NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1705 8.1727 122.0494 56.2721 34.1132 174.0203 2 V 4.6216 8.1565 127.0142 60.6258 32.4695 174.4914 3 F 4.4643 9.8642 128.8440 57.6416 40.1651 174.8247 4 E 4.2434 9.0683 121.1065 55.5481 30.9838 176.7406 5 R 3.3438 9.0581 120.9030 61.0063 29.9737 179.4015 6 C 4.3416 8.0269 115.3375 59.6881 37.9661 175.7240 7 E 3.9089 8.1298 120.7380 59.2456 29.2624 178.5182 8 L 3.5921 8.0861 120.1394 57.8021 42.0615 178.5630 9 A 3.9277 7.7825 120.7276 55.5112 18.2487 179.9525 10 R 3.9335 8.0766 116.3487 59.5001 29.9487 179.4418 11 T 3.8581 7.8233 115.7529 66.5998 68.4742 176.7341 12 L 3.8426 8.2072 121.3659 57.4291 41.6281 179.4039 13 K 3.9055 8.0311 119.6330 59.7041 31.9552 179.1383 14 R 4.0051 8.0429 117.2177 58.8109 29.9966 178.0680 15 L 4.3640 7.3230 116.3812 54.3884 41.7030 177.2843 16 G 3.8890 7.8400 107.0013 46.5111 0.0000 174.9125 17 M 3.9780 7.8116 120.7419 56.3991 32.2821 175.6122 18 D 4.3623 7.9937 117.5231 56.1930 40.5892 175.5966 19 G 3.9517 9.5192 115.5650 45.1848 0.0000 170.9551 20 Y 4.2551 8.2246 121.5676 58.9220 39.0682 176.5673 21 R 3.5664 8.9591 127.1537 57.2828 27.7848 177.2276 22 G 3.8027 8.1454 102.9899 45.7710 0.0000 173.9324 23 I 4.0121 7.5760 122.2518 59.4570 37.6764 175.9530 24 S 4.6298 8.3166 120.9155 57.9621 64.9861 174.8023 25 L 4.2389 8.4454 123.4236 58.5024 41.8159 179.2283 26 A 4.1819 8.1550 120.2218 55.2826 18.3297 179.2538 27 N 4.4711 8.0150 114.5540 56.3651 38.5862 177.7127 28 W 4.3696 7.9460 120.4884 60.0444 29.0569 178.5533 29 M 4.1339 8.4363 118.8016 58.5265 31.4133 177.9839 30 C 3.2221 8.1742 118.6893 59.0629 42.5479 175.2427 31 L 4.0013 8.1628 121.7296 58.2729 41.7798 178.7151 32 A 4.2370 8.3349 122.0206 54.3633 18.2838 179.3517 33 K 2.9025 8.2110 118.0449 59.4626 32.0485 179.1704 34 W 4.0839 7.8520 117.4181 59.2700 29.0342 178.3283 35 E 4.3606 8.5067 119.0008 58.7177 29.2281 177.8365 36 S 4.4990 7.9918 108.9340 56.8528 65.0567 174.4668 37 G 3.3090 8.3221 108.8514 47.0030 0.0000 173.5991 38 Y 3.6425 7.7006 113.6429 58.5554 35.1456 168.3957 39 N 5.2392 7.6046 119.8620 52.0289 39.6996 175.8498 40 T 4.0685 8.8142 117.3562 64.2259 69.1111 176.0034 41 R 4.3525 8.2068 119.1927 56.0386 30.7313 176.3589 42 A 4.3489 7.7027 122.3526 52.4939 19.3199 176.9748 43 T 5.5801 8.2333 110.5373 59.7626 72.4300 173.1160 44 N 4.8465 8.3593 121.4154 52.4589 42.1774 172.3210 45 Y 4.7630 8.7485 128.0991 57.2616 40.8898 173.8781 46 N 4.8178 8.3337 124.2946 51.1989 39.1569 175.4063 47 A 3.6576 8.2717 127.8405 54.5797 18.9925 179.1194 48 G 3.7068 8.0568 104.5705 48.0591 0.0000 173.9446 49 D 4.7467 7.5972 116.2171 51.9953 40.0838 176.1282 50 R 3.9570 8.1007 116.4022 57.0720 28.0808 175.8576 51 S 4.9782 7.2324 108.9353 57.1190 66.4408 172.6557 52 T 5.1192 8.9615 115.6835 62.0515 72.9831 172.9205 53 D 5.3436 8.9256 125.4005 53.3654 43.0094 175.0558 54 Y 4.8800 9.4116 121.2120 57.3849 41.4349 177.5797 55 G 4.5126 8.9108 111.7377 45.8959 0.0000 173.5961 56 I 4.0519 8.1114 116.4635 62.9017 37.9855 177.9673 57 F 4.8233 7.9803 115.7144 56.3924 39.9362 175.2127 58 Q 3.5941 7.9095 119.2209 57.0861 26.5933 174.0291 59 I 4.4109 8.2482 118.9366 60.9361 39.2954 176.8622 60 N 5.3625 9.1764 126.1285 53.4041 39.7203 175.7831 61 S 4.6858 9.2535 120.8558 60.3545 63.3269 175.4870 62 R 3.8092 9.1058 122.4680 58.8039 30.3391 177.8549 63 Y 4.2889 7.8761 113.9399 57.5890 40.8239 177.0365 64 W 4.7233 8.1660 119.1203 57.6515 30.0825 173.6598 65 C 5.5863 7.8760 110.6299 53.5433 44.1231 171.8491 66 N 5.0761 8.9069 119.9106 52.2479 39.4437 174.9195 67 D 4.7854 8.5793 123.1677 52.2501 40.3427 177.3721 68 G 3.9931 8.5411 107.6565 46.1252 0.0000 174.5943 69 K 4.4804 8.0074 116.9510 56.5984 33.1325 175.6931 70 T 4.5911 7.7216 