NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Y 4.3090 8.1444 121.6958 58.9938 39.8078 175.3415 2 Y 4.1135 9.5929 119.2271 58.0976 38.6152 169.1690 3 M 3.9446 7.5860 116.9304 55.1587 33.6568 176.9570 4 D 3.9979 7.3125 119.4067 57.3047 41.2937 178.3955 5 V 3.6542 7.3474 118.9661 64.6999 31.5143 178.1787 6 Q 3.7855 6.9832 116.5901 58.6076 28.3856 178.0664 7 E 3.8630 8.4706 120.5851 59.2359 29.7438 178.8161 8 A 3.9559 7.7908 120.2852 54.9647 18.3429 179.8397 9 K 3.9411 8.2053 117.2378 59.6776 32.1701 179.6812 10 L 3.9788 8.4342 119.6171 57.7802 41.2929 179.5952 11 R 3.9935 8.1046 118.1526 59.1110 30.1621 177.8816 12 D 4.4406 7.9114 117.7462 57.2472 41.1364 178.4937 13 K 4.0564 8.2670 117.9115 59.1172 32.2195 177.5564 14 M 4.6639 8.1262 116.8899 54.2724 32.1951 176.9976 15 R 4.1436 7.6015 122.0497 59.5678 30.1977 178.3602 16 G 4.2448 7.5577 105.8684 44.3001 0.0000 173.7039 17 T 4.0887 8.1129 111.7795 63.4296 69.8621 175.7506 18 G 3.8803 8.1453 107.0227 44.8976 0.0000 173.5945 19 V 3.9009 7.6235 120.7193 62.5065 32.7123 175.3269 20 S 4.4959 8.6416 124.4633 57.4642 64.1560 173.8451 21 V 3.9323 8.4382 126.4412 62.3930 31.4613 175.3370 22 T 4.3504 8.9700 126.5938 61.7588 69.6517 174.0852 23 R 4.4513 8.4480 128.0538 55.5244 30.4663 176.2106 24 S 4.5657 8.8594 124.9825 57.3152 64.8353 177.1577 25 G 3.8879 9.1413 119.7571 46.6799 0.0000 172.9271 26 D 4.6691 9.3951 121.0931 54.7564 43.2571 176.2337 27 N 4.9951 7.6837 115.6683 51.7478 40.0903 174.1975 28 I 4.6890 8.4195 120.7331 59.7404 39.9611 174.8583 29 I 4.6176 8.8923 128.5154 60.0574 38.8013 175.0544 30 L 4.8184 8.9634 130.1339 53.3522 42.0003 174.5226 31 N 5.2968 8.7016 121.4520 51.6804 39.4618 173.9372 32 M 4.8690 9.0471 123.8378 52.5233 34.6132 174.1851 33 P 4.3945 0.0000 0.0000 62.3982 32.5648 176.6858 34 N 4.4580 9.0330 119.9594 57.0207 38.9937 176.6385 35 N 4.4547 8.1187 115.1010 56.2625 39.3124 176.0796 36 V 3.8703 7.5515 110.2034 63.3806 32.5008 177.3817 37 T 3.9284 7.8101 115.8697 64.6685 69.0561 174.5623 38 F 5.9509 7.3932 116.7081 54.5559 41.2768 173.8564 39 D 4.4083 8.0510 122.0777 55.1891 40.9309 177.3576 40 S 4.5277 7.3418 116.2518 58.8921 64.0777 174.3946 41 S 4.7555 7.6140 113.2837 59.6620 69.5624 175.4898 42 S 4.0228 7.8580 115.1389 57.7428 63.0241 174.2348 43 A 3.6140 8.4735 124.9663 52.3185 17.5931 176.7953 44 T 4.4938 8.5575 110.5749 60.4686 71.7859 173.7271 45 L 4.7998 8.7596 127.9714 53.7451 41.6634 177.3941 46 K 4.2616 8.3526 122.8278 55.5125 33.8143 176.4624 47 P 4.1898 0.0000 0.0000 66.0134 31.1849 178.6655 48 A 4.0564 8.0243 118.7943 55.1699 18.3592 179.8129 49 G 3.4035 7.9662 103.4573 47.8741 0.0000 175.5969 50 A 4.0229 8.3403 123.9118 54.7411 18.3631 179.2610 51 N 4.2384 8.4438 115.8842 57.2273 39.0834 177.3623 52 T 3.9023 7.9575 117.1247 66.5877 68.4497 176.8239 53 L 4.0161 8.5487 121.2428 57.9775 41.4672 179.7363 54 T 3.9603 8.0973 116.0113 66.4872 68.3819 176.8441 55 G 3.5982 7.8434 107.2110 47.7326 0.0000 175.8500 56 V 3.5762 7.9241 120.4750 65.7909 31.7220 177.9834 57 A 4.0400 8.3304 120.7610 55.3320 18.1567 179.4978 58 M 3.9977 8.2327 117.5415 58.7046 32.0954 179.2034 59 V 4.4840 7.5874 119.1609 65.5133 31.4763 177.9818 60 L 4.1706 7.8712 117.7084 57.0611 41.4590 178.9370 61 K 4.2178 7.6156 117.5736 58.8577 32.5117 178.6641 62 E 4.1550 8.2132 119.0140 57.8193 29.3782 175.6781 63 Y 4.7399 7.8183 116.0417 55.5811 39.2455 173.2285 64 P 4.6518 0.0000 0.0000 63.4596 32.1049 176.6140 65 K 4.7504 8.3707 118.8259 57.0931 33.1486 175.5998 66 T 5.0148 8.1293 110.1824 60.1291 70.9816 173.4455 67 A 