NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8431 8.3549 109.7361 45.5247 0.0000 172.9292 2 S 4.3459 8.4264 115.2046 56.6419 63.5922 172.6469 3 S 4.5902 8.5561 123.2566 56.3629 62.6916 173.0433 4 G 4.1023 8.0296 111.8830 43.3181 0.0000 170.6814 5 S 4.5515 8.3169 116.5880 55.8767 64.4662 173.8221 6 S 4.0787 8.8453 123.6080 59.8669 62.8597 171.8472 7 G 3.6226 8.1172 113.6172 44.5594 0.0000 171.6554 8 P 4.3934 0.0000 0.0000 63.8738 31.7812 177.3177 9 R 4.3603 7.4231 118.4739 55.2170 29.8605 175.4799 10 T 4.7092 8.1396 111.9345 59.7666 72.0539 173.3765 11 V 4.9102 7.8105 113.7531 58.7195 34.0962 175.9715 12 K 4.2308 8.6132 122.1068 56.4064 33.3658 176.6503 13 E 4.6957 8.7486 124.2943 55.5734 29.3059 175.9377 14 L 4.3202 8.2858 124.6227 54.3104 43.4851 177.5786 15 T 4.3654 8.3519 119.2117 62.3838 69.2134 173.5168 16 V 4.5972 8.1408 126.6634 61.7641 33.0075 175.1596 17 S 4.6822 9.2035 121.9805 56.9636 65.3049 174.6497 18 A 5.1136 8.5556 130.0114 53.9313 18.0895 176.6107 19 G 3.9538 7.2922 109.2420 43.6459 0.0000 172.7014 20 D 4.4100 6.9438 119.7437 52.1798 44.1266 175.3838 21 N 4.7512 8.8833 119.9525 53.0775 37.9218 174.2637 22 L 4.8940 8.5694 122.5304 53.0220 44.7696 175.4831 23 I 5.2653 8.3382 122.7726 59.5755 40.5526 174.6674 24 I 4.6799 8.6698 119.7319 59.3727 41.2322 174.5083 25 T 5.0796 8.1266 117.9721 61.5100 71.6564 174.2271 26 L 4.3086 8.4188 126.4889 54.4808 42.0317 176.2117 27 P 4.2348 0.0000 0.0000 65.0686 31.6146 175.3089 28 D 4.3733 8.1215 118.7220 55.2818 40.3177 175.3736 29 N 5.0895 8.7082 121.8089 52.4000 38.7956 173.2553 30 E 5.3952 8.4494 117.7526 54.5941 32.2725 175.8330 31 V 4.4737 7.9861 121.5233 60.2626 35.1089 172.6355 32 E 4.9667 8.7033 124.0767 54.3576 31.8099 174.7123 33 L 4.7990 8.6146 126.5653 52.6722 45.2823 175.2941 34 K 4.9727 8.7560 123.2524 54.5403 35.4494 174.0734 35 A 5.1281 8.1630 127.6610 50.3807 20.9453 176.3094 36 F 4.7504 9.3724 121.5936 55.7915 41.7530 174.4534 37 V 4.8512 8.7465 123.9469 60.9968 33.4513 174.5491 38 A 5.1255 8.4655 128.9763 49.2596 21.9027 174.1855 39 P 4.7170 0.0000 0.0000 62.0404 32.3686 175.9936 40 A 4.4727 8.3220 122.3354 51.1873 18.9745 176.0438 41 P 4.3244 0.0000 0.0000 61.5984 32.2378 175.9087 42 P 4.5285 0.0000 0.0000 62.5475 32.4116 176.0099 43 V 3.8370 8.2510 115.9644 63.3423 31.4984 175.5115 44 E 4.2942 7.3517 117.9115 58.1641 31.5225 175.8794 45 T 3.8549 7.6163 120.8423 63.9979 68.6102 173.9931 46 T 4.2917 8.0136 116.8130 59.6105 70.9823 173.8468 47 Y 4.4329 7.7506 122.1055 57.5233 39.2556 174.1990 48 N 4.5793 8.2286 120.2895 52.1906 40.6138 173.1514 49 Y 4.6905 8.3611 122.2462 56.3032 40.0730 174.8178 50 E 4.6883 8.3184 125.7498 54.2563 31.7940 175.0048 51 W 4.9986 9.3660 127.8928 56.5004 31.2614 175.4534 52 N 5.2498 8.7219 116.0799 52.4712 43.3279 173.2132 53 L 5.1640 8.7557 124.2367 53.9024 42.7745 175.7144 54 I 4.3287 8.2984 118.8307 61.0808 39.5980 175.8964 55 S 4.6890 7.7824 117.4017 56.7383 64.6892 172.4597 56 H 5.1234 8.1702 119.3196 53.5228 31.1386 171.8620 57 P 4.4889 0.0000 0.0000 62.6569 31.9420 177.2942 58 T 4.0259 8.4099 113.8544 65.0708 67.5355 175.2875 59 D 4.5020 8.2117 120.4545 56.7861 41.1017 175.8431 60 Y 4.6695 7.7983 119.9584 56.4313 39.7688 175.3425 61 Q 3.8187 8.0376 126.4666 57.5657 29.0423 176.3799 62 G 3.7813 6.9972 105.9650 46.1048 0.0000 171.0574 63 E 4.5133 7.9656 121.9759 54.6247 31.7977 175.3739 64 I 4.6947 7.9888 122.9950 59.9041 41.6061 175.1810 65 K 4.4399 8.3768 120.3608 57.9598 32.7522 177.0528 66 Q 4.1179 8.5798 113.1815 56.2782 26.9096 174.6310 67 G 4.0054 7.6375 101.3960 46.7179 0.0000 174.8166 68 H 4.2864 7.9969 119.4543 58.1883 29.4072 175.3490 69 K 4.7314 7.3231 118.4154 54.3801 34.7284 175.6021 70 Q 2.8345 8.3259 119.5349 58.0755 29.8213 175.7761 71 T 4.9406 7.6507 108.3984 59.4775 71.3539 173.3412 72 L 4.3161 8.4629 126.6192 53.0462 44.6592 174.4749 73 N 5.2616 8.4550 123.1058 51.4655 41.1683 174.0193 74 L 4.7150 8.2569 123.6164 53.3630 45.0560 175.2938 75 S 4.9303 8.1678 113.9543 57.1322 66.5278 172.9985 76 Q 3.3624 8.7506 115.0516 