NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.6082 8.2116 122.2799 52.4323 19.2102 176.4498 2 T 4.4323 7.8532 116.0794 60.7318 69.9266 171.4980 3 K 5.4652 9.5925 130.8888 54.4250 34.7836 175.6768 4 A 4.9990 8.3176 126.1702 50.9995 22.4410 176.5020 5 V 4.6298 8.7201 116.9821 61.3557 33.5607 172.2321 6 A 4.4716 9.4217 131.6185 52.1908 20.5323 176.5025 7 V 4.3029 8.2593 119.5759 61.2668 34.2814 174.1227 8 L 5.0085 8.7004 128.7843 53.4491 43.9438 175.9622 9 K 4.8769 7.7216 122.5874 56.3415 36.0290 175.2219 10 G 3.7470 8.6384 116.4990 46.2893 0.0000 174.4451 11 D 4.6800 7.7864 123.1147 54.4869 40.7429 178.7540 12 G 3.8758 8.0803 113.7628 46.1464 0.0000 170.8093 13 P 4.4494 0.0000 0.0000 63.0706 31.7341 176.5117 14 V 4.0669 8.0407 121.3635 62.9635 32.2396 174.6399 15 Q 4.8523 9.1601 125.3418 54.0949 33.6562 174.7599 16 G 4.3945 8.9070 107.5002 44.6734 0.0000 171.5359 17 I 5.5191 9.0429 121.2986 57.7699 40.1269 174.7753 18 I 4.9569 8.2717 119.6825 59.0387 41.0959 174.3742 19 N 5.2811 8.5754 121.9932 51.2850 41.9699 173.1485 20 F 4.7354 7.6675 116.3459 56.6272 43.6665 173.1230 21 E 4.9648 8.2769 119.7828 54.6658 33.2620 173.9735 22 Q 4.4248 8.3496 128.6884 54.3811 28.9635 175.3221 23 K 4.2245 8.7743 126.7184 59.4108 33.2792 177.6101 24 E 4.7335 7.8211 118.1490 53.9441 33.4006 176.1394 25 S 4.1171 8.8546 117.6070 60.8476 62.8035 174.7746 26 N 4.8018 8.1113 115.4303 52.8049 39.5031 174.5980 27 G 4.0163 7.8730 108.4498 43.4888 0.0000 171.7700 28 P 4.6931 0.0000 0.0000 62.2967 32.6623 175.3173 29 V 4.5417 8.5500 118.2386 61.0702 35.0089 174.0031 30 K 4.9607 8.6824 128.0886 55.2194 33.6684 175.6459 31 V 3.6839 8.9378 129.1718 62.7066 33.1227 175.2203 32 W 6.0223 7.6130 122.1664 54.6555 31.6188 171.4556 33 G 3.9903 9.6223 103.6935 44.6860 0.0000 172.1769 34 S 4.9933 9.0460 113.6952 57.3669 67.0681 173.8347 35 I 4.7036 8.4184 124.3612 59.6588 38.9066 174.5923 36 K 4.9247 9.1530 128.2069 55.7219 35.4039 176.6411 37 G 4.0442 9.0414 113.1895 45.4894 0.0000 174.4717 38 L 4.0960 7.7208 119.9166 54.4550 42.2951 176.4734 39 T 4.5190 8.6694 116.6344 61.2253 68.0851 174.0018 40 E 4.3045 8.3380 122.3591 57.1642 30.6915 176.1370 41 G 3.7447 8.4585 106.0723 43.9125 0.0000 172.6393 42 L 4.6859 7.8985 117.7850 54.5952 42.8215 176.9827 43 H 5.1331 8.7414 119.3084 53.8870 33.1607 173.3825 44 G 4.2723 9.1963 111.9183 46.1958 0.0000 172.3751 45 F 5.5164 9.0573 117.1317 55.4061 41.5333 173.2136 46 H 5.0139 9.1591 119.8459 53.9234 32.7344 173.0995 47 V 4.4197 8.4919 116.7701 61.5622 32.2319 175.2079 48 H 5.1114 8.7172 121.1696 53.4807 32.5216 173.1767 49 E 3.9842 8.6309 120.3674 57.1548 30.1816 176.7927 50 F 4.1639 8.3806 123.5992 57.3446 37.9953 175.1779 51 G 4.0729 8.5061 107.2641 44.8355 0.0000 173.2685 52 D 4.6437 8.0886 120.1990 53.4485 40.8444 176.7111 53 N 5.2439 8.4336 125.9010 52.7155 36.5545 176.3573 54 T 3.9327 7.6418 110.0774 64.6307 69.5887 174.8260 55 A 4.2830 7.7916 128.3096 51.4595 20.7767 176.9356 56 G 4.0593 8.4501 102.5254 43.8294 0.0000 176.1127 57 C 4.2344 8.9576 116.2051 60.9477 29.3244 175.9767 58 T 3.9973 7.9520 115.3846 65.6267 68.7574 175.0262 59 S 4.5112 8.3926 119.3932 56.5239 61.9397 171.5639 60 A 4.2684 7.9696 127.1049 52.3174 20.1029 176.9684 61 G 4.0606 8.2466 107.6967 44.8658 0.0000 175.8138 62 P 4.4038 0.0000 0.0000 61.3280 32.2767 175.1242 63 H 4.0444 7.8969 114.1485 54.9455 28.3042 175.1312 64 F 4.3482 8.7804 127.2106 58.5797 40.2574 174.9357 65 N 4.6272 7.4480 123.5257 50.4268 36.3440 173.4214 66 P 3.5749 0.0000 0.0000 66.1755 31.9234 178.2638 67 L 4.0459 7.5557 115.6108 54.5034 42.0851 175.8549 68 S 3.6346 7.7966 