4.5540 9.4676 128.4774 50.8943 20.7933 176.3682 68 V 3.9169 9.0630 124.7424 62.0207 32.1552 174.0733 69 N 5.1486 8.8279 125.8882 51.7755 39.8179 174.9288 70 V 4.3139 9.0398 126.7841 61.8988 32.3462 174.3983 71 I 5.1271 7.9325 129.7534 58.7304 39.3595 175.0760 72 G 4.2728 8.3969 114.9651 45.1955 0.0000 171.8377 73 Y 5.1449 8.4581 122.3961 56.7712 41.3345 174.6806 74 T 4.6825 8.0412 112.4732 62.0305 70.1072 172.5058 75 D 4.5345 9.0327 126.9031 54.6679 41.8741 175.8943 76 S 4.7752 8.3958 117.8014 58.3250 63.2710 174.4531 77 T 4.0728 8.1746 118.6560 67.1295 67.2636 172.9212 78 G 3.5403 8.8675 122.1094 44.0843 0.0000 172.1952 79 G 4.7679 7.4203 118.5862 44.1583 0.0000 172.5224 80 H 4.3654 8.2205 124.4037 58.5100 28.2072 177.1683 81 D 4.2687 7.6366 121.0358 57.1546 40.8570 178.4568 82 L 3.9953 7.7298 119.0122 57.8876 41.6592 179.1920 83 N 4.3927 8.7345 116.8242 56.3579 38.3732 177.4132 84 M 4.0648 7.9702 120.3607 58.2732 32.0041 178.8620 85 R 3.8649 7.9806 118.1599 59.3234 30.2316 178.8952 86 L 3.8779 7.8668 119.9851 57.9270 41.8744 178.7937 87 S 4.0038 8.3778 113.5963 61.5778 62.3057 176.1083 88 Q 3.9048 8.1723 122.1881 58.9295 28.7724 177.5300 89 Q 3.9186 8.6021 121.0100 59.4510 29.0994 178.8204 90 R 3.7761 8.1809 118.9201 59.1571 30.0219 178.9524 91 A 4.0518 7.8547 120.1144 55.2517 18.3327 179.2055 92 D 4.2752 8.5553 116.9981 57.4847 41.3765 178.6154 93 S 4.1747 8.3177 115.8533 61.5551 62.8794 176.8835 94 V 3.5901 7.8264 120.1824 65.8226 31.2412 177.8709 95 A 4.0050 8.1983 120.8240 55.3387 18.2555 179.7713 96 S 4.0753 8.5134 112.9437 61.5227 62.9469 176.5177 97 A 3.9992 7.9745 124.0350 54.8051 18.0255 179.6171 98 L 3.9076 7.9973 117.3931 58.1076 41.2962 179.6723 99 I 4.5218 7.9559 121.3570 64.3251 36.8184 178.5572 100 T 3.8834 8.0596 115.7447 66.7818 68.3590 176.1550 101 Q 4.2154 7.8403 120.4219 57.7577 29.0840 175.0959 102 G 3.2715 6.5127 110.1741 44.8859 0.0000 173.1181 103 V 4.0171 7.9502 122.1785 61.2322 32.7109 175.3285 104 D 4.7069 8.5967 126.3429 54.4108 41.2326 177.5449 105 A 4.0922 8.6218 126.6685 54.9568 18.6949 179.0987 106 S 4.3255 7.9764 110.0359 60.1811 63.4584 174.9099 107 R 4.4590 7.8439 118.7464 55.9803 30.4333 175.3963 108 I 5.0908 7.3180 119.3300 59.4082 39.9790 175.1013 109 R 4.7898 9.3444 126.1701 54.6622 33.8489 173.6104 110 T 5.0611 8.5708 115.1706 60.0476 71.0547 173.3190 111 Q 4.3516 9.0087 125.2135 53.7594 32.2156 175.1850 112 G 3.7939 9.0079 113.1087 44.8290 0.0000 173.0334 113 L 4.7420 8.0211 130.0651 53.3150 41.9034 179.5803 114 G 3.8052 7.6632 106.9270 49.1006 0.0000 172.8114 115 P 4.5924 0.0000 0.0000 62.5139 31.8742 177.1317 116 A 4.4366 7.6586 120.3031 54.1677 20.7471 177.8815 117 N 4.8020 8.0147 119.3688 50.6755 39.3584 173.0234 118 P 5.1684 0.0000 0.0000 61.4808 31.4413 176.9388 119 I 3.6815 8.3857 124.3318 62.8726 38.2283 174.6023 120 A 4.7326 7.5497 120.5723 49.9783 22.5581 175.1336 121 S 4.2860 8.4315 114.3873 59.2400 63.2398 175.3261 122 N 4.7034 8.4912 120.0384 53.9992 39.6936 176.5025 123 S 4.2400 8.1277 112.6429 60.6188 62.9565 174.7468 124 T 4.4350 7.6003 110.0518 60.5522 71.3221 175.6194 125 A 3.9783 8.4587 124.5662 54.9832 18.4911 179.9725 126 E 3.9927 8.2396 117.2277 59.8390 29.6630 179.7067 127 G 4.1475 7.6297 106.3851 47.0245 0.0000 175.4785 128 K 3.9102 8.4040 122.0716 59.5021 31.9172 178.7391 129 A 4.1204 8.0825 120.1246 55.2895 18.3875 179.3837 130 Q 4.0967 7.6941 115.2213 59.1001 29.0155 178.3713 131 N 4.7203 8.7571 118.0329 55.1878 38.7882 174.7859 132 R 4.6937 7.4277 118.3153 54.9931 29.8448 175.4009 133 R 4.7773 8.6034 