56.6729 26.2181 174.4720 77 L 4.2249 7.4904 115.5704 54.3296 42.4094 176.9582 78 S 4.8462 7.7610 117.2472 55.7037 65.4390 174.0827 79 V 4.2833 7.9042 120.4266 61.3366 31.3076 175.9723 80 G 3.9101 8.2115 113.0609 45.8962 0.0000 169.9789 81 L 4.9453 7.5163 121.9871 53.7720 43.6470 175.2487 82 Y 4.7460 8.6094 122.4200 56.1395 41.9476 174.2249 83 V 4.5596 8.2683 123.7537 61.1618 34.0865 174.1272 84 F 5.4226 8.6612 127.7541 55.9311 41.1426 174.8993 85 K 4.2917 9.2632 126.9669 53.8691 33.5722 175.7085 86 V 3.6009 7.5240 128.7099 60.6341 32.2839 175.4656 87 T 4.2350 8.6893 124.6576 62.2273 69.6426 174.4952 88 V 4.7215 8.6617 128.7144 60.1398 33.2336 174.7961 89 S 4.5867 8.1428 121.3934 56.3322 66.1639 172.7726 90 S 4.8042 8.5437 115.6954 56.1073 65.3691 173.7570 91 E 3.9289 9.0105 120.8623 59.3881 29.1681 178.8615 92 N 5.2088 7.9007 116.3190 52.3574 39.7625 172.7556 93 A 4.9835 7.9449 116.5796 51.1469 23.8340 176.0033 94 F 4.7191 8.9343 120.2404 57.3482 43.4811 173.3075 95 G 4.4784 7.8843 110.9174 45.9022 0.0000 171.7045 96 E 5.0095 8.5023 117.1206 55.2779 32.2012 174.2469 97 G 4.4733 8.3145 107.7994 45.0696 0.0000 171.0813 98 F 5.1835 8.6704 117.2910 56.1658 43.1959 174.7873 99 V 4.6188 8.7777 122.9180 60.1711 34.5157 173.9988 100 N 5.3228 8.9524 122.6282 51.6847 40.9212 173.9522 101 V 4.8487 9.0947 123.5849 61.5397 34.6163 174.1212 102 T 5.0283 8.7397 124.7320 61.9132 71.3109 173.8271 103 V 4.7594 8.3831 125.6544 61.0427 33.8411 174.8818 104 K 4.7135 9.2672 129.1089 55.3289 33.2253 175.3014 105 P 4.6743 0.0000 0.0000 62.2317 32.4642 175.9297 106 A 3.9733 8.6794 124.7007 52.9658 18.0165 178.0356 107 R 4.2673 8.1178 120.5846 54.4125 28.4494 173.6237 108 S 3.9150 8.1868 118.5465 63.1613 61.9358 172.9865 109 G 3.8644 8.6438 113.1513 43.1250 0.0000 169.7334 110 P 4.5866 0.0000 0.0000 62.6139 32.2880 175.0046 111 S 4.4370 8.2555 110.3488 60.3155 64.8654 175.2377 112 S 4.2470 7.7271 112.4963 57.8959 63.0885 174.1376 113 G 4.0444 8.6717 110.3214 45.7380 0.0000 173.6175 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 G 8.35 3.84 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 0.00 2 S 8.43 4.35 0.00 3.90 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 3 S 8.56 4.59 0.00 3.84 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 4 G 8.03 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.32 4.55 0.00 3.78 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.85 4.08 0.00 4.01 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 7 G 8.12 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 0.00 0.00 0.00 8 P 0.00 4.39 0.00 2.19 2.18 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 9 R 7.42 4.36 0.00 1.84 1.93 0.00 3.15 0.00 0.00 3.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 10 T 8.14 4.71 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 1.20 0.00 0.00 11 V 7.81 4.91 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 1.04 0.00 0.00 0.96 0.00 0.00 12 K 8.61 4.23 0.00 1.81 1.72 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.43 7.81 13 E 8.75 4.70 0.00 1.86 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 2.31 2.35 0.00 14 L 8.29 4.32 0.00 1.40 1.42 0.37 0.49 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 15 T 8.35 4.37 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 1.24 0.00 0.00 16 V 8.14 4.60 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 0.66 0.00 0.00 0.78 0.00 0.00 17 S 9.20 4.68 0.00 3.96 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 18 A 8.56 5.11 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 19 G 7.29 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 D 6.94 4.41 0.00 2.60 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.88 4.75 0.00 2.79 2.86 0.00 0.00 5.90 7.81 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 22 L 8.57 4.89 0.00 1.59 1.62 0.99 1.18 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 23 I 8.34 5.27 1.89 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 0.63 0.97 0.00 0.00 24 I 8.67 4.68 2.05 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 