NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.2075 8.3344 116.7707 58.3262 64.2035 174.2915 5 V 3.5136 8.5566 130.1171 62.2507 32.0182 169.4543 6 V 4.1855 8.9474 128.6840 61.6018 33.8952 174.6555 7 K 4.7420 8.1345 124.1808 54.3394 35.7585 177.0815 8 S 4.1893 8.9401 118.3830 62.1108 62.7371 176.6258 9 E 4.2994 8.1809 113.4152 57.6847 29.3436 176.6662 10 D 4.6193 7.9581 119.3380 54.4001 41.2629 177.6548 11 Y 4.0854 7.6045 118.1700 59.7916 37.7439 177.4888 12 A 4.1417 7.0825 120.7866 52.8137 19.0405 176.7634 13 L 4.7239 7.3767 115.7264 51.6738 43.9316 174.7980 14 P 4.3002 0.0000 0.0000 63.0143 31.6861 175.9067 15 S 4.8392 8.3731 115.7701 56.4664 66.0286 172.2112 16 Y 4.5715 8.3100 120.8647 56.4326 39.8039 174.8483 17 V 4.3086 6.8204 117.5130 59.9042 35.6839 174.5600 18 D 4.6442 8.4810 123.4638 52.6391 41.2338 175.7630 19 R 4.5114 7.8316 123.6914 54.1078 33.3566 175.8482 20 R 3.4251 8.7205 124.4797 59.3267 30.1124 177.2098 21 D 4.7464 7.9797 113.4919 53.8169 39.0977 175.9033 22 Y 4.7197 7.8579 120.8152 55.2872 38.8052 173.4815 23 P 4.5684 0.0000 0.0000 65.2276 31.7618 177.0895 24 L 4.6808 6.6989 118.9905 51.4163 41.0559 174.2931 25 P 4.6499 0.0000 0.0000 62.3123 32.0521 176.7001 26 D 4.5697 8.7719 119.3034 56.8020 40.9661 177.0949 27 V 4.5480 7.4554 109.4958 59.0336 35.5718 174.7532 28 A 4.3891 8.2754 123.9571 51.6980 19.3610 177.1951 29 H 3.7012 8.6216 122.0466 58.3433 29.8872 175.8738 30 V 4.2045 7.7422 118.7906 60.7934 32.9942 174.7336 31 K 4.2468 8.6023 126.2059 57.8673 33.8336 176.5288 32 N 4.7011 7.9148 116.7937 51.8601 39.4650 174.1518 33 L 4.7280 8.1736 122.7947 52.5865 44.6910 177.2042 34 S 4.4752 8.2675 117.1263 57.2763 65.6228 174.9559 35 A 3.9938 8.4636 122.6212 55.4791 17.8857 179.8773 36 S 4.0844 7.9601 112.0786 61.7760 63.1667 176.4447 37 Q 3.9663 7.8192 122.1138 58.5736 28.5537 179.0670 38 K 3.9494 8.2649 119.1643 59.2309 31.9103 179.3269 39 A 4.0081 7.7013 121.4742 54.8999 18.1988 179.4503 40 L 3.8949 8.1394 119.1591 58.3679 42.0178 179.4383 41 K 3.9983 8.0952 117.2229 59.3310 32.1650 178.9122 42 E 4.1595 8.0901 119.0681 59.1288 29.4202 179.0945 43 K 4.0269 8.3359 119.9975 59.3298 32.0276 178.4027 44 E 4.2219 8.3481 119.0599 58.7316 29.5997 178.3422 45 K 4.2493 7.9539 116.9005 57.7645 32.4347 176.5605 46 A 4.4727 7.6522 122.3227 50.0431 20.8770 176.4284 47 S 3.9793 8.3216 112.6269 58.6284 62.8117 175.3306 48 W 4.6673 8.4451 126.4957 59.1833 29.2871 178.5938 49 S 4.2660 7.7901 114.7045 61.5516 62.2660 175.5093 50 S 4.4070 7.8294 113.8558 59.3669 62.8573 174.1613 51 L 4.5405 7.6069 121.9545 53.9562 42.3871 177.5216 52 S 4.5496 9.3815 118.7262 57.4336 65.4653 175.5106 53 I 3.6643 8.2541 123.3350 65.0707 36.9690 178.4520 54 D 4.3565 8.1130 118.6656 57.2969 40.6197 178.5981 55 E 4.0646 7.9012 119.4151 59.0005 29.4984 179.3616 56 K 3.9512 8.2262 118.9191 59.5322 32.1795 179.6659 57 V 3.6965 8.1023 118.6175 65.6776 31.1441 177.7273 58 E 4.0137 7.8799 118.6870 58.9962 29.8353 178.4361 59 L 4.1062 7.9714 119.1696 57.8554 41.7201 178.7348 60 Y 4.0966 8.1508 119.4239 60.8922 38.6268 178.1320 61 R 4.5477 7.9436 117.4844 57.3810 30.4087 178.3106 62 L 4.1382 7.6112 119.3635 57.0131 41.7253 178.9942 63 K 3.5775 7.6230 118.9880 57.7989 32.4426 176.3430 64 F 5.1873 7.3492 117.1905 55.3752 41.1860 175.4285 65 K 3.6111 8.2661 124.2041 57.1829 32.3973 176.4034 66 E 4.9363 9.0354 118.3711 54.4377 32.2390 176.4323 67 S 5.0430 9.0703 119.2372 56.8904 65.8140 175.5658 68 F 3.8988 8.9290 119.6529 60.6775 38.3643 177.6561 69 A 4.0856 8.1067 118.6082 55.2805 18.3503 179.1426 70 E 4.1090 8.2008 116.8302 59.7562 29.4027 179.4846 71 M 4.2900 7.9949 117.2657 57.4518 31.3276 177.3339 72 N 4.6890 7.9097 115.0710 52.0582 39.3798 175.5425 73 R 4.0505 7.1086 118.4130 56.0799 30.0582 176.7975 74 S 4.5620 8.3601 115.3418 57.8351 64.4158 172.3520 75 T 4.7529 8.0119 109.8614 60.5141 71.9183 173.1781 76 N 4.7971 8.4659 115.5033 53.2079 38.9933 176.6885 77 E 3.9322 8.1223 121.8648 59.1716 29.4157 178.8222 78 W 4.3357 8.3823 116.2776 59.5756 27.8866 178.3346 79 K 3.0983 6.7224 118.8078 59.2542 31.3414 179.4618 80 T 3.7700 7.5191 115.4463 66.4065 68.3991 