NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 E 4.2931 8.4444 121.4719 56.1446 30.2773 174.9164 5 L 4.5479 7.4937 124.5976 50.6203 42.4526 174.2013 6 T 4.3695 7.6718 114.3799 60.2361 72.8932 174.8277 7 L 4.0561 8.4669 121.9965 58.6161 41.7072 178.1427 8 N 4.4612 8.2371 114.8403 56.8911 39.0950 176.4382 9 V 3.7691 7.5734 118.3550 66.0771 31.4596 177.9534 10 L 4.1751 7.9262 117.4758 58.0216 41.5827 179.1242 11 Q 4.4572 8.4040 116.1045 57.4984 29.5240 177.0865 12 T 4.5334 7.7501 118.3951 62.3837 68.5556 172.8866 *14 N 4.6123 7.6952 117.8408 52.3087 39.3707 174.9476 15 A 4.0010 8.7056 118.7409 55.7696 18.0938 179.4309 16 Q 3.9713 8.1427 117.2363 59.5204 28.6563 178.2562 17 E 3.9868 8.6727 119.4626 59.0853 29.4300 178.9582 18 Y 3.7960 8.0653 117.1390 61.1575 37.9373 178.2044 19 E 4.0392 8.3429 119.4142 59.6343 29.6535 179.1996 20 D 4.3526 8.4967 119.2259 57.4440 40.6155 179.0076 21 I 3.7563 7.2070 118.3142 64.2032 37.5994 177.9516 22 R 4.0148 7.8911 118.9688 59.5395 29.6537 178.4717 23 A 4.1019 8.1264 119.3995 54.8394 18.4083 179.1852 24 A 4.1541 7.7186 118.6358 52.7467 18.7645 177.4113 25 G 4.3447 6.7695 103.6628 43.4160 0.0000 173.9265 26 S 4.0766 8.4118 114.8666 61.2089 62.2285 175.8950 27 D 4.3071 8.0190 121.2330 56.6953 39.1476 178.2817 28 E 3.9333 8.1018 120.0806 58.8112 29.5213 179.1777 29 R 3.8945 8.2062 118.8394 59.3336 30.0776 178.4056 30 R 4.0272 8.2490 118.6795 59.5248 30.0097 178.1374 31 E 3.9605 8.1135 118.2665 59.4387 29.5215 179.1129 32 L 3.9760 7.8937 120.0781 58.5623 41.9385 179.0737 33 T 3.9692 8.1770 114.6635 67.1945 68.4981 176.0522 34 H 4.5425 8.5342 117.0239 58.7674 28.7682 177.3780 35 A 4.2680 8.3597 122.4078 55.0391 18.4345 179.9611 36 V 3.5766 7.7310 113.0926 64.0669 31.0192 177.5417 *38 R 4.3021 7.9063 118.7974 55.7936 31.4808 175.8566 39 E 4.4207 8.1930 114.7226 56.5230 29.9846 175.9618 40 L 4.7894 7.7413 118.4707 52.7958 44.3631 175.3912 41 D 4.8376 8.5748 121.3856 52.3995 42.5132 176.0314 42 A 4.3575 8.5424 127.9096 50.4915 19.9049 175.1727 43 P 4.3606 0.0000 0.0000 61.9550 32.2022 175.5746 44 D 4.5642 8.2348 118.9864 55.9257 40.8832 177.0219 45 N 4.4849 9.0221 118.3842 53.4220 36.5774 173.8355 46 W 4.9551 8.0342 117.8567 55.4765 31.5526 176.4678 47 T 4.6931 8.4765 112.6786 60.7266 71.9179 172.4217 *49 N 4.8310 8.6331 116.8583 53.7545 40.1921 174.5824 50 G 3.9635 8.6602 110.3925 45.3373 0.0000 172.3475 51 E 3.8028 8.4423 122.2528 55.1896 30.3271 176.5072 52 Y 4.7719 9.1598 124.1226 57.9887 41.5051 176.4756 53 G 4.0899 8.8596 104.5599 45.7060 0.0000 173.6210 54 S 4.7535 8.8882 117.3224 57.5070 63.5995 175.8755 55 E 3.9452 8.1948 120.6808 59.1981 29.4576 177.3036 56 F 5.1329 8.4054 117.8139 57.4692 38.7043 175.8962 57 G 3.7468 8.4001 112.6311 44.2702 0.0000 176.3855 58 G 4.0316 8.1797 105.2819 46.6474 0.0000 174.4431 59 F 4.0920 7.1733 120.1475 59.0729 38.9899 175.8403 60 F 5.0165 7.6361 117.4801 54.6766 42.0092 173.0320 61 P 4.4029 0.0000 0.0000 65.0884 31.6118 176.7924 62 V 4.5389 7.9561 117.7585 60.9479 34.4578 174.3370 63 Q 5.0690 8.7048 127.6907 54.4408 32.5844 173.3915 64 V 4.8764 8.9713 126.4301 61.2159 34.1320 174.3010 65 R 4.9667 8.8026 127.2243 54.5785 32.2488 175.7748 66 F 5.2292 9.4834 121.0170 56.1887 42.6975 174.2605 67 T 4.5083 8.9582 120.1347 60.6717 72.3089 172.4219 68 P 3.1981 0.0000 0.0000 61.5281 31.9757 177.0028 69 A 3.8552 7.5063 121.9910 55.6052 18.1718 179.0168 70 H 4.2598 7.6665 109.8208 56.2968 29.0244 176.0442 71 E 3.9337 7.6250 118.2444 57.3515 27.4922 175.8595 72 R 4.1143 7.5185 120.8361 58.7822 30.2979 175.9580 73 F 5.5095 7.0685 110.8007 56.4034 41.0403 172.5253 74 H 5.0244 9.1919 113.4807 54.5263 32.3916 172.2063 75 L 5.4879 9.3325 118.6000 53.2977 44.9224 175.6773 76 A 5.2137 8.9930 122.8945 50.2717 22.4860 174.7704 77 L 4.9638 9.5465 126.0633 54.4656 43.6481 175.0716 78 C 5.0535 9.2991 124.8512 57.7775 30.9123 174.1798 79 S 2.7900 7.9450 