117.4324 61.3374 69.4196 172.3094 71 P 4.2059 0.0000 0.0000 64.1098 31.6137 176.2240 72 G 3.9361 8.7933 111.2675 46.2004 0.0000 173.1848 73 A 4.1963 7.4561 120.8512 51.3743 19.1205 177.4570 74 L 4.6952 8.2759 119.6480 53.2162 45.1181 177.1606 75 N 4.9130 7.9263 115.2310 52.0723 38.7600 174.3964 76 A 3.9433 8.6251 124.3059 55.1351 19.0869 178.4129 77 C 4.5684 8.4998 110.8033 57.2393 41.1299 173.0869 78 H 4.0482 7.8164 116.6300 56.4772 26.3242 173.9013 79 L 4.7980 8.3342 117.9577 52.9189 46.6221 176.6030 80 S 4.6047 8.3662 115.2056 58.0721 63.2657 176.0448 81 C 4.1239 8.8199 124.3227 59.5669 40.6765 176.3494 82 S 3.9008 7.8054 114.6244 61.2703 61.6528 175.9350 83 A 4.0602 7.8161 122.4307 54.3676 17.8928 177.9288 84 L 4.4512 7.8064 116.3922 55.0792 41.8206 177.6137 85 L 5.0231 7.8883 117.4196 54.5148 42.3691 176.6629 86 Q 4.3746 7.8632 117.7082 55.2555 29.6265 175.9236 87 D 4.4082 8.6125 120.6311 57.2491 41.1126 176.8281 88 N 4.5560 8.0318 118.1571 53.2914 39.2693 174.7167 89 I 4.2136 8.4737 118.7292 60.9805 38.0893 176.9832 90 A 3.9364 8.2678 124.5601 56.0259 18.1979 179.9419 91 D 4.3117 8.0964 116.3982 57.3761 40.9064 178.7407 92 A 4.0975 7.9647 120.9437 55.1698 18.4330 179.7096 93 V 3.4219 8.3284 117.0661 65.8498 31.5340 178.1430 94 A 3.8235 8.0238 120.6207 55.2481 18.2063 178.8385 95 C 4.2105 8.3600 116.8026 59.7502 39.3019 175.5795 96 A 3.9102 8.3185 122.8246 55.0598 17.5816 179.7857 97 K 3.8126 7.6869 116.3115 59.4270 32.1729 179.1670 98 R 4.0781 7.8161 119.0409 59.3187 30.0955 178.5811 99 V 2.4860 7.4873 117.9439 65.8889 31.3048 178.3465 100 V 3.8073 7.7514 110.7792 63.3963 31.1984 178.2985 101 R 4.1262 7.5679 117.2956 57.4395 30.4389 176.4479 102 D 4.7023 7.6090 119.1098 52.7867 41.8717 175.3997 103 P 4.2158 0.0000 0.0000 66.2104 30.8760 178.4329 104 Q 4.0068 8.1815 116.1112 56.7825 29.8637 177.8674 105 G 4.0242 7.8688 106.9738 46.7758 0.0000 175.8053 106 I 3.4875 7.7595 119.4259 63.5469 37.9415 177.9944 107 R 4.2386 7.2751 117.1383 57.6376 29.9766 177.3818 108 A 4.1333 7.6252 120.6878 53.6173 18.6001 177.6845 109 W 4.6558 8.1402 116.9039 55.4954 29.7192 177.3836 110 V 3.7244 8.7798 123.8639 66.1198 30.8937 177.6583 111 A 4.0576 8.2908 120.0029 54.6699 18.1212 179.3118 112 W 3.9907 8.4006 127.1688 60.7670 30.6126 178.3834 113 R 3.7966 8.3139 116.2238 59.4433 29.6321 178.3780 114 N 4.4302 8.1825 115.2022 55.3792 38.6395 176.1618 115 R 4.2604 7.7125 115.0880 55.6796 31.6330 175.3388 116 C 4.5321 7.9706 115.3748 57.5805 42.9064 174.5027 117 Q 3.2132 6.6606 119.8476 56.9688 28.7937 175.1899 118 N 4.1612 8.5491 121.5584 54.4972 36.2842 173.9172 119 R 4.4889 7.3176 114.5285 54.2052 33.1351 175.9439 120 D 4.5801 8.3966 119.2176 53.7848 40.2651 175.9096 121 V 4.4986 8.1108 118.5978 61.0590 32.4847 178.2980 122 R 4.0153 8.1471 122.1454 59.3866 29.7912 178.8275 123 Q 3.9942 8.1721 115.2372 59.3273 28.3821 178.5404 124 Y 3.9967 7.8876 115.5711 60.1086 38.2056 176.8540 125 V 4.4131 7.8388 110.7355 60.7438 32.9045 175.4774 126 Q 4.1756 7.5355 120.3506 57.1023 28.8468 176.8249 127 G 3.9287 8.8702 109.8349 46.2172 0.0000 174.5601 128 C 4.4697 8.0474 115.4035 56.3773 40.6262 174.1044 129 G 3.8821 8.1326 107.2598 46.6538 0.0000 174.2198 130 V 4.0061 7.8583 118.1081 61.0795 32.0252 175.8259 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 K 8.17 4.17 0.00 2.00 1.61 0.00 1.23 0.00 0.00 0.90 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.92 1.14 7.81 2 V 8.16 4.62 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 0.91 0.00 0.00 0.94 0.00 0.00 3 F 9.86 4.46 0.00 2.85 2.80 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 4 E 9.07 4.24 0.00 1.93 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 2.29 2.39 0.00 5 R 9.06 3.34 0.00 2.01 1.93 