NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 3.9930 8.3549 109.7411 45.7341 0.0000 172.8046 5 S 4.4599 8.5663 113.5177 59.6355 63.6326 174.8098 6 R 3.9181 8.3507 120.6733 59.4314 30.8711 177.5772 7 R 3.6805 7.9544 116.7398 58.9166 29.9585 176.3108 8 Y 4.5351 8.1248 112.7891 57.5017 38.1939 174.6887 9 D 4.6322 7.7455 120.9591 53.5567 41.5027 176.6816 10 S 4.1370 8.7416 123.0727 59.5297 64.0304 174.0784 11 R 3.8041 8.6278 119.7407 57.1757 26.9197 177.2894 12 T 4.1336 7.7830 106.9947 63.6926 69.5088 175.4777 13 T 4.5196 7.2586 112.0284 61.3536 69.6468 173.7539 14 I 4.4170 7.5264 113.7957 60.0047 40.5300 174.4103 15 F 4.8446 8.3735 119.7393 56.7657 40.0378 176.0341 16 S 4.5239 8.6054 118.8312 56.4623 64.1310 173.6194 17 P 4.4383 0.0000 0.0000 65.2989 31.0330 177.4366 18 E 4.1836 8.1136 115.4902 55.9863 29.7144 176.0399 19 G 3.5063 8.2108 107.2109 47.0212 0.0000 173.9285 20 R 4.6283 7.8718 116.6493 53.7378 33.5830 175.8400 21 L 4.6809 8.0658 120.3651 54.2367 42.1225 177.1382 22 Y 3.5414 7.3408 119.6960 61.4032 37.8033 178.7426 23 Q 3.9473 8.0063 117.8213 59.2462 28.9920 179.4982 24 V 3.5648 7.6355 118.3712 66.1649 31.7739 177.7152 25 E 3.9664 8.1244 118.2233 59.7742 29.3681 179.0118 26 Y 4.5234 8.1412 116.6782 60.6846 37.8674 178.0130 27 A 4.0751 8.5078 122.5826 55.0117 18.4076 179.5864 28 L 3.9196 8.2020 117.7337 57.9820 41.4933 179.2134 29 E 3.8963 7.9279 117.6802 59.3998 29.7648 178.6505 30 S 4.2939 7.9953 112.8546 61.5194 62.4396 176.0978 31 I 3.7212 8.0465 123.1532 64.3571 36.6205 178.3403 32 S 4.1329 8.1540 113.9940 60.7077 62.6918 174.6255 33 H 4.7194 7.7508 117.8340 55.4129 28.9864 174.6766 34 A 4.4190 7.8920 123.4659 50.5697 19.5406 177.9149 35 G 4.0503 8.5075 108.1522 45.5694 0.0000 173.6352 36 T 4.1911 8.4612 119.2654 63.3456 69.8162 173.1654 37 A 5.1353 8.5260 126.2283 50.2019 22.0618 175.3109 38 I 4.6064 9.3657 122.5586 59.3331 41.1688 174.9328 39 G 4.4733 8.6707 111.7801 44.5587 0.0000 171.8099 40 I 4.7181 8.8610 125.7375 59.6421 40.9394 173.9727 41 M 4.7982 8.8390 126.6519 53.9926 33.3859 175.0431 42 A 4.7725 8.8223 129.6210 49.8980 21.8447 176.4020 43 S 4.3017 8.6682 113.6732 60.8482 63.0610 175.0329 44 D 4.8607 9.1217 118.5455 50.5768 39.6701 176.0324 45 G 4.1295 6.8818 108.2202 45.9720 0.0000 171.3919 46 I 5.0826 7.6434 119.0850 59.3406 40.8525 175.5364 47 V 4.4904 8.9469 125.1903 61.0556 34.4004 174.1885 48 L 5.2798 8.5894 126.2219 52.9401 44.5830 175.7026 49 A 4.8467 9.0676 124.6561 50.1954 22.5738 174.5730 50 A 5.0670 8.4811 121.7098 50.3001 22.9133 174.8182 51 E 4.4962 8.9443 121.7056 54.3327 31.4780 175.7540 52 R 4.0296 8.5707 126.8195 55.9656 30.7271 176.0146 53 K 4.1038 8.7334 124.4862 56.4612 33.1314 173.5479 54 V 3.1424 8.5274 128.9892 63.0839 31.9830 171.6163 55 T 4.6523 8.0104 114.1468 60.8062 71.8304 172.0518 56 S 4.7059 8.1098 114.9977 56.6093 65.8921 174.7188 57 T 3.8995 8.5510 119.8158 66.7255 68.1502 175.9601 58 L 4.1772 7.7468 118.3549 55.7356 42.1066 176.9621 59 L 3.9054 7.3666 121.6446 54.8255 42.2731 176.3614 60 E 4.2046 8.5650 127.2507 55.3721 28.6724 175.5804 61 Q 4.1193 8.4582 128.5712 58.6668 29.8101 178.0190 62 D 4.3031 8.2500 117.0625 57.7874 40.8305 177.3367 63 T 4.2655 7.7775 111.5671 63.7239 68.7308 174.5624 63A S 4.6121 7.2323 116.2700 57.6130 63.6827 173.6415 64 T 4.0835 7.8283 116.8033 63.2094 71.7550 173.2925 65 E 4.8775 8.5544 120.5579 55.1996 32.0321 175.6251 66 K 4.5680 7.7413 116.5803 56.6215 36.6284 175.6213 67 L 5.0498 7.6439 119.3171 53.1439 43.4704 175.8291 68 Y 4.8027 8.8323 121.6227 55.8534 41.8388 174.9865 69 K 4.2431 8.7823 124.1591 55.6355 33.2166 176.0391 70 L 4.3335 8.6517 126.1729 56.2860 42.6023 175.3618 71 N 5.0547 7.9336 113.8513 52.3366 41.8116 172.7859 72 D 4.6768 8.6778 115.7412 55.2850 41.6102 177.0366 73 K 4.7175 7.9380 116.6597 55.9107 34.5925 175.4973 74 I 5.2731 7.6534 120.7880 59.5876 41.5025 174.0551 75 A 5.2096 9.0489 126.7098 50.4835 23.2908 175.0386 76 V 4.9359 8.8539 111.1114 59.5171 36.4154 174.6365 77 A 5.2219 8.8407 124.6748 