NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.3057 8.2644 123.5815 51.5416 19.9133 177.6311 5 E 3.7536 9.3345 119.0764 61.3751 29.9180 174.9447 6 Q 3.3855 8.8763 117.1113 56.3084 26.5369 172.3128 7 P 4.1000 0.0000 0.0000 64.5031 31.9394 177.1971 8 Y 4.8771 7.4562 114.3102 57.9055 38.8111 175.0914 9 H 4.8854 7.8671 115.7087 55.8550 29.7722 173.1931 10 H 4.9121 8.1072 116.1534 53.9669 30.1680 175.7158 11 G 3.8964 8.4687 113.1961 44.6730 0.0000 173.7449 12 S 4.2796 8.2946 114.6342 57.8730 64.9102 175.1127 13 L 3.9268 8.4791 124.3759 58.0411 41.4368 179.7417 14 R 3.5378 7.6394 117.8979 59.4143 29.9886 178.4170 15 R 3.9062 7.9187 118.3129 59.3278 30.1160 178.5757 16 V 3.5974 7.9226 118.0641 66.1189 31.5002 178.0081 17 L 4.0878 8.3471 119.0911 57.8377 41.4611 179.5685 18 L 4.0095 8.2967 118.7831 57.6204 41.6051 179.4396 19 A 3.9943 8.2058 120.7818 55.1823 18.3450 179.8803 20 R 3.8395 8.0784 116.3811 59.3737 30.1332 179.1097 21 A 3.9657 8.3213 120.8949 55.1688 18.3737 179.3192 22 E 3.8551 8.2193 117.8244 59.3247 29.8253 178.9522 23 S 4.0672 7.9867 113.0767 61.7832 62.3979 176.3467 24 T 3.8696 8.0375 118.4419 66.2981 68.0570 176.2780 25 L 3.9195 8.2684 122.7545 58.5237 41.8844 179.1213 26 E 3.9370 8.0051 116.7608 58.9346 29.3901 179.3221 27 K 4.1297 7.8048 117.6694 58.9677 32.4697 178.2735 28 D 4.8620 8.8160 115.7148 52.4681 42.6355 177.4874 29 G 4.0691 7.9635 105.6563 44.7275 0.0000 174.8994 30 V 3.6364 8.1667 117.6747 64.6919 31.2685 178.1572 31 D 4.4528 8.0456 118.6747 56.2343 40.8716 177.0341 32 G 3.8060 7.8525 106.6682 45.8003 0.0000 173.4464 33 L 4.3258 7.5573 121.3397 53.7569 42.4576 176.7744 34 S 4.5764 8.3208 117.0731 55.5214 65.6305 174.0577 35 L 3.9412 8.5293 130.5330 58.3230 41.8833 179.0603 36 R 3.9271 7.9431 117.4899 59.4590 30.0009 178.9250 37 Q 4.0148 8.0096 117.5349 58.9578 28.6952 178.8573 38 L 3.9806 8.2203 119.9438 57.6665 41.4140 179.3688 39 A 4.0377 8.0399 120.0112 55.2975 18.6095 179.6357 40 R 4.0515 7.8803 116.5490 59.3302 29.9677 179.0251 41 E 4.0493 8.4283 117.6834 58.8177 29.4078 178.1568 42 A 4.6196 7.7020 118.9555 50.3166 20.1304 177.1203 43 G 3.7091 7.5497 109.7825 46.4280 0.0000 172.4496 *49 P 4.3021 0.0000 0.0000 62.1247 33.5202 177.9625 50 S 4.1912 7.9614 114.2584 58.7262 62.7391 173.5468 51 K 4.3400 8.5723 124.9173 55.7848 32.3728 175.7416 52 H 4.1106 8.1389 122.1565 57.3332 29.8375 174.8811 53 F 4.2871 7.7136 117.4493 57.0833 39.5608 175.7890 54 R 4.0201 8.7656 125.1814 59.3388 30.2715 176.0095 55 D 4.5824 7.6734 115.5076 51.2816 43.1011 175.8880 56 R 3.8073 8.4674 118.5875 59.8436 29.8146 177.8554 57 Q 3.9417 8.1706 118.4109 59.1291 29.0166 178.0296 58 A 4.0166 8.6011 122.1195 54.8556 18.3577 179.2580 59 L 2.6185 7.4615 118.4922 58.0003 42.0015 179.3399 60 L 3.8977 7.8448 118.7834 57.7841 41.4510 179.1891 61 D 4.3481 8.3287 118.8131 57.3035 40.6925 178.7355 62 A 4.0682 8.0192 121.2125 55.1224 18.3267 179.6714 63 L 3.8773 8.0714 117.3945 57.8197 41.6967 179.6317 64 A 3.9244 8.2101 120.8419 55.0952 18.3111 179.2066 65 E 3.9994 8.5705 118.2173 59.6787 29.7491 178.9155 66 S 4.2165 8.4418 113.4051 61.2653 62.3162 176.3201 67 G 3.5732 8.3735 108.6485 47.8973 0.0000 175.7054 68 F 4.1191 8.0207 120.6160 60.0858 38.8823 177.6490 69 L 4.0421 8.2625 118.7667 58.1517 41.4413 179.9742 70 R 3.9732 8.2380 117.8654 