118.4550 55.7266 64.0972 172.2149 80 P 4.2371 0.0000 0.0000 62.8005 31.4627 177.5627 81 G 4.0117 8.2639 107.8981 46.5301 0.0000 173.3653 82 D 4.5515 8.9584 119.5039 57.4747 41.1117 178.2268 83 V 3.8040 7.7588 117.5427 64.8900 32.0436 176.0673 84 S 4.7106 7.6818 113.6757 56.4677 65.2089 174.6010 85 Q 4.0522 8.8255 125.7378 57.8271 28.9520 176.1750 86 V 4.6400 7.0120 109.8842 58.6346 35.1979 175.7988 87 W 4.3534 8.9540 122.7407 57.0427 30.2308 175.8352 88 V 4.8343 8.8970 117.5115 59.4214 34.9335 174.2892 89 L 5.1114 8.9521 127.2137 53.6862 43.7591 175.4259 90 V 4.7102 8.6363 119.8223 59.4095 35.1967 174.4727 91 L 5.0112 8.3215 125.5878 53.2518 44.7471 175.1319 92 V 4.5959 8.6850 126.5740 60.7538 34.0028 174.2500 93 N 4.9404 9.0075 127.4904 53.2229 40.1892 174.1944 94 A 4.1595 8.6482 128.8035 54.1416 18.7887 178.1440 95 G 3.9388 8.6902 111.6806 44.7368 0.0000 174.3056 96 G 4.1190 9.2533 107.9742 45.0291 0.0000 173.6483 97 E 4.7637 7.5244 115.9412 53.8914 32.7606 173.3473 98 P 4.6502 0.0000 0.0000 62.8368 32.9336 174.8455 99 F 5.3942 8.4318 122.1773 57.1888 42.6184 173.2032 100 A 4.2650 7.1734 123.9660 50.5292 23.0973 175.6514 101 V 3.8689 8.1513 120.9702 63.1242 31.4483 176.2017 102 V 4.1259 8.7571 121.9453 62.4309 32.7898 176.1699 103 Q 4.6180 7.6691 120.1998 54.7221 32.5047 173.0456 104 V 4.9402 8.3635 124.3363 61.2150 34.7592 174.4288 105 Q 4.7209 9.1295 126.3517 53.9715 31.3073 176.9257 106 R 4.1127 9.0493 121.1636 58.3717 30.0271 177.1502 107 R 4.8165 7.6385 115.5193 53.5190 33.7736 174.2141 108 F 3.3312 9.2652 123.0455 59.0049 39.3971 175.3845 109 A 4.1817 8.5380 131.4406 49.3021 19.3792 176.2353 110 S 3.2609 7.1695 118.2688 62.0657 63.1165 176.5199 111 E 3.8287 7.7963 121.8542 58.6862 29.1815 179.0944 112 A 3.8750 7.6048 120.4203 54.6864 18.3747 179.7191 113 V 3.3016 7.3219 116.4173 66.3165 31.6148 178.2956 114 S 3.8884 7.7772 114.7986 61.9754 62.5613 176.5997 115 H 3.9564 8.2437 118.6293 58.9467 28.4188 178.0598 116 S 4.0146 7.8939 116.8912 61.4627 62.5486 176.7631 117 L 3.6339 7.9112 121.6513 57.5304 41.2592 179.4025 118 A 3.6600 7.7920 120.7238 54.8466 18.2256 179.3580 119 L 3.7518 8.0053 118.8505 58.2217 42.1578 178.8583 120 A 3.9924 8.2395 120.8299 55.2467 18.3083 179.4373 121 A 4.3481 8.0601 119.6725 55.5518 18.3674 180.1008 122 S 4.1869 8.2342 112.8363 61.4692 63.1879 176.6218 123 L 4.1115 8.2349 122.8309 57.6336 41.2195 178.9500 124 D 4.5686 8.5965 118.1462 57.7358 41.0239 178.4538 125 T 4.0244 8.0564 115.3143 66.6988 68.6181 176.1056 126 Q 4.3419 8.2998 116.9973 56.3943 28.7291 176.9515 127 G 3.8965 7.7461 108.1966 45.7923 0.0000 173.4704 128 Y 4.1552 7.9337 117.2310 57.0149 38.5751 176.8141 129 S 4.3344 8.5543 118.7677 58.3070 65.0792 175.6185 130 V 3.2900 8.2661 122.5292 66.1234 31.3684 177.7385 131 N 4.1415 8.0968 116.2275 56.9600 38.7642 176.4265 132 D 4.4047 7.9839 120.0245 57.3437 40.8509 178.8225 133 I 3.6020 8.0948 120.7988 64.1885 36.8277 178.3765 134 I 3.5562 7.6066 119.9235 64.8279 37.0545 177.7070 135 H 4.3745 7.5938 114.8293 59.0094 28.8430 177.7428 136 I 3.8553 7.7219 121.3336 64.1465 36.8245 180.3179 137 L 4.1529 8.0268 119.6188 54.6444 41.2346 179.2346 *139 A 4.1912 8.0256 123.5027 52.2731 20.5598 179.6306 140 E 3.8474 8.7516 116.0220 59.3144 29.4629 177.7808 141 G 3.7782 9.2439 107.3402 45.2243 0.0000 174.6581 142 G 4.1725 7.7659 106.2015 45.8786 0.0000 174.4539 143 Q 4.1288 7.4829 123.6760 55.9697 28.6755 175.9409 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 E 8.44 4.29 0.00 1.95 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 2.19 2.30 0.00 5 L 7.49 4.55 0.00 1.66 1.53 0.90 0.76 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 6 T 7.67 4.37 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 1.24 0.00 0.00 7 L 8.47 4.06 0.00 2.02 1.77 1.03 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 8 N 8.24 4.46 0.00 2.76 2.88 0.00 0.00 6.90 7.71 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 9 V 7.57 3.77 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 0.97 0.00 0.00 0.97 0.00 0.00 10 L 7.93 4.18 0.00 2.07 1.93 0.98 0.89 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 11 Q 8.40 4.46 0.00 2.30 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.43 0.00 0.00 0.00 0.00 0.00 2.68 2.70 0.00 12 T 7.75 4.53 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 1.25 0.00 0.00 *14 N 7.70 4.61 0.00 3.03 3.09 0.00 0.00 5.96 7.61 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 15 A 8.71 4.