.2306 8.6213 116.3110 59.0034 30.0935 179.4909 100 S 4.1321 8.3737 115.6848 61.5360 62.8247 176.7637 101 R 3.8974 8.2124 120.7483 59.3386 29.6417 178.8988 102 E 4.3326 8.2382 116.8146 59.5351 29.5720 178.9157 103 A 4.1537 8.0374 119.6897 55.3785 18.7128 178.9121 104 H 4.2840 8.1783 116.5908 59.3569 29.9586 179.0103 105 V 3.1396 7.4366 117.2678 63.2757 31.1532 177.3017 *107 A 4.2164 8.0338 121.6518 51.6573 20.6376 179.7511 108 A 3.9147 7.9797 117.5084 55.4122 18.2736 179.9370 109 F 4.2387 8.1822 116.1166 60.5388 38.7082 177.7374 110 A 4.0362 8.0621 119.2485 55.2120 18.5368 179.3794 111 V 3.7028 7.9193 116.6833 66.3038 31.6667 178.5700 112 R 4.0390 8.3610 117.5527 58.9777 29.3344 178.7372 113 A 4.0954 8.4191 120.7945 54.9935 18.0346 179.3809 114 A 4.1051 7.9773 118.9153 54.4511 18.4674 178.1549 115 T 4.4070 7.8131 104.2149 60.9078 69.9516 174.2505 116 S 4.5840 7.6723 116.5668 55.8196 64.5885 172.1649 117 P 4.2763 0.0000 0.0000 65.5869 31.2741 178.7715 118 S 4.1383 8.0214 112.6093 61.5404 62.9432 176.4803 119 L 3.9609 7.8036 122.8106 57.2226 41.3878 179.1243 120 A 4.0161 8.2012 120.8563 55.2774 18.2825 179.3243 121 E 3.8720 8.3051 117.5986 59.4775 29.7246 179.1953 122 I 3.6910 7.6184 119.4224 64.2258 37.0760 178.3522 123 R 3.8483 8.3212 120.0042 59.3623 29.8990 178.4015 124 R 3.8888 8.5024 118.7601 59.4953 30.1200 178.3572 125 K 4.0161 8.1421 119.2701 59.7425 32.1220 178.9517 126 T 3.8988 7.9722 116.0393 66.6518 68.3475 176.7922 127 L 4.0021 8.2662 121.2612 57.6354 41.5675 179.2637 128 F 4.0819 8.7018 121.0446 61.6272 39.3958 177.3017 129 T 3.8330 8.1321 115.1846 66.7137 68.2609 176.7872 130 I 3.6547 7.8364 121.5793 64.5114 37.1900 178.7167 131 R 3.8500 8.1902 119.2264 59.4421 29.8071 179.2094 132 T 3.6939 7.8023 115.7724 66.4809 68.4459 176.8908 133 G 3.5134 7.8364 107.3121 47.7775 0.0000 175.8008 134 L 3.9811 7.9905 121.7952 57.5661 41.4708 179.7403 135 S 4.0918 8.5881 115.2211 61.4167 62.7258 176.6356 136 A 3.9721 7.9197 123.4171 55.1206 16.8134 179.7494 137 V 3.5222 7.6230 116.5858 66.2612 31.5652 178.3158 138 L 4.2040 7.9554 118.5770 57.8808 41.4981 179.5074 139 I 3.8013 8.3917 120.3053 64.2516 36.8024 178.5657 140 G 3.8568 8.1631 105.6532 46.4400 0.0000 174.0420 141 I 4.4569 6.9659 113.6571 59.9129 38.0977 175.7559 142 G 4.0480 8.0295 107.3391 47.3078 0.0000 174.9029 143 T 4.0385 7.9433 116.4371 62.1801 69.0950 173.5533 144 P 4.3238 0.0000 0.0000 63.8184 32.1925 175.7274 145 E 3.7643 8.9293 118.6386 56.5784 27.5422 177.0089 146 A 3.9682 8.2579 120.9673 55.5199 18.6212 179.0188 147 E 3.9524 8.0036 118.2231 59.2880 29.7193 179.0648 148 T 3.9020 7.8047 115.1915 66.7051 68.5639 176.8283 149 R 3.8842 8.4080 120.1816 58.9430 30.0042 178.8192 150 A 3.9310 8.3076 120.7290 55.2530 18.3874 179.4151 151 A 3.9246 7.8177 118.7485 55.4079 18.3387 179.8432 152 L 3.9235 8.1439 117.5247 57.7381 41.6581 179.4870 153 L 3.9069 8.0804 120.3490 58.1181 42.0590 178.7808 154 L 3.9181 7.9088 120.0301 58.1122 41.9218 178.7142 155 A 4.0008 8.1897 120.7574 55.3559 18.1841 179.6610 156 T 3.8069 8.1724 114.4420 67.0257 68.5065 177.2780 157 V 3.6130 7.5876 113.7383 64.4219 31.5738 178.3515 158 D 4.4346 8.3125 118.8572 57.3182 40.6664 179.2503 159 G 3.5551 8.3972 106.4186 47.8075 0.0000 175.7991 160 L 3.9794 8.2721 121.9872 57.2991 41.4705 179.5220 161 A 3.8897 8.1996 120.8995 54.9308 18.1106 179.2791 162 L 3.8178 7.6190 117.5506 58.6113 42.6064 178.7357 163 D 4.3024 7.9345 118.4230 57.1691 40.4050 178.6468 164 A 3.7495 7.3565 120.9184 54.4864 17.9844 179.5287 165 I 3.7094 7.1248 118.3378 64.8300 37.3345 178.3928 166 G 3.7755 7.4298 102.9730 46.2247 0.0000 173.9138 167 S 4.8442 7.6449 115.9058 56.5059 63.7022 