112.3649 59.4246 60.4352 169.5452 69 R 4.7242 7.5331 117.3754 54.4467 32.4778 177.0934 70 K 4.3706 9.2156 120.3405 56.0473 33.9184 176.4696 71 H 4.3162 8.4747 121.6220 54.9800 31.3320 173.0432 72 G 4.4806 8.3677 108.7903 45.6610 0.0000 173.2070 73 G 3.9854 8.0408 114.5071 45.4466 0.0000 172.5516 74 P 4.6139 0.0000 0.0000 62.8106 31.6775 178.0220 75 K 4.5383 7.6003 113.7451 57.8508 34.8365 174.6259 76 D 4.7442 7.9834 118.4924 53.0646 44.3400 175.0849 77 E 4.2673 8.5680 122.4538 56.3904 31.4991 176.3275 78 E 3.5887 8.7854 118.2146 56.5085 28.0285 173.7471 79 R 3.6855 5.8400 130.3125 56.0393 31.9877 174.9818 80 H 4.2330 7.7792 119.6603 56.3531 29.8058 176.0712 81 V 3.9208 8.3454 122.0837 61.0130 30.6844 175.9297 82 G 3.4214 6.8559 115.0113 44.0571 0.0000 170.1178 83 D 4.5146 6.8783 119.4497 52.9178 42.2316 174.7822 84 L 4.7027 7.5675 119.4826 52.9209 46.2291 177.0394 85 G 4.3163 8.8302 111.8849 46.9163 0.0000 176.4308 86 N 5.8413 9.4482 117.6927 51.2982 41.3008 173.2330 87 V 4.2703 8.7965 112.9606 60.0413 35.0120 174.8607 88 T 5.1717 8.0375 115.9059 62.1560 73.0085 173.0574 89 A 4.9400 9.1167 127.3537 50.3262 21.6870 176.3454 90 D 4.8401 8.9415 122.0215 53.3117 41.8037 177.8699 91 K 4.1161 8.4589 119.3999 58.4394 32.3845 177.1826 92 D 4.3587 7.8937 118.6733 55.5830 41.5335 176.4835 93 G 4.3097 9.1423 107.9788 44.7447 0.0000 172.6832 94 V 4.8998 7.5854 117.9900 59.4202 34.7131 174.0107 95 A 5.0745 8.9057 126.5237 49.9566 20.5153 175.8295 96 D 4.7784 8.6014 122.4477 53.8240 42.7268 175.5397 97 V 4.4613 8.5725 124.7593 60.4182 34.4464 176.5183 98 S 5.2790 8.2610 123.3518 57.2577 61.8872 174.1366 99 I 4.5990 8.1165 120.7623 60.8257 39.9556 176.4883 100 E 5.1669 8.6506 123.9821 55.5799 31.5779 174.8374 101 D 4.8155 8.9024 120.4784 52.5048 45.2379 175.2935 102 S 4.9974 8.1820 117.1306 56.6795 63.0857 173.6840 103 V 4.5502 7.5406 117.3369 63.4623 37.8053 175.1992 104 I 4.0691 8.0215 112.9557 60.7218 38.3312 174.8544 105 S 4.5641 7.7919 115.5381 58.0538 66.6301 175.7609 106 L 4.0927 9.0449 124.5506 52.7386 39.6173 175.7504 107 S 4.0996 8.7357 113.1753 58.8396 64.2344 175.0518 108 G 4.1765 8.6608 112.8020 45.6027 0.0000 173.0077 109 D 4.4475 8.5280 118.9118 56.6859 41.0651 177.8130 110 H 4.7689 8.1627 114.3330 55.4723 29.2545 174.8983 111 S 4.5262 7.5797 115.0570 58.3453 64.0541 174.2772 112 I 4.0092 6.9757 121.0014 60.6743 39.9686 174.4526 113 I 3.5333 6.8841 122.5120 62.4335 37.5664 176.9718 114 G 4.0917 8.8157 112.5210 46.6785 0.0000 173.7979 115 R 4.5923 7.2354 118.0809 55.2589 31.5861 174.3959 116 T 5.0056 7.7278 112.3458 60.8490 71.2561 172.3095 117 L 5.1811 8.4084 123.9150 53.7011 46.1778 174.3621 118 V 4.7203 8.6089 123.7788 59.9544 34.5063 174.7005 119 V 4.9155 8.0441 122.3334 61.6880 33.6193 174.3286 120 H 5.2055 9.0202 121.4109 52.9055 31.8919 174.0360 121 E 4.5491 8.6582 120.9564 57.0113 30.0262 175.7008 122 K 4.7993 7.8678 116.8398 54.3749 36.6373 175.0926 123 A 4.4111 8.5139 122.6568 52.8345 19.3008 175.8597 124 D 4.9949 8.6312 117.9159 52.8629 43.9408 176.3181 125 D 4.6020 9.3091 122.4992 53.3954 42.3740 175.2558 126 L 3.9577 9.4191 117.7853 55.7990 38.8155 173.0228 127 G 4.4185 9.7981 113.7547 46.0998 0.0000 171.8661 128 K 4.7115 7.5755 117.6511 54.8545 35.3701 173.9520 129 G 4.4854 7.8190 111.2308 43.8085 0.0000 173.0661 130 G 3.9080 8.3348 108.2245 45.6358 0.0000 172.5149 131 N 5.0986 7.5649 116.9041 49.4657 40.4157 173.9850 132 E 3.8275 8.8181 117.1222 60.1232 29.3869 178.4874 133 E 3.8799 8.3216 118.3186 59.3072 29.0320 179.0602 134 S 4.2513 7.9609 115.2013 61.6256 62.7291 175.9498 135 T 4.3322 8.0550 111.5942 62.8556 68.9885 