58.9002 29.9425 178.9048 71 L 2.9065 7.8218 120.3982 57.9784 42.1011 179.0391 72 T 3.7799 8.2022 115.8593 66.6251 68.4278 176.1019 73 A 4.0886 8.1610 122.4507 55.3841 18.3581 179.5865 74 A 3.9930 8.1360 118.9996 55.2590 18.4753 179.8936 75 L 3.9502 8.0544 117.5601 58.0126 41.6657 179.5630 76 E 3.9945 8.4315 118.7310 59.5363 29.2994 179.6887 77 R 3.9132 8.2403 117.8823 59.0377 29.8683 178.8979 78 A 3.9797 7.8288 119.7604 55.0963 18.5524 179.5207 79 V 3.6856 7.8708 116.6020 66.3559 31.4359 177.9246 80 E 3.9667 8.0812 116.8783 59.6288 29.3652 178.8287 81 E 4.0448 8.4267 118.4361 57.9909 29.9458 177.0655 82 A 4.3796 6.9350 120.3910 50.6651 19.7604 176.6958 83 E 4.0271 8.4826 118.9556 57.2692 30.5381 178.4030 84 S 4.6086 8.3006 118.4753 57.5359 62.1299 174.2365 85 H 4.9707 7.2622 116.3343 52.7233 33.2216 173.8755 86 A 3.9852 8.0092 125.0381 55.5701 18.2807 180.2802 87 R 2.5100 7.2932 116.1772 58.9304 29.8123 178.4151 88 A 3.8223 7.2418 119.9298 55.0956 18.3119 179.7134 89 R 3.8942 7.8741 116.6010 59.3080 30.2389 179.2496 90 F 4.2500 8.8882 117.8164 60.6292 39.0479 177.4992 91 A 3.9783 8.0775 120.0650 55.2123 18.1696 179.5838 92 A 3.9322 8.2980 119.4832 55.2221 18.3747 179.8426 93 L 3.9101 8.2315 117.5395 57.7307 41.6569 179.6124 94 A 3.5722 7.7467 120.5523 54.9607 18.2243 179.7963 95 G 3.5883 7.8141 103.8286 48.0327 0.0000 175.6594 96 A 4.0747 8.1828 123.2852 54.8316 18.3338 179.0649 97 Y 3.9785 8.2755 118.2414 60.9216 38.9638 178.5580 98 V 3.6217 7.9672 119.1049 66.1604 31.6885 178.0399 99 S 4.1160 8.1867 114.8887 61.4807 62.7707 176.4500 100 F 3.9002 8.3165 122.9706 61.2285 38.9467 176.8684 101 A 3.9731 7.7010 118.9059 55.3951 18.2446 179.3627 102 L 4.0477 7.8149 115.5659 57.2103 41.8372 178.8996 103 A 4.0673 7.7158 119.3821 53.4577 19.7304 176.9791 104 H 4.8252 7.6540 113.9987 54.0927 29.9480 175.0392 105 R 3.9323 7.8478 122.3039 59.6315 30.5515 178.9041 106 E 3.9835 8.3183 117.8358 59.0804 29.2837 179.0144 107 L 3.8735 8.1928 120.0634 57.9157 42.2269 178.4611 108 L 3.7286 7.9820 119.3984 57.9026 42.2675 178.2362 109 A 4.2675 7.8685 120.7601 55.1468 18.1618 180.3029 110 L 4.2088 7.6923 115.9558 56.0727 41.8535 178.2650 *112 Y 5.2251 7.9719 117.1572 57.7439 39.9081 177.8578 113 G 3.6861 8.4904 108.0297 48.5753 0.0000 174.5642 114 N 4.4647 8.8909 119.2532 56.3199 39.2246 176.7615 115 K 3.8740 8.4393 117.4598 59.3545 32.2082 176.6704 116 H 4.8263 7.9180 112.7862 55.2764 29.1713 174.5143 117 A 4.2837 7.7834 123.6037 50.7736 18.9334 176.0963 118 P 4.2833 0.0000 0.0000 64.5639 31.6584 176.7385 119 G 3.8265 8.9820 110.1794 45.9888 0.0000 173.2399 120 A 3.9897 7.5894 121.1976 51.8834 19.0270 179.1001 121 A 4.1576 8.4842 123.7305 51.8617 20.2710 179.0712 122 S 4.0531 8.7901 119.3313 61.7730 62.8791 177.1390 123 Q 4.0745 8.0052 120.5820 58.7679 28.3851 178.6025 124 V 3.5313 7.6783 119.7460 65.8238 31.7758 177.7394 125 V 3.3519 7.7098 117.9736 66.2055 31.3463 177.8332 126 E 3.8146 8.4747 118.1939 59.2301 29.4357 179.1779 127 A 4.0604 7.9527 120.9716 55.1048 18.2305 179.9392 128 G 2.4366 7.2931 103.0348 47.8613 0.0000 175.4643 129 H 4.2391 7.8569 117.3037 58.2001 28.9052 177.4767 130 A 4.1643 7.6802 122.4843 55.0777 17.7106 180.0976 131 S 4.1706 7.2733 107.5819 59.4199 62.7354 175.8759 *133 D 4.4890 8.1815 122.4303 54.4045 42.7513 177.2885 134 L 3.9069 