119.7604 55.0661 34.1233 174.0461 134 V 4.6870 8.5248 119.0281 61.2694 34.5332 173.8601 135 E 5.1278 9.2348 128.1519 54.7201 32.0390 175.5501 136 I 4.2282 8.9260 127.5327 60.7899 38.4628 175.8817 137 T 4.6367 9.0999 126.7126 62.5119 69.2901 174.6643 138 L 4.5743 9.0203 129.1986 53.8876 42.5085 176.2651 139 S 5.1320 8.4914 120.0117 55.6318 66.4525 172.3881 140 P 4.8511 0.0000 0.0000 62.2899 32.0511 175.9582 141 L 3.9389 8.6113 124.0339 55.2702 42.1949 177.8436 142 L 3.9873 8.6543 125.2503 54.6120 40.4754 174.8891 143 E 3.6416 8.7683 126.6002 55.8133 26.3249 174.4954 144 H 4.2681 8.5446 118.2918 55.0706 29.1096 175.1023 145 H 3.8667 8.9547 116.8267 56.6126 27.9672 174.6225 146 H 4.6217 8.2781 120.9476 53.9462 28.3546 173.5145 147 H 4.6616 8.2402 121.8577 54.2064 29.5408 172.9725 148 H 4.9372 8.4408 116.8187 55.2192 30.6240 173.8070 149 H 4.6146 8.1013 122.0189 55.8965 28.9707 173.9619 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 Y 8.14 4.31 0.00 2.96 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 2 Y 9.59 4.11 0.00 3.34 3.11 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 3 M 7.59 3.94 0.00 1.94 1.97 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.38 0.00 4 D 7.31 4.00 0.00 1.95 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 7.35 3.65 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 0.61 0.00 0.00 1.03 0.00 0.00 6 Q 6.98 3.79 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.16 6.07 0.00 0.00 0.00 0.00 0.00 1.89 1.26 0.00 7 E 8.47 3.86 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 8 A 7.79 3.96 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 9 K 8.21 3.94 0.00 1.98 1.90 0.00 1.89 0.00 0.00 1.89 0.00 0.00 3.10 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.51 1.69 7.81 10 L 8.43 3.98 0.00 1.63 1.69 0.88 0.79 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 11 R 8.10 3.99 0.00 1.84 2.12 0.00 3.24 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 12 D 7.91 4.44 0.00 2.92 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 13 K 8.27 4.06 0.00 1.76 1.85 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.59 7.81 14 M 8.13 4.66 0.00 1.94 2.14 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.66 0.00 15 R 7.60 4.14 0.00 1.99 1.98 0.00 3.31 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 16 G 7.56 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 8.11 4.09 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 1.22 0.00 0.00 18 G 8.15 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 19 V 7.62 3.90 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 0.83 0.00 0.00 0.90 0.00 0.00 20 S 8.64 4.50 0.00 4.13 3.77 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 21 V 8.44 3.93 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 0.84 0.00 0.00 0.91 0.00 0.00 22 T 8.97 4.35 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 23 R 8.45 4.45 0.00 1.78 1.82 0.00 3.32 0.00 0.00 3.30 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.76 0.00 24 S 8.86 4.57 0.00 3.92 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 25 G 9.14 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 26 D 9.40 4.67 0.00 2.67 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 27 N 7.68 5.00 0.00 2.95 2.94 0.00 0.00 6.76 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 8.42 4.69 1.84 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.69 0.88 0.00 0.00 29 I 8.89 4.62 2.01 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 1.23 0.98 0.93 0.00 0.00 30 L 8.96 4.82 0.00 1.58 1.62 