0.00 3.43 0.00 0.00 3.48 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.86 0.00 6 C 8.03 4.34 0.00 3.01 3.12 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 7 E 8.13 3.91 0.00 2.06 2.23 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 2.57 2.41 0.00 8 L 8.09 3.59 0.00 1.36 1.37 -0.21 0.48 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 9 A 7.78 3.93 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 10 R 8.08 3.93 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 11 T 7.82 3.86 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 1.25 0.00 0.00 12 L 8.21 3.84 0.00 1.70 1.55 0.88 0.29 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 13 K 8.03 3.91 0.00 1.95 1.92 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 8.04 4.01 0.00 1.93 1.97 0.00 3.21 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 15 L 7.32 4.36 0.00 1.57 1.57 0.87 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.84 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 0.00 0.00 0.00 17 M 7.81 3.98 0.00 1.33 1.96 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.22 0.00 18 D 7.99 4.36 0.00 2.68 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 19 G 9.52 3.95 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 20 Y 8.22 4.26 0.00 3.40 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 21 R 8.96 3.57 0.00 1.82 1.80 0.00 3.34 0.00 0.00 2.97 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.36 0.00 22 G 8.15 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 0.00 0.00 0.00 23 I 7.58 4.01 1.65 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.67 -0.25 0.00 0.00 24 S 8.32 4.63 0.00 4.11 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 25 L 8.45 4.24 0.00 2.12 1.81 0.98 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.15 4.18 1.52 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 27 N 8.01 4.47 0.00 2.81 2.76 0.00 0.00 6.97 7.34 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 28 W 7.95 4.37 0.00 3.47 3.09 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 29 M 8.44 4.13 0.00 2.14 2.35 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.92 0.00 30 C 8.17 3.22 0.00 2.72 3.19 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 31 L 8.16 4.00 0.00 1.84 1.91 0.59 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.33 4.24 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.21 2.90 0.00 1.69 1.72 0.00 0.61 0.00 0.00 1.17 0.00 0.00 2.71 0.00 0.00 2.19 0.00 0.00 0.00 0.00 1.23 0.49 7.81 34 W 7.85 4.08 0.00 3.45 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.51 4.36 0.00 2.02 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 2.58 2.57 0.00 36 S 7.99 4.50 0.00 4.06 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 37 G 8.32 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 7.70 3.64 0.00 3.26 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 39 N 7.60 5.24 0.00 2.77 2.84 0.00 0.00 7.00 7.11 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 40 T 8.81 4.07 4.44 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 1.48 0.00 0.00 41 R 8.21 4.35 0.00 2.03 2.03 0.00 3.18 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 42 A 7.70 4.35 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 43 T 8.23 5.58 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 1.25 0.00 0.00 44 N 8.36 4.85 0.00 2.84 2.78 0.00 0.00 6.69 7.56 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 45 Y 8.75 4.76 0.00 2.96 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 46 N 8.33 4.82 0.00 2.63 2.59 0.00 0.00 6.68 7.79 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 47 A 8.27 3.66 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.06 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.60 