NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 D 4.6429 8.3649 120.5310 54.3357 41.9239 174.4328 7 S 4.5420 8.3733 119.0962 56.0662 67.0643 171.9465 8 Q 4.3319 9.1066 123.4490 54.9145 31.9380 173.5379 9 I 4.0976 8.4361 126.8231 60.1301 38.1604 175.1668 10 Q 4.4502 8.3854 124.8067 54.2052 29.5121 175.7996 11 F 4.2821 8.8185 123.7663 56.2403 38.1116 176.7889 12 T 4.0541 8.4376 117.0113 63.3601 69.0137 175.4978 13 R 4.5443 7.8980 117.2053 55.9229 30.5511 176.7074 14 H 4.0583 8.3652 119.4274 59.8321 29.7141 176.6478 15 A 3.8802 8.0704 121.7533 55.4133 18.1301 179.3895 16 S 4.0187 7.9738 110.8943 61.6437 62.5429 175.9492 17 D 4.3216 8.5026 122.0963 57.1002 40.4929 178.9171 18 V 3.4551 8.1143 119.2064 65.9408 31.5720 177.7681 19 L 3.8678 8.1771 120.4813 58.0486 41.7754 178.7159 20 L 3.9483 8.0996 120.2875 58.3330 42.1668 178.7964 21 N 4.3517 8.2219 116.2257 56.0733 38.3667 177.3728 22 L 4.0884 7.8693 120.7684 57.5061 41.6744 178.7905 23 N 4.4187 8.2735 117.1923 56.2642 38.7918 177.3014 24 R 3.8749 8.1239 119.8860 59.2293 30.1731 178.6514 25 L 3.9568 7.7589 118.5260 57.9720 41.5934 179.3498 26 R 3.8372 7.9952 118.5511 59.7834 29.7129 178.7057 27 S 4.1143 8.0505 112.6141 60.8571 62.9121 175.4903 28 R 4.3592 7.7936 119.5544 54.4320 30.6046 175.6540 29 D 4.3377 7.7958 117.1021 55.2106 40.5757 173.5437 30 I 4.2675 8.2361 118.6678 60.7980 38.8002 176.6889 31 L 3.7083 8.8230 122.5273 55.2797 39.6543 174.8548 32 T 3.7627 7.4338 108.5867 62.1050 68.8836 173.6040 33 D 4.8130 8.0660 122.2655 52.5304 40.5224 175.1420 34 V 4.4229 7.0044 116.6325 62.1319 34.3577 170.9365 35 V 4.8947 8.0784 120.5304 61.3701 34.7062 174.0343 36 I 4.7939 9.2285 129.6332 60.1519 39.0393 174.7496 37 V 4.5877 9.0229 128.2448 61.5874 33.1687 174.7967 38 V 4.4126 8.6045 128.3283 61.2554 31.5086 177.1952 39 S 3.8451 8.5668 126.3533 58.7786 60.3640 173.8173 40 R 4.0358 8.6401 122.3497 59.9852 30.3569 177.1267 41 E 4.0629 7.5838 114.5453 56.0431 30.1335 175.5471 42 Q 5.0859 7.8954 120.5122 54.1656 32.5580 175.0612 43 F 4.8803 8.9516 119.5583 56.1224 43.1462 174.1228 44 R 4.9007 8.8469 122.7799 55.7962 31.6378 175.4610 45 A 4.4714 8.4618 122.8000 51.9330 23.8678 174.3394 46 H 5.1671 9.2598 116.2527 54.2043 30.5208 176.5284 47 K 3.3254 9.0546 125.2935 59.7433 31.7420 179.4466 48 T 3.9237 7.7529 109.3010 64.8010 68.6756 176.5331 49 V 3.3883 7.5776 120.4565 65.6559 31.5610 177.8114 50 L 4.0837 7.7775 118.7138 58.1638 41.1836 179.4909 51 M 4.3629 8.5782 117.7905 58.4313 32.0005 178.2949 52 A 4.1586 8.1387 120.1215 55.0997 18.6197 178.7652 53 C 4.4369 7.9295 113.1250 59.5673 29.2643 174.1038 54 S 4.7753 8.2479 115.7067 55.6475 64.8138 174.7187 55 G 3.6390 8.5076 113.5540 48.0416 0.0000 175.0665 56 L 3.7216 7.4502 122.5623 58.3417 41.9381 179.0654 57 F 4.3314 7.6769 116.5973 60.6868 38.7125 177.1749 58 Y 4.1955 8.3121 118.8783 61.0154 38.8169 178.1672 59 S 4.2039 8.6996 116.3559 61.4590 63.0160 176.7101 60 I 3.5019 7.8953 122.8137 64.3632 36.6851 177.8584 61 F 4.6765 7.3675 114.6547 58.4889 38.9243 176.5961 62 T 4.3679 7.1740 112.8970 61.7428 66.6162 173.7320 63 D 4.4377 7.5481 120.9918 53.5548 40.8622 176.1964 64 Q 4.1820 8.8577 126.2906 59.3402 28.0115 177.9105 65 L 4.1189 8.2973 121.6843 57.0602 42.5909 177.4429 66 K 4.5047 7.8880 118.7899 57.3626 33.0960 178.6024 67 R 4.2636 8.0601 122.5488 59.4001 30.2455 176.6182 68 N 4.8471 7.9544 111.6826 52.6965 39.3786 175.0843 69 L 4.1799 7.8566 118.8164 55.3477 42.4123 176.6983 70 S 4.8246 8.5719 114.9554 58.0458 64.4876 173.2259 71 V 4.9773 7.5546 119.3227 62.2208 34.5266 173.4828 72 I 4.7823 9.1383 128.1398 59.6260 40.9742 