NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.2440 8.1749 117.3707 63.3562 69.7456 172.8215 4 I 4.1329 8.1357 127.3688 58.2111 38.7195 173.5427 5 N 4.4498 8.9818 126.2781 52.3941 40.2761 172.8633 6 P 4.4734 0.0000 0.0000 62.9415 32.2824 175.4247 7 T 4.3676 7.9059 115.8167 61.8743 70.7868 175.5885 8 N 4.5859 8.1263 124.4086 52.5564 37.1661 174.9027 9 Y 4.1898 7.9110 123.2823 60.6161 37.7838 177.8368 10 T 3.9181 7.9100 116.4014 66.8088 68.6880 176.4507 11 L 3.8658 7.8615 120.2641 57.4063 41.6955 178.9907 12 L 4.0017 8.0020 120.5191 58.0485 41.9755 179.1950 13 K 4.0435 8.3429 118.5477 59.4242 31.7660 179.4654 14 K 4.0266 7.4339 117.4365 59.5316 32.2619 179.1650 15 Q 4.1238 8.2521 118.1325 58.7884 28.7255 178.4941 16 A 3.9897 8.4297 121.9962 55.3108 18.3894 179.3801 17 A 4.0276 8.0773 119.0387 55.4083 18.1806 180.1520 18 S 4.1148 8.0798 113.7586 61.7227 62.8863 176.5076 19 L 4.3975 7.2190 115.6961 55.7611 41.3699 177.4497 20 I 4.3012 7.8428 120.5935 62.5422 39.6223 175.8453 21 E 4.2155 8.0957 119.5382 57.0884 29.7320 176.2978 22 D 4.5141 8.7631 123.0110 54.7850 38.6765 173.1021 23 E 4.7056 7.7310 118.2366 55.0659 31.2498 175.5936 24 H 4.6649 8.6462 117.3133 55.1766 30.8403 173.8905 25 H 4.5935 7.9140 118.2780 54.4196 29.1017 174.9448 26 M 3.9224 8.5508 126.4218 58.8540 31.9981 177.9362 27 I 3.6203 7.7618 118.9571 64.3220 37.2308 178.1034 28 A 3.9430 7.9048 121.0416 55.1171 18.2132 179.5462 29 I 3.5841 7.7091 118.2763 64.6261 37.1961 178.7652 30 L 3.5060 8.0797 120.1295 57.4553 41.1997 179.7998 31 S 4.0899 8.2912 115.4910 61.8399 62.7657 176.5639 32 N 4.3771 8.3232 119.2124 56.5342 38.1839 177.4978 33 M 4.1472 8.4054 120.6890 58.2699 32.0535 178.8832 34 S 4.1317 8.5468 114.4453 61.3323 63.0918 176.5607 35 A 3.9088 7.8412 124.1190 54.6658 17.9325 179.2283 36 L 3.8851 7.9005 117.8513 58.4391 42.4751 178.9256 37 L 4.1512 8.0960 118.8735 57.8591 41.3378 179.0251 38 N 4.3211 8.0068 115.9137 56.6954 38.9794 176.0931 39 D 4.5920 8.1291 118.1344 55.5471 41.1686 176.4545 40 N 4.9084 7.8871 114.6180 52.3509 40.2424 173.8609 41 L 4.6021 7.7638 118.7235 52.7998 43.7762 175.6638 42 D 4.6137 8.5142 122.8303 53.8592 42.7284 175.0231 43 Q 3.4946 8.5512 118.8465 57.1371 26.1209 173.5348 44 I 4.8699 7.5323 108.1948 59.2014 40.9765 174.6427 45 N 5.0994 8.8977 117.1431 52.3103 38.7629 174.0777 46 W 5.1483 8.0059 128.5126 56.6607 34.6332 173.3369 47 V 4.8621 7.7606 126.5722 60.9483 34.4911 174.2106 48 G 3.5980 8.0552 111.0124 46.0909 0.0000 171.7155 49 F 5.7274 8.6038 117.5046 55.9681 43.4130 173.9963 50 Y 5.1181 8.9794 117.8901 56.2760 41.7556 174.5479 51 L 5.1667 9.2229 122.9247 52.8253 45.0292 175.7858 52 L 4.8066 8.6037 123.9972 54.5106 41.7784 176.6643 53 E 4.5479 9.0090 123.9671 55.7568 33.1886 176.0037 54 Q 3.1585 9.5456 122.9823 57.3217 26.2704 173.1248 55 N 4.3049 8.6401 108.2974 53.6787 36.3045 174.0295 56 E 4.7819 7.6536 112.5451 55.3759 33.7873 173.6700 57 L 4.9037 8.8614 121.3441 54.1663 43.5565 175.9446 58 I 5.1321 8.9021 124.2947 58.9329 40.3248 174.8486 59 L 3.2242 8.8487 129.5584 55.9095 42.3371 176.5098 60 G 4.5580 8.2742 114.3206 44.0980 0.0000 170.5005 61 P 4.6080 0.0000 0.0000 63.3783 32.4425 175.5876 62 F 4.8386 7.6775 116.1115 56.2553 40.7491 172.8904 63 Q 4.2053 9.9868 118.9322 53.4164 31.0383 176.4677 64 G 3.9142 8.1134 111.9279 45.5396 0.0000 171.6835 65 H 4.9563 8.5120 118.1899 54.1350 29.9680 173.3059 66 P 4.5808 0.0000 0.0000 63.3769 31.5883 175.5052 67 A 4.6911 8.0577 122.4637 49.9257 22.4221 176.4470 68 C 4.4761 8.3941 116.8649 57.3581 41.4937 174.6994 69 V 3.8239 8.6153 123.9405 65.5748 32.4213 175.2013 70 H 5.4712 8.2426 116.1152 