176.8292 81 V 3.5963 7.9199 120.1575 66.0784 31.6907 178.2608 82 V 3.7827 8.3217 118.5139 65.9722 31.4391 178.2067 83 G 3.6016 8.3418 105.3877 47.8200 0.0000 175.5663 84 A 4.1460 8.3246 123.3280 54.6724 18.3958 179.5112 85 A 4.1378 8.3551 119.3992 55.8848 18.4602 179.8646 86 M 4.1049 8.2882 117.1199 58.2692 31.9519 178.8568 87 F 4.0513 8.2816 120.9477 61.4299 39.5971 177.3481 88 F 4.0934 8.4365 117.4215 60.3830 38.4316 177.8226 89 I 3.9948 7.9513 119.1894 63.9940 37.0556 178.3753 90 G 3.6366 8.1547 107.0564 47.6976 0.0000 175.5890 91 F 3.9960 8.1738 123.5631 61.1942 39.2500 177.3231 92 T 3.6984 7.9276 115.3294 66.4474 68.1453 176.3875 93 A 4.0249 7.7835 122.3429 54.9342 18.2035 179.7315 94 L 3.8719 7.4614 117.4683 57.8604 41.5599 179.5909 95 L 3.8729 7.3182 118.4790 57.7346 41.5533 179.4174 96 L 4.0356 7.9812 118.9934 57.6485 41.5114 179.6495 97 I 3.7179 7.9704 120.1214 64.0584 37.0916 178.1713 98 W 4.2000 8.5018 129.4595 60.4177 30.5455 177.5354 99 E 3.8591 8.7177 119.3550 59.3109 28.9224 178.6220 100 K 4.0876 7.9240 118.2126 59.7911 32.2467 177.8932 101 H 4.0678 7.9656 117.5601 58.8969 29.9343 176.0763 102 Y 4.1206 7.6539 116.2702 57.9868 38.4849 176.7233 103 V 3.9619 7.4854 118.4314 64.4818 32.6732 175.8526 104 Y 4.5580 7.5780 116.3384 57.9097 38.4289 175.9270 105 G 4.1146 8.3133 113.8858 43.4042 0.0000 171.2555 106 P 4.3541 0.0000 0.0000 62.2787 32.0068 176.1026 107 I 4.0066 7.7952 113.9386 59.1490 39.1036 173.7183 108 P 4.3303 0.0000 0.0000 62.8688 31.8448 177.5066 109 H 4.3321 8.4807 116.0948 57.9247 28.5344 176.9956 110 T 2.6641 7.0022 109.1811 62.6930 68.6199 174.7950 111 F 4.4695 7.6017 119.8070 58.0281 39.8031 176.6917 112 E 4.1692 8.0040 121.6234 56.0836 31.0815 176.9985 113 E 3.9697 9.0387 123.6165 59.7509 29.5803 179.1406 114 E 3.9061 8.2239 118.3262 59.0296 29.8748 178.1826 115 W 3.8676 8.3226 127.8990 60.6418 30.7256 177.8279 116 V 3.7930 8.3780 118.0791 65.9559 30.9781 177.8703 117 A 4.0539 7.9922 120.5674 55.0183 18.1500 179.8510 118 K 3.7912 8.0931 117.0420 59.5383 32.0489 179.3472 119 Q 3.8576 8.3478 120.1958 59.5670 28.9940 178.5418 120 T 4.0414 8.3628 117.1337 66.3928 68.4703 176.5757 121 K 3.5891 7.7960 121.3302 59.4549 32.2045 178.6572 122 R 3.8446 8.0885 119.2298 59.9179 29.8449 178.2759 123 M 4.0510 8.4001 118.6240 58.4611 31.8014 178.7810 124 L 4.1254 7.8768 119.0255 57.6600 41.4681 179.2374 125 D 4.4276 8.3028 119.1477 56.9336 40.8584 177.6015 126 M 4.2709 8.2186 114.9533 54.0545 32.5553 176.0093 127 K 4.1970 7.6775 117.5504 56.2912 30.4196 176.2011 128 V 3.4579 8.1938 118.3363 64.5165 32.8821 175.1285 129 A 4.1124 8.7453 129.2868 52.9264 15.5563 175.5294 130 P 4.5134 0.0000 0.0000 64.2116 32.6811 178.7614 131 I 4.1306 7.8263 119.4218 63.8602 37.6193 176.0134 132 Q 4.6874 7.9889 114.3321 57.3165 35.3467 176.2474 133 G 3.8170 8.4340 105.7165 48.1613 0.0000 172.8865 134 F 4.8406 8.2602 121.2639 59.1723 41.9557 176.7598 135 S 4.2943 9.2569 116.8525 61.3681 63.0797 176.6858 136 A 4.2910 8.2262 121.7453 54.2121 18.3945 177.8785 137 K 4.4734 8.4336 114.7706 55.9481 32.6128 175.6226 138 W 4.5973 7.9075 129.8074 55.2360 32.4127 174.8208 139 D 4.4625 8.0185 126.0496 53.0324 39.8529 176.4299 140 Y 4.2836 8.4608 125.4977 60.8705 38.4362 177.8988 141 D 4.4906 8.2929 118.9394 57.4060 41.0919 177.7207 142 K 3.9758 8.3064 115.2842 56.4197 32.6260 176.2943 143 N 3.9760 7.3957 116.9474 53.3842 37.7192 172.0366 144 E 3.4464 5.9000 113.6908 54.3514 33.4196 175.6693 145 W 4.4547 7.8665 120.5554 56.3955 29.6524 176.6013 146 K 3.8766 8.7500 124.5372 56.6425 32.2718 177.3400 147 K 4.1387 8.5194 122.4171 56.7897 32.0649 176.9056 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 4 S 8.33 4.21 0.00 3.81 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.56 3.51 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 0.72 0.00 0.00 0.91 0.00 0.00 6 V 8.95 4.19 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 0.90 0.00 0.00 1.02 0.00 0.00 7 K 8.13 4.74 0.00 1.81 1.65 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.41 7.81 8 S 8.94 4.19 0.00 3.92 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 9 E 8.18 4.30 0.00 2.03 