1.26 0.94 0.97 0.00 0.00 25 T 8.13 5.08 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 1.22 0.00 0.00 26 L 8.42 4.31 0.00 1.66 1.64 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.23 0.00 2.18 2.19 0.00 3.80 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 1.98 1.99 0.00 28 D 8.12 4.37 0.00 2.92 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 29 N 8.71 5.09 0.00 2.90 2.99 0.00 0.00 6.02 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 30 E 8.45 5.40 0.00 1.80 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 2.16 2.07 0.00 31 V 7.99 4.47 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 0.68 0.00 0.00 0.90 0.00 0.00 32 E 8.70 4.97 0.00 2.08 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 2.02 2.14 0.00 33 L 8.61 4.80 0.00 0.80 1.38 0.48 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.76 4.97 0.00 1.89 1.62 0.00 1.54 0.00 0.00 1.73 0.00 0.00 2.76 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.54 1.05 7.81 35 A 8.16 5.13 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 0.00 0.00 36 F 9.37 4.75 0.00 3.14 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 37 V 8.75 4.85 2.21 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 0.50 0.00 0.00 0.94 0.00 0.00 38 A 8.47 5.13 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 39 P 0.00 4.72 0.00 2.26 2.12 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 40 A 8.32 4.47 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 41 P 0.00 4.32 0.00 1.94 0.77 0.00 3.87 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.82 0.00 42 P 0.00 4.53 0.00 2.15 2.11 0.00 3.70 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 2.07 1.89 0.00 43 V 8.25 3.84 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.92 0.00 0.00 44 E 7.35 4.29 0.00 1.92 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 2.20 2.27 0.00 45 T 7.62 3.85 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 1.08 0.00 0.00 46 T 8.01 4.29 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 1.21 0.00 0.00 47 Y 7.75 4.43 0.00 2.67 2.52 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 48 N 8.23 4.58 0.00 2.71 2.54 0.00 0.00 6.78 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 49 Y 8.36 4.69 0.00 3.13 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 50 E 8.32 4.69 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 2.17 2.27 0.00 51 W 9.37 5.00 0.00 3.29 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 52 N 8.72 5.25 0.00 2.70 2.73 0.00 0.00 6.77 6.66 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 53 L 8.76 5.16 0.00 1.90 1.77 0.98 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 54 I 8.30 4.33 1.95 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 1.38 1.27 0.99 0.00 0.00 55 S 7.78 4.69 0.00 3.86 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 56 H 8.17 5.12 0.00 3.46 3.43 0.00 5.72 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.49 0.00 2.25 2.14 0.00 3.58 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.64 0.00 58 T 8.41 4.03 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 59 D 8.21 4.50 0.00 2.81 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 60 Y 7.80 4.67 0.00 3.20 3.18 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 61 Q 8.04 3.82 0.00 1.73 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 5.49 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 62 G 7.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 E 7.97 4.51 0.00 1.85 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 2.09 2.05 0.00 64 I 7.99 4.69 1.94 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.63 0.84 0.00 0.00 65 K 8.38 4.44 0.00 1.74 1.68 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.48 7.81 66 Q 8.58 4.12 0.00 2.21 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.26 0.00 0.00 0.00 0.00 0.00 2.80 2.36 0.00 67 G 7.64 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 H 8.00 4.29 0.00 3.21 3.42 0.00 5.67 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.32 4.73 0.00 1.64 1.72 