NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4494 8.3044 120.3360 55.3035 32.7411 174.1216 2 V 4.0036 8.1682 124.2766 59.6942 32.8989 171.9959 3 E 3.8441 9.0154 127.7040 57.0071 30.6726 175.6213 4 I 4.3970 8.1075 125.6695 59.9840 40.0204 173.8390 5 N 4.9788 8.0365 120.3947 50.5627 41.3180 174.6250 6 N 4.2208 8.7564 117.8973 57.0003 38.7950 176.4857 7 Q 4.1613 8.1104 118.8573 59.1940 28.8269 178.9201 8 R 4.0906 8.9176 119.5104 58.8730 30.0175 178.9528 9 K 3.9184 8.4453 119.5680 59.6199 32.2582 178.3997 10 A 3.5557 8.0490 121.1878 55.1872 17.9555 179.4154 11 F 4.2871 8.3940 118.7470 61.6667 39.5691 177.2947 12 L 3.9273 8.4030 118.8825 57.8683 41.5166 179.1355 13 D 4.3307 8.8280 119.6268 57.6690 40.7804 178.7202 14 M 3.9756 8.2640 118.7503 58.6471 32.2215 178.0175 15 L 3.6818 7.9003 119.2961 57.6503 41.6808 179.2027 16 A 4.0071 8.5106 122.2080 54.2061 18.0568 179.4610 17 W 4.0131 7.7190 126.0498 60.0323 31.1277 177.5824 18 S 3.8813 8.8694 113.3220 61.4955 60.2993 175.9032 19 E 4.1343 8.4144 117.7518 56.1702 28.4910 177.5169 20 G 3.9703 7.4205 106.5926 46.8049 0.0000 175.1961 21 T 4.1816 7.3288 109.5982 62.6142 70.0984 174.2254 22 D 5.0624 7.7717 122.4601 52.1633 40.2602 175.6057 23 N 5.0863 7.8935 113.8452 52.0453 38.5189 176.3920 24 G 4.0082 8.4904 106.2399 46.1556 0.0000 173.6311 25 R 4.3023 7.9369 115.6057 57.4573 32.5059 175.6493 26 Q 3.8831 8.4946 120.3990 55.8846 29.1876 175.9711 27 K 3.9514 8.4737 124.9085 57.4236 32.6472 176.1932 28 T 4.3552 7.9294 114.2192 61.5232 70.0410 173.1212 29 R 4.2373 8.8874 127.0188 57.4868 31.2086 176.5869 30 N 4.7693 7.6185 115.0464 54.0835 38.9711 173.5434 31 H 4.0565 8.8135 119.2947 56.6534 26.9217 176.1300 32 G 3.9271 9.2063 107.1785 46.3032 0.0000 175.0025 33 Y 4.0445 8.9772 119.4029 60.0483 38.1642 176.6018 34 D 3.6574 7.8985 117.8282 52.5149 41.0919 176.1119 35 V 4.0241 7.4869 121.0148 63.2190 32.9011 174.9689 36 I 4.8528 9.1715 129.2007 59.4566 39.4796 175.7098 37 V 4.3372 7.7745 124.8252 62.8581 31.2462 176.2539 38 G 3.9304 8.6721 110.6763 44.6405 0.0000 174.2630 39 G 4.1803 7.5994 106.1713 44.7721 0.0000 174.1888 40 E 4.2422 8.0816 118.6489 56.4764 30.7105 175.9483 41 L 5.3764 8.4120 121.0949 52.9560 45.0270 175.5886 42 F 5.1302 8.4349 116.1390 55.4685 40.3257 175.3082 43 T 4.0866 8.6413 107.3631 61.1081 70.0731 173.4642 44 D 4.7587 8.0794 121.8594 53.2882 40.9159 174.7258 45 Y 4.9202 8.6784 123.9755 58.0796 38.6608 178.0366 46 S 3.8611 8.4817 117.2824 61.1891 63.2986 173.4453 47 D 5.0082 7.4826 117.4298 52.8290 44.2457 173.6862 48 H 2.5800 7.9705 122.3672 54.4358 30.3573 174.1153 49 P 3.8940 0.0000 0.0000 64.2063 30.7502 176.8645 50 R 3.8117 7.3322 114.1697 56.5680 28.3763 175.5061 51 K 4.1592 7.3149 118.4861 55.6604 33.0623 176.7425 52 L 4.6099 8.1065 131.0969 53.0683 40.7044 175.2640 53 V 3.4734 7.8037 119.5111 63.1650 31.9778 175.3786 54 T 4.5299 8.2783 118.6662 60.6727 67.6627 174.3502 55 L 4.1931 8.2635 128.8687 57.3679 42.1940 177.7350 56 N 4.9899 8.4835 115.6752 51.0080 42.6341 173.7394 57 P 4.1967 0.0000 0.0000 64.9116 31.6184 176.8105 58 K 4.5223 7.8991 114.6973 55.8310 33.4616 175.6329 59 L 4.7196 9.6279 121.4431 53.3442 45.2291 174.8314 60 K 5.1619 8.4663 123.7205 54.8301 35.7820 175.3595 61 S 4.6830 8.6868 114.5944 57.2189 65.4917 174.5673 62 T 4.9519 7.8488 113.3237 60.1671 69.8854 174.8941 63 G 3.9073 8.0336 111.7471 46.6089 0.0000 172.3146 64 A 4.9152 9.2303 125.4716 51.2857 22.5254 175.5960 65 G 5.0389 9.3247 105.9102 45.0229 0.0000 175.0554 66 R 4.1808 10.2052 118.3400 58.0498 29.7772 177.3034 67 Y 4.5041 7.3107 113.3357 57.6146 39.1958 175.9977 68 Q 3.3701 8.2862 117.5199 56.9288 26.8829 174.3307 69 L 4.7138 8.7467 122.0098 54.6011 43.5580 