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 31 N 8.70 5.30 0.00 2.87 3.09 0.00 0.00 6.69 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 32 M 9.05 4.87 0.00 1.85 1.97 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 33 P 0.00 4.39 0.00 2.18 1.99 0.00 3.60 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 2.20 2.08 0.00 34 N 9.03 4.46 0.00 3.00 2.90 0.00 0.00 6.97 6.84 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 35 N 8.12 4.45 0.00 2.73 2.84 0.00 0.00 6.99 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 36 V 7.55 3.87 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.93 0.00 0.00 37 T 7.81 3.93 3.17 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 0.43 0.00 0.00 38 F 7.39 5.95 0.00 3.16 3.04 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 39 D 8.05 4.41 0.00 2.69 2.60 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 40 S 7.34 4.53 0.00 3.88 3.77 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 41 S 7.61 4.76 0.00 3.94 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 42 S 7.86 4.02 0.00 3.85 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 43 A 8.47 3.61 1.12 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 44 T 8.56 4.49 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 45 L 8.76 4.80 0.00 1.59 1.70 1.01 0.99 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 46 K 8.35 4.26 0.00 1.99 1.94 0.00 1.48 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.57 1.45 7.81 47 P 0.00 4.19 0.00 2.17 2.16 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 48 A 8.02 4.06 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 49 G 7.97 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 0.00 0.00 0.00 50 A 8.34 4.02 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 51 N 8.44 4.24 0.00 2.94 2.99 0.00 0.00 7.19 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 52 T 7.96 3.90 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 53 L 8.55 4.02 0.00 1.76 1.70 0.87 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.10 3.96 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 1.21 0.00 0.00 55 G 7.84 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 56 V 7.92 3.58 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 0.96 0.00 0.00 1.01 0.00 0.00 57 A 8.33 4.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 M 8.23 4.00 0.00 2.06 2.31 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.54 0.00 59 V 7.59 4.48 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 1.07 0.00 0.00 1.10 0.00 0.00 60 L 7.87 4.17 0.00 1.87 1.76 0.94 0.76 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 61 K 7.62 4.22 0.00 1.95 1.84 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.71 7.81 62 E 8.21 4.15 0.00 2.05 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 2.21 2.57 0.00 63 Y 7.82 4.74 0.00 2.84 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 64 P 0.00 4.65 0.00 2.24 2.20 0.00 3.94 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 2.06 2.02 0.00 65 K 8.37 4.75 0.00 1.91 1.82 0.00 1.52 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.29 1.42 7.81 66 T 8.13 5.01 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 67 A 9.47 4.55 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 68 V 9.06 3.92 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 0.83 0.00 0.00 0.96 0.00 0.00 69 N 8.83 5.15 0.00 2.90 2.77 0.00 0.00 6.45 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 70 V 9.04 4.31 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.95 0.00 0.00 71 I 7.93 5.13 1.84 