NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 H 4.6881 8.4449 120.3908 56.0521 30.6157 172.1237 5 V 4.5882 7.9787 119.1590 59.4385 35.7875 173.3676 6 T 4.5646 9.4462 120.6510 62.0282 71.0676 173.4662 7 I 4.7594 7.9331 126.5563 59.4379 39.8107 174.8440 8 R 4.3723 7.9074 121.4384 55.0103 33.2128 173.8880 9 E 4.5889 8.7243 118.7703 56.2815 30.0704 177.2351 10 A 4.6579 8.9363 125.5772 52.1427 19.8335 176.4686 11 T 4.9831 9.1463 109.1354 59.0141 72.4261 174.8331 12 E 3.3955 8.8556 119.8826 59.3102 28.9624 179.6434 13 G 3.6804 7.6077 103.4384 46.8359 0.0000 174.4435 14 D 4.6450 7.9610 120.0286 54.7277 41.3344 178.0238 15 L 3.7689 7.2487 121.4891 58.1844 41.9691 178.4277 16 E 3.9214 8.0414 118.3606 59.6161 29.6493 178.7466 17 Q 3.9820 7.9603 117.4666 59.0065 28.7821 178.4093 18 M 4.0049 8.2598 120.0888 58.3816 31.9580 178.9242 19 V 3.2828 7.8276 118.4701 66.0832 31.6175 177.4630 20 H 3.3120 8.0138 117.8951 59.1761 29.3654 176.8892 21 M 3.8383 7.6998 118.7735 58.4877 32.2068 177.8428 22 L 4.0750 7.9872 118.9495 57.8883 41.9811 179.4825 23 A 4.0644 8.1495 120.4984 54.6304 18.0808 178.5792 24 D 4.3114 7.6046 115.0887 54.9030 41.9492 176.1692 25 D 4.3793 7.2959 119.7327 54.2157 41.8785 176.8889 26 V 3.5609 8.4747 124.8511 65.9407 31.6503 177.5904 27 L 4.4773 8.0099 117.3622 56.6793 42.3860 178.9956 28 G 3.6704 8.7908 105.9374 47.4684 0.0000 175.4470 29 R 4.5143 8.0095 122.0360 58.5806 30.0220 177.9160 30 K 4.2813 7.8953 116.0644 57.2706 32.4621 177.4718 31 R 4.4782 7.7770 115.7705 56.0310 32.3715 175.6976 32 E 4.6011 8.5708 117.2894 55.1708 30.9386 176.3380 33 R 4.4909 8.9720 120.0083 55.0227 30.6737 172.3216 34 Y 4.5167 8.3386 124.6856 56.0314 39.9550 174.3400 35 E 4.2434 7.2984 122.5027 55.5633 31.9363 174.1714 36 K 4.4041 8.0599 118.7521 53.5286 34.5221 174.9492 37 P 4.4170 0.0000 0.0000 62.0799 32.0311 176.1323 38 L 4.3647 7.9727 118.8001 53.3997 42.5044 175.6734 39 P 4.4132 0.0000 0.0000 62.6625 32.0249 178.1647 40 V 3.7676 8.5214 116.0271 64.2414 31.5103 178.7845 41 S 4.1388 8.0764 113.9711 61.8257 62.5290 176.1463 42 Y 4.2150 7.8805 119.9433 60.6269 37.5983 178.4637 43 V 3.7029 7.7905 118.8726 66.1460 31.9049 178.1341 44 R 3.9905 8.5424 118.0799 59.1869 29.8338 178.9875 45 A 4.0193 8.0180 120.1578 55.0476 18.3364 179.3196 46 F 3.9682 8.5840 119.3991 61.4999 39.4457 177.4981 47 K 4.0204 8.3996 117.9766 59.5381 31.6248 179.2236 48 E 3.9640 7.9005 117.5441 59.4072 29.5498 179.1856 49 I 3.7851 7.8274 119.9039 64.1517 36.9324 178.3014 50 K 3.7195 7.7039 119.7879 59.3457 32.0887 178.6937 51 K 4.3062 7.8696 117.3377 57.9019 32.9249 176.1881 52 D 4.6866 7.5519 120.7003 52.4368 41.0212 177.0023 53 K 4.1349 8.7216 127.1025 58.9393 32.4072 177.6773 54 N 5.1600 8.8072 115.7452 52.8718 38.6556 173.3829 55 N 5.3332 8.2397 117.3059 51.9974 41.3619 173.4569 56 E 4.8622 9.4484 125.4020 54.5645 34.5613 174.5320 57 L 5.0931 8.4742 121.8321 53.2083 44.3868 175.2998 58 I 4.9480 8.9328 125.0331 59.5276 40.3040 175.1482 59 V 4.9628 8.6360 118.7649 59.4577 35.7328 174.2182 60 A 4.9436 8.7682 125.7108 50.6130 21.0387 175.8161 61 C 5.1531 9.4380 120.4547 57.8357 32.3325 172.9362 62 N 4.9344 9.1268 121.2459 50.7831 38.0555 175.1371 63 G 3.9780 8.3404 116.2192 46.4888 0.0000 173.6040 64 E 4.1117 8.7737 123.5209 57.0984 30.0292 175.8904 65 E 4.2647 7.9244 121.4861 55.3396 29.9613 175.3843 66 I 4.4080 8.9048 128.7557 61.2962 37.6864 176.1261 67 V 4.3883 8.4656 118.0020 60.7492 33.3045 175.3792 68 G 4.4200 7.7705 106.0631 46.1578 0.0000 172.3689 69 M 5.4388 8.4901 118.0187 54.4477 35.1415 173.1862 70 L 4.9367 8.3246 117.8987 56.1451 44.4400 172.9529 71 Q 5.2753 