0.00 1.64 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.43 7.81 70 Q 8.33 2.83 0.00 1.12 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.55 0.00 0.00 0.00 0.00 0.00 1.77 1.16 0.00 71 T 7.65 4.94 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 1.06 0.00 0.00 72 L 8.46 4.32 0.00 0.30 0.13 0.60 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 73 N 8.46 5.26 0.00 2.44 2.55 0.00 0.00 6.82 7.72 0.00 0.00 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 8.26 4.71 0.00 1.38 1.36 0.13 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.17 4.93 0.00 3.78 3.76 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.75 3.36 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.98 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 77 L 7.49 4.22 0.00 1.76 1.42 0.83 -0.05 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 78 S 7.76 4.85 0.00 4.01 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 79 V 7.90 4.28 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 0.70 0.00 0.00 0.99 0.00 0.00 80 G 8.21 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 81 L 7.52 4.95 0.00 1.49 1.35 0.86 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 82 Y 8.61 4.75 0.00 2.54 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 0.00 0.00 0.00 0.00 83 V 8.27 4.56 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 1.19 0.00 0.00 0.89 0.00 0.00 84 F 8.66 5.42 0.00 3.40 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 85 K 9.26 4.29 0.00 1.09 1.44 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.88 0.21 7.81 86 V 7.52 3.60 0.67 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 -0.16 0.00 0.00 0.24 0.00 0.00 87 T 8.69 4.23 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 0.98 0.00 0.00 88 V 8.66 4.72 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 0.84 0.00 0.00 0.74 0.00 0.00 89 S 8.14 4.59 0.00 4.07 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 90 S 8.54 4.80 0.00 3.89 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 91 E 9.01 3.93 0.00 1.97 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 2.32 2.41 0.00 92 N 7.90 5.21 0.00 2.80 2.73 0.00 0.00 6.74 8.24 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 93 A 7.94 4.98 1.14 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 0.00 0.00 94 F 8.93 4.72 0.00 3.06 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 7.88 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 96 E 8.50 5.01 0.00 1.80 1.72 0.00 0.00 0.00 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 2.50 0.00 97 G 8.31 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 98 F 8.67 5.18 0.00 2.86 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 99 V 8.78 4.62 2.38 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 1.33 0.00 0.00 1.12 0.00 0.00 100 N 8.95 5.32 0.00 2.78 2.77 0.00 0.00 6.53 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 0.00 101 V 9.09 4.85 2.37 0.00 0.00 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 0.00 0.00 1.19 0.00 0.00 102 T 8.74 5.03 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 1.20 0.00 0.00 103 V 8.38 4.76 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.10 0.00 0.00 104 K 9.27 4.71 0.00 1.74 1.71 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.55 1.54 7.81 105 P 0.00 4.67 0.00 2.08 2.06 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 106 A 8.68 3.97 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 0.00 107 R 8.12 4.27 0.00 1.92 1.97 0.00 3.06 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 1.52 1.59 0.00 108 S 8.19 3.91 0.00 3.85 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 0.00 109 G 8.64 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.59 0.00 2.19 2.11 0.00 3.71 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 1.99 1.98 0.00 111 S 8.26 4.44 0.00 3.83 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 0.00 112 S 7.73 4.25 0.00 3.83 3.79 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 0.00 113 G 8.67 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