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.14 3.97 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.86 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 17 E 8.67 3.99 0.00 2.26 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 2.30 2.34 0.00 18 Y 8.07 3.80 0.00 3.19 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.34 4.04 0.00 2.18 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 2.51 2.73 0.00 20 D 8.50 4.35 0.00 2.80 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 21 I 7.21 3.76 1.93 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.55 0.89 0.00 0.00 22 R 7.89 4.01 0.00 1.90 2.10 0.00 3.08 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 23 A 8.13 4.10 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 24 A 7.72 4.15 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 25 G 6.77 4.34 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 0.00 26 S 8.41 4.08 0.00 3.89 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 27 D 8.02 4.31 0.00 2.89 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.10 3.93 0.00 2.22 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 0.00 2.39 2.42 0.00 29 R 8.21 3.89 0.00 2.00 2.09 0.00 3.11 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 30 R 8.25 4.03 0.00 2.01 2.04 0.00 3.01 0.00 0.00 2.87 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.34 0.00 31 E 8.11 3.96 0.00 2.24 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 2.34 2.56 0.00 32 L 7.89 3.98 0.00 1.78 1.91 0.88 0.94 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 33 T 8.18 3.97 4.53 0.00 0.00 0.00 0.00 0.00 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 34 H 8.53 4.54 0.00 3.27 3.41 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 35 A 8.36 4.27 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 36 V 7.73 3.58 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 0.91 0.00 0.00 1.08 0.00 0.00 *38 R 7.91 4.30 0.00 1.90 2.32 0.00 3.32 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 39 E 8.19 4.42 0.00 2.46 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 0.00 2.66 2.70 0.00 40 L 7.74 4.79 0.00 1.81 1.72 1.30 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.57 4.84 0.00 2.57 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 42 A 8.54 4.36 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 43 P 0.00 4.36 0.00 1.65 1.73 0.00 3.51 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.70 0.00 44 D 8.23 4.56 0.00 2.71 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 45 N 9.02 4.48 0.00 3.17 3.05 0.00 0.00 7.02 7.68 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 46 W 8.03 4.96 0.00 3.47 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 47 T 8.48 4.69 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 1.23 0.00 0.00 *49 N 8.63 4.83 0.00 2.85 3.03 0.00 0.00 6.73 7.60 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 50 G 8.66 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 51 E 8.44 3.80 0.00 1.95 1.71 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 2.11 1.95 0.00 52 Y 9.16 4.77 0.00 2.92 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 G 8.86 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 S 8.89 4.75 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 55 E 8.19 3.95 0.00 2.01 2.00 0.00 0.00 0.00 