7.8973 120.2766 58.7538 41.9346 179.2541 135 T 3.7564 7.4597 114.5994 66.6771 68.3261 176.7659 136 V 3.5829 7.6977 119.5856 65.9653 31.5027 177.8594 137 R 3.8947 8.3152 118.7249 59.4949 29.9712 178.5545 138 I 3.8208 7.7491 119.6453 64.3087 37.0890 178.6350 139 V 3.8546 7.9142 119.0229 66.4037 31.4201 178.1321 140 T 4.0863 8.2669 115.8135 66.9255 68.2441 176.4108 141 E 4.0191 8.7632 120.5636 59.4137 29.4523 179.3586 142 A 4.1081 8.1558 120.8522 55.2643 18.3215 179.7380 143 Q 3.9946 8.3669 116.4923 58.8617 28.5460 178.6310 144 A 4.0474 8.0192 121.1520 54.8364 18.5719 179.0665 145 A 4.1912 8.2932 118.0126 52.8464 18.4551 178.4123 146 G 3.8757 7.5316 104.9203 46.2358 0.0000 174.7697 147 D 4.5370 8.2692 122.7930 55.7753 41.1518 176.2024 148 I 4.5388 7.2549 110.1285 58.3835 40.7971 175.5777 149 G 3.8845 8.3298 110.9402 44.9689 0.0000 171.5151 150 P 4.5746 0.0000 0.0000 62.0188 32.1831 175.7403 151 G 4.2225 8.5570 107.1211 43.1098 0.0000 173.3546 152 D 4.3388 8.3361 119.9403 54.0345 41.7606 176.7425 153 A 4.1032 8.6839 130.4909 55.1122 18.4348 179.0127 154 S 4.0998 8.6652 113.2302 61.4476 63.1580 176.9952 155 R 3.9804 8.0864 121.3589 58.9319 29.9034 178.7926 156 I 3.7930 7.8901 119.4819 64.4803 37.1045 178.2761 157 A 4.0386 8.2921 121.8050 55.1324 18.1263 179.4582 158 L 3.9706 7.9796 118.8755 58.2498 42.0982 179.3817 159 V 3.5515 8.1846 118.2263 65.7965 31.4404 177.8185 160 A 3.3323 8.0421 120.5180 54.9215 18.2268 179.3068 161 F 4.1754 8.4184 119.0930 61.4458 39.3698 177.1546 162 A 3.5878 7.9976 120.3210 55.2293 18.1460 179.5717 163 T 3.4609 7.7157 114.2613 66.9347 68.5085 176.8149 164 F 4.3097 7.9002 119.1980 60.2858 38.9879 177.6091 165 H 4.6339 8.8047 118.7633 59.0165 29.4805 177.5119 166 G 3.5198 8.3243 108.0808 47.7676 0.0000 175.5542 167 I 3.6794 7.7895 122.3599 64.1301 37.1302 178.3177 168 A 4.0368 8.2372 121.3778 55.5251 18.3037 179.8285 169 T 3.7884 8.1259 114.3102 66.7660 68.3106 176.8888 170 L 3.9795 7.9317 119.5876 57.6668 42.0122 179.2051 171 A 4.1159 8.3343 120.7023 55.2219 18.1891 179.6478 172 A 4.1310 8.3372 118.2842 54.3782 18.4789 178.9999 173 G 4.0688 7.6989 101.7741 43.1377 0.0000 172.0798 174 G 3.5997 7.5978 113.3366 45.4217 0.0000 173.8372 *176 L 4.1358 7.8028 123.9849 53.2497 44.1681 176.3432 177 D 4.3667 9.2223 117.2072 55.2042 39.3264 174.0645 178 G 3.9018 8.2693 104.8510 45.2459 0.0000 173.2919 179 A 4.1625 7.7167 123.6053 50.8752 19.1065 175.8354 180 P 4.3915 0.0000 0.0000 62.2370 32.2559 177.6117 181 V 3.6567 8.7421 123.5528 65.3313 30.9828 177.9643 182 D 4.3555 8.1581 117.9608 57.2629 41.0412 178.0748 183 E 4.0516 8.1472 118.5352 59.1736 29.3392 179.5479 184 V 3.6413 7.6526 118.0283 65.7818 31.7461 177.8678 185 V 3.9082 8.1830 118.4298 66.6858 31.2617 178.1561 186 T 3.9617 8.0333 114.9646 66.5928 68.3133 176.5667 187 A 4.0413 8.2321 122.4809 55.1365 18.3636 179.5275 188 A 4.0349 8.4245 119.5060 55.4206 18.3534 180.0469 189 S 4.5491 8.9667 114.1156 62.1060 62.9537 176.6872 190 D 4.5537 8.6321 121.8399 57.7827 40.5465 179.1147 191 T 3.9938 8.2553 116.2557 66.4494 68.6269 176.5038 192 F 4.3120 8.6771 122.8215 61.2113 39.3679 176.8728 193 W 4.0824 8.8128 128.0120 60.7070 30.3378 177.9930 194 R 3.9598 8.2126 116.7163 59.3384 29.6024 179.1103 195 G 3.6275 8.1555 104.1641 46.8469 0.0000 174.8806 196 L 4.1272 7.2106 119.7712 