176.4103 70 L 4.7150 8.6735 125.8839 54.2949 43.7890 178.4908 71 S 3.8769 8.4425 115.9311 61.5695 62.7675 176.3464 72 R 3.5128 7.7897 122.1789 59.0667 29.5599 178.2018 73 W 4.5560 7.5153 117.4730 58.9328 29.2532 178.4416 74 W 4.6494 8.3493 128.7653 60.6540 30.1179 177.3855 75 D 4.1513 8.5803 119.1193 57.5326 40.2484 178.7747 76 A 3.8215 7.5414 120.4436 55.5832 18.3642 179.1747 77 Y 3.7596 7.9868 114.7377 61.0046 37.8488 178.7355 78 R 3.2689 7.8273 119.8710 59.3595 30.0435 178.3742 79 K 3.8166 7.5744 118.6612 59.6262 32.0247 178.1935 80 Q 3.9852 8.3490 118.8797 59.3185 29.1090 177.7520 81 L 4.3161 8.3559 118.2879 54.0574 42.9862 176.7322 82 G 3.7779 7.3290 105.6039 46.2509 0.0000 175.0509 83 L 4.4434 8.4772 118.6374 53.3697 42.3803 177.8999 84 K 4.2233 9.0083 124.6124 58.9274 32.3299 176.1682 85 D 5.6926 7.8871 114.1745 51.3428 42.0860 174.8563 86 F 4.3508 9.5173 123.2945 57.9915 39.6056 176.6801 87 S 4.3716 8.3029 114.8369 56.8178 64.5125 172.2505 88 P 3.5301 0.0000 0.0000 65.5066 30.0492 178.7879 89 K 4.0996 7.7452 117.6164 59.6861 32.0108 178.9587 90 S 4.6610 7.7632 114.8128 61.6407 62.8062 176.6951 91 Q 4.1452 8.8626 121.5316 59.0105 27.8591 178.5037 92 D 4.4189 9.5063 120.5927 57.4278 40.7545 178.3602 93 A 4.0895 9.3313 121.4689 55.4562 18.0691 179.7055 94 V 3.5788 9.0002 117.0160 66.0256 31.5313 177.7997 95 A 4.3163 8.5382 120.6928 55.6451 18.2017 179.7405 96 L 3.5228 9.2014 117.4239 57.6309 41.5027 179.7980 97 Q 3.8917 8.9742 120.8095 59.2777 29.1239 177.8760 98 Q 3.9177 8.7682 119.9207 59.2768 28.7230 179.2975 99 I 3.7989 8.7285 121.7397 64.1957 36.9824 178.4555 100 K 3.9649 8.4816 120.9763 59.3405 31.8303 178.7254 101 E 4.0524 8.8556 118.8715 58.4177 29.4130 178.2893 102 R 4.4676 7.6636 116.5736 54.6810 30.3522 176.1538 103 G 3.9946 7.9774 106.3375 46.3570 0.0000 174.9939 104 A 4.1982 7.9963 119.6653 52.3119 18.4863 179.9053 105 L 3.8112 7.6063 118.4303 57.3730 41.8695 177.5676 106 P 4.2176 0.0000 0.0000 65.5084 31.2355 178.5410 107 M 3.9909 7.8950 117.1712 58.4578 31.9895 178.5256 108 I 3.5740 7.7301 119.7687 64.5265 37.0858 177.8969 109 D 4.4956 7.9802 118.7365 57.5032 40.8364 178.7357 110 R 4.3420 7.8131 112.6698 56.3612 30.0787 177.1604 111 G 4.0402 8.3780 109.9515 46.1604 0.0000 173.7667 112 D 4.8587 7.5499 120.4506 54.1253 37.8658 176.5942 113 I 3.8190 7.5062 124.2924 63.7408 37.6910 177.7226 114 R 3.9533 7.8381 118.7228 59.2565 29.8698 178.8778 115 Q 4.0142 8.0231 117.2105 58.7467 28.6912 178.4678 116 A 3.8999 7.6286 120.3702 55.2296 18.2051 179.3377 117 I 3.9619 8.0609 117.3220 64.9856 37.5769 177.5748 118 D 4.5479 8.7233 118.7080 57.5671 40.8364 178.2646 119 R 3.9162 8.4243 118.2413 59.7190 30.3838 177.6016 120 C 4.4948 8.5980 114.9152 60.2358 28.4992 175.4992 121 S 4.3016 8.0106 117.2665 61.5945 62.2748 176.4365 122 N 4.7144 8.2142 115.2971 53.7297 37.0928 175.1810 123 I 3.7045 8.0954 120.0071 61.7628 38.3148 175.9491 124 W 4.8327 7.9964 119.5539 54.4371 31.3805 176.1120 125 A 4.4684 8.8549 127.2602 54.5277 18.1759 178.0465 126 S 4.5444 8.5276 110.1372 59.5082 63.9973 174.5076 127 L 4.5228 8.1638 122.7539 53.5471 42.0276 174.6192 128 P 4.4642 0.0000 0.0000 64.5665 31.4492 176.7931 129 G 3.9888 9.9657 112.6009 44.8925 0.0000 173.9832 130 A 4.1505 8.0556 122.8761 53.9295 18.4110 178.5055 131 G 3.7206 8.2017 102.0916 47.2543 0.0000 173.6363 132 Y 4.3699 8.3164 114.5091 57.0761 38.1621 176.7723 133 G 3.8823 8.2134 107.0904 46.0658 0.0000 173.9289 134 Q 4.3413 7.7456 118.6809 54.0255 30.3089 175.3089 135 F 4.1673 8.6060 120.7874 58.5722 38.2524 173.7466 136 E 4.7795 7.8170 127.1403 55.1324 31.0770 176.0595 137 H 4.7512 9.3959 121.0378 55.7549 30.3506 174.5418 138 K 4.5701 8.7327 118.1777 55.1267 32.8061 