NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3742 8.3044 120.3192 55.9227 33.7929 174.2936 2 H 4.6589 8.5030 116.4065 55.4596 29.2420 173.5719 3 L 4.7511 8.0222 120.4510 53.5016 44.8732 177.4265 4 T 4.1565 8.3688 120.0854 62.4422 70.5676 174.2998 5 P 3.8951 0.0000 0.0000 66.0854 31.4442 178.9417 6 E 4.0153 8.0296 116.7749 59.3477 29.4123 179.0239 7 E 3.9762 7.8866 118.2107 58.9601 29.6838 179.0966 8 K 3.8262 8.7252 119.8546 59.5858 32.1012 179.4753 9 S 4.1209 8.3749 114.5595 61.2577 62.8259 176.3261 10 A 3.9536 7.8783 124.0497 54.8873 18.2075 179.5669 11 V 3.3057 7.7748 116.6925 66.4815 31.2967 178.0901 12 T 3.9567 7.9204 115.0061 66.8273 68.1484 176.3603 13 A 4.0578 8.0927 121.3358 55.1386 18.7095 179.1710 14 L 3.9183 7.9867 118.4660 57.9224 42.2365 178.7933 15 W 4.4780 8.7738 128.5517 60.5852 30.3381 178.1086 16 G 3.7599 7.9408 104.7021 46.9838 0.0000 174.7640 17 K 4.4625 7.7483 117.9652 55.2613 32.8400 176.7523 18 V 3.5925 7.0387 120.7958 62.3229 31.9354 175.7369 19 N 4.5177 8.2862 125.6720 52.2483 38.8782 175.2735 20 V 3.4514 8.0495 128.4168 65.9024 31.2391 177.3121 21 D 4.2999 7.9898 118.0031 57.4946 40.9422 178.5223 22 E 3.9691 8.5914 119.1615 59.3830 29.4385 179.6275 23 V 3.5412 7.9435 118.6767 65.7801 31.5543 178.3255 24 G 3.6691 8.5011 106.1506 47.6571 0.0000 175.9821 25 G 3.5534 7.7215 106.9697 47.4696 0.0000 175.5149 26 E 3.8749 8.0499 121.3313 58.7518 29.6706 178.7436 27 A 3.9041 8.1805 121.0664 55.1517 18.3899 179.3751 28 L 3.9584 7.8823 118.9619 58.0881 42.1091 179.3454 29 G 3.5708 8.2145 105.7536 48.0701 0.0000 175.9520 30 R 3.9117 8.2151 121.2822 58.3494 29.9639 178.7804 31 L 4.0159 7.8759 120.3734 58.4941 42.2183 179.2916 32 L 4.0731 7.6212 119.8383 56.7830 41.2083 179.8168 33 V 3.5059 7.2340 117.3276 65.9083 31.7205 178.0411 34 V 3.4459 7.9218 116.7927 64.5248 32.7831 175.6774 35 Y 3.6909 7.2369 116.0611 53.8816 37.8382 174.0815 36 P 4.8250 0.0000 0.0000 64.5658 31.2490 178.3173 37 W 4.4086 8.0175 116.1420 59.1354 28.1673 177.6967 38 T 4.2884 7.9214 110.7008 63.9882 68.4162 176.3490 39 Q 4.3639 8.1874 121.5061 58.1974 28.4312 178.1514 40 R 3.7593 7.3344 116.7214 58.9372 29.1627 178.0041 41 F 4.3594 7.4025 115.8731 57.5191 39.7345 175.8350 42 F 4.5341 7.7563 118.3860 56.6412 39.7967 177.4619 43 E 4.0218 8.2380 122.4252 59.4757 29.6610 179.6408 44 S 4.4259 7.9894 111.2564 60.0868 63.4876 175.1237 45 F 4.5387 8.0539 120.1477 59.0414 39.7330 175.0144 46 G 3.9212 7.0899 105.9155 44.2674 0.0000 174.3585 47 D 4.5746 8.7647 126.3791 54.0747 40.2347 176.1045 48 L 4.8882 8.2481 127.7573 54.5707 42.8314 179.1757 49 S 4.4137 8.0991 117.8210 61.2336 63.1471 175.2234 50 T 4.7261 7.3807 109.8567 58.1892 72.9273 172.7536 51 P 4.1826 0.0000 0.0000 66.2163 31.3856 178.5651 52 D 4.2864 8.0855 116.4685 57.4082 40.5772 178.6440 53 A 4.0161 8.1922 120.4588 54.9543 18.5065 179.7249 54 V 3.6754 8.4301 117.0474 66.6403 31.5402 178.3938 55 M 4.1673 8.7094 118.0265 57.9170 31.8148 178.4430 56 G 3.9303 7.9942 104.6193 45.1104 0.0000 173.2719 57 N 4.3533 7.5992 120.9591 53.0212 39.2583 173.6422 58 P 4.3172 0.0000 0.0000 65.9180 31.2876 178.5996 59 K 3.7467 8.1197 118.3885 58.8632 31.8101 179.5284 60 V 3.6862 7.8125 118.0406 65.9625 31.7816 177.9155 61 K 3.8471 8.3733 118.3553 59.6094 31.8951 179.1912 62 A 3.9959 8.3738 121.2254 55.4542 18.2382 179.1975 63 H 4.3718 8.5488 117.0249 59.1240 29.9034 177.6482 64 G 3.6610 8.6524 108.1732 47.7691 0.0000 175.6016 65 K 4.0764 7.9986 121.5281 58.8661 32.2490 178.9856 66 K 3.9897 7.8449 119.9058 59.3114 32.1730 179.0140 67 V 3.6237 8.1440 118.9054 66.2296 31.4725 178.1371 68 L 4.3840 8.5416 119.0756 57.3934 41.3091 179.8807 69 G 3.6964 8.2059 105.5881 47.8812 0.0000 175.6202 70 A 4.1511 8.0937 123.8296 54.6069 18.5209 179.2763 71 F 4.1042 8.4494 119.1783 61.7864 39.2374 177.3325 72 S 4.2231 8.4218 113.4710 62.1367 63.1563 176.4025 73 D 4.6098 8.1793 121.0280 57.1483 40.5250 179.0791 74 G 3.4457 7.9078 106.3256 47.4982 0.0000 175.6931 75 L 3.8242 7.2590 119.2904 56.6851 41.6219 178.5136 76 A 4.2858 7.4685 