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 0.00 2.29 2.28 0.00 10 D 7.96 4.62 0.00 3.10 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 11 Y 7.60 4.09 0.00 3.06 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 12 A 7.08 4.14 0.95 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 0.00 0.00 13 L 7.38 4.72 0.00 1.74 1.56 0.87 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.30 0.00 2.06 2.03 0.00 3.61 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 2.04 2.09 0.00 15 S 8.37 4.84 0.00 3.99 3.86 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 16 Y 8.31 4.57 0.00 2.99 2.93 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 17 V 6.82 4.31 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 0.66 0.00 0.00 0.80 0.00 0.00 18 D 8.48 4.64 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.83 4.51 0.00 1.72 1.70 0.00 3.52 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 20 R 8.72 3.43 0.00 1.81 2.06 0.00 3.52 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.46 0.00 21 D 7.98 4.75 0.00 2.84 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 22 Y 7.86 4.72 0.00 2.97 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 P 0.00 4.57 0.00 2.30 2.45 0.00 3.71 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.05 0.00 24 L 6.70 4.68 0.00 1.62 1.66 0.95 1.21 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 25 P 0.00 4.65 0.00 2.09 1.69 0.00 3.91 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 2.04 0.00 26 D 8.77 4.57 0.00 2.74 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 27 V 7.46 4.55 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 0.79 0.00 0.00 1.12 0.00 0.00 28 A 8.28 4.39 1.15 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 29 H 8.62 3.70 0.00 2.54 3.33 0.00 5.89 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.74 4.20 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 0.84 0.00 0.00 0.74 0.00 0.00 31 K 8.60 4.25 0.00 1.87 1.88 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.41 7.81 32 N 7.91 4.70 0.00 2.70 2.77 0.00 0.00 6.72 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 33 L 8.17 4.73 0.00 1.58 1.52 0.90 0.90 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 34 S 8.27 4.48 0.00 4.04 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 35 A 8.46 3.99 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 36 S 7.96 4.08 0.00 4.06 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 37 Q 7.82 3.97 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 38 K 8.26 3.95 0.00 1.81 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.18 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.65 7.81 39 A 7.70 4.01 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 40 L 8.14 3.89 0.00 1.76 1.87 0.94 1.02 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 41 K 8.10 4.00 0.00 1.89 1.87 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.67 1.62 7.81 42 E 8.09 4.16 0.00 2.19 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 2.56 2.46 0.00 43 K 8.34 4.03 0.00 1.93 2.01 0.00 1.67 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 44 E 8.35 4.22 0.00 2.16 2.26 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 2.63 2.37 0.00 45 K 7.95 4.25 0.00 1.92 1.88 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.53 1.75 7.81 46 A 7.65 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 47 S 8.32 3.98 0.00 3.80 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.45 4.67 0.00 3.49 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 49 S 7.79 4.27 0.00 3.85 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 S 7.83 4.41 0.00 3.98 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 51 L 7.61 4.54 0.00 2.05 1.64 1.03 0.96 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 52 S 9.38 4.55 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.25 3.66 1.87 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 1.64 0.89 0.90 0.00 0.00 54 D 8.11 4.36 0.00 2.72 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 55 E 7.90 4.06 0.00 2.22 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 2.36 0.00 56 K 8.23 3.95 0.00 1.97 