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 1.79 0.00 56 F 8.41 5.13 0.00 3.15 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.40 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 G 8.18 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 F 7.17 4.09 0.00 2.27 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 0.00 0.00 0.00 0.00 60 F 7.64 5.02 0.00 3.12 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 61 P 0.00 4.40 0.00 2.16 2.37 0.00 3.74 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 62 V 7.96 4.54 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 1.10 0.00 0.00 1.11 0.00 0.00 63 Q 8.70 5.07 0.00 2.41 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.63 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 64 V 8.97 4.88 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 0.39 0.00 0.00 1.02 0.00 0.00 65 R 8.80 4.97 0.00 1.18 1.48 0.00 2.21 0.00 0.00 2.42 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.96 0.00 66 F 9.48 5.23 0.00 3.21 3.38 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 67 T 8.96 4.51 4.08 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 1.03 0.00 0.00 68 P 0.00 3.20 0.00 1.14 0.73 0.00 2.85 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.44 0.00 69 A 7.51 3.86 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 70 H 7.67 4.26 0.00 3.29 3.53 0.00 5.81 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 E 7.63 3.93 0.00 2.10 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 2.23 2.19 0.00 72 R 7.52 4.11 0.00 1.84 2.10 0.00 2.97 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.52 0.00 73 F 7.07 5.51 0.00 3.09 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 H 9.19 5.02 0.00 3.32 3.28 0.00 5.22 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 9.33 5.49 0.00 2.00 1.82 1.49 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.99 5.21 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 77 L 9.55 4.96 0.00 2.13 1.91 1.10 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 78 C 9.30 5.05 0.00 2.00 1.18 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 79 S 7.95 2.79 0.00 2.72 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 80 P 0.00 4.24 0.00 1.57 2.01 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 81 G 8.26 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 D 8.96 4.55 0.00 2.67 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 V 7.76 3.80 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 0.77 0.00 0.00 0.84 0.00 0.00 84 S 7.68 4.71 0.00 4.07 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 85 Q 8.83 4.05 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 86 V 7.01 4.64 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 0.73 0.00 0.00 0.96 0.00 0.00 87 W 8.95 4.35 0.00 3.49 3.17 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 88 V 8.90 4.83 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 0.68 0.00 0.00 0.79 0.00 0.00 89 L 8.95 5.11 0.00 1.75 1.51 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 90 V 8.64 4.71 1.80 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 0.66 0.00 0.00 1.02 0.00 0.00 91 L 8.32 5.01 0.00 1.60 1.32 0.71 0.79 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 92 V 8.69 4.60 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.11 0.00 0.00 93 N 9.01 4.94 0.00 3.10 2.77 0.00 0.00 6.65 7.41 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 94 A 8.65 4.16 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 95 G 8.69 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 96 G 9.25 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 0.00 0.00 0.00 97 E 7.52 4.76 0.00 2.06 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.28 0.00 98 P 0.00 4.65 0.00 2.05 1.98 0.00 3.57 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.07 0.00 99 F 8.43 5.39 0.00 3.15 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 0.00 100 