4.75 0.00 2.73 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 50 R 8.10 3.96 0.00 2.04 2.20 0.00 3.12 0.00 0.00 3.20 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.54 0.00 51 S 7.23 4.98 0.00 3.99 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 52 T 8.96 5.12 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 0.78 0.00 0.00 53 D 8.93 5.34 0.00 2.75 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 54 Y 9.41 4.88 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 55 G 8.91 4.51 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 56 I 8.11 4.05 1.68 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 2.19 0.14 0.00 0.00 57 F 7.98 4.82 0.00 3.23 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 58 Q 7.91 3.59 0.00 2.53 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.70 0.00 59 I 8.25 4.41 2.14 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.20 1.13 0.00 0.00 60 N 9.18 5.36 0.00 3.11 3.04 0.00 0.00 6.97 7.69 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 61 S 9.25 4.69 0.00 4.06 4.38 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 62 R 9.11 3.81 0.00 1.62 1.78 0.00 2.72 0.00 0.00 2.79 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.92 0.00 63 Y 7.88 4.29 0.00 1.61 1.81 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 64 W 8.17 4.72 0.00 3.65 3.30 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 65 C 7.88 5.59 0.00 3.15 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.91 5.08 0.00 2.79 2.70 0.00 0.00 7.05 9.28 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 67 D 8.58 4.79 0.00 2.84 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 68 G 8.54 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 69 K 8.01 4.48 0.00 1.81 1.89 0.00 1.60 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.45 7.81 70 T 7.72 4.59 4.25 0.00 0.00 0.00 0.00 0.00 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 71 P 0.00 4.21 0.00 2.01 2.01 0.00 3.83 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.79 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 73 A 7.46 4.20 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 74 L 8.28 4.70 0.00 1.53 1.46 0.88 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 75 N 7.93 4.91 0.00 2.69 2.57 0.00 0.00 6.75 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 76 A 8.63 3.94 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 77 C 8.50 4.57 0.00 3.28 3.24 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 78 H 7.82 4.05 0.00 3.29 3.35 0.00 5.81 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.33 4.80 0.00 1.68 1.50 1.00 0.69 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 80 S 8.37 4.60 0.00 3.83 3.69 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 81 C 8.82 4.12 0.00 2.22 1.23 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 82 S 7.81 3.90 0.00 3.88 3.83 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 83 A 7.82 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 84 L 7.81 4.45 0.00 1.95 1.83 1.07 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.89 5.02 0.00 1.79 1.71 1.13 1.01 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 86 Q 7.86 4.37 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 7.07 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 87 D 8.61 4.41 0.00 2.62 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 88 N 8.03 4.56 0.00 2.69 2.75 0.00 0.00 6.95 7.94 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 89 I 8.47 4.21 1.77 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.98 0.96 0.00 0.00 90 A 8.27 3.94 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 91 D 8.10 4.31 0.00 2.75 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 92 A 