178.1437 139 A 3.6851 8.9419 126.3383 55.5931 18.1164 179.7308 140 D 4.6252 8.0380 116.8729 57.6264 41.0942 178.9509 141 S 4.0941 7.9845 115.2007 61.3121 62.7763 176.6921 142 L 3.8084 8.6523 122.7510 57.7632 41.3769 179.4841 143 I 3.6567 8.9947 119.9100 64.1970 36.9640 178.2353 144 A 4.0002 8.1778 121.9008 55.3430 18.0250 179.9565 145 K 3.7164 7.4051 115.2270 59.0723 32.1605 179.2790 146 F 4.1033 8.2419 121.4857 61.1117 39.3716 177.2568 147 K 4.3573 8.7646 120.4046 59.1596 31.7231 179.2319 148 E 4.1420 8.2572 116.9947 58.5859 29.3851 178.3259 149 A 4.1336 7.4445 118.9883 52.2466 18.6091 178.2064 150 G 3.7845 8.4054 106.9183 44.9162 0.0000 174.4886 151 G 3.3404 6.9732 109.1204 45.1542 0.0000 173.9989 152 T 4.4326 8.6174 120.0791 62.9531 69.4874 173.9811 153 V 4.5790 7.6227 120.8352 62.5356 34.8152 174.6058 154 R 4.1955 8.2260 122.1690 56.7693 31.4085 175.7972 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 M 8.30 4.45 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.57 0.00 2 V 8.17 4.00 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 0.75 0.00 0.00 0.98 0.00 0.00 3 E 9.02 3.84 0.00 1.95 1.88 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 2.31 2.39 0.00 4 I 8.11 4.40 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.03 0.93 0.00 0.00 5 N 8.04 4.98 0.00 2.99 2.88 0.00 0.00 5.56 6.96 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 6 N 8.76 4.22 0.00 2.84 2.86 0.00 0.00 6.88 7.51 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 7 Q 8.11 4.16 0.00 2.37 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.69 0.00 0.00 0.00 0.00 0.00 2.52 2.69 0.00 8 R 8.92 4.09 0.00 2.01 2.02 0.00 3.22 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 9 K 8.45 3.92 0.00 1.82 1.92 0.00 1.61 0.00 0.00 1.62 0.00 0.00 3.06 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.48 7.81 10 A 8.05 3.56 0.38 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 11 F 8.39 4.29 0.00 3.65 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 12 L 8.40 3.93 0.00 1.95 1.90 1.01 1.00 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 13 D 8.83 4.33 0.00 2.80 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 M 8.26 3.98 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.53 0.00 15 L 7.90 3.68 0.00 1.66 1.15 0.10 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.51 4.01 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 17 W 7.72 4.01 0.00 3.33 3.41 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 18 S 8.87 3.88 0.00 4.07 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 19 E 8.41 4.13 0.00 1.99 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 2.40 0.00 20 G 7.42 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 21 T 7.33 4.18 4.20 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 1.22 0.00 0.00 22 D 7.77 5.06 0.00 2.69 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 23 N 7.89 5.09 0.00 2.55 2.58 0.00 0.00 6.41 7.00 0.00 0.00 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 G 8.49 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 25 R 7.94 4.30 0.00 1.69 1.86 0.00 3.22 0.00 0.00 3.09 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 26 Q 8.49 3.88 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.22 6.93 0.00 0.00 0.00 0.00 0.00 2.44 2.33 0.00 27 K 8.47 3.95 0.00 1.74 1.72 0.00 1.83 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.36 7.81 28 T 7.93 4.36 4.18 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 1.26 0.00 0.00 29 R 8.89 4.24 0.00 2.00 1.94 0.00 3.29 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 30 N 7.62 4.77 0.00 2.73 2.80 0.00 0.00 7.47 7.89 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 31 H 8.81 4.06 0.00 