NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4126 8.3349 115.5402 58.3932 64.8773 172.1723 2 L 4.6441 8.1407 119.2853 51.3132 44.1290 175.4697 3 S 4.5829 9.2149 118.0971 57.7725 64.7564 174.9370 4 A 4.0063 8.6360 121.7774 55.0281 18.0038 179.8086 5 A 3.8707 7.8419 118.7826 55.4335 18.5948 179.4222 6 E 3.7852 8.1675 116.7451 59.6131 29.5646 179.5553 7 A 3.7912 8.3896 120.9390 55.1771 18.2921 179.4593 8 D 4.2777 8.2186 117.7076 57.4173 40.8927 178.9793 9 L 3.9617 7.8977 119.3438 57.7900 41.5172 179.4745 10 A 3.8405 8.0058 120.8662 54.7318 18.1108 180.0362 11 G 3.5911 8.0511 104.4743 47.7923 0.0000 176.0860 12 K 4.0551 8.0886 120.4287 59.4117 32.2450 179.4075 13 S 4.4297 8.2198 112.7553 60.8676 63.2995 175.8507 14 W 4.6828 8.4424 132.1064 59.9271 30.4865 177.5039 15 A 4.0117 8.2984 121.0830 55.1577 17.5476 177.7741 16 P 4.1656 0.0000 0.0000 65.6157 31.2852 178.8181 17 V 3.7365 7.5041 116.3849 66.0679 31.3925 177.8325 18 F 3.9087 7.6109 118.6752 60.4852 39.0910 176.1683 19 A 4.1135 7.5275 120.1788 54.0612 19.6508 177.5696 20 N 4.8455 7.4231 112.5904 50.9989 38.7682 174.8044 21 K 3.8646 7.8210 123.6596 59.7912 32.7907 177.0818 22 N 4.2005 8.0605 115.6739 56.4495 38.5283 177.0447 23 A 3.9672 7.7938 121.2315 55.4111 18.6070 179.3118 24 N 4.5791 8.4484 115.1823 56.2211 38.5083 177.9822 25 G 2.2789 8.0058 107.6800 47.1474 0.0000 175.8580 26 L 3.9052 7.5603 120.8066 57.6678 41.5620 179.3091 27 D 4.3669 7.9122 118.4866 57.1127 40.7524 178.6777 28 F 3.2779 8.0751 121.2269 60.8766 39.4595 176.8945 29 L 3.1761 7.3035 120.0568 57.8553 41.7719 179.1420 30 V 3.3474 7.4621 117.7975 65.8949 31.4895 177.8832 31 A 4.0922 7.9779 120.7869 54.7968 18.1126 179.4764 32 L 3.7838 7.1495 118.8272 58.4659 42.0566 179.3117 33 F 4.7955 7.5521 117.3911 60.4593 38.4989 177.7346 34 E 3.9462 7.9750 117.7315 59.5299 29.4818 179.2188 35 K 3.8921 7.8506 116.9346 57.9075 33.5556 177.6393 36 F 4.8934 8.5557 117.3508 53.6342 39.6606 173.0152 37 P 4.5788 0.0000 0.0000 65.0008 31.6960 177.3811 38 D 4.4464 8.4039 117.4136 56.7086 38.8076 178.6891 39 S 4.7904 8.6686 114.7433 60.7889 62.9421 175.9743 40 A 3.8903 8.0985 124.5495 54.4226 17.8116 179.0738 41 N 4.2716 7.8170 114.4774 56.3233 38.6344 176.2862 42 F 4.3349 7.7832 115.5650 58.6421 39.5177 174.9689 43 F 4.7524 8.1546 120.7127 55.1531 41.1216 175.4393 44 A 3.9455 8.8836 129.3124 55.6039 18.2198 178.3969 45 D 4.4016 7.7319 113.0206 56.5529 41.4150 177.0602 46 F 4.9197 7.7640 116.9777 58.3654 39.7191 175.6358 47 K 4.2016 7.7529 120.6308 57.6065 33.1682 175.3156 48 G 4.2069 8.9988 111.3655 46.0062 0.0000 174.4508 49 K 4.3122 7.1819 116.3636 55.9842 32.7970 177.2379 50 S 4.6302 8.3443 115.9812 57.1629 66.0168 175.4634 51 V 3.4818 8.2640 121.8696 66.3865 31.0194 178.2198 52 A 4.0890 7.8823 119.8683 55.1801 18.0366 179.2116 53 D 4.3096 7.6663 116.3719 57.2698 41.1266 178.8334 54 I 3.5367 7.8729 120.7569 64.3436 36.9019 178.4463 55 K 3.8519 8.1643 117.9167 59.4053 31.9705 178.4937 56 A 4.2386 7.4208 118.6424 52.1570 19.1587 177.6199 57 S 4.2677 7.9528 114.5993 57.3709 62.9420 173.0563 58 P 4.5356 0.0000 0.0000 64.3015 31.6763 177.0085 59 K 4.2970 8.2615 118.7893 57.7276 33.1022 178.3594 60 L 4.0626 7.9876 121.3634 58.4823 41.8143 178.8653 61 R 3.8974 8.0397 117.6505 59.6720 29.6887 177.9961 62 D 4.4080 8.0970 118.0974 57.2699 40.9372 178.8496 63 V 3.7368 7.7827 118.5122 66.1716 31.6978 178.3433 64 S 4.4051 8.7435 114.3127 60.8683 62.8478 176.5749 65 S 4.1858 8.1582 118.5421 61.6648 62.9061 176.6338 66 R 4.1383 7.8924 121.7327 58.8128 29.7758 179.1358 67 I 4.0062 7.7059 118.2068 64.7597 37.2613 178.5878 68 F 4.7914 8.5959 118.5850 61.0726 38.5775 177.9689 69 T 4.2956 8.8978 116.1209 66.6245 68.1433 176.7401 70 R 3.9916 8.3181 120.7150 59.1334 30.0906 178.2291 71 L 3.8805 8.1271 120.3189 57.8617 41.8787 178.4727 72 N 3.8972 8.0815 117.0700 56.7025 38.7536 176.7736 73 E 3.8394 7.8164 119.8734 59.3454 29.3289 179.4258 74 F 3.9837 8.1888 118.2941 60.2676 38.6547 177.9196 75 V 3.2521 7.5369 117.4653 65.8403 31.3137 177.5085 76 N 4.4076 8.0489 115.4750 55.7924 38.7421 176.2130 77 N 4.6699 7.6929 114.9247 52.5801 39.1266 176.4320 78 A 3.7695 