173.9127 73 N 5.4593 8.9375 123.2204 51.6051 40.6989 174.1389 74 L 4.8429 8.2694 122.6700 52.3574 44.9612 175.8910 75 D 4.2624 7.9156 119.2198 54.3243 41.2958 176.0658 76 P 4.3516 0.0000 0.0000 64.9769 31.3636 176.7050 77 E 4.1151 8.6363 117.8855 56.9365 29.6943 176.6373 78 I 3.8585 7.4581 121.0564 60.2148 36.6961 175.9143 79 N 4.5253 8.5911 125.0738 52.0510 38.5271 173.5799 80 P 4.5124 0.0000 0.0000 65.9047 31.4888 178.1542 81 E 4.0815 8.3345 117.3776 59.3371 29.4202 178.7774 82 G 3.7224 8.1983 105.2914 47.8938 0.0000 175.1906 83 F 4.0969 8.2275 122.7124 61.0145 39.4077 176.7414 84 N 3.8905 8.7176 117.0522 56.6411 38.7155 176.8561 85 I 3.6949 7.8773 121.2600 64.3787 37.1829 178.4410 86 L 4.0860 7.5362 119.5819 57.4391 41.1932 179.2659 87 L 3.8373 7.4553 119.9818 57.9674 42.2957 178.4606 88 D 4.4988 8.2142 118.9497 57.4148 40.8152 178.1839 89 F 4.8543 8.0757 122.3781 61.1332 39.0344 176.9119 90 M 3.4838 7.8478 116.4771 58.5108 31.9620 177.7637 91 Y 4.2984 7.6337 112.5969 58.5479 38.5091 176.0256 92 T 4.4693 6.9958 106.9971 60.0333 70.3657 175.0567 93 S 3.8294 8.2848 117.2417 58.5497 61.8335 169.6945 94 R 4.6416 7.7588 120.2332 54.0386 31.8597 174.7116 95 L 4.8773 8.4902 123.8176 53.2614 43.5038 175.1815 96 N 4.7263 8.7001 124.3573 51.9980 39.2203 174.6010 97 L 4.7579 8.2610 122.8888 52.7639 45.0482 176.1318 98 R 4.7083 9.3566 121.9212 53.9310 32.5612 176.8511 99 E 3.9957 8.9977 121.8557 58.7345 29.6345 177.9387 100 G 3.9360 8.0367 105.4740 46.1411 0.0000 174.2783 101 N 4.9136 8.0953 116.6564 52.3651 37.9037 176.0222 102 I 3.5966 7.6878 121.7086 64.8731 38.1315 177.0222 103 M 3.9905 8.1900 118.5683 58.6235 31.7501 178.5133 104 A 3.9852 7.9905 120.0597 55.0999 18.6042 179.6154 105 V 3.5162 7.8798 116.7410 66.4114 31.5550 178.0744 106 M 3.9722 8.1849 118.1410 58.3701 31.7097 178.4337 107 A 4.0067 8.1154 120.8085 55.7003 18.5671 179.8796 108 T 3.9170 8.2905 114.2212 66.7894 68.5093 176.8601 109 A 4.0540 8.5866 123.0732 55.3135 18.4569 179.4218 110 M 3.9722 8.2967 117.4284 58.7935 31.8364 178.3174 111 Y 4.1636 7.5060 118.3327 60.7174 39.1094 177.6054 112 L 3.7175 8.0180 117.6151 54.3193 42.8316 176.1765 113 Q 3.7511 7.7757 116.6312 57.3691 26.5089 174.3071 114 M 4.9916 7.9227 118.0300 53.1751 32.4131 176.9371 115 E 3.9260 8.2188 122.4039 59.7421 30.1304 178.5210 116 H 4.1859 8.1715 115.5908 58.9236 28.8479 177.8882 117 V 3.4206 7.6939 119.5264 65.7857 31.3616 178.0794 118 V 3.5390 7.6812 117.9828 66.0806 31.3668 177.5733 119 D 4.3356 8.4965 118.1966 57.5813 41.0335 178.3660 120 T 3.9111 8.0596 116.5597 66.6923 68.3509 176.5117 121 C 4.1995 8.1499 118.7306 62.6426 28.2271 175.9399 122 R 3.8836 8.1056 120.3159 59.5837 29.4804 178.3620 123 K 3.9174 8.0198 117.7841 59.4173 32.2251 178.2372 124 F 4.3210 8.2756 120.8923 61.5058 39.6083 177.2191 125 I 3.5138 8.0989 119.4929 64.2137 36.6558 178.2726 126 K 4.1262 7.8461 117.1728 57.9249 31.8129 177.7629 127 A 4.4373 7.0247 118.4564 53.2898 20.5647 176.4730 128 S 4.1209 7.5504 116.6590 58.6055 62.9931 174.1704 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 6 D 8.36 4.64 0.00 2.67 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 7 S 8.37 4.54 0.00 3.87 3.71 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 8 Q 9.11 4.33 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.81 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 9 I 8.44 4.10 1.98 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 1.38 0.72 0.44 0.00 0.00 10 Q 8.39 4.45 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.13 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 11 F 8.82 4.28 0.00 