3.31 3.69 0.00 5.84 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 9.21 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 Y 8.98 4.04 0.00 3.16 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 34 D 7.90 3.66 0.00 2.21 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 35 V 7.49 4.02 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 1.02 0.00 0.00 0.87 0.00 0.00 36 I 9.17 4.85 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 1.27 1.17 0.89 0.00 0.00 37 V 7.77 4.34 2.25 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 1.04 0.00 0.00 0.94 0.00 0.00 38 G 8.67 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 G 7.60 4.18 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 0.00 0.00 0.00 40 E 8.08 4.24 0.00 1.91 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 2.39 2.28 0.00 41 L 8.41 5.38 0.00 1.40 1.47 0.93 0.89 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 42 F 8.43 5.13 0.00 2.83 2.83 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 43 T 8.64 4.09 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 1.16 0.00 0.00 44 D 8.08 4.76 0.00 2.67 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 8.68 4.92 0.00 3.11 3.21 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 46 S 8.48 3.86 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 47 D 7.48 5.01 0.00 2.74 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 48 H 7.97 2.58 0.00 1.89 2.77 0.00 5.76 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 3.89 0.00 1.88 1.67 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.55 0.00 50 R 7.33 3.81 0.00 1.95 1.96 0.00 3.11 0.00 0.00 3.12 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 51 K 7.31 4.16 0.00 1.84 1.62 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.33 7.81 52 L 8.11 4.61 0.00 1.59 1.56 0.91 0.97 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 53 V 7.80 3.47 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 0.92 0.00 0.00 0.92 0.00 0.00 54 T 8.28 4.53 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 1.24 0.00 0.00 55 L 8.26 4.19 0.00 1.67 1.78 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 56 N 8.48 4.99 0.00 2.72 2.66 0.00 0.00 6.82 7.53 0.00 0.00 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 P 0.00 4.20 0.00 2.04 2.16 0.00 3.64 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 58 K 7.90 4.52 0.00 1.72 1.82 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.34 7.81 59 L 9.63 4.72 0.00 1.69 1.46 0.97 0.52 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 60 K 8.47 5.16 0.00 1.73 1.65 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.74 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.39 7.81 61 S 8.69 4.68 0.00 3.82 3.64 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 62 T 7.85 4.95 4.20 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 1.18 0.00 0.00 63 G 8.03 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 64 A 9.23 4.92 0.68 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 65 G 9.32 5.04 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 66 R 10.21 4.18 0.00 0.67 0.66 0.00 2.21 0.00 0.00 2.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.90 0.00 67 Y 7.31 4.50 0.00 3.32 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Q 8.29 3.37 0.00 2.53 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.02 0.00 0.00 0.00 0.00 0.00 2.37 2.66 0.00 69 L 8.75 4.71 0.00 2.11 2.18 1.31 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 70 L 8.67 4.72 0.00 2.04 1.64 1.01 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.44 3.88 0.00 3.93 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 72 R 7.79 3.51 0.00 1.52 1.15 0.00 2.78 0.00 0.00 2.99 