7.4680 125.3287 55.0892 18.4943 178.9587 79 A 5.2809 7.6579 115.1551 51.3252 19.2317 176.8631 80 N 4.7283 7.9394 118.6820 51.5562 39.4204 174.2498 81 A 4.0695 8.5929 126.9795 55.0916 18.2045 179.0205 82 G 3.5203 8.1194 103.4463 47.9881 0.0000 175.7103 83 K 3.8844 8.0091 121.5579 59.0734 32.0537 179.3204 84 M 4.0104 8.0912 118.6903 58.6354 31.9033 178.4626 85 S 4.2509 8.3279 115.1313 62.0926 63.1246 176.9067 86 A 3.9809 7.8341 122.6887 55.5608 18.2213 179.5777 87 M 3.9184 8.2998 117.5979 58.4695 31.8801 179.0327 88 L 4.2010 8.8029 120.0656 57.8850 41.7217 179.7735 89 S 4.1290 8.1482 115.0396 61.7769 62.8480 176.6158 90 Q 3.9644 8.0616 122.0829 58.9634 28.7831 177.9725 91 F 4.1219 8.6155 121.5769 61.2458 39.4750 176.9721 92 A 3.9434 8.5497 120.7501 55.1306 18.2318 179.4653 93 K 3.7805 8.2346 117.1840 59.8171 31.9237 179.3503 94 E 3.9242 7.8760 117.1574 59.7990 29.7605 178.8734 95 H 4.3326 8.0361 116.1898 58.8700 28.7005 178.0220 96 V 3.9856 7.6070 121.7783 65.3862 31.0502 178.2613 97 G 3.3683 7.4091 103.2438 47.1233 0.0000 174.7158 98 F 4.7845 7.8661 117.4809 57.4200 39.4511 176.7381 99 G 4.1057 8.2169 107.3533 45.0094 0.0000 173.6067 100 V 3.5210 7.5991 119.8937 61.6850 32.7567 175.2506 101 G 4.3590 8.0301 113.9418 43.1627 0.0000 172.5597 102 S 4.3090 8.7823 112.7175 61.6807 62.2848 176.2799 103 A 4.1589 8.0618 123.8453 55.2260 18.2479 179.4355 104 Q 3.7903 7.9900 116.1687 58.9180 28.6503 178.6398 105 F 3.8884 8.0016 117.9031 59.6663 39.1496 177.6132 106 E 3.9858 8.2866 118.9507 59.1782 29.0324 179.0203 107 N 3.5533 7.4894 116.6238 55.9426 38.4897 177.3566 108 V 3.4198 7.0406 119.0846 65.9810 31.2564 177.7196 109 R 3.4518 7.5911 117.0890 59.5724 29.9406 177.9191 110 S 4.3350 7.6765 113.2418 61.9288 63.4220 176.0233 111 M 4.4344 7.8723 118.3756 56.0534 32.2859 177.3883 112 F 4.1075 8.2282 121.1132 61.6732 39.6161 174.8074 113 P 4.3918 0.0000 0.0000 65.8698 31.2317 178.8543 114 G 3.6537 8.1212 103.8150 47.4611 0.0000 175.4902 115 F 4.0256 7.7284 121.7153 61.1159 39.7084 176.9919 116 V 3.3393 7.5240 117.6046 65.9879 29.7154 177.8340 117 A 4.0852 7.9673 120.4806 54.9724 17.9574 179.3537 118 S 3.8656 7.4946 110.8934 60.2840 63.0721 175.8638 119 V 3.8563 7.1493 121.2397 63.3170 32.4619 175.6568 120 A 4.2386 6.6457 114.3048 50.8009 22.4583 175.7989 121 A 4.0311 8.7603 126.0265 51.7744 18.8824 175.9585 122 P 4.6531 0.0000 0.0000 61.2418 32.6960 174.4442 123 P 4.4231 0.0000 0.0000 62.0263 32.0730 175.6976 124 A 4.1747 8.3954 122.8267 54.2383 18.6985 178.1821 125 G 4.0209 9.0230 109.6807 45.8602 0.0000 175.6345 126 A 4.0257 8.3841 122.1712 55.1656 18.3903 179.2483 127 D 4.6151 8.3462 116.8949 57.7805 40.9661 178.8257 128 A 4.1002 8.1162 120.4640 54.8451 18.3541 179.3058 129 A 3.8006 7.7631 119.6387 55.1528 18.4123 179.9721 130 W 4.0012 8.0679 117.6312 60.0385 29.1356 178.9069 131 T 4.1836 8.1773 109.6646 64.6791 68.1221 176.4748 132 K 3.8701 8.2259 122.4563 59.1906 31.8498 178.5387 133 L 3.6570 7.9922 120.9417 58.1714 41.8736 179.0120 134 F 4.2180 8.6265 118.2088 59.9465 38.6881 177.8540 135 G 3.6784 8.3680 106.1219 48.0629 0.0000 175.6240 136 L 3.8935 7.8637 121.8743 57.3346 41.5313 179.9297 137 I 3.5215 7.0856 118.5098 64.0361 37.0776 178.3667 138 I 3.6999 8.0685 121.0251 64.6094 37.1211 178.1253 139 D 4.3652 8.3398 119.6644 57.4950 40.6362 178.9124 140 A 4.0549 7.8050 120.9902 54.9084 18.2205 179.7779 141 L 3.9598 7.6665 117.4079 57.9468 41.2297 179.7807 142 K 3.9817 8.2642 118.1390 59.1445 31.6789 179.1685 143 A 4.1607 7.6757 119.9948 54.4417 18.5817 178.6223 144 A 4.2677 7.6109 116.5862 52.6548 18.5472 178.2378 145 G 3.9733 8.3288 105.2414 45.2730 0.0000 174.1478 146 A 4.2448 8.0803 127.5895 52.3443 19.3547 175.8108 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 S 8.33 4.41 0.00 4.08 3.96 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 2 L 8.14 4.64 0.00 1.66 1.46 0.71 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.21 4.58 0.00 3.86 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 4 A 8.64 4.01 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 5 A 7.84 3.87 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 6 E 8.17 