1.82 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.40 1.58 7.81 57 V 8.10 3.70 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 1.02 0.00 0.00 0.92 0.00 0.00 58 E 7.88 4.01 0.00 2.23 2.15 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 2.33 2.36 0.00 59 L 7.97 4.11 0.00 1.97 1.66 0.86 0.50 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 60 Y 8.15 4.10 0.00 3.22 3.18 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 61 R 7.94 4.55 0.00 1.90 2.03 0.00 3.47 0.00 0.00 3.39 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.77 0.00 62 L 7.61 4.14 0.00 1.78 1.62 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.62 3.58 0.00 1.46 1.28 0.00 1.12 0.00 0.00 1.46 0.00 0.00 2.76 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.30 0.21 7.81 64 F 7.35 5.19 0.00 2.59 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 65 K 8.27 3.61 0.00 1.03 1.99 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.25 7.81 66 E 9.04 4.94 0.00 2.31 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 2.27 2.24 0.00 67 S 9.07 5.04 0.00 4.12 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 8.93 3.90 0.00 3.04 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 8.11 4.09 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 70 E 8.20 4.11 0.00 2.23 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 2.36 2.35 0.00 71 M 7.99 4.29 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 72 N 7.91 4.69 0.00 2.92 2.91 0.00 0.00 7.04 6.94 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 73 R 7.11 4.05 0.00 1.91 1.96 0.00 3.08 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.59 0.00 74 S 8.36 4.56 0.00 4.06 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 T 8.01 4.75 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 1.25 0.00 0.00 76 N 8.47 4.80 0.00 2.72 2.70 0.00 0.00 6.44 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 77 E 8.12 3.93 0.00 2.07 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 2.35 2.35 0.00 78 W 8.38 4.34 0.00 3.67 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 79 K 6.72 3.10 0.00 1.44 1.36 0.00 1.27 0.00 0.00 1.23 0.00 0.00 2.87 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.52 3.77 4.30 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 1.18 0.00 0.00 81 V 7.92 3.60 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 1.06 0.00 0.00 1.02 0.00 0.00 82 V 8.32 3.78 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 1.09 0.00 0.00 1.21 0.00 0.00 83 G 8.34 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 84 A 8.32 4.15 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.36 4.14 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 86 M 8.29 4.10 0.00 2.15 2.34 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 3.04 2.61 0.00 87 F 8.28 4.05 0.00 3.05 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 88 F 8.44 4.09 0.00 3.27 3.08 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 89 I 7.95 3.99 1.91 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 1.51 0.70 0.93 0.00 0.00 90 G 8.15 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 91 F 8.17 4.00 0.00 2.34 2.93 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 92 T 7.93 3.70 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 1.19 0.00 0.00 93 A 7.78 4.02 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 94 L 7.46 3.87 0.00 1.47 1.56 0.93 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.32 3.87 0.00 1.71 1.59 0.79 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.98 4.04 0.00 1.86 1.74 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 97 I 7.97 3.72 2.07 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 1.41 0.88 0.92 0.00 0.00 98 W 8.50 4.20 0.00 3.49 3.38 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 99 E 8.72 3.86 0.00 2.32 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 0.00 1.60 2.15 0.00 100 K 7.92 4.09 0.00 1.85 1.99 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.50 7.81 101 H 7.97 4.07 0.00 2.98 3.19 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.65 4.12 0.00 1.43 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 0.00 