50.3038 21.4068 175.6265 78 V 4.5590 9.1931 123.3207 61.3471 33.8800 175.5729 79 A 4.3179 9.2377 127.8360 53.6264 21.3073 174.6246 80 G 3.6961 8.6042 112.2808 45.4139 0.0000 171.9520 81 L 4.0527 8.3598 125.0148 55.1260 41.8183 177.8211 82 T 3.8890 8.8922 121.4518 66.7934 68.4091 176.1762 83 A 3.9959 8.0432 121.8771 55.3871 18.3885 179.2240 84 D 4.4331 8.1437 116.5782 57.3594 40.9821 178.6149 85 A 4.0093 8.0298 121.2366 55.3818 18.3642 179.3784 86 E 3.6961 8.2848 117.1926 59.5530 29.3639 179.7196 87 I 3.6749 7.5437 119.2306 64.5657 37.2748 178.5515 88 L 3.8284 7.5906 119.1943 57.5772 41.2759 179.6445 89 I 3.4844 8.2200 120.1785 64.2348 37.0433 177.9254 90 N 4.2454 8.2517 118.2174 56.9844 38.7759 177.0525 91 T 3.9073 7.7289 110.6980 64.6017 68.8469 176.3619 92 A 3.9535 7.9548 123.7370 55.0851 18.2601 179.7982 93 R 3.8998 8.1834 116.9116 59.3385 30.0146 179.4422 94 I 3.7201 7.8614 119.6274 64.7055 37.2206 177.8329 95 H 4.1882 8.4950 118.9720 59.3491 29.5619 177.0862 96 A 3.9586 7.9709 122.2630 55.2830 18.2163 179.6840 97 Q 4.0452 7.9077 116.6603 58.9537 28.7875 178.5410 98 N 4.3749 8.5111 117.9631 56.3471 38.4853 176.7189 99 Y 3.9891 7.9999 120.8207 60.5958 38.8537 177.9788 100 L 4.4220 8.0385 122.5647 57.7303 42.0561 178.9216 101 K 3.9168 8.3366 118.5536 59.3511 32.0886 178.6615 102 T 3.8459 7.4798 115.4582 65.8608 68.6935 175.7693 103 Y 4.5044 7.5499 114.6581 56.4282 39.1034 175.1758 104 N 4.3635 8.3500 116.6409 53.5388 37.0654 173.9824 105 E 4.8304 7.6943 114.0648 54.8484 34.0012 175.1211 106 D 4.6369 8.5830 122.1763 53.9589 41.6128 176.2513 107 I 2.8832 8.1502 123.0533 59.8446 38.5747 174.0846 108 P 4.1780 0.0000 0.0000 62.3189 32.1771 176.8767 109 V 3.4785 8.4345 122.9980 66.4944 31.2959 178.1591 110 E 3.7906 7.9962 117.9921 59.2214 29.4551 178.5441 111 I 3.5782 7.3143 119.9806 64.2766 37.1554 178.1619 112 L 3.9182 7.5750 120.5577 58.0621 42.0044 178.9870 113 V 2.9220 7.5326 118.1864 65.6599 31.2641 177.9717 114 R 3.7949 8.4253 118.7910 59.2634 29.9624 178.3438 115 R 3.8092 7.8828 118.4852 59.4938 29.9604 178.1959 116 L 3.9470 7.7762 119.9515 58.3776 41.9609 179.1592 117 S 4.2506 8.1950 115.1008 61.5671 62.7069 176.3842 118 D 4.3935 8.3864 122.1310 57.1789 40.2753 178.7860 119 I 3.8216 7.5341 119.6850 64.2745 37.4618 178.3227 120 K 4.2723 7.9049 119.2037 59.6964 31.9601 178.9272 121 Q 4.1351 8.5443 120.2726 59.3523 28.7872 179.0514 122 G 3.6364 8.1420 106.4788 48.0609 0.0000 174.8796 123 Y 4.0618 8.0715 115.5925 59.3408 37.8014 177.4305 124 T 4.3001 7.7014 116.7560 64.1154 69.4927 175.0172 125 Q 4.4191 7.5664 119.4990 56.1532 30.6270 174.4335 126 H 4.6006 7.6847 110.1562 55.7242 30.6076 173.4960 127 G 3.8173 8.9520 108.8124 44.3270 0.0000 175.1220 128 G 3.9947 7.8745 105.7640 46.2625 0.0000 173.2145 129 L 4.6673 6.9286 118.8630 52.2301 43.7511 176.7523 130 R 4.1340 8.1291 116.8647 55.2816 30.1839 174.7256 131 P 4.4993 0.0000 0.0000 62.1035 32.2297 175.8112 132 F 4.3559 8.4330 118.5492 57.3719 40.1012 177.4032 133 G 4.0344 9.0580 115.1711 44.8432 0.0000 172.8426 134 V 4.8465 7.2207 117.8899 61.5609 35.8046 174.8322 135 S 4.6133 8.4185 121.3660 56.6871 66.6306 173.0291 136 F 5.3504 8.7148 121.6736 55.6725 42.1778 174.6428 137 I 4.5010 8.3240 122.3743 59.9065 39.5581 174.0796 138 Y 4.9768 8.8827 124.7231 56.3769 39.9440 175.3164 139 A 4.6382 9.4820 125.8369 50.2756 21.4725 174.9862 140 G 4.9528 8.5543 107.0166 45.6621 0.0000 169.5782 141 Y 4.9524 8.4198 119.8358 55.8770 41.6168 173.8285 142 D 4.6403 7.5052 124.2555 51.5291 42.5890 174.8163 143 D 4.4770 8.5214 117.1714 53.8476 39.2315 176.3474 144 R 4.0904 8.4582 126.2460 56.7624 30.1220 175.2617 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 G 8.35 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 0.00 0.00 0.00 5 S 8.57 4.46 0.00 4.04 4.02 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 6 R 8.35 3.92 0.00 1.83 1.95 0.00 3.16 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 7 R 7.95 3.68 0.00 1.51 1.19 0.00 2.21 0.00 0.00 2.89 