3.79 0.00 2.15 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 2.26 2.27 0.00 7 A 8.39 3.79 1.25 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 0.00 0.00 0.00 8 D 8.22 4.28 0.00 2.87 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 9 L 7.90 3.96 0.00 1.86 1.68 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.01 3.84 0.45 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 11 G 8.05 3.59 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 0.00 12 K 8.09 4.06 0.00 2.02 1.96 0.00 1.73 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.50 7.81 13 S 8.22 4.43 0.00 4.30 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 14 W 8.44 4.68 0.00 3.86 3.47 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 15 A 8.30 4.01 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 16 P 0.00 4.17 0.00 1.99 2.11 0.00 3.80 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 2.05 2.16 0.00 17 V 7.50 3.74 1.71 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 1.06 0.00 0.00 0.89 0.00 0.00 18 F 7.61 3.91 0.00 1.57 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 19 A 7.53 4.11 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 20 N 7.42 4.85 0.00 2.92 2.68 0.00 0.00 6.64 7.62 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 21 K 7.82 3.86 0.00 1.27 1.50 0.00 1.36 0.00 0.00 1.76 0.00 0.00 3.32 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.47 1.64 7.81 22 N 8.06 4.20 0.00 2.75 2.80 0.00 0.00 6.91 7.96 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 23 A 7.79 3.97 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 24 N 8.45 4.58 0.00 3.17 3.23 0.00 0.00 6.92 7.13 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 25 G 8.01 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 7.56 3.91 0.00 1.83 1.64 0.89 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 27 D 7.91 4.37 0.00 3.10 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 F 8.08 3.28 0.00 2.13 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 29 L 7.30 3.18 0.00 1.55 1.31 0.39 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.46 3.35 1.95 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 0.89 0.00 0.00 0.83 0.00 0.00 31 A 7.98 4.09 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 32 L 7.15 3.78 0.00 1.00 1.12 0.84 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.55 4.80 0.00 3.13 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 E 7.97 3.95 0.00 2.04 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 2.32 2.62 0.00 35 K 7.85 3.89 0.00 1.62 0.74 0.00 1.47 0.00 0.00 1.95 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.23 1.30 7.81 36 F 8.56 4.89 0.00 3.01 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 37 P 0.00 4.58 0.00 2.15 2.12 0.00 3.91 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 38 D 8.40 4.45 0.00 2.90 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 39 S 8.67 4.79 0.00 4.47 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 0.00 40 A 8.10 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 N 7.82 4.27 0.00 2.71 2.58 0.00 0.00 7.01 6.82 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 42 F 7.78 4.33 0.00 2.78 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 43 F 8.15 4.75 0.00 3.19 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 44 A 8.88 3.95 1.25 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 0.00 0.00 0.00 45 D 7.73 4.40 0.00 2.45 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 0.00 0.00 0.00 0.00 46 F 7.76 4.92 0.00 3.00 2.67 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 47 K 7.75 4.20 0.00 1.88 1.80 0.00 1.54 0.00 0.00 1.92 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.75 1.49 7.81 48 G 9.00 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 0.00 0.00 0.00 0.00 49 K 7.18 4.31 0.00 1.98 1.75 0.00 2.01 0.00 0.00 1.82 0.00 0.00 3.28 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.62 7.81 50 S 8.34 4.63 0.00 4.04 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 51 V 8.26 3.48 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 0.92 0.00 0.00 0.91 0.00 0.00 52 A 7.88 4.09 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 