3.14 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 12 T 8.44 4.05 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 13 R 7.90 4.54 0.00 2.00 2.18 0.00 3.01 0.00 0.00 3.30 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 14 H 8.37 4.06 0.00 3.33 3.52 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.07 3.88 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 16 S 7.97 4.02 0.00 3.89 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 17 D 8.50 4.32 0.00 2.79 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 18 V 8.11 3.46 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 0.91 0.00 0.00 0.70 0.00 0.00 19 L 8.18 3.87 0.00 1.76 1.72 0.71 0.33 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 20 L 8.10 3.95 0.00 1.79 1.78 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.22 4.35 0.00 3.07 2.84 0.00 0.00 7.08 6.73 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 22 L 7.87 4.09 0.00 1.92 1.79 0.79 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 23 N 8.27 4.42 0.00 3.16 2.96 0.00 0.00 7.14 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 24 R 8.12 3.87 0.00 2.04 1.96 0.00 3.36 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.82 0.00 25 L 7.76 3.96 0.00 1.94 2.01 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.00 3.84 0.00 1.82 1.70 0.00 2.77 0.00 0.00 2.62 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.64 0.00 27 S 8.05 4.11 0.00 4.03 3.94 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 28 R 7.79 4.36 0.00 1.79 1.97 0.00 3.30 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 29 D 7.80 4.34 0.00 2.69 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 30 I 8.24 4.27 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 1.29 0.93 0.92 0.00 0.00 31 L 8.82 3.71 0.00 1.82 1.81 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 32 T 7.43 3.76 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 1.09 0.00 0.00 33 D 8.07 4.81 0.00 2.71 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.00 4.42 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 0.46 0.00 0.00 1.06 0.00 0.00 35 V 8.08 4.89 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.94 0.00 0.00 36 I 9.23 4.79 2.13 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.06 0.93 0.00 0.00 37 V 9.02 4.59 2.29 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 0.98 0.00 0.00 0.95 0.00 0.00 38 V 8.60 4.41 2.32 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 0.86 0.00 0.00 0.50 0.00 0.00 39 S 8.57 3.85 0.00 4.12 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 8.64 4.04 0.00 1.78 1.97 0.00 3.19 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 41 E 7.58 4.06 0.00 2.17 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 2.24 2.25 0.00 42 Q 7.90 5.09 0.00 1.74 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.71 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 43 F 8.95 4.88 0.00 3.20 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 44 R 8.85 4.90 0.00 1.68 1.81 0.00 3.22 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 45 A 8.46 4.47 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 46 H 9.26 5.17 0.00 3.29 3.22 0.00 5.84 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 47 K 9.05 3.33 0.00 1.40 1.07 0.00 1.33 0.00 0.00 0.96 0.00 0.00 2.78 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.30 1.16 7.81 48 T 7.75 3.92 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 1.17 0.00 0.00 49 V 7.58 3.39 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 0.08 0.00 0.00 0.70 0.00 0.00 50 L 7.78 4.08 0.00 1.84 1.32 0.52 