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.84 0.41 0.00 0.00 72 G 8.40 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Y 8.46 5.14 0.00 2.95 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.04 4.68 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 1.27 0.00 0.00 75 D 9.03 4.53 0.00 2.67 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 76 S 8.40 4.78 0.00 4.03 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 77 T 8.17 4.07 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 78 G 8.87 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 G 7.42 4.77 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 0.00 0.00 0.00 80 H 8.22 4.37 0.00 3.36 3.59 0.00 5.46 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 7.64 4.27 0.00 2.59 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 82 L 7.73 4.00 0.00 1.79 1.68 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 83 N 8.73 4.39 0.00 2.76 2.86 0.00 0.00 7.01 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 84 M 7.97 4.06 0.00 2.03 2.33 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.83 0.00 85 R 7.98 3.86 0.00 2.01 1.94 0.00 3.10 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.90 0.00 86 L 7.87 3.88 0.00 1.71 1.76 0.86 0.84 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 87 S 8.38 4.00 0.00 3.94 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 88 Q 8.17 3.90 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.63 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 89 Q 8.60 3.92 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.53 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 90 R 8.18 3.78 0.00 1.96 2.00 0.00 3.03 0.00 0.00 2.97 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 1.50 0.00 91 A 7.85 4.05 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 8.56 4.28 0.00 2.82 2.88 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 93 S 8.32 4.17 0.00 4.29 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 7.83 3.59 2.27 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 1.02 0.00 0.00 1.10 0.00 0.00 95 A 8.20 4.01 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 96 S 8.51 4.08 0.00 4.04 4.15 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 97 A 7.97 4.00 1.44 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 0.00 0.00 98 L 8.00 3.91 0.00 1.90 1.74 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 99 I 7.96 4.52 2.00 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 1.54 1.28 0.95 0.00 0.00 100 T 8.06 3.88 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 1.21 0.00 0.00 101 Q 7.84 4.22 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.52 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 102 G 6.51 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 0.00 0.00 0.00 103 V 7.95 4.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.99 0.00 0.00 104 D 8.60 4.71 0.00 2.84 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 0.00 105 A 8.62 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 0.00 106 S 7.98 4.33 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 0.00 107 R 7.84 4.46 0.00 2.08 1.97 0.00 3.11 0.00 0.00 3.39 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 108 I 7.32 5.09 1.88 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 1.13 0.86 0.96 0.00 0.00 109 R 9.34 4.79 0.00 1.78 1.70 0.00 3.04 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 110 T 8.57 5.06 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 0.00 111 Q 9.01 4.35 0.00 1.94 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.36 