8.7407 121.1560 54.3138 32.2806 174.5501 72 V 4.9992 8.8898 124.5401 60.0671 35.2075 174.1977 73 T 4.7920 8.6344 113.9005 59.8078 71.6373 172.5105 74 F 5.5819 8.9662 125.0894 56.3362 40.6512 175.4659 75 T 4.3396 9.3208 120.5284 60.8852 72.7124 171.5911 76 P 3.9117 0.0000 0.0000 62.1420 32.7231 174.5923 77 Y 4.7265 8.0062 116.6959 56.5273 42.4946 176.2623 78 L 4.1341 8.7331 120.3393 57.1975 42.5704 177.9881 79 T 4.2407 7.8784 108.2237 62.3537 69.5138 172.9269 80 Y 3.2086 8.5957 116.5999 60.0611 35.7497 170.5783 81 Q 3.3665 8.9930 112.5166 57.3849 26.3795 174.1689 82 G 4.5204 8.4230 98.2329 47.2602 0.0000 173.3048 83 S 4.7517 8.1172 115.1642 57.4226 64.6649 174.6906 84 W 4.7717 8.9858 123.4796 56.7124 30.5318 175.4346 85 R 5.2929 9.6643 121.3576 54.4588 34.0719 174.0862 86 A 5.2791 8.8910 123.3026 50.6535 21.7002 175.5568 87 T 4.9605 8.9858 119.9792 61.8810 71.0388 173.5500 88 I 4.7490 8.5709 128.1467 60.0412 38.9586 175.0619 89 E 4.3907 9.0473 126.8439 54.7064 32.8489 175.0729 90 G 4.2364 8.4061 113.4833 46.6748 0.0000 173.3414 91 V 4.3925 7.4963 116.5543 62.7928 32.7108 176.2873 92 R 4.7515 9.2207 127.0033 54.6421 33.9244 174.6426 93 T 4.9263 8.2251 118.1878 61.4303 71.9367 173.4156 94 H 4.1065 8.9584 125.4425 56.7037 30.2632 176.4949 95 S 4.0615 8.8780 119.4672 60.6258 63.0181 174.6456 96 A 4.5855 8.3364 121.9106 51.8633 18.8589 176.3622 97 A 4.7490 7.9138 119.2679 52.4796 19.8252 177.4405 98 R 3.9810 8.0571 117.8070 58.9361 30.7111 177.2678 99 G 3.9028 8.7949 108.6223 46.3662 0.0000 173.7918 100 Q 4.4049 7.9185 116.5316 55.0554 29.3528 176.6523 101 G 4.0426 8.2138 105.1115 46.8432 0.0000 176.3161 102 I 3.8383 7.4584 123.5830 63.9736 36.9937 178.4698 103 G 3.6023 8.0569 106.1311 47.9104 0.0000 175.3656 104 S 4.2644 8.3373 115.3532 61.2580 62.4686 176.0640 105 Q 4.0651 8.0783 120.3673 58.8784 28.4802 178.5858 106 L 4.0030 8.2378 121.4766 58.2830 42.0916 179.2785 107 V 3.8525 8.2438 118.2801 66.2829 31.5398 177.7645 108 C 4.2340 8.6263 116.9004 62.4757 27.9574 175.9180 109 W 4.0698 8.6511 129.8657 60.5011 30.2860 177.9183 110 A 4.3354 8.5764 120.7912 55.3572 17.8526 179.6905 111 I 3.7544 8.3385 118.7212 64.6612 37.1426 178.5680 112 E 3.9234 8.2666 119.4743 59.0687 29.2030 179.3447 113 R 3.5206 7.7533 118.6285 59.2226 30.1682 178.3612 114 A 4.1221 8.2996 120.6779 55.2465 18.3607 179.7033 115 K 3.8770 8.0796 116.8641 59.7021 31.8978 179.2859 116 E 3.8279 7.9261 117.6943 59.4320 29.4824 179.0480 117 R 3.8543 7.3743 115.0409 56.3560 30.1175 177.4201 118 G 3.7392 7.7271 107.3066 45.6659 0.0000 173.6470 119 C 4.5860 7.8041 116.7540 60.0352 28.5645 173.4570 120 H 5.0582 8.7271 119.6552 56.1942 29.4713 174.8489 121 L 4.5556 7.5855 117.5203 54.5163 43.4961 173.9114 122 I 5.3054 8.2642 120.2666 59.5116 40.9404 174.1318 123 Q 4.9073 9.0381 125.4774 55.0963 32.5459 173.0017 124 L 4.6451 7.7008 118.2709 55.6763 42.7774 173.6051 125 T 4.5328 8.3850 109.4390 59.7525 71.1654 173.3556 126 T 4.5264 8.0421 114.1638 59.1811 71.5317 173.2370 127 D 4.3765 8.5686 124.2641 54.2983 41.6305 177.1334 128 K 4.1518 8.6350 125.5931 58.7232 32.1925 177.6763 129 Q 4.1082 8.8423 117.1922 56.7299 28.6653 176.2613 130 R 4.3870 7.9562 118.9858 53.6782 29.6014 175.0066 131 P 4.2644 0.0000 0.0000 65.9042 31.3333 178.1457 132 D 4.6088 8.0277 116.6196 54.7173 41.0202 178.3042 133 A 4.0059 7.6519 121.8343 55.0778 18.4727 179.0858 134 L 4.0197 8.1047 118.4071 58.5696 42.0993 178.9989 135 R 3.9220 8.0723 117.8726 59.3744 30.1321 177.8453 136 F 4.2003 8.2199 120.4123 61.8170 39.3476 176.8010 137 Y 4.0571 8.0557 116.0930 60.8739 37.6930 177.9740 138 E 4.6227 8.4678 121.0938 