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.50 0.00 73 W 7.52 4.56 0.00 3.68 3.57 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 74 W 8.35 4.65 0.00 3.77 3.34 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 75 D 8.58 4.15 0.00 2.77 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.54 3.82 1.24 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 77 Y 7.99 3.76 0.00 3.25 3.07 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 78 R 7.83 3.27 0.00 0.67 1.67 0.00 2.80 0.00 0.00 3.00 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.61 0.00 79 K 7.57 3.82 0.00 1.71 1.87 0.00 1.64 0.00 0.00 1.50 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.39 7.81 80 Q 8.35 3.99 0.00 1.96 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 81 L 8.36 4.32 0.00 1.77 1.76 1.08 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 82 G 7.33 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 83 L 8.48 4.44 0.00 1.42 2.04 1.12 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 84 K 9.01 4.22 0.00 1.85 1.96 0.00 1.76 0.00 0.00 1.81 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.44 7.81 85 D 7.89 5.69 0.00 3.13 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 F 9.52 4.35 0.00 2.28 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 87 S 8.30 4.37 0.00 3.94 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 88 P 0.00 3.53 0.00 1.55 0.49 0.00 3.18 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.26 0.00 89 K 7.75 4.10 0.00 1.77 1.80 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.55 7.81 90 S 7.76 4.66 0.00 4.26 4.43 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 91 Q 8.86 4.15 0.00 2.49 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 1.16 2.23 0.00 92 D 9.51 4.42 0.00 2.88 2.82 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 93 A 9.33 4.09 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 9.00 3.58 2.36 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 0.85 0.00 0.00 1.41 0.00 0.00 95 A 8.54 4.32 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 L 9.20 3.52 0.00 1.91 1.74 0.95 0.84 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 97 Q 8.97 3.89 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.62 2.85 0.00 98 Q 8.77 3.92 0.00 2.05 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.57 0.00 0.00 0.00 0.00 0.00 2.00 1.92 0.00 99 I 8.73 3.80 2.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.13 0.77 0.00 0.00 100 K 8.48 3.96 0.00 1.84 1.96 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.47 7.81 101 E 8.86 4.05 0.00 2.11 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 2.41 2.59 0.00 102 R 7.66 4.47 0.00 1.79 1.93 0.00 3.41 0.00 0.00 3.10 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.74 0.00 103 G 7.98 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 A 8.00 4.20 1.20 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 0.00 0.00 105 L 7.61 3.81 0.00 1.66 1.69 0.91 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 106 P 0.00 4.22 0.00 2.13 2.08 0.00 3.73 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 2.09 2.15 0.00 107 M 7.90 3.99 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.60 0.00 108 I 7.73 3.57 1.74 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.49 1.03 0.00 0.00 109 D 7.98 4.50 0.00 2.86 2.76 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 0.00 110 R 7.81 4.34 0.00 1.97 2.02 0.00 3.34 0.00 0.00 3.22 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.76 0.00 111 G 8.38 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 0.00 112 D 7.55 4.86 0.00 2.79 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 0.00 113 I 7.51 3.82 1.51 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 -0.36 0.39 0.00 0.00 114 R 7.84 3.95 0.00 1.84 1.98 0.00 3.13 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 115 Q 8.02 4.01 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 116 A 7.63 3.90 1.07 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 0.00 117 I 8.06 3.96 2.16 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 1.40 0.92 1.00 0.00 0.00 118 D 8.72 4.55 0.00 2.86 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 0.00 119 R 8.42 3.92 0.00 2.03 2.10 0.00 3.36 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 120 C 8.60 4.49 0.00 3.63 3.66 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 0.00 121 S 8.01 4.30 0.00 4.11 4.29 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 0.00 122 N 8.21 4.71 0.00 2.85 2.96 0.00 0.00 5.96 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 0.00 123 I 8.10 3.70 1.08 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.44 -0.95 0.00 0.00 124 W 8.00 4.83 0.00 3.60 3.36 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 0.00 125 A 8.85 4.47 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 0.00 126 S 8.53 4.54 0.00 4.30 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 0.00 127 L 8.16 4.52 0.00 2.12 1.80 1.43 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 128 P 0.00 4.46 0.00 2.08 2.09 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.34 0.00 129 G 9.97 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.06 4.15 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 0.00 0.00 0.00 0.00 0.00 131 G 8.20 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 0.00 0.00 0.00 132 Y 8.32 4.37 0.00 2.98 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 0.00 133 G 8.21 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 0.00 134 Q 7.75 4.34 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.14 0.00 0.00 0.00 0.00 0.00 2.54 2.38 0.00 135 F 8.61 4.17 0.00 3.02 2.95 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 0.00 136 E 7.82 4.78 0.00 1.80 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 2.67 2.50 0.00 137 H 9.40 4.75 0.00 3.31 3.59 0.00 5.64 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 0.00 138 K 8.73 4.57 0.00 1.84 1.78 0.00 1.74 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.49 1.48 7.81 139 A 8.94 3.69 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 0.00 140 D 8.04 4.63 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 0.00 141 S 7.98 4.09 0.00 4.26 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 0.00 142 L 8.65 3.81 0.00 1.81 1.70 1.06 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 143 I 8.99 3.66 1.85 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 1.66 1.16 0.91 0.00 0.00 144 A 8.18 4.00 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 0.00 145 K 7.41 3.72 0.00 1.27 1.26 0.00 1.00 0.00 0.00 1.33 0.00 0.00 2.43 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.32 0.21 7.81 146 F 8.24 4.10 0.00 3.14 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.76 4.36 0.00 1.94 1.85 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.57 1.62 7.81 148 E 8.26 4.14 0.00 1.79 1.93 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 2.32 2.26 0.00 149 A 7.44 4.13 1.05 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 0.00 0.00 150 G 8.41 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 0.00 151 G 6.97 3.34 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 0.00 152 T 8.62 4.43 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 1.25 0.00 0.00 153 V 7.62 4.58 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 0.78 0.00 0.00 1.02 0.00 0.00 154 R 8.23 4.20 0.00 2.00 1.94 0.00 3.35 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00