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 51 M 8.58 4.36 0.00 2.22 2.44 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.10 3.03 0.00 52 A 8.14 4.16 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 53 C 7.93 4.44 0.00 3.08 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 54 S 8.25 4.78 0.00 3.98 4.19 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 55 G 8.51 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 0.00 0.00 0.00 56 L 7.45 3.72 0.00 1.46 1.10 0.54 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 57 F 7.68 4.33 0.00 3.48 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 0.00 58 Y 8.31 4.20 0.00 3.08 3.29 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 59 S 8.70 4.20 0.00 3.95 3.87 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 0.00 0.00 0.00 60 I 7.90 3.50 1.36 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.13 0.42 0.00 0.00 61 F 7.37 4.68 0.00 3.05 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 62 T 7.17 4.37 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 1.20 0.00 0.00 63 D 7.55 4.44 0.00 2.82 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 64 Q 8.86 4.18 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.89 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 65 L 8.30 4.12 0.00 1.91 1.56 0.92 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.89 4.50 0.00 2.03 1.87 0.00 1.57 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.67 1.53 7.81 67 R 8.06 4.26 0.00 2.01 2.17 0.00 3.25 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.85 0.00 68 N 7.95 4.85 0.00 2.77 2.84 0.00 0.00 6.92 7.85 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 69 L 7.86 4.18 0.00 1.73 1.66 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 70 S 8.57 4.82 0.00 3.89 4.06 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 71 V 7.55 4.98 2.12 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 0.80 0.00 0.00 0.96 0.00 0.00 72 I 9.14 4.78 2.08 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 1.44 0.92 1.05 0.00 0.00 73 N 8.94 5.46 0.00 2.60 2.72 0.00 0.00 6.92 7.85 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 74 L 8.27 4.84 0.00 1.47 1.63 0.74 1.22 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 75 D 7.92 4.26 0.00 2.65 2.17 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 76 P 0.00 4.35 0.00 2.19 2.14 0.00 3.76 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 1.95 1.96 0.00 77 E 8.64 4.12 0.00 2.04 1.98 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 2.32 2.37 0.00 78 I 7.46 3.86 1.81 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.12 0.91 0.00 0.00 79 N 8.59 4.53 0.00 2.95 2.98 0.00 0.00 6.14 7.76 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 80 P 0.00 4.51 0.00 2.42 2.48 0.00 3.67 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.48 0.00 81 E 8.33 4.08 0.00 2.10 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 2.42 2.43 0.00 82 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 83 F 8.23 4.10 0.00 3.22 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 0.00 84 N 8.72 3.89 0.00 2.93 3.04 0.00 0.00 7.27 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 85 I 7.88 3.69 2.01 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 1.52 0.78 0.96 0.00 0.00 86 L 7.54 4.09 0.00 1.63 1.65 0.96 0.25 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 87 L 7.46 3.84 0.00 0.85 1.49 1.01 1.45 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 88 D 8.21 4.50 0.00 3.00 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 89 F 8.08 4.85 0.00 3.23 3.24 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 