174.9511 136 K 4.2431 7.9813 121.1448 58.0819 33.3692 177.1319 137 T 3.6815 8.5949 113.2161 61.5193 69.3440 174.7711 138 G 4.5426 8.4883 109.1579 44.2387 0.0000 172.9184 139 N 4.1246 8.1450 115.5610 53.9909 38.1303 175.3792 140 A 4.2661 7.4297 115.7104 51.7728 18.3140 181.0914 141 G 4.0770 8.2856 105.9323 47.3942 0.0000 173.9118 142 S 4.7013 8.0466 112.3105 57.4799 66.6285 175.0034 143 R 4.4862 8.3005 121.1481 55.9621 31.8064 173.8769 144 L 4.7715 8.1416 116.5080 56.1683 43.7421 173.8383 145 A 4.1894 8.7421 119.6448 53.4181 19.2895 176.9316 146 C 4.9849 8.4594 114.7922 56.8368 33.8262 173.1727 147 G 4.7358 8.4934 105.9014 46.8108 0.0000 171.7054 148 V 4.7927 8.1365 118.7526 60.8768 34.5508 174.4848 149 I 4.2860 8.3682 127.5792 61.0690 37.7419 175.8499 150 G 4.2629 8.5711 113.8891 44.5640 0.0000 171.9922 151 I 5.0594 8.1875 119.6335 59.4074 39.9590 175.5362 152 A 4.4893 8.8861 127.0956 50.6740 20.4231 176.5018 153 Q 3.8430 8.0187 121.4787 55.1771 30.2426 173.1875 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 1 A 8.21 4.61 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 2 T 7.85 4.43 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 1.18 0.00 0.00 3 K 9.59 5.47 0.00 1.93 1.76 0.00 1.88 0.00 0.00 2.03 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.45 7.81 4 A 8.32 5.00 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 5 V 8.72 4.63 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 0.68 0.00 0.00 0.96 0.00 0.00 6 A 9.42 4.47 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 7 V 8.26 4.30 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 0.98 0.00 0.00 0.94 0.00 0.00 8 L 8.70 5.01 0.00 1.90 1.46 1.02 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 9 K 7.72 4.88 0.00 1.76 1.62 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.48 7.81 10 G 8.64 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 11 D 7.79 4.68 0.00 2.80 2.64 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 12 G 8.08 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.45 0.00 2.19 2.17 0.00 3.89 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 14 V 8.04 4.07 2.14 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 0.96 0.00 0.00 0.97 0.00 0.00 15 Q 9.16 4.85 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 16 G 8.91 4.39 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 0.00 17 I 9.04 5.52 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 2.30 0.96 0.00 0.00 18 I 8.27 4.96 1.56 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 1.37 0.86 0.92 0.00 0.00 19 N 8.58 5.28 0.00 1.59 2.43 0.00 0.00 6.88 8.13 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 20 F 7.67 4.74 0.00 2.63 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.28 4.96 0.00 2.19 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 2.48 2.46 0.00 22 Q 8.35 4.42 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 23 K 8.77 4.22 0.00 1.94 1.98 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.49 7.81 24 E 7.82 4.73 0.00 2.05 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 2.30 2.36 0.00 25 S 8.85 4.12 0.00 3.96 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 26 N 8.11 4.80 0.00 2.70 2.85 0.00 0.00 6.85 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 27 G 7.87 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 0.00 0.00 0.00 28 P 0.00 4.69 0.00 2.23 2.09 0.00 3.73 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 29 V 8.55 4.54 2.15 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 1.13 0.00 0.00 1.01 0.00 0.00 30 K 8.68 4.96 0.00 2.16 2.06 0.00 2.01 0.00 0.00 2.00 