54.7826 42.4615 176.8969 197 A 3.7836 6.8158 121.0496 52.0558 18.9089 177.3409 198 Q 4.1002 8.0917 118.7247 56.0970 28.8481 176.0583 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 A 8.26 4.31 1.02 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 0.00 0.00 5 E 9.33 3.75 0.00 2.00 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 2.24 2.37 0.00 6 Q 8.88 3.39 0.00 2.27 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.20 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 7 P 0.00 4.10 0.00 0.66 1.67 0.00 3.43 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 1.74 1.91 0.00 8 Y 7.46 4.88 0.00 2.91 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 9 H 7.87 4.89 0.00 3.06 3.27 0.00 5.83 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 H 8.11 4.91 0.00 3.12 3.18 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 G 8.47 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.29 4.28 0.00 4.00 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 13 L 8.48 3.93 0.00 1.65 1.71 0.99 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 14 R 7.64 3.54 0.00 1.12 1.70 0.00 3.02 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.37 0.00 15 R 7.92 3.91 0.00 1.98 1.90 0.00 3.22 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 16 V 7.92 3.60 2.09 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 0.99 0.00 0.00 1.01 0.00 0.00 17 L 8.35 4.09 0.00 2.06 1.90 1.09 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.30 4.01 0.00 1.99 1.76 1.08 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.21 3.99 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 20 R 8.08 3.84 0.00 2.04 2.00 0.00 3.15 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 21 A 8.32 3.97 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 22 E 8.22 3.86 0.00 2.14 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 0.00 2.27 2.27 0.00 23 S 7.99 4.07 0.00 3.95 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 24 T 8.04 3.87 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 1.22 0.00 0.00 25 L 8.27 3.92 0.00 1.93 1.76 0.92 0.85 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 26 E 8.01 3.94 0.00 1.95 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 2.46 2.43 0.00 27 K 7.80 4.13 0.00 1.87 1.84 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.45 7.81 28 D 8.82 4.86 0.00 2.65 2.66 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 29 G 7.96 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 0.00 0.00 0.00 30 V 8.17 3.64 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 0.75 0.00 0.00 0.92 0.00 0.00 31 D 8.05 4.45 0.00 2.68 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 32 G 7.85 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 0.00 0.00 0.00 33 L 7.56 4.33 0.00 1.84 1.58 0.87 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.32 4.58 0.00 3.81 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 35 L 8.53 3.94 0.00 1.78 1.66 1.05 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 36 R 7.94 3.93 0.00 1.90 1.97 0.00 3.19 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 37 Q 8.01 4.01 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 38 L 8.22 3.98 0.00 1.83 1.73 0.94 0.89 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 39 A 8.04 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 