90 M 7.85 3.48 0.00 1.86 2.39 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.03 2.67 0.00 91 Y 7.63 4.30 0.00 2.86 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 92 T 7.00 4.47 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 1.29 0.00 0.00 93 S 8.28 3.83 0.00 3.99 4.08 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 0.00 0.00 0.00 0.00 94 R 7.76 4.64 0.00 1.91 1.84 0.00 3.08 0.00 0.00 3.11 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 95 L 8.49 4.88 0.00 1.49 1.46 0.73 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 96 N 8.70 4.73 0.00 2.75 2.74 0.00 0.00 6.96 7.85 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 97 L 8.26 4.76 0.00 1.37 1.41 0.51 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 98 R 9.36 4.71 0.00 1.94 1.81 0.00 3.16 0.00 0.00 3.11 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 99 E 9.00 4.00 0.00 1.97 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 0.00 2.34 2.39 0.00 100 G 8.04 3.94 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 0.00 101 N 8.10 4.91 0.00 2.98 3.11 0.00 0.00 6.43 7.22 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 0.00 102 I 7.69 3.60 1.92 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 1.60 1.72 0.98 0.00 0.00 103 M 8.19 3.99 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 104 A 7.99 3.99 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 0.00 105 V 7.88 3.52 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 0.83 0.00 0.00 0.94 0.00 0.00 106 M 8.18 3.97 0.00 2.10 2.23 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 2.77 2.55 0.00 107 A 8.12 4.01 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 0.00 108 T 8.29 3.92 4.40 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 1.41 0.00 0.00 109 A 8.59 4.05 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 0.00 110 M 8.30 3.97 0.00 2.07 2.37 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.84 0.00 111 Y 7.51 4.16 0.00 2.83 3.29 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 0.00 112 L 8.02 3.72 0.00 1.86 1.61 1.15 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 7.78 3.75 0.00 2.37 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.88 0.00 0.00 0.00 0.00 0.00 2.20 2.12 0.00 114 M 7.92 4.99 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.72 0.00 115 E 8.22 3.93 0.00 1.99 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 2.36 2.43 0.00 116 H 8.17 4.19 0.00 3.23 3.36 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 0.00 117 V 7.69 3.42 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 0.71 0.00 0.00 0.37 0.00 0.00 118 V 7.68 3.54 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 0.93 0.00 0.00 1.01 0.00 0.00 119 D 8.50 4.34 0.00 2.87 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 0.00 120 T 8.06 3.91 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 1.20 0.00 0.00 121 C 8.15 4.20 0.00 3.17 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 0.00 122 R 8.11 3.88 0.00 1.89 2.12 0.00 3.11 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 123 K 8.02 3.92 0.00 1.82 2.09 0.00 1.88 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.48 7.81 124 F 8.28 4.32 0.00 3.29 3.26 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 0.00 125 I 8.10 3.51 2.00 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 1.61 1.02 0.89 0.00 0.00 126 K 7.85 4.13 0.00 1.88 1.84 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.64 7.81 127 A 7.02 4.44 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 0.00 128 S 7.55 4.12 0.00 2.78 3.44 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