173.1670 168 P 4.4659 0.0000 0.0000 65.1545 31.7138 179.1908 169 A 4.0517 7.9997 120.6737 54.5547 18.4126 177.9539 170 L 4.1548 7.8436 113.9344 55.8279 42.5742 176.7497 171 Y 4.5370 7.3662 116.5332 55.6910 37.7410 173.2928 172 P 4.6098 0.0000 0.0000 61.6285 33.0779 176.4886 173 P 4.3638 0.0000 0.0000 65.8547 31.2088 178.8063 174 E 4.0632 8.2312 115.8696 59.2269 29.5900 178.5573 175 Y 3.9998 8.0439 120.4967 60.6752 38.8847 177.7802 176 L 4.0442 8.0986 119.4706 57.8905 41.7209 179.2650 177 E 4.1227 8.5440 118.7531 59.4335 29.3846 178.7998 178 H 4.0606 8.1978 117.9123 59.1610 29.9496 176.8489 179 A 3.7814 7.6293 122.4972 55.2209 18.0678 179.1819 180 L 3.8664 8.0134 118.5984 58.4288 42.0369 178.6196 181 D 4.4069 8.4618 117.9587 57.5148 40.9196 178.3285 182 I 3.6256 7.5574 119.0421 64.3646 37.1683 177.8618 183 Q 4.0983 7.9783 119.2084 59.2705 29.1975 178.0355 184 I 4.0193 8.1986 121.2909 64.2025 37.2527 178.8022 185 G 3.4771 8.1156 103.7269 46.1197 0.0000 174.9086 *187 I 4.1993 7.6538 122.7263 60.8661 39.1461 176.7133 188 L 4.3073 7.8486 118.0814 55.0736 42.0013 176.6053 189 Q 4.1862 7.3586 118.2923 57.4426 28.7297 177.0218 190 G 3.8945 8.9899 111.5451 45.1511 0.0000 173.2846 191 A 4.3789 7.4514 122.0693 51.8675 19.2120 177.9058 192 D 4.6600 8.8655 121.1726 53.1494 39.2831 175.4416 193 V 4.6393 7.2907 114.7377 59.6936 36.2916 174.9915 194 V 4.4864 8.1788 118.6576 61.0778 31.7549 173.9578 195 P 4.4767 0.0000 0.0000 63.9490 31.2929 174.3566 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 9 T 8.03 4.33 4.56 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 1.22 0.00 0.00 10 S 8.55 3.80 0.00 3.91 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.06 0.00 1.67 1.30 0.00 3.56 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.77 0.00 12 E 8.24 4.33 0.00 2.35 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 0.00 2.52 2.75 0.00 13 R 8.12 4.02 0.00 2.07 2.01 0.00 3.12 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 14 L 8.04 4.09 0.00 2.14 1.97 0.98 1.07 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 15 A 8.76 4.16 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.37 4.03 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 17 A 8.16 4.01 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 18 L 8.40 3.90 0.00 1.88 1.93 1.02 0.64 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 19 F 8.45 3.99 0.00 3.25 3.19 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 20 D 8.35 4.36 0.00 3.11 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 21 V 8.07 3.52 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.99 0.00 0.00 22 A 8.16 3.82 0.95 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 23 A 7.63 3.61 0.99 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 0.00 0.00 24 E 7.41 4.18 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 25 S 7.95 4.46 0.00 3.91 3.98 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 26 G 8.10 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 27 L 7.88 3.83 0.00 1.48 1.58 -0.25 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.29 4.03 0.00 2.11 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 2.37 0.00 29 G 8.18 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 0.00 0.00 0.00 30 A 7.51 4.74 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 31 S 7.75 4.38 0.00 4.08 4.04 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 32 V 8.43 3.62 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 1.17 0.00 0.00 0.97 0.00 0.00 33 R 7.92 3.91 0.00 1.94 1.92 0.00 3.25 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 34 E 8.23 3.98 0.00 2.11 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 