53 D 7.67 4.31 0.00 2.99 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 54 I 7.87 3.54 1.75 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.44 0.31 0.00 0.00 55 K 8.16 3.85 0.00 1.76 1.84 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.63 7.81 56 A 7.42 4.24 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 57 S 7.95 4.27 0.00 4.01 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 58 P 0.00 4.54 0.00 2.25 2.18 0.00 3.87 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 2.02 2.01 0.00 59 K 8.26 4.30 0.00 2.02 1.91 0.00 1.55 0.00 0.00 1.49 0.00 0.00 2.82 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.41 7.81 60 L 7.99 4.06 0.00 1.69 1.69 0.73 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 61 R 8.04 3.90 0.00 1.96 1.94 0.00 3.28 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.81 0.00 62 D 8.10 4.41 0.00 2.95 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 63 V 7.78 3.74 2.39 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 1.17 0.00 0.00 1.09 0.00 0.00 64 S 8.74 4.41 0.00 4.11 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.16 4.19 0.00 4.19 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 0.00 66 R 7.89 4.14 0.00 2.02 2.18 0.00 3.22 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.88 0.00 67 I 7.71 4.01 2.37 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.16 1.33 0.00 0.00 68 F 8.60 4.79 0.00 3.24 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 69 T 8.90 4.30 4.45 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 1.36 0.00 0.00 70 R 8.32 3.99 0.00 2.14 2.17 0.00 3.08 0.00 0.00 2.96 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.86 0.00 71 L 8.13 3.88 0.00 1.92 1.01 0.37 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.08 3.90 0.00 2.51 2.88 0.00 0.00 7.17 7.67 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 73 E 7.82 3.84 0.00 1.95 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 0.00 2.50 2.44 0.00 74 F 8.19 3.98 0.00 2.91 2.67 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 75 V 7.54 3.25 1.86 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 0.62 0.00 0.00 0.25 0.00 0.00 76 N 8.05 4.41 0.00 2.78 2.79 0.00 0.00 7.00 8.69 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 77 N 7.69 4.67 0.00 2.53 2.72 0.00 0.00 6.88 8.29 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 78 A 7.47 3.77 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 79 A 7.66 5.28 1.25 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 0.00 0.00 0.00 80 N 7.94 4.73 0.00 2.64 2.75 0.00 0.00 7.07 7.75 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 81 A 8.59 4.07 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 82 G 8.12 3.52 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 K 8.01 3.88 0.00 1.84 1.79 0.00 1.62 0.00 0.00 1.79 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.44 7.81 84 M 8.09 4.01 0.00 2.02 2.23 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 2.56 2.94 0.00 85 S 8.33 4.25 0.00 4.12 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 86 A 7.83 3.98 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 87 M 8.30 3.92 0.00 1.40 2.10 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.22 0.00 88 L 8.80 4.20 0.00 1.89 1.75 0.91 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.15 4.13 0.00 4.03 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 90 Q 8.06 3.96 0.00 2.22 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 91 F 8.62 4.12 0.00 3.57 3.40 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 92 A 8.55 3.94 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 93 K 8.23 3.78 0.00 1.79 1.85 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.74 7.81 94 E 7.88 3.92 0.00 2.06 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 2.57 0.00 95 H 8.04 4.33 0.00 3.09 3.41 0.00 5.82 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 96 V 7.61 3.99 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 1.34 0.00 0.00 0.94 0.00 0.00 97 G 7.41 3.