A 7.17 4.26 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 V 8.15 3.87 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 0.84 0.00 0.00 0.96 0.00 0.00 102 V 8.76 4.13 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 0.56 0.00 0.00 0.95 0.00 0.00 103 Q 7.67 4.62 0.00 2.04 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.48 0.00 104 V 8.36 4.94 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 0.92 0.00 0.00 0.95 0.00 0.00 105 Q 9.13 4.72 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 106 R 9.05 4.11 0.00 1.98 2.12 0.00 3.00 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 107 R 7.64 4.82 0.00 1.83 1.92 0.00 3.40 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.68 0.00 108 F 9.27 3.33 0.00 2.60 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.54 4.18 1.04 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 0.00 0.00 110 S 7.17 3.26 0.00 4.05 3.46 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 0.00 111 E 7.80 3.83 0.00 1.86 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.23 0.00 112 A 7.60 3.88 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 0.00 113 V 7.32 3.30 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 0.91 0.00 0.00 0.82 0.00 0.00 114 S 7.78 3.89 0.00 3.96 3.80 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 0.00 115 H 8.24 3.96 0.00 3.23 3.27 0.00 5.82 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 0.00 116 S 7.89 4.01 0.00 3.85 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 0.00 117 L 7.91 3.63 0.00 1.42 1.11 -0.32 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.79 3.66 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 L 8.01 3.75 0.00 1.73 1.74 0.83 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.24 3.99 1.51 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 0.00 121 A 8.06 4.35 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 S 8.23 4.19 0.00 4.08 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 0.00 123 L 8.23 4.11 0.00 1.94 1.75 0.78 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 124 D 8.60 4.57 0.00 3.35 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 0.00 125 T 8.06 4.02 4.47 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 1.28 0.00 0.00 126 Q 8.30 4.34 0.00 2.47 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.07 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 127 G 7.75 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 0.00 128 Y 7.93 4.16 0.00 3.16 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 S 8.55 4.33 0.00 4.05 4.01 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 0.00 130 V 8.27 3.29 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 0.85 0.00 0.00 0.80 0.00 0.00 131 N 8.10 4.14 0.00 2.75 2.78 0.00 0.00 7.22 8.49 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 0.00 132 D 7.98 4.40 0.00 3.07 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 0.00 133 I 8.09 3.60 1.79 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 1.49 0.85 0.80 0.00 0.00 134 I 7.61 3.56 1.85 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.40 0.79 0.00 0.00 135 H 7.59 4.37 0.00 3.27 3.30 0.00 5.66 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 0.00 136 I 7.72 3.86 1.71 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.51 0.76 0.00 0.00 137 L 8.03 4.15 0.00 1.58 1.61 0.88 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 *139 A 8.03 4.19 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 0.00 140 E 8.75 3.85 0.00 1.89 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 2.27 2.34 0.00 141 G 9.24 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 0.00 142 G 7.77 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 0.00 143 Q 7.48 4.13 0.00 1.85 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.49 0.00 0.00 0.00 0.00 0.00 2.45 2.57 0.00 * Residues marked with a * may have inaccurate shift predictions.