7.88 4.05 0.00 1.79 1.98 0.00 3.30 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 41 E 8.43 4.05 0.00 2.15 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 2.39 0.00 42 A 7.70 4.62 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 43 G 7.55 3.71 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 0.00 0.00 0.00 *49 P 0.00 4.30 0.00 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0.00 0.00 125 V 7.71 3.35 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 0.70 0.00 0.00 0.92 0.00 0.00 126 E 8.47 3.81 0.00 2.00 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 0.00 2.27 2.35 0.00 127 A 7.95 4.06 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 0.00 128 G 7.29 2.44 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 0.00 129 H 7.86 4.24 0.00 3.16 3.29 0.00 5.68 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.68 4.16 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 0.00 131 S 7.27 4.17 0.00 3.99 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 *133 D 8.18 4.49 0.00 2.86 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 L 7.90 3.91 0.00 1.81 1.87 0.90 0.79 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 0.00 135 T 7.46 3.76 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 136 V 7.70 3.58 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.89 0.00 0.00 137 R 8.32 3.89 0.00 1.91 2.18 0.00 3.17 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 138 I 7.75 3.82 2.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.92 1.11 0.00 0.00 139 V 7.91 3.85 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 1.13 0.00 0.00 0.84 0.00 0.00 140 T 8.27 4.09 4.40 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 1.23 0.00 0.00 141 E 8.76 4.02 0.00 2.21 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 0.00 2.37 2.59 0.00 142 A 8.16 4.11 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 Q 8.37 3.99 0.00 2.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 144 A 8.02 4.05 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 0.00 145 A 8.29 4.19 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 0.00 146 G 7.53 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 0.00 147 D 8.27 4.54 0.00 2.99 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 0.00 148 I 7.25 4.54 1.66 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.61 0.04 0.00 0.00 149 G 8.33 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 0.00 150 P 0.00 4.57 0.00 1.93 1.98 0.00 3.64 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 151 G 8.56 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 0.00 0.00 0.00 152 D 8.34 4.34 0.00 2.72 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 A 8.68 4.10 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 0.00 154 S 8.67 4.10 0.00 4.03 4.12 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 0.00 155 R 8.09 3.98 0.00 2.00 2.04 0.00 3.30 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.67 0.00 156 I 7.89 3.79 2.08 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 1.47 1.04 1.04 0.00 0.00 157 A 8.29 4.04 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 0.00 158 L 7.98 3.97 0.00 1.98 1.87 1.03 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 159 V 8.18 3.55 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 1.17 0.00 