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 F 7.87 4.78 0.00 3.07 2.91 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 99 G 8.22 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 7.60 3.52 1.71 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 0.79 0.00 0.00 0.62 0.00 0.00 101 G 8.03 4.36 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 0.00 102 S 8.78 4.31 0.00 4.12 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 0.00 103 A 8.06 4.16 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 0.00 104 Q 7.99 3.79 0.00 2.14 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 1.68 2.36 0.00 105 F 8.00 3.89 0.00 3.19 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 0.00 106 E 8.29 3.99 0.00 2.24 1.95 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 2.34 2.37 0.00 107 N 7.49 3.55 0.00 2.28 1.42 0.00 0.00 6.60 7.78 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 0.00 108 V 7.04 3.42 1.86 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 0.71 0.00 0.00 0.68 0.00 0.00 109 R 7.59 3.45 0.00 1.83 2.06 0.00 3.56 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.82 0.00 110 S 7.68 4.34 0.00 4.07 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 0.00 111 M 7.87 4.43 0.00 2.31 2.27 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.83 0.00 112 F 8.23 4.11 0.00 3.10 3.06 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 0.00 113 P 0.00 4.39 0.00 2.29 2.42 0.00 3.75 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 114 G 8.12 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 F 7.73 4.03 0.00 3.13 3.10 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 0.00 116 V 7.52 3.34 1.85 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 1.08 0.00 0.00 0.38 0.00 0.00 117 A 7.97 4.09 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 118 S 7.49 3.87 0.00 3.93 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 0.00 119 V 7.15 3.86 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.61 0.00 0.00 120 A 6.65 4.24 1.17 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 0.00 0.00 0.00 121 A 8.76 4.03 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 0.00 122 P 0.00 4.65 0.00 2.32 2.19 0.00 3.80 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 2.06 2.01 0.00 123 P 0.00 4.42 0.00 2.28 2.25 0.00 3.83 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.02 0.00 124 A 8.40 4.17 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 0.00 125 G 9.02 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 0.00 126 A 8.38 4.03 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 D 8.35 4.62 0.00 2.85 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 0.00 128 A 8.12 4.10 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 0.00 129 A 7.76 3.80 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 W 8.07 4.00 0.00 3.87 3.59 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 0.00 131 T 8.18 4.18 4.36 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 1.44 0.00 0.00 132 K 8.23 3.87 0.00 2.00 1.86 0.00 1.62 0.00 0.00 1.47 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.40 7.81 133 L 7.99 3.66 0.00 1.38 1.30 0.53 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 134 F 8.63 4.22 0.00 3.30 3.05 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 0.00 135 G 8.37 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 0.00 136 L 7.86 3.89 0.00 1.67 1.61 0.82 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 137 I 7.09 3.52 1.84 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.34 0.28 0.00 0.00 138 I 8.07 3.70 2.05 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.18 0.99 0.00 0.00 139 D 8.34 4.37 0.00 2.64 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 7.81 4.05 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 0.00 141 L 7.67 3.96 0.00 1.85 1.75 0.76 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 142 K 8.26 3.98 0.00 1.97 1.87 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.62 7.81 143 A 7.68 4.16 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 0.00 144 A 7.61 4.27 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 145 G 8.33 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 0.00 0.00 0.00 146 A 8.08 4.24 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