118.9203 53.0802 19.4314 176.7612 77 H 4.8464 8.0170 115.2668 55.0801 29.7312 175.4275 78 L 3.9458 8.0367 119.6457 57.1134 41.7573 178.1141 79 D 4.6412 7.7287 116.4513 54.5455 42.1797 176.4357 80 N 4.8918 7.8598 116.8048 51.8242 40.6350 174.9818 81 L 3.9878 7.6847 122.3063 57.3951 42.1401 179.0397 82 K 4.0086 8.0803 119.4957 59.7284 31.9912 178.9831 83 G 3.5707 7.9474 104.1695 48.0462 0.0000 175.4706 84 T 3.8211 7.5236 116.6946 65.2685 68.6116 175.8708 85 F 4.8802 7.8998 117.1736 56.8376 39.6384 177.0242 86 A 4.0661 7.6555 122.9578 55.9396 18.2736 180.3658 87 T 3.8762 7.8611 113.4452 66.6991 68.6173 176.6775 88 L 4.1380 7.9834 121.8138 57.8330 42.1907 178.8988 89 S 4.3549 8.4144 115.1913 61.0696 62.3834 176.0588 90 E 3.9502 8.1300 120.9151 58.9639 29.1099 179.1771 91 L 3.9106 7.8799 120.3473 58.6139 42.1807 178.8190 92 H 4.3083 8.2775 116.1036 59.5772 28.5177 176.3424 93 C 3.7854 8.1142 121.3088 61.6715 30.9072 175.1396 94 D 4.3090 8.5546 123.6393 56.6364 40.8767 177.8488 95 K 4.2056 7.6298 116.8439 58.3644 33.0260 177.9106 96 L 4.0661 8.1256 117.0551 55.4467 42.1434 176.6324 97 H 4.1659 7.4228 114.2912 56.6987 26.4958 175.1235 98 V 3.8865 7.8544 118.3651 60.8270 32.7491 174.8177 99 D 4.3697 8.7546 126.8519 54.2787 41.7683 176.8270 100 A 3.2759 8.2400 127.8214 54.3290 18.0788 179.0210 101 E 3.8871 8.3580 118.0086 59.0251 29.6427 178.5049 102 N 4.2658 7.7586 116.4694 55.8764 38.4272 177.2404 103 F 4.4979 7.3168 119.5838 60.5945 38.9912 177.8614 104 R 4.0021 7.9144 117.3209 58.9879 29.9721 178.7962 105 L 3.7401 7.5113 118.7404 57.6545 41.5324 179.2387 106 L 4.0396 8.0011 120.2462 58.0774 42.1217 178.9602 107 G 3.8070 8.1063 105.5857 48.2892 0.0000 175.3378 108 N 4.4593 8.1392 119.2629 55.7514 38.4226 177.7635 109 V 3.6260 7.9121 119.8135 65.7760 31.5902 177.6908 110 L 3.8424 8.1844 120.4324 58.2300 41.9145 179.0430 111 V 3.5647 7.6959 117.7072 66.3938 31.4545 177.7786 112 C 4.1501 8.0334 116.1977 62.7259 27.9435 176.3400 113 V 3.5565 7.9485 120.1660 65.9790 31.0528 178.1066 114 L 3.8960 8.0705 118.9359 57.5208 41.2978 179.4403 115 A 3.7735 7.4055 120.7119 55.2236 18.1105 179.1035 116 H 4.1088 7.8674 115.5924 59.7105 29.9998 177.0545 117 H 3.9302 7.9206 116.5310 58.8146 29.0588 177.4637 118 F 4.5532 8.5470 118.4912 57.3326 39.3732 177.4229 119 G 3.9032 8.7892 108.8475 45.7611 0.0000 176.0470 120 K 3.8082 9.1172 120.8793 59.9536 32.0456 177.6477 121 E 4.0715 8.1618 118.9214 58.3552 29.9098 177.0312 122 F 4.6413 8.5273 123.3717 56.9932 37.8617 175.4877 123 T 4.1737 7.4050 115.5839 60.0875 71.3137 173.5121 124 P 4.1283 0.0000 0.0000 65.5463 31.4222 177.1743 125 P 4.2232 0.0000 0.0000 65.5143 31.2489 178.9025 126 V 3.5703 7.4470 117.0756 65.7882 31.4417 177.7416 127 Q 3.4745 8.1903 119.5545 58.9718 28.7236 178.0767 128 A 3.9668 8.3165 121.8477 55.2979 18.4937 179.4680 129 A 3.8872 7.8000 118.5278 55.6662 18.3979 179.5697 130 Y 3.9254 8.3359 115.2360 61.0949 37.8886 178.6202 131 Q 4.1224 8.8469 119.6559 58.8803 28.7758 178.9747 132 K 3.9850 7.9346 119.3473 59.2871 32.0814 179.5991 133 V 3.4827 7.6498 118.2029 66.1811 31.4549 178.4559 134 V 3.8353 8.2036 112.1068 64.4136 31.3104 178.4705 135 A 4.1104 8.1898 120.6655 54.9834 18.1882 179.7823 136 G 3.5574 8.0989 104.2660 47.9816 0.0000 175.9137 137 V 3.4078 8.3050 121.2610 65.5512 31.3231 177.8379 138 A 3.8941 8.0448 119.3580 55.3304 18.3500 179.0770 139 N 4.4179 8.4183 114.8484 56.2994 38.3949 177.5668 140 A 4.0314 8.0589 122.3652 55.1895 18.3915 179.6842 141 L 3.7375 7.8865 116.8272 56.6800 41.5558 178.4706 142 A 4.5845 7.4573 119.5658 52.3113 19.2782 178.1306 143 H 4.1124 7.6989 117.2544 59.0658 29.9772 175.9987 144 K 4.4412 8.1191 115.9871 56.3837 31.8794 176.2836 145 Y 4.1241 8.0186 118.0830 58.2267 38.3918 175.6393 146 H 4.4691 8.3545 118.3539 56.0755 28.3997 173.1747 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 4.37 0.00 1.97 2.17 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 2 H 8.50 4.66 0.00 3.15 3.24 0.00 5.71 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 3 L 