2.59 0.00 35 V 8.16 3.59 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 1.06 0.00 0.00 36 A 8.37 4.02 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 K 8.38 3.86 0.00 1.96 2.02 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.47 7.81 38 R 8.01 3.90 0.00 1.85 1.98 0.00 3.52 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 39 A 8.31 4.21 1.42 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 0.00 0.00 0.00 40 G 7.81 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 0.00 0.00 0.00 41 V 7.75 4.56 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 0.78 0.00 0.00 1.02 0.00 0.00 42 S 8.23 4.48 0.00 4.05 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 43 I 8.42 3.82 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 1.60 0.65 0.94 0.00 0.00 44 G 8.21 3.70 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 0.00 0.00 0.00 45 A 8.07 3.98 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 46 V 7.54 3.53 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 1.07 0.00 0.00 47 Q 8.13 4.32 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.72 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 48 H 7.91 4.12 0.00 3.19 3.36 0.00 5.75 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 H 7.30 4.21 0.00 2.27 2.15 0.00 5.84 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 7.63 5.19 0.00 3.10 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 T 8.13 3.83 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 130 I 7.84 3.65 1.85 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 1.50 0.68 0.88 0.00 0.00 131 R 8.19 3.85 0.00 1.79 1.87 0.00 3.12 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 132 T 7.80 3.69 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 1.06 0.00 0.00 133 G 7.84 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 L 7.99 3.98 0.00 1.79 1.69 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 135 S 8.59 4.09 0.00 3.90 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 A 7.92 3.97 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 0.00 137 V 7.62 3.52 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 1.02 0.00 0.00 0.97 0.00 0.00 138 L 7.96 4.20 0.00 1.84 1.68 0.94 0.65 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 0.00 139 I 8.39 3.80 1.91 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 1.44 0.70 0.90 0.00 0.00 140 G 8.16 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 I 6.97 4.46 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.00 0.91 0.00 0.00 142 G 8.03 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 0.00 0.00 0.00 0.00 143 T 7.94 4.04 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 1.26 0.00 0.00 144 P 0.00 4.32 0.00 2.03 1.98 0.00 3.82 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 145 E 8.93 3.76 0.00 2.09 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 2.23 0.00 146 A 8.26 3.97 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 0.00 147 E 8.00 3.95 0.00 2.03 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 2.35 2.22 0.00 148 T 7.80 3.90 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 0.00 149 R 8.41 3.88 0.00 1.95 1.97 0.00 3.22 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 150 A 8.31 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 0.00 151 A 7.82 3.92 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 0.00 152 L 8.14 3.92 0.00 1.84 1.73 0.92 0.56 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 0.00 153 L 8.08 3.91 0.00 1.83 1.80 0.92 0.40 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 0.00 154 L 7.91 3.92 0.00 1.79 1.77 0.90 1.00 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 0.00 155 