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.35 0.00 8 Y 8.12 4.54 0.00 2.92 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 D 7.75 4.63 0.00 2.65 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 10 S 8.74 4.14 0.00 3.91 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 11 R 8.63 3.80 0.00 2.01 1.96 0.00 3.12 0.00 0.00 3.20 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 12 T 7.78 4.13 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 13 T 7.26 4.52 4.32 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 1.20 0.00 0.00 14 I 7.53 4.42 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.16 0.92 0.00 0.00 15 F 8.37 4.84 0.00 3.10 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.61 4.52 0.00 3.63 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 17 P 0.00 4.44 0.00 2.09 2.18 0.00 3.74 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 18 E 8.11 4.18 0.00 1.87 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 2.28 2.34 0.00 19 G 8.21 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 20 R 7.87 4.63 0.00 1.66 1.67 0.00 3.05 0.00 0.00 3.11 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 21 L 8.07 4.68 0.00 1.59 1.50 0.82 0.17 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 22 Y 7.34 3.54 0.00 2.87 2.47 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 23 Q 8.01 3.95 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 24 V 7.64 3.56 2.19 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 1.14 0.00 0.00 0.91 0.00 0.00 25 E 8.12 3.97 0.00 1.98 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 2.37 2.38 0.00 26 Y 8.14 4.52 0.00 2.98 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.51 4.08 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 28 L 8.20 3.92 0.00 1.91 1.75 0.93 0.82 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 29 E 7.93 3.90 0.00 2.07 2.33 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 2.36 2.43 0.00 30 S 8.00 4.29 0.00 4.01 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 31 I 8.05 3.72 1.99 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 1.77 0.76 0.92 0.00 0.00 32 S 8.15 4.13 0.00 3.93 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 33 H 7.75 4.72 0.00 3.19 3.34 0.00 5.65 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 34 A 7.89 4.42 1.24 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 0.00 0.00 35 G 8.51 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 36 T 8.46 4.19 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 37 A 8.53 5.14 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 38 I 9.37 4.61 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 1.17 0.83 0.92 0.00 0.00 39 G 8.67 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 0.00 0.00 0.00 0.00 40 I 8.86 4.72 1.88 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 1.12 0.70 0.92 0.00 0.00 41 M 8.84 4.80 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 42 A 8.82 4.77 1.26 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 0.00 0.00 0.00 43 S 8.67 4.30 0.00 4.00 4.02 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 44 D 9.12 4.86 0.00 2.77 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 45 G 6.88 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 0.00 0.00 0.00 46 I 7.64 5.08 1.90 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 1.28 0.77 0.97 0.00 0.00 47 V 8.95 4.49 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 1.06 0.00 0.00 0.94 0.00 0.00 48 L 8.59 5.28 0.00 1.52 1.53 0.93 0.75 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 49 A 9.07 4.85 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 50 A 8.48 5.07 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 51 E 8.94 4.50 0.00 2.04 1.82 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 2.22 2.27 0.00 52 R 8.57 4.03 0.00 1.83 1.94 0.00 3.24 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.60 0.00 53 K 8.73 4.10 0.00 1.72 1.71 0.00 2.02 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.42 7.81 54 V 8.53 3.14 