8.02 4.75 0.00 1.57 1.46 0.81 0.85 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 4 T 8.37 4.16 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 5 P 0.00 3.90 0.00 2.12 2.09 0.00 3.56 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 6 E 8.03 4.02 0.00 2.02 1.97 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 2.38 2.44 0.00 7 E 7.89 3.98 0.00 2.17 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 2.35 2.34 0.00 8 K 8.73 3.83 0.00 1.86 1.81 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.38 1.38 7.81 9 S 8.37 4.12 0.00 4.00 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 10 A 7.88 3.95 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.77 3.31 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 0.45 0.00 0.00 0.49 0.00 0.00 12 T 7.92 3.96 4.50 0.00 0.00 0.00 0.00 0.00 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 13 A 8.09 4.06 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 14 L 7.99 3.92 0.00 1.85 2.11 0.57 0.38 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 15 W 8.77 4.48 0.00 3.79 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 16 G 7.94 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 0.00 0.00 0.00 17 K 7.75 4.46 0.00 2.05 2.14 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.47 7.81 18 V 7.04 3.59 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 -0.03 0.00 0.00 0.72 0.00 0.00 19 N 8.29 4.52 0.00 2.69 2.59 0.00 0.00 6.84 7.71 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 20 V 8.05 3.45 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 1.12 0.00 0.00 0.93 0.00 0.00 21 D 7.99 4.30 0.00 2.96 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 22 E 8.59 3.97 0.00 1.92 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 2.28 2.42 0.00 23 V 7.94 3.54 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.54 0.00 0.00 24 G 8.50 3.67 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 0.00 0.00 0.00 25 G 7.72 3.55 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 0.00 26 E 8.05 3.87 0.00 2.25 1.91 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 2.28 2.31 0.00 27 A 8.18 3.90 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 7.88 3.96 0.00 1.85 1.62 0.85 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.21 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 0.00 0.00 0.00 30 R 8.22 3.91 0.00 1.90 1.93 0.00 3.21 0.00 0.00 3.03 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 31 L 7.88 4.02 0.00 1.88 1.87 0.95 0.77 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 32 L 7.62 4.07 0.00 1.77 1.69 0.82 1.00 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 33 V 7.23 3.51 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.90 0.00 0.00 34 V 7.92 3.45 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 0.02 0.00 0.00 0.77 0.00 0.00 35 Y 7.24 3.69 0.00 2.51 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.83 0.00 2.31 2.31 0.00 3.66 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.93 0.00 37 W 8.02 4.41 0.00 3.56 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.92 4.29 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 1.08 0.00 0.00 39 Q 8.19 4.36 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 40 R 7.33 3.76 0.00 1.63 1.95 0.00 2.90 0.00 0.00 2.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 7.40 4.36 0.00 1.93 2.51 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 42 F 7.76 4.53 0.00 2.87 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 0.00 0.00 0.00 43 E 8.24 4.02 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 2.47 2.21 0.00 44 S 7.99 4.43 0.00 4.11 4.09 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 0.00 0.00 0.00 0.00 45 F 8.05 4.54 0.00 3.10 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 46 G 7.09 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.76 4.57 0.00 2.67 2.64 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 48 L 8.25 4.89 0.00 1.73 1.61 1.04 0.99 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 49 S 8.10 4.41 0.00 3.86 