59.0362 29.3203 179.3502 139 Q 4.0446 8.0091 117.3312 58.6319 28.7779 178.2554 140 L 4.1943 7.1262 118.2561 55.3038 41.8731 177.5287 141 G 4.0341 7.5421 105.3723 45.1951 0.0000 174.2018 142 F 4.3455 8.6617 119.3853 56.7695 39.7288 174.2827 143 K 4.6736 8.5516 123.5585 54.7489 34.6781 176.9988 144 A 4.4685 8.4330 131.3098 51.1937 17.1313 177.2791 145 S 4.3746 7.8426 115.8960 59.3286 64.3964 174.8221 146 H 4.9698 7.9720 116.3794 53.7414 31.8793 172.4092 147 E 4.3646 8.6170 120.5237 55.1285 30.5180 176.6257 148 G 3.8763 8.5137 112.8409 44.1846 0.0000 172.6405 149 L 4.6076 8.1961 126.1529 52.6626 43.2452 176.7292 150 K 4.5762 8.2846 121.1982 54.7897 35.8754 175.7068 151 M 4.5326 8.0901 120.2498 54.3991 34.3640 173.9996 152 H 4.4206 8.6537 123.5066 54.4937 30.4962 175.4334 153 F 4.7494 8.2407 120.5303 57.8769 38.9444 175.8186 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 H 8.44 4.69 0.00 3.15 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 7.98 4.59 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 0.73 0.00 0.00 0.93 0.00 0.00 6 T 9.45 4.56 4.21 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 1.18 0.00 0.00 7 I 7.93 4.76 1.03 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.40 -0.65 0.00 0.00 8 R 7.91 4.37 0.00 1.85 1.93 0.00 2.77 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.52 0.00 9 E 8.72 4.59 0.00 1.95 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 2.49 2.50 0.00 10 A 8.94 4.66 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 11 T 9.15 4.98 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 1.28 0.00 0.00 12 E 8.86 3.40 0.00 2.01 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 2.39 2.24 0.00 13 G 7.61 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 0.00 0.00 0.00 14 D 7.96 4.65 0.00 2.77 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.25 3.77 0.00 1.37 1.52 0.86 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.04 3.92 0.00 2.02 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 2.49 2.38 0.00 17 Q 7.96 3.98 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.68 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 18 M 8.26 4.00 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.54 0.00 19 V 7.83 3.28 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 0.57 0.00 0.00 0.36 0.00 0.00 20 H 8.01 3.31 0.00 2.82 3.16 0.00 5.84 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 21 M 7.70 3.84 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 22 L 7.99 4.07 0.00 1.86 1.72 0.96 0.55 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 23 A 8.15 4.06 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 D 7.60 4.31 0.00 2.63 2.53 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 0.00 25 D 7.30 4.38 0.00 2.69 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 26 V 8.47 3.56 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 0.91 0.00 0.00 0.90 0.00 0.00 27 L 8.01 4.48 0.00 1.86 1.67 0.96 0.91 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 28 G 8.79 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.01 4.51 0.00 2.00 1.99 0.00 3.09 0.00 0.00 3.05 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.54 0.00 30 K 7.90 4.28 0.00 1.91 1.84 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.61 7.81 31 R 7.78 4.48 0.00 1.79 1.96 0.00 3.36 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 32 E 8.57 4.60 0.00 2.00 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 0.00 2.56 2.46 0.00 33 R 8.97 4.49 0.00 1.76 1.94 0.00 3.29 0.00 0.00 3.17 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 34 Y 8.34 4.52 0.00 2.91 