54.0880 30.9421 174.4820 71 I 4.5187 8.5510 122.8469 58.8264 40.8489 173.2919 72 P 4.6793 0.0000 0.0000 62.0077 32.6679 176.3062 73 I 3.8352 8.2048 124.1631 62.9315 37.4512 176.8486 74 G 4.0069 9.0661 113.5285 45.1394 0.0000 173.3393 75 K 4.4768 7.6912 118.9658 55.3047 35.5033 176.9820 76 G 4.1651 8.6172 110.0274 45.1843 0.0000 175.0343 77 V 3.0663 8.3107 117.1958 65.9804 31.1768 177.7740 78 C 4.1096 7.7538 116.0664 62.7575 27.9777 176.2208 79 G 4.0721 7.7405 108.1090 47.5723 0.0000 175.7610 80 T 4.1930 8.3992 119.0982 65.7047 68.3061 176.7499 81 A 3.9951 7.7808 122.5525 54.9833 18.4741 179.9434 82 V 3.4772 7.5363 117.0396 66.2298 31.5759 178.5591 83 S 4.1670 8.0283 112.9046 61.0818 63.0777 175.4220 84 E 4.2170 8.3919 118.6875 56.2026 29.6055 176.4211 85 R 3.9843 7.6281 116.7170 56.2402 28.3185 175.9927 86 R 4.7510 7.6645 110.7026 54.8411 32.4835 174.6137 87 T 4.2192 8.5088 116.1090 64.5062 69.3868 173.4030 88 Q 4.5976 9.0720 124.6526 54.1703 31.4041 174.7389 89 V 4.4453 8.5697 124.7034 61.2922 33.2526 174.7875 90 V 4.3550 8.8654 129.7661 61.2440 32.6140 176.2540 91 A 4.0953 8.8345 130.8441 54.5069 20.0051 175.8790 92 D 4.9492 8.0331 114.6008 52.4743 42.4278 175.2230 93 V 3.6075 8.9263 127.8730 66.0755 31.6802 177.9522 94 H 3.9464 7.9990 117.7646 58.4114 29.7052 175.5362 95 Q 4.4801 7.9597 116.1067 55.3467 29.2428 174.9545 96 F 4.2443 8.3895 123.1523 56.9337 39.6922 174.2580 97 K 3.6994 7.8851 129.5210 60.4523 31.7158 176.0892 98 G 4.1217 8.8893 114.5404 45.2662 0.0000 172.3388 99 H 4.7520 8.2090 115.8064 55.4486 29.1275 174.3997 100 I 4.5957 8.6937 113.9588 58.4042 40.7594 176.0977 101 A 3.9702 8.5651 122.2696 55.6324 18.0834 180.4981 102 C 4.3425 8.0888 111.5377 59.4191 41.7507 174.0458 103 D 4.3507 8.1986 118.7156 53.7747 40.9902 177.8166 104 A 3.8960 7.7590 123.5997 55.4635 18.2037 178.4531 105 N 4.5153 7.9802 110.0430 54.0254 39.3544 174.1028 106 S 4.6425 7.8805 112.8527 57.6755 63.5348 173.5069 107 K 4.4551 9.0515 128.0393 58.3479 33.4860 176.9130 108 S 5.1000 7.7423 112.2323 57.1508 67.0456 172.5468 109 E 5.3298 9.0200 119.8322 55.6574 33.7094 173.6415 110 I 4.9216 8.0664 123.3428 59.1153 41.6902 173.9967 111 V 4.7633 8.6536 128.3639 61.0688 34.6714 173.9705 112 V 4.7070 8.6656 128.5458 60.1927 33.6078 173.0460 113 P 4.7939 0.0000 0.0000 62.9566 32.3911 175.5110 114 I 4.7416 8.7386 123.3785 59.8377 39.3435 174.7929 115 F 5.3146 9.7847 125.9933 55.9578 41.9940 176.1814 116 K 4.1827 9.3123 123.1948 56.2931 33.8547 175.5612 117 D 4.4680 9.3470 128.5664 55.7106 39.0787 173.6625 118 D 4.5994 8.3919 114.0842 54.5883 39.2489 173.8595 119 K 4.6068 7.7043 120.7217 54.2977 34.1966 175.1465 120 I 3.8790 8.2030 127.1166 60.9490 37.4310 175.7703 121 I 4.2324 8.9075 118.8796 59.8033 38.7333 175.7965 122 G 4.2143 6.7947 107.7816 46.4842 0.0000 171.3148 123 V 4.9882 7.9583 110.9391 59.8951 36.7727 173.9567 124 L 4.7506 8.9474 125.4435 53.5600 44.0048 174.5783 125 D 5.3103 9.1325 126.1108 52.5054 44.5067 174.3060 126 I 5.1439 8.6459 125.9433 59.7956 40.6363 174.2267 127 D 5.6915 9.6982 126.9015 52.5930 44.0172 175.2710 128 A 5.2058 8.8423 122.1740 49.6226 22.4400 175.2788 129 P 4.5104 0.0000 0.0000 63.3574 32.0776 175.8830 130 I 4.6423 7.1918 111.6677 58.9909 40.5769 174.9375 131 T 4.2679 8.2576 111.2668 61.5611 69.7877 173.3525 132 D 4.4100 8.7188 119.3199 55.4211 39.0779 175.7179 133 R 3.7951 7.8748 119.7142 58.1703 30.4887 176.2129 134 F 5.1952 7.8018 115.2044 55.5610 41.1922 174.1171 135 D 5.1495 8.8636 122.9604 50.8920 42.5168 176.0495 136 D 4.3715 8.7071 117.4900 57.6473 40.4988 178.5700 137 N 4.2509 8.2245 117.0648 56.7553 39.0566 176.5061 138 D 4.2093 