0.00 1.03 0.00 0.00 160 A 8.04 3.33 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 0.00 161 F 8.42 4.18 0.00 2.83 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 0.00 0.00 0.00 0.00 0.00 0.00 162 A 8.00 3.59 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 0.00 163 T 7.72 3.46 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 164 F 7.90 4.31 0.00 3.13 3.31 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 0.00 165 H 8.80 4.63 0.00 2.85 2.93 0.00 5.79 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 0.00 166 G 8.32 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.79 3.68 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 1.44 0.72 1.00 0.00 0.00 168 A 8.24 4.04 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 T 8.13 3.79 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 1.19 0.00 0.00 170 L 7.93 3.98 0.00 1.76 1.73 0.90 1.00 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 0.00 171 A 8.33 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 A 8.34 4.13 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 0.00 173 G 7.70 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 0.00 0.00 0.00 174 G 7.60 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 0.00 0.00 0.00 *176 L 7.80 4.14 0.00 1.75 1.88 1.01 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 177 D 9.22 4.37 0.00 2.72 2.66 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 0.00 178 G 8.27 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 A 7.72 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 0.00 180 P 0.00 4.39 0.00 2.21 2.00 0.00 3.74 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.08 0.00 181 V 8.74 3.66 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 0.97 0.00 0.00 0.98 0.00 0.00 182 D 8.16 4.36 0.00 2.83 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 0.00 183 E 8.15 4.05 0.00 2.25 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 0.00 2.35 2.33 0.00 184 V 7.65 3.64 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 1.14 0.00 0.00 0.99 0.00 0.00 185 V 8.18 3.91 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 1.03 0.00 0.00 1.12 0.00 0.00 186 T 8.03 3.96 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 187 A 8.23 4.04 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 0.00 188 A 8.42 4.03 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 0.00 189 S 8.97 4.55 0.00 4.14 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 0.00 190 D 8.63 4.55 0.00 2.79 2.83 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 0.00 191 T 8.26 3.99 4.37 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 1.28 0.00 0.00 192 F 8.68 4.31 0.00 3.34 3.54 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 0.00 193 W 8.81 4.08 0.00 3.69 3.33 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 0.00 194 R 8.21 3.96 0.00 2.10 2.01 0.00 3.28 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.96 0.00 195 G 8.16 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 L 7.21 4.13 0.00 1.13 1.34 0.27 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 197 A 6.82 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 Q 8.09 4.10 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.49 0.00 0.00 0.00 0.00 0.00 2.27 2.18 0.00 * Residues marked with a * may have inaccurate shift predictions.