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 35 E 7.30 4.24 0.00 1.99 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 2.14 2.38 0.00 36 K 8.06 4.40 0.00 1.61 1.64 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.15 1.07 7.81 37 P 0.00 4.42 0.00 2.15 2.02 0.00 3.72 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 38 L 7.97 4.36 0.00 1.66 1.68 0.89 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.41 0.00 2.30 2.00 0.00 3.92 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.34 0.00 40 V 8.52 3.77 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 0.86 0.00 0.00 0.93 0.00 0.00 41 S 8.08 4.14 0.00 3.87 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 42 Y 7.88 4.22 0.00 3.25 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 7.79 3.70 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 1.14 0.00 0.00 0.98 0.00 0.00 44 R 8.54 3.99 0.00 1.88 1.99 0.00 3.18 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 1.68 1.78 0.00 45 A 8.02 4.02 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 46 F 8.58 3.97 0.00 3.35 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.40 4.02 0.00 2.07 1.90 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.61 1.84 7.81 48 E 7.90 3.96 0.00 2.12 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 2.65 2.51 0.00 49 I 7.83 3.79 1.78 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 1.37 1.52 0.82 0.00 0.00 50 K 7.70 3.72 0.00 1.29 1.85 0.00 2.04 0.00 0.00 1.81 0.00 0.00 3.12 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.38 7.81 51 K 7.87 4.31 0.00 1.97 1.93 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.15 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.62 1.44 7.81 52 D 7.55 4.69 0.00 2.65 2.60 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 53 K 8.72 4.13 0.00 1.84 1.91 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.49 7.81 54 N 8.81 5.16 0.00 3.11 3.36 0.00 0.00 6.20 6.52 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 55 N 8.24 5.33 0.00 2.85 2.65 0.00 0.00 6.84 7.59 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 56 E 9.45 4.86 0.00 2.00 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 2.35 2.46 0.00 57 L 8.47 5.09 0.00 1.63 1.65 1.02 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.93 4.95 1.90 0.00 0.00 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 1.36 1.41 0.57 0.00 0.00 59 V 8.64 4.96 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 0.74 0.00 0.00 0.91 0.00 0.00 60 A 8.77 4.94 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 61 C 9.44 5.15 0.00 2.76 2.96 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 62 N 9.13 4.93 0.00 2.73 2.63 0.00 0.00 7.16 7.98 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 63 G 8.34 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 0.00 0.00 0.00 64 E 8.77 4.11 0.00 1.96 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 2.29 2.28 0.00 65 E 7.92 4.26 0.00 1.98 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 2.28 2.27 0.00 66 I 8.90 4.41 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.90 0.91 0.00 0.00 67 V 8.47 4.39 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 0.74 0.00 0.00 0.92 0.00 0.00 68 G 7.77 4.42 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 0.00 69 M 8.49 5.44 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 70 L 8.32 4.94 0.00 1.80 1.80 1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.74 5.28 0.00 2.15 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.21 2.42 0.00 72 V 8.89 5.00 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 0.87 0.00 0.00 0.65 0.00 0.00 73 T 8.63 4.79 4.19 