8.7240 120.5267 57.1059 40.8831 178.5347 139 K 3.8022 8.1780 120.1499 59.5113 32.2591 178.2674 140 E 3.8196 8.1699 119.3774 59.7748 29.5791 178.5958 141 H 4.1063 7.7329 116.0961 58.7395 28.5934 177.9035 142 L 4.0630 8.1171 121.2920 57.7279 41.4257 179.3849 143 E 3.9921 8.4590 118.6323 59.1971 29.3687 179.2221 144 A 4.0358 7.8648 120.8561 55.1691 18.5213 179.7870 145 I 3.7530 7.8183 118.4619 64.5005 37.1114 178.8365 146 V 3.7215 8.0973 119.2683 65.8023 31.2990 177.9946 147 K 4.1776 8.1284 119.5738 59.5240 31.8139 178.8920 148 I 3.7508 7.6144 119.7563 64.3008 36.9830 178.5062 149 I 3.7410 7.6832 120.4554 64.3663 36.8743 178.1969 150 E 3.9935 8.5669 119.8209 59.5863 29.1173 179.6347 151 K 3.9415 8.0012 117.1447 59.5125 31.9822 178.8618 152 Q 4.0819 7.8812 119.8648 58.9507 28.7847 177.8949 153 L 4.0693 7.8657 118.7862 56.7710 41.8375 177.3413 154 A 4.3106 8.0812 125.1432 52.6448 18.5046 176.9268 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 3 T 8.17 4.24 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 1.20 0.00 0.00 4 I 8.14 4.13 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.66 0.84 0.00 0.00 5 N 8.98 4.45 0.00 2.62 2.77 0.00 0.00 7.29 8.51 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 6 P 0.00 4.47 0.00 2.20 2.03 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 7 T 7.91 4.37 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 8 N 8.13 4.59 0.00 2.74 2.65 0.00 0.00 7.21 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 9 Y 7.91 4.19 0.00 2.72 2.72 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 10 T 7.91 3.92 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 11 L 7.86 3.87 0.00 1.68 1.71 0.93 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.00 4.00 0.00 1.86 1.90 0.92 0.47 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 13 K 8.34 4.04 0.00 2.03 1.89 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.88 7.81 14 K 7.43 4.03 0.00 1.74 1.88 0.00 1.62 0.00 0.00 1.90 0.00 0.00 3.13 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.54 7.81 15 Q 8.25 4.12 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 16 A 8.43 3.99 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.08 4.03 1.42 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 18 S 8.08 4.11 0.00 4.09 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 19 L 7.22 4.40 0.00 1.75 1.70 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.84 4.30 2.06 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 1.16 1.19 0.95 0.00 0.00 21 E 8.10 4.22 0.00 2.04 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 0.00 2.32 2.25 0.00 22 D 8.76 4.51 0.00 2.87 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 23 E 7.73 4.71 0.00 2.04 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 2.50 2.37 0.00 24 H 8.65 4.66 0.00 2.99 3.23 0.00 5.88 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 H 7.91 4.59 0.00 3.22 3.24 0.00 5.83 0.00 0.00 0.00 0.00 6.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 M 8.55 3.92 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 27 I 7.76 3.62 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.81 0.88 0.00 0.00 28 A 7.90 3.94 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 29 I 7.71 3.58 1.93 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.72 0.82 0.00 0.00 30 L 8.08 3.51 0.00 1.43 1.12 0.64 -0.32 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 31 S 8.29 4.09 0.00 3.93 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.32 4.38 0.00 2.83 2.86 0.00 0.00 7.12 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 33 M 8.41 4.15 0.00 2.27 2.29 