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.84 1.77 7.81 31 V 8.94 3.68 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 0.06 0.00 0.00 1.05 0.00 0.00 32 W 7.61 6.02 0.00 3.41 3.28 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 33 G 9.62 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 34 S 9.05 4.99 0.00 3.81 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 35 I 8.42 4.70 1.77 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 0.98 0.74 0.89 0.00 0.00 36 K 9.15 4.92 0.00 1.76 1.56 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.30 1.54 7.81 37 G 9.04 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 38 L 7.72 4.10 0.00 1.79 1.35 0.84 0.45 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 39 T 8.67 4.52 4.27 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 1.30 0.00 0.00 40 E 8.34 4.30 0.00 2.12 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 2.31 0.00 41 G 8.46 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 42 L 7.90 4.69 0.00 1.49 1.58 0.91 1.19 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 43 H 8.74 5.13 0.00 2.95 3.30 0.00 5.62 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 44 G 9.20 4.27 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 0.00 45 F 9.06 5.52 0.00 3.04 2.90 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 46 H 9.16 5.01 0.00 3.23 3.09 0.00 5.80 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.49 4.42 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 0.77 0.00 0.00 0.90 0.00 0.00 48 H 8.72 5.11 0.00 3.11 3.20 0.00 5.63 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.63 3.98 0.00 1.89 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 1.94 1.96 0.00 50 F 8.38 4.16 0.00 3.29 2.97 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 51 G 8.51 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 52 D 8.09 4.64 0.00 2.55 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 53 N 8.43 5.24 0.00 2.81 2.83 0.00 0.00 6.45 7.74 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 54 T 7.64 3.93 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 1.24 0.00 0.00 55 A 7.79 4.28 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 56 G 8.45 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 C 8.96 4.23 0.00 3.10 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 58 T 7.95 4.00 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 1.20 0.00 0.00 59 S 8.39 4.51 0.00 3.98 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 60 A 7.97 4.27 1.53 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 0.00 0.00 61 G 8.25 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.40 0.00 1.99 1.99 0.00 3.77 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 1.94 1.91 0.00 63 H 7.90 4.04 0.00 3.36 3.50 0.00 5.74 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.78 4.35 0.00 2.77 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 65 N 7.45 4.63 0.00 2.80 2.63 0.00 0.00 5.83 7.70 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 66 P 0.00 3.57 0.00 2.07 2.11 0.00 3.49 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.90 0.00 67 L 7.56 4.05 0.00 1.58 1.69 0.88 0.81 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 68 S 7.80 3.63 0.00 3.91 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 69 R 7.53 4.72 0.00 1.70 2.12 0.00 3.21 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 70 K 9.22 4.37 0.00 1.80 1.69 0.00 1.53 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.59 7.81 71 H 8.47 4.32 0.00 3.36 3.18 0.00 5.85 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 72 G 8.37 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.04 