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 50 T 7.38 4.73 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 1.21 0.00 0.00 51 P 0.00 4.18 0.00 2.15 2.13 0.00 3.59 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 52 D 8.09 4.29 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 53 A 8.19 4.02 1.40 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 54 V 8.43 3.68 2.19 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 1.05 0.00 0.00 0.96 0.00 0.00 55 M 8.71 4.17 0.00 1.94 2.09 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 2.60 2.89 0.00 56 G 7.99 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 57 N 7.60 4.35 0.00 2.96 2.90 0.00 0.00 6.77 7.55 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 58 P 0.00 4.32 0.00 2.24 2.26 0.00 3.73 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 8.12 3.75 0.00 1.76 0.74 0.00 1.70 0.00 0.00 1.29 0.00 0.00 2.78 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.98 1.20 7.81 60 V 7.81 3.69 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.11 0.00 0.00 61 K 8.37 3.85 0.00 1.89 1.82 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.55 7.81 62 A 8.37 4.00 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 63 H 8.55 4.37 0.00 3.39 3.50 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 64 G 8.65 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 0.00 0.00 0.00 65 K 8.00 4.08 0.00 1.87 1.98 0.00 1.91 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.46 7.81 66 K 7.84 3.99 0.00 2.00 2.00 0.00 1.77 0.00 0.00 1.65 0.00 0.00 3.18 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.50 7.81 67 V 8.14 3.62 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 1.03 0.00 0.00 0.90 0.00 0.00 68 L 8.54 4.38 0.00 1.92 1.88 1.08 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.21 3.70 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 0.00 0.00 0.00 70 A 8.09 4.15 1.59 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 0.00 0.00 71 F 8.45 4.10 0.00 3.36 3.35 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 72 S 8.42 4.22 0.00 4.36 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 73 D 8.18 4.61 0.00 2.61 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 74 G 7.91 3.45 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 0.00 0.00 0.00 0.00 75 L 7.26 3.82 0.00 1.57 1.46 -0.33 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.47 4.29 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 77 H 8.02 4.85 0.00 3.04 3.13 0.00 5.82 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 78 L 8.04 3.95 0.00 1.51 1.64 0.75 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.73 4.64 0.00 2.61 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 80 N 7.86 4.89 0.00 2.71 2.60 0.00 0.00 7.13 6.48 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 81 L 7.68 3.99 0.00 1.76 1.86 0.88 0.77 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 82 K 8.08 4.01 0.00 1.81 1.76 0.00 1.52 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.20 1.44 7.81 83 G 7.95 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 0.00 0.00 0.00 84 T 7.52 3.82 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 0.44 0.00 0.00 85 F 7.90 4.88 0.00 3.20 2.89 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 86 A 7.66 4.07 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 87 T 7.86 3.88 4.26 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 1.23 0.00 0.00 88 L 7.98 4.14 0.00 1.93 1.83 1.05 1.06 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 89 S 8.41 4.35 0.00 4.05 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 90 E 8.13 3.95 0.00 2.08 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 0.00 2.33 2.54 0.00 91 L 7.88 3.91 0.00 1.89 1.88 0.91 0.93 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 92 H 8.28 4.31 0.00 3.76 3.77 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.11 3.79 0.00 1.58 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 0.00 0.00 0.00 0.00 94 D 8.55 4.31 0.00 2.70 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 