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.82 0.00 34 S 8.55 4.13 0.00 4.14 4.35 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 35 A 7.84 3.91 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 36 L 7.90 3.89 0.00 1.63 1.90 0.92 1.39 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 37 L 8.10 4.15 0.00 1.73 1.73 0.95 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 38 N 8.01 4.32 0.00 2.78 2.94 0.00 0.00 7.31 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 39 D 8.13 4.59 0.00 2.82 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 40 N 7.89 4.91 0.00 2.73 2.70 0.00 0.00 6.79 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 7.76 4.60 0.00 1.71 1.63 1.07 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.51 4.61 0.00 2.57 2.65 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 43 Q 8.55 3.49 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.57 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 44 I 7.53 4.87 2.15 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.71 1.06 0.00 0.00 45 N 8.90 5.10 0.00 2.73 2.96 0.00 0.00 6.67 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 46 W 8.01 5.15 0.00 3.38 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.76 4.86 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 0.61 0.00 0.00 0.82 0.00 0.00 48 G 8.06 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 8.60 5.73 0.00 2.96 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 50 Y 8.98 5.12 0.00 3.03 2.86 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 51 L 9.22 5.17 0.00 1.70 1.57 0.93 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.60 4.81 0.00 1.65 1.63 0.95 1.16 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 53 E 9.01 4.55 0.00 1.98 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 2.23 2.43 0.00 54 Q 9.55 3.16 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 55 N 8.64 4.30 0.00 2.88 2.92 0.00 0.00 6.98 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 56 E 7.65 4.78 0.00 2.07 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 2.43 2.35 0.00 57 L 8.86 4.90 0.00 1.72 1.70 0.80 1.03 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 58 I 8.90 5.13 2.06 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 1.17 1.09 0.92 0.00 0.00 59 L 8.85 3.22 0.00 1.63 1.55 0.51 1.32 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 60 G 8.27 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.61 0.00 2.15 1.95 0.00 3.70 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.08 0.00 62 F 7.68 4.84 0.00 1.57 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 0.00 0.00 0.00 0.00 63 Q 9.99 4.21 0.00 1.73 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.92 0.00 0.00 0.00 0.00 0.00 2.10 2.40 0.00 64 G 8.11 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 65 H 8.51 4.96 0.00 3.33 3.34 0.00 5.75 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 4.58 0.00 2.13 2.14 0.00 3.75 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 2.13 2.28 0.00 67 A 8.06 4.69 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 C 8.39 4.48 0.00 2.95 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 69 V 8.62 3.82 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.97 0.00 0.00 70 H 8.24 5.47 0.00 3.04 3.38 0.00 5.89 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 8.55 4.52 1.59 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 0.96 0.40 0.71 0.00 0.00 72 P 0.00 4.68 0.00 2.05 1.95 0.00 3.56 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 73 I 8.20 3.84 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.46 0.90 0.00 0.00 74 G 9.07 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 