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 112 G 9.01 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 0.00 0.00 0.00 113 L 8.02 4.74 0.00 1.22 1.44 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 114 G 7.66 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 0.00 0.00 0.00 115 P 0.00 4.59 0.00 2.21 2.18 0.00 3.73 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 2.00 1.99 0.00 116 A 7.66 4.44 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 0.00 117 N 8.01 4.80 0.00 3.00 2.79 0.00 0.00 7.11 8.09 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 0.00 118 P 0.00 5.17 0.00 2.03 2.25 0.00 3.73 0.00 0.00 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 119 I 8.39 3.68 1.61 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.63 0.87 0.00 0.00 120 A 7.55 4.73 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 0.00 121 S 8.43 4.29 0.00 3.89 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 0.00 122 N 8.49 4.70 0.00 2.68 2.86 0.00 0.00 6.96 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 0.00 123 S 8.13 4.24 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 0.00 124 T 7.60 4.44 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 125 A 8.46 3.98 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 0.00 126 E 8.24 3.99 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 127 G 7.63 4.15 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 0.00 0.00 0.00 128 K 8.40 3.91 0.00 1.92 1.92 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.71 7.81 129 A 8.08 4.12 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 0.00 130 Q 7.69 4.10 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 131 N 8.76 4.72 0.00 2.84 2.90 0.00 0.00 7.14 7.95 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 0.00 132 R 7.43 4.69 0.00 2.00 1.95 0.00 3.20 0.00 0.00 3.29 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.86 0.00 133 R 8.60 4.78 0.00 1.91 2.15 0.00 3.04 0.00 0.00 2.99 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.73 0.00 134 V 8.52 4.69 2.20 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 0.93 0.00 0.00 1.25 0.00 0.00 135 E 9.23 5.13 0.00 2.21 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 2.32 2.53 0.00 136 I 8.93 4.23 1.89 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 1.25 0.77 0.93 0.00 0.00 137 T 9.10 4.64 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 1.24 0.00 0.00 138 L 9.02 4.57 0.00 1.57 1.63 0.91 0.61 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 0.00 139 S 8.49 5.13 0.00 3.81 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 0.00 140 P 0.00 4.85 0.00 1.97 2.05 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.21 0.00 141 L 8.61 3.94 0.00 1.56 1.72 1.03 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 142 L 8.65 3.99 0.00 1.64 1.68 1.00 1.01 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 0.00 143 E 8.77 3.64 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 144 H 8.54 4.27 0.00 3.28 3.33 0.00 5.55 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 H 8.95 3.87 0.00 3.25 3.40 0.00 5.68 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 0.00 146 H 8.28 4.62 0.00 3.13 3.22 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 H 8.24 4.66 0.00 3.07 3.21 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 H 8.44 4.94 0.00 2.97 3.18 0.00 5.67 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 H 8.10 4.61 0.00 3.13 3.16 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 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