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 1.28 0.00 0.00 74 F 8.97 5.58 0.00 3.27 3.36 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 75 T 9.32 4.34 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 0.56 0.00 0.00 76 P 0.00 3.91 0.00 1.47 0.49 0.00 2.88 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 1.31 1.28 0.00 77 Y 8.01 4.73 0.00 3.03 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 78 L 8.73 4.13 0.00 1.76 1.74 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 79 T 7.88 4.24 4.31 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 1.24 0.00 0.00 80 Y 8.60 3.21 0.00 3.21 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 81 Q 8.99 3.37 0.00 2.26 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 82 G 8.42 4.52 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 83 S 8.12 4.75 0.00 4.01 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 84 W 8.99 4.77 0.00 3.24 3.27 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 85 R 9.66 5.29 0.00 1.93 1.81 0.00 2.38 0.00 0.00 2.98 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.58 0.00 86 A 8.89 5.28 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 87 T 8.99 4.96 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 88 I 8.57 4.75 1.85 0.00 0.00 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 1.18 0.60 0.97 0.00 0.00 89 E 9.05 4.39 0.00 1.96 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.28 0.00 90 G 8.41 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.50 4.39 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 0.83 0.00 0.00 1.07 0.00 0.00 92 R 9.22 4.75 0.00 1.66 1.70 0.00 3.23 0.00 0.00 3.13 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 93 T 8.23 4.93 4.15 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 1.23 0.00 0.00 94 H 8.96 4.11 0.00 3.29 3.14 0.00 5.59 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.88 4.06 0.00 3.98 3.92 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 96 A 8.34 4.59 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 97 A 7.91 4.75 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 98 R 8.06 3.98 0.00 1.79 1.84 0.00 3.55 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 1.77 1.53 0.00 99 G 8.79 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 0.00 100 Q 7.92 4.40 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.07 0.00 0.00 0.00 0.00 0.00 2.60 2.25 0.00 101 G 8.21 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 0.00 0.00 0.00 102 I 7.46 3.84 1.86 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 1.45 0.58 0.89 0.00 0.00 103 G 8.06 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 0.00 104 S 8.34 4.26 0.00 4.02 3.97 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 0.00 0.00 0.00 105 Q 8.08 4.07 0.00 2.37 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 106 L 8.24 4.00 0.00 1.92 1.92 0.83 0.99 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 0.00 107 V 8.24 3.85 2.32 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 1.42 0.00 0.00 1.33 0.00 0.00 108 C 8.63 4.23 0.00 3.30 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.65 4.07 0.00 3.60 3.44 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 0.00 110 A 8.58 4.34 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 0.00 111 I 8.34 3.75 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.31 0.90 0.00 0.00 112 E 8.27 3.92 0.00 1.91 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 0.00 2.45 2.38 0.00 113 R 7.75 3.52 0.00 1.54 2.12 0.00 2.85 0.00 0.00 2.58 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.60 0.00 114 A 8.30 4.12 1.59 