75 K 7.69 4.48 0.00 1.89 1.64 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.32 7.81 76 G 8.62 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 0.00 0.00 0.00 0.00 77 V 8.31 3.07 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 0.63 0.00 0.00 0.35 0.00 0.00 78 C 7.75 4.11 0.00 2.63 2.65 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 79 G 7.74 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 80 T 8.40 4.19 4.63 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 1.36 0.00 0.00 81 A 7.78 4.00 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 82 V 7.54 3.48 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 1.00 0.00 0.00 0.88 0.00 0.00 83 S 8.03 4.17 0.00 4.05 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 84 E 8.39 4.22 0.00 2.05 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 0.00 2.34 2.57 0.00 85 R 7.63 3.98 0.00 2.08 2.20 0.00 3.24 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 86 R 7.66 4.75 0.00 1.87 1.91 0.00 3.11 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 87 T 8.51 4.22 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 1.22 0.00 0.00 88 Q 9.07 4.60 0.00 1.85 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 89 V 8.57 4.45 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 0.87 0.00 0.00 0.94 0.00 0.00 90 V 8.87 4.35 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 0.99 0.00 0.00 0.61 0.00 0.00 91 A 8.83 4.10 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 92 D 8.03 4.95 0.00 2.70 2.56 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 0.00 0.00 0.00 0.00 93 V 8.93 3.61 2.22 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 0.87 0.00 0.00 0.92 0.00 0.00 94 H 8.00 3.95 0.00 3.07 3.46 0.00 5.97 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Q 7.96 4.48 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.63 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 96 F 8.39 4.24 0.00 3.04 3.13 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 97 K 7.89 3.70 0.00 1.51 1.33 0.00 1.59 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.26 1.31 7.81 98 G 8.89 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 0.00 0.00 0.00 99 H 8.21 4.75 0.00 3.30 3.69 0.00 5.70 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.69 4.60 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.03 0.95 0.00 0.00 101 A 8.57 3.97 1.32 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 0.00 102 C 8.09 4.34 0.00 2.87 3.03 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 0.00 103 D 8.20 4.35 0.00 2.77 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.76 3.90 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 0.00 105 N 7.98 4.52 0.00 2.65 2.79 0.00 0.00 6.82 7.63 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 0.00 106 S 7.88 4.64 0.00 3.77 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 0.00 107 K 9.05 4.46 0.00 1.98 1.83 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.66 7.81 108 S 7.74 5.10 0.00 4.09 4.13 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 0.00 109 E 9.02 5.33 0.00 2.02 1.68 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 2.03 2.47 0.00 110 I 8.07 4.92 1.20 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.31 -0.25 0.00 0.00 111 V 8.65 4.76 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 0.97 0.00 0.00 0.85 0.00 0.00 112 V 8.67 4.71 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.89 0.00 0.00 113 P 0.00 4.79 0.00 1.82 1.97 0.00 3.85 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 2.26 2.14 0.00 114 I 8.74 4.74 1.89 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.01 