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 74 P 0.00 4.61 0.00 2.21 2.20 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 75 K 7.60 4.54 0.00 1.84 1.88 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.32 1.42 7.81 76 D 7.98 4.74 0.00 2.67 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.57 4.27 0.00 1.94 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 2.21 2.30 0.00 78 E 8.79 3.59 0.00 2.23 1.77 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 2.29 2.34 0.00 79 R 5.84 3.69 0.00 2.00 1.91 0.00 3.24 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 80 H 7.78 4.23 0.00 3.31 3.34 0.00 5.72 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 81 V 8.35 3.92 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 0.85 0.00 0.00 0.89 0.00 0.00 82 G 6.86 3.42 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 83 D 6.88 4.51 0.00 2.76 2.68 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 84 L 7.57 4.70 0.00 0.69 0.92 0.52 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.83 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 0.00 0.00 0.00 0.00 86 N 9.45 5.84 0.00 2.79 2.85 0.00 0.00 5.95 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 87 V 8.80 4.27 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 -0.32 0.00 0.00 0.83 0.00 0.00 88 T 8.04 5.17 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 1.21 0.00 0.00 89 A 9.12 4.94 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 90 D 8.94 4.84 0.00 2.69 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.46 4.12 0.00 1.92 2.18 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.43 7.81 92 D 7.89 4.36 0.00 2.63 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 93 G 9.14 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 0.00 0.00 0.00 0.00 94 V 7.59 4.90 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 0.99 0.00 0.00 0.95 0.00 0.00 95 A 8.91 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 96 D 8.60 4.78 0.00 2.66 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 97 V 8.57 4.46 2.13 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 1.03 0.00 0.00 0.63 0.00 0.00 98 S 8.26 5.28 0.00 3.92 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 99 I 8.12 4.60 2.01 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.74 1.04 0.00 0.00 100 E 8.65 5.17 0.00 1.88 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 2.29 2.42 0.00 101 D 8.90 4.82 0.00 2.82 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.18 5.00 0.00 3.98 3.87 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 0.00 103 V 7.54 4.55 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 0.80 0.00 0.00 0.92 0.00 0.00 104 I 8.02 4.07 1.80 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.93 0.97 0.00 0.00 105 S 7.79 4.56 0.00 3.80 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 0.00 106 L 9.04 4.09 0.00 1.56 1.51 0.74 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 107 S 8.74 4.10 0.00 3.77 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 0.00 108 G 8.66 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 0.00 0.00 0.00 0.00 109 D 8.53 4.45 0.00 2.85 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 0.00 110 H 8.16 4.77 0.00 3.13 3.29 0.00 5.68 0.00 0.00 0.00 0.