7.96 4.10 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.33 3.42 2.18 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 0.79 0.00 0.00 0.87 0.00 0.00 94 A 8.02 3.82 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 95 C 8.36 4.21 0.00 3.07 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.32 3.91 0.74 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 97 K 7.69 3.81 0.00 1.63 1.43 0.00 1.29 0.00 0.00 0.78 0.00 0.00 2.32 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 0.93 7.81 98 R 7.82 4.08 0.00 1.99 2.16 0.00 3.29 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.97 0.00 99 V 7.49 2.49 1.75 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 -0.36 0.00 0.00 -0.57 0.00 0.00 100 V 7.75 3.81 2.12 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 1.13 0.00 0.00 1.40 0.00 0.00 101 R 7.57 4.13 0.00 1.96 2.05 0.00 3.24 0.00 0.00 3.40 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.14 0.00 102 D 7.61 4.70 0.00 3.04 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 0.00 103 P 0.00 4.22 0.00 2.01 2.13 0.00 3.69 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 2.14 0.00 104 Q 8.18 4.01 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.88 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 105 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 0.00 106 I 7.76 3.49 0.96 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.29 -0.75 0.00 0.00 107 R 7.28 4.24 0.00 2.05 2.03 0.00 3.23 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.53 0.00 108 A 7.63 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.14 4.66 0.00 3.50 3.26 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 0.00 110 V 8.78 3.72 2.18 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.29 4.06 1.52 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 0.00 112 W 8.40 3.99 0.00 3.45 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 0.00 113 R 8.31 3.80 0.00 2.01 2.02 0.00 3.35 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.16 0.00 114 N 8.18 4.43 0.00 2.69 2.72 0.00 0.00 6.86 7.21 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 0.00 115 R 7.71 4.26 0.00 0.98 0.84 0.00 2.21 0.00 0.00 2.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.07 0.00 116 C 7.97 4.53 0.00 1.52 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 0.00 117 Q 6.66 3.21 0.00 0.93 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.88 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 118 N 8.55 4.16 0.00 2.78 2.81 0.00 0.00 6.90 7.66 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 0.00 119 R 7.32 4.49 0.00 1.76 1.78 0.00 3.23 0.00 0.00 3.04 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 120 D 8.40 4.58 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 0.00 121 V 8.11 4.50 2.42 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 0.90 0.00 0.00 1.05 0.00 0.00 122 R 8.15 4.02 0.00 1.94 2.02 0.00 3.16 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 123 Q 8.17 3.99 0.00 2.03 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.91 0.00 0.00 0.00 0.00 0.00 2.09 1.52 0.00 124 Y 7.89 4.00 0.00 3.27 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 0.00 125 V 7.84 4.41 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 1.00 0.00 0.00 1.06 0.00 0.00 126 Q 7.54 4.18 0.00 1.87 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.93 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 127 G 8.87 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 0.00 0.00 0.00 128 C 8.05 4.47 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 0.00 129 G 8.13 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 0.00 130 V 7.86 4.01 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 0.80 0.00 0.00 0.96 0.00 0.00