0.97 0.00 0.00 115 F 9.78 5.31 0.00 2.80 2.99 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 0.00 116 K 9.31 4.18 0.00 1.79 1.66 0.00 1.70 0.00 0.00 1.60 0.00 0.00 3.19 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.35 1.45 7.81 117 D 9.35 4.47 0.00 2.86 2.72 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 0.00 118 D 8.39 4.60 0.00 2.93 2.84 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 0.00 119 K 7.70 4.61 0.00 1.83 1.87 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.37 7.81 120 I 8.20 3.88 1.68 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.09 0.30 0.70 0.00 0.00 121 I 8.91 4.23 1.86 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 1.35 0.81 0.96 0.00 0.00 122 G 6.79 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 0.00 123 V 7.96 4.99 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.03 0.00 0.00 124 L 8.95 4.75 0.00 1.82 1.53 0.41 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 125 D 9.13 5.31 0.00 2.86 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 0.00 126 I 8.65 5.14 1.53 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 1.17 0.76 1.13 0.00 0.00 127 D 9.70 5.69 0.00 2.83 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.84 5.21 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 0.00 129 P 0.00 4.51 0.00 2.20 2.19 0.00 3.88 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 130 I 7.19 4.64 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.66 0.89 0.00 0.00 131 T 8.26 4.27 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 1.22 0.00 0.00 132 D 8.72 4.41 0.00 2.71 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 R 7.87 3.80 0.00 1.48 1.39 0.00 2.94 0.00 0.00 3.02 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.50 0.00 134 F 7.80 5.20 0.00 3.11 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 0.00 135 D 8.86 5.15 0.00 2.91 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 0.00 136 D 8.71 4.37 0.00 2.72 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 0.00 137 N 8.22 4.25 0.00 2.79 3.07 0.00 0.00 7.23 8.49 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 0.00 138 D 8.72 4.21 0.00 3.07 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 0.00 139 K 8.18 3.80 0.00 1.82 2.01 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.44 7.81 140 E 8.17 3.82 0.00 1.98 1.90 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 2.13 2.26 0.00 141 H 7.73 4.11 0.00 2.13 2.57 0.00 5.87 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 L 8.12 4.06 0.00 1.66 1.69 0.96 0.94 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 0.00 143 E 8.46 3.99 0.00 2.12 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 2.34 2.56 0.00 144 A 7.86 4.04 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.82 3.75 2.09 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.36 1.00 0.00 0.00 146 V 8.10 3.72 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.08 0.00 0.00 147 K 8.13 4.18 0.00 2.00 2.01 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.49 7.81 148 I 7.61 3.75 2.08 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.76 0.93 0.00 0.00 149 I 7.68 3.74 2.09 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 1.54 0.79 0.85 0.00 0.00 150 E 8.57 3.99 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.63 0.00 151 K 8.00 3.94 0.00 1.88 1.88 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.79 1.60 7.81 152 Q 7.88 4.08 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 153 L 7.87 4.07 0.00 1.68 1.70 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 154 A 8.08 4.31 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