A 8.19 4.00 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 0.00 156 T 8.17 3.81 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 157 V 7.59 3.61 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 0.80 0.00 0.00 0.94 0.00 0.00 158 D 8.31 4.43 0.00 2.68 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 0.00 159 G 8.40 3.56 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 0.00 160 L 8.27 3.98 0.00 1.87 1.77 0.94 1.19 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 0.00 161 A 8.20 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 0.00 162 L 7.62 3.82 0.00 1.73 1.83 0.89 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 163 D 7.93 4.30 0.00 2.21 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 0.00 164 A 7.36 3.75 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 0.00 165 I 7.12 3.71 1.94 0.00 0.00 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 1.38 0.78 0.76 0.00 0.00 166 G 7.43 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 0.00 167 S 7.64 4.84 0.00 4.08 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 0.00 168 P 0.00 4.47 0.00 2.24 2.33 0.00 3.96 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.93 0.00 169 A 8.00 4.05 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 0.00 170 L 7.84 4.15 0.00 1.66 1.39 0.86 0.78 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 0.00 171 Y 7.37 4.54 0.00 2.91 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 0.00 172 P 0.00 4.61 0.00 2.59 2.22 0.00 3.73 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 2.16 2.00 0.00 173 P 0.00 4.36 0.00 2.24 2.20 0.00 3.65 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.36 0.00 174 E 8.23 4.06 0.00 2.20 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 2.45 2.35 0.00 175 Y 8.04 4.00 0.00 3.16 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 0.00 176 L 8.10 4.04 0.00 2.00 1.76 1.10 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 177 E 8.54 4.12 0.00 2.16 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 2.45 2.65 0.00 178 H 8.20 4.06 0.00 3.27 3.31 0.00 5.61 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 A 7.63 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 L 8.01 3.87 0.00 1.73 1.99 0.89 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 181 D 8.46 4.41 0.00 2.92 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 0.00 182 I 7.56 3.63 1.91 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 1.31 0.70 0.87 0.00 0.00 183 Q 7.98 4.10 0.00 2.01 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.95 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 184 I 8.20 4.02 2.05 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 1.49 0.71 0.94 0.00 0.00 185 G 8.12 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *187 I 7.65 4.20 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 1.69 0.86 0.91 0.00 0.00 188 L 7.85 4.31 0.00 1.72 1.69 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 189 Q 7.36 4.19 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.52 0.00 0.00 0.00 0.00 0.00 2.67 2.45 0.00 190 G 8.99 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 0.00 191 A 7.45 4.38 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 0.00 192 D 8.87 4.66 0.00 2.59 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 V 7.29 4.64 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 0.79 0.00 0.00 0.93 0.00 0.00 194 V 8.18 4.49 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 0.78 0.00 0.00 0.92 0.00 0.00 195 P 0.00 4.48 0.00 2.15 2.01 0.00 3.83 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 1.87 1.90 0.00 * Residues marked with a * may have inaccurate shift predictions.