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 0.84 0.00 0.00 0.93 0.00 0.00 55 T 8.01 4.65 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 56 S 8.11 4.71 0.00 3.81 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.55 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 58 L 7.75 4.18 0.00 1.61 1.72 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.37 3.91 0.00 1.62 1.70 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.56 4.20 0.00 1.95 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 61 Q 8.46 4.12 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.46 6.68 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 62 D 8.25 4.30 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 63 T 7.78 4.27 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 63A S 7.23 4.61 0.00 4.02 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 T 7.83 4.08 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 65 E 8.55 4.88 0.00 2.05 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 2.15 2.26 0.00 66 K 7.74 4.57 0.00 1.62 1.80 0.00 1.69 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.43 7.81 67 L 7.64 5.05 0.00 1.34 1.48 0.90 0.71 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 68 Y 8.83 4.80 0.00 2.85 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 69 K 8.78 4.24 0.00 1.74 1.75 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.47 7.81 70 L 8.65 4.33 0.00 1.83 1.68 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 71 N 7.93 5.05 0.00 2.62 2.79 0.00 0.00 7.28 8.02 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 72 D 8.68 4.68 0.00 2.72 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 73 K 7.94 4.72 0.00 1.72 2.04 0.00 1.68 0.00 0.00 1.99 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.47 7.81 74 I 7.65 5.27 1.89 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 1.29 0.75 0.97 0.00 0.00 75 A 9.05 5.21 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.85 4.94 1.87 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 0.26 0.00 0.00 0.90 0.00 0.00 77 A 8.84 5.22 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 78 V 9.19 4.56 2.28 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 0.78 0.00 0.00 1.29 0.00 0.00 79 A 9.24 4.32 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 80 G 8.60 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 81 L 8.36 4.05 0.00 1.68 1.66 0.93 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 82 T 8.89 3.89 4.29 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 1.34 0.00 0.00 83 A 8.04 4.00 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 84 D 8.14 4.43 0.00 2.96 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.03 4.01 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 86 E 8.28 3.70 0.00 2.10 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 1.98 2.44 0.00 87 I 7.54 3.67 2.11 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.81 0.99 0.00 0.00 88 L 7.59 3.83 0.00 1.89 1.67 0.52 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.22 3.48 1.77 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.74 0.74 0.00 0.00 90 N 8.25 4.25 0.00 2.78 2.92 0.00 0.00 7.02 7.65 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 91 T 7.73 3.91 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 92 A 7.95 3.95 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 93 R 8.18 3.90 0.00 2.02 1.99 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.79 0.00 94 I 7.86 3.72 2.02 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 1.42 0.52 0.94 0.00 0.00 95 H 8.49 4.19 0.00 3.23 3.48 0.00 5.78 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 96 A 7.97 3.96 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 97 Q 7.91 4.05 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.59 2.56 0.00 98 N 8.51 4.37 0.00 2.94 2.90 0.00 0.00 6.58 8.05 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 99 Y 8.00 3.99 0.00 3.21 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 0.00 100 L 8.04 4.42 0.00 1.92 1.85 1.03 0.57 