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 7.58 4.53 0.00 3.97 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 0.00 112 I 6.98 4.01 1.10 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.20 0.75 0.00 0.00 113 I 6.88 3.53 1.98 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 1.19 1.31 0.87 0.00 0.00 114 G 8.82 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 0.00 115 R 7.24 4.59 0.00 1.97 1.97 0.00 3.10 0.00 0.00 3.29 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.46 0.00 116 T 7.73 5.01 4.27 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 1.33 0.00 0.00 117 L 8.41 5.18 0.00 1.84 1.47 1.01 0.84 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 0.00 118 V 8.61 4.72 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 0.68 0.00 0.00 0.88 0.00 0.00 119 V 8.04 4.92 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 0.81 0.00 0.00 1.03 0.00 0.00 120 H 9.02 5.21 0.00 3.30 3.44 0.00 5.67 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.66 4.55 0.00 2.17 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 2.35 2.38 0.00 122 K 7.87 4.80 0.00 1.87 1.66 0.00 1.77 0.00 0.00 1.84 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.32 7.81 123 A 8.51 4.41 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 0.00 124 D 8.63 4.99 0.00 2.81 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 9.31 4.60 0.00 2.78 2.81 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 0.00 126 L 9.42 3.96 0.00 1.82 1.66 1.04 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 127 G 9.80 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 0.00 128 K 7.58 4.71 0.00 1.71 1.69 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.38 7.81 129 G 7.82 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 G 8.33 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 0.00 0.00 0.00 131 N 7.56 5.10 0.00 2.82 2.94 0.00 0.00 6.74 7.51 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 0.00 132 E 8.82 3.83 0.00 2.02 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 2.38 2.34 0.00 133 E 8.32 3.88 0.00 2.11 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 2.39 2.48 0.00 134 S 7.96 4.25 0.00 4.04 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 0.00 135 T 8.05 4.33 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 1.25 0.00 0.00 136 K 7.98 4.24 0.00 1.91 1.96 0.00 1.90 0.00 0.00 1.90 0.00 0.00 3.08 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.31 1.45 7.81 137 T 8.59 3.68 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 1.19 0.00 0.00 138 G 8.49 4.54 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 0.00 0.00 0.00 139 N 8.15 4.12 0.00 2.94 2.84 0.00 0.00 7.11 7.52 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 0.00 140 A 7.43 4.27 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 0.00 141 G 8.29 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 0.00 0.00 0.00 142 S 8.05 4.70 0.00 3.87 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 0.00 143 R 8.30 4.49 0.00 1.90 2.11 0.00 3.24 0.00 0.00 3.41 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 144 L 8.14 4.77 0.00 1.59 1.62 0.94 0.61 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 0.00 145 A 8.74 4.19 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 0.00 146 C 8.46 4.98 0.00 2.99 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 0.00 147 G 8.49 4.74 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 0.00 148 V 8.14 4.79 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 1.16 0.00 0.00 0.98 0.00 0.00 149 I 8.37 4.29 2.00 0.00 0.00 1.00 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 1.05 0.98 0.00 0.00 150 G 8.57 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.19 5.06 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 1.24 0.56 0.98 0.00 0.00 152 A 8.89 4.49 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 0.00 153 Q 8.02 3.84 0.00 2.20 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00