0.00 0.00 0.00 103 V 7.49 3.96 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 0.67 0.00 0.00 0.85 0.00 0.00 104 Y 7.58 4.56 0.00 3.11 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 0.00 105 G 8.31 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 P 0.00 4.35 0.00 2.16 2.02 0.00 3.74 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 1.95 1.92 0.00 107 I 7.80 4.01 1.52 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.50 0.61 0.00 0.00 108 P 0.00 4.33 0.00 2.27 1.89 0.00 3.70 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 2.17 2.07 0.00 109 H 8.48 4.33 0.00 3.26 3.48 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.00 2.66 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 0.07 0.00 0.00 111 F 7.60 4.47 0.00 3.18 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 0.00 112 E 8.00 4.17 0.00 2.32 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 2.40 2.39 0.00 113 E 9.04 3.97 0.00 2.09 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 2.44 2.47 0.00 114 E 8.22 3.91 0.00 2.13 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 2.38 2.37 0.00 115 W 8.32 3.87 0.00 3.58 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.38 3.79 2.31 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 1.11 0.00 0.00 1.14 0.00 0.00 117 A 7.99 4.05 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 0.00 118 K 8.09 3.79 0.00 1.63 1.59 0.00 1.42 0.00 0.00 1.26 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.45 7.81 119 Q 8.35 3.86 0.00 2.24 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 120 T 8.36 4.04 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 121 K 7.80 3.59 0.00 1.70 1.86 0.00 1.53 0.00 0.00 1.49 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.28 7.81 122 R 8.09 3.84 0.00 1.81 2.01 0.00 3.07 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 123 M 8.40 4.05 0.00 1.97 2.36 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.47 0.00 124 L 7.88 4.13 0.00 1.52 1.26 -0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.30 4.43 0.00 2.74 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 0.00 126 M 8.22 4.27 0.00 2.13 2.15 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 2.84 0.00 127 K 7.68 4.20 0.00 1.85 1.92 0.00 1.52 0.00 0.00 1.19 0.00 0.00 2.51 0.00 0.00 2.21 0.00 0.00 0.00 0.00 1.54 1.24 7.81 128 V 8.19 3.46 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 0.79 0.00 0.00 0.91 0.00 0.00 129 A 8.75 4.11 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 130 P 0.00 4.51 0.00 2.25 2.37 0.00 3.82 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 131 I 7.83 4.13 1.91 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 1.44 0.46 0.95 0.00 0.00 132 Q 7.99 4.69 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 133 G 8.43 3.82 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 0.00 0.00 0.00 134 F 8.26 4.84 0.00 3.05 3.22 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 0.00 135 S 9.26 4.29 0.00 4.22 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 0.00 136 A 8.23 4.29 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 0.00 137 K 8.43 4.47 0.00 2.17 1.95 0.00 1.77 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.45 7.81 138 W 7.91 4.60 0.00 2.86 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 0.00 139 D 8.02 4.46 0.00 2.37 2.15 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 0.00 140 Y 8.46 4.28 0.00 3.10 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 0.00 141 D 8.29 4.49 0.00 2.80 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 0.00 142 K 8.31 3.98 0.00 1.52 1.70 0.00 1.83 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.40 1.39 7.81 143 N 7.40 3.98 0.00 2.79 2.75 0.00 0.00 6.94 8.66 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 0.00 144 E 5.90 3.45 0.00 1.70 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.92 0.00 145 W 7.87 4.45 0.00 3.12 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 K 8.75 3.88 0.00 1.67 1.76 0.00 1.87 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.41 1.48 7.81 147 K 8.52 4.14 0.00 1.72 1.70 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.39 7.81