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 0.00 0.00 115 K 8.08 3.88 0.00 1.92 1.81 0.00 1.90 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.64 7.81 116 E 7.93 3.83 0.00 1.96 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 2.21 2.30 0.00 117 R 7.37 3.85 0.00 1.43 1.35 0.00 2.80 0.00 0.00 2.80 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.50 0.00 118 G 7.73 3.74 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 0.00 0.00 0.00 119 C 7.80 4.59 0.00 3.20 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 0.00 120 H 8.73 5.06 0.00 3.04 3.29 0.00 5.68 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 L 7.59 4.56 0.00 1.57 1.51 0.85 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 122 I 8.26 5.31 1.96 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.32 0.90 0.00 0.00 123 Q 9.04 4.91 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.46 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 124 L 7.70 4.65 0.00 1.51 1.43 -0.15 -0.56 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 0.00 125 T 8.39 4.53 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 126 T 8.04 4.53 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 0.97 0.00 0.00 127 D 8.57 4.38 0.00 2.69 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 0.00 128 K 8.63 4.15 0.00 1.79 1.86 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.46 7.81 129 Q 8.84 4.11 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.92 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 130 R 7.96 4.39 0.00 1.99 1.90 0.00 3.16 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 131 P 0.00 4.26 0.00 2.18 2.20 0.00 3.75 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 132 D 8.03 4.61 0.00 2.70 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 0.00 133 A 7.65 4.01 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 0.00 134 L 8.10 4.02 0.00 1.83 1.76 0.99 0.88 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 0.00 135 R 8.07 3.92 0.00 1.96 2.14 0.00 3.28 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 136 F 8.22 4.20 0.00 3.03 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 0.00 137 Y 8.06 4.06 0.00 3.11 2.85 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 0.00 138 E 8.47 4.62 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 139 Q 8.01 4.04 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.02 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 140 L 7.13 4.19 0.00 2.14 1.81 0.64 0.85 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 0.00 141 G 7.54 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 0.00 142 F 8.66 4.35 0.00 3.29 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.55 4.67 0.00 1.71 1.71 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.43 7.81 144 A 8.43 4.47 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 0.00 145 S 7.84 4.37 0.00 4.06 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 0.00 146 H 7.97 4.97 0.00 3.06 3.23 0.00 5.88 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.62 4.36 0.00 1.95 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 0.00 2.25 2.23 0.00 148 G 8.51 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 0.00 149 L 8.20 4.61 0.00 1.63 1.59 0.92 0.88 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 0.00 150 K 8.28 4.58 0.00 1.67 1.55 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.32 7.81 151 M 8.09 4.53 0.00 1.75 1.84 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 152 H 8.65 4.42 0.00 3.07 3.16 0.00 5.94 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 F 8.24 4.75 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