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 0.00 101 K 8.34 3.92 0.00 1.79 1.91 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.45 7.81 102 T 7.48 3.85 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 0.09 0.00 0.00 103 Y 7.55 4.50 0.00 2.52 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 0.00 104 N 8.35 4.36 0.00 2.84 2.88 0.00 0.00 6.71 7.40 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 0.00 105 E 7.69 4.83 0.00 2.12 1.90 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 2.35 2.60 0.00 106 D 8.58 4.64 0.00 2.71 2.63 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 0.00 107 I 8.15 2.88 1.60 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 -0.36 0.77 0.00 0.00 108 P 0.00 4.18 0.00 2.00 1.81 0.00 2.86 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 109 V 8.43 3.48 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 0.92 0.00 0.00 0.88 0.00 0.00 110 E 8.00 3.79 0.00 1.97 1.83 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 2.29 2.31 0.00 111 I 7.31 3.58 1.74 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.34 0.80 0.00 0.00 112 L 7.58 3.92 0.00 1.56 1.67 0.87 0.81 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 0.00 113 V 7.53 2.92 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 0.46 0.00 0.00 -0.24 0.00 0.00 114 R 8.43 3.79 0.00 1.86 1.98 0.00 3.14 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.61 0.00 115 R 7.88 3.81 0.00 1.98 2.04 0.00 3.14 0.00 0.00 2.96 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.55 0.00 116 L 7.78 3.95 0.00 1.92 1.72 0.78 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.19 4.25 0.00 4.07 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 D 8.39 4.39 0.00 2.90 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.53 3.82 2.01 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.78 0.99 0.00 0.00 120 K 7.90 4.27 0.00 2.01 1.95 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.48 1.56 7.81 121 Q 8.54 4.14 0.00 2.23 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.58 0.00 122 G 8.14 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.07 4.06 0.00 3.10 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 0.00 124 T 7.70 4.30 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 1.15 0.00 0.00 125 Q 7.57 4.42 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.22 0.00 126 H 7.68 4.60 0.00 3.17 3.19 0.00 5.74 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 0.00 127 G 8.95 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 G 7.87 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 0.00 0.00 0.00 129 L 6.93 4.67 0.00 1.64 1.61 0.86 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.13 4.13 0.00 1.90 1.92 0.00 3.01 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 131 P 0.00 4.50 0.00 2.08 2.09 0.00 3.66 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 132 F 8.43 4.36 0.00 2.88 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 0.00 133 G 9.06 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 0.00 134 V 7.22 4.85 1.79 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 -0.34 0.00 0.00 0.84 0.00 0.00 135 S 8.42 4.61 0.00 3.70 3.62 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 0.00 136 F 8.71 5.35 0.00 2.33 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 0.00 0.00 0.00 137 I 8.32 4.50 1.88 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 1.25 0.79 0.95 0.00 0.00 138 Y 8.88 4.98 0.00 2.79 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 A 9.48 4.64 1.24 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 0.00 0.00 140 G 8.55 4.95 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 0.00 141 Y 8.42 4.95 0.00 2.98 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 0.00 142 D 7.51 4.64 0.00 2.59 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 0.00 143 D 8.52 4.48 0.00 2.81 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 0.00 144 R 8.46 4.09 0.00 1.62 1.82 0.00 3.23 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.47 0.00