95 K 7.63 4.21 0.00 1.83 1.79 0.00 1.60 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.48 7.81 96 L 8.13 4.07 0.00 1.64 1.63 0.75 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.42 4.17 0.00 3.37 3.41 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.85 3.89 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 0.03 0.00 0.00 0.48 0.00 0.00 99 D 8.75 4.37 0.00 2.84 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.24 3.28 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 E 8.36 3.89 0.00 2.04 1.91 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 2.30 2.37 0.00 102 N 7.76 4.27 0.00 2.46 2.64 0.00 0.00 6.85 8.14 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 0.00 103 F 7.32 4.50 0.00 3.12 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.91 4.00 0.00 2.00 1.97 0.00 3.41 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 1.74 1.75 0.00 105 L 7.51 3.74 0.00 1.65 1.31 0.53 -0.11 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 0.00 106 L 8.00 4.04 0.00 1.81 1.94 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.11 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 0.00 108 N 8.14 4.46 0.00 2.82 2.95 0.00 0.00 6.74 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 0.00 109 V 7.91 3.63 2.19 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 1.15 0.00 0.00 1.18 0.00 0.00 110 L 8.18 3.84 0.00 1.75 1.83 0.84 0.39 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 0.00 111 V 7.70 3.56 2.34 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 1.28 0.00 0.00 1.18 0.00 0.00 112 C 8.03 4.15 0.00 3.20 2.94 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 0.00 113 V 7.95 3.56 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 0.97 0.00 0.00 0.92 0.00 0.00 114 L 8.07 3.90 0.00 0.63 1.19 0.57 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.41 3.77 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 0.00 116 H 7.87 4.11 0.00 3.21 3.51 0.00 5.95 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 0.00 117 H 7.92 3.93 0.00 2.72 2.53 0.00 5.70 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 0.00 118 F 8.55 4.55 0.00 3.33 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 0.00 119 G 8.79 3.90 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 0.00 0.00 0.00 120 K 9.12 3.81 0.00 1.92 2.05 0.00 1.62 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.53 7.81 121 E 8.16 4.07 0.00 2.37 2.19 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 2.37 2.32 0.00 122 F 8.53 4.64 0.00 3.01 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 0.00 123 T 7.40 4.17 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 1.31 0.00 0.00 124 P 0.00 4.13 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 125 P 0.00 4.22 0.00 2.11 2.06 0.00 3.46 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.45 3.57 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 1.08 0.00 0.00 0.91 0.00 0.00 127 Q 8.19 3.47 0.00 1.54 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 128 A 8.32 3.97 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 0.00 129 A 7.80 3.89 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 0.00 130 Y 8.34 3.93 0.00 3.36 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 0.00 131 Q 8.85 4.12 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.75 2.61 0.00 132 K 7.93 3.99 0.00 1.92 1.83 0.00 1.72 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.63 7.81 133 V 7.65 3.48 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 0.85 0.00 0.00 0.72 0.00 0.00 134 V 8.20 3.84 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 1.07 0.00 0.00 1.12 0.00 0.00 135 A 8.19 4.11 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.10 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.31 3.41 2.14 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 0.71 0.00 0.00 0.71 0.00 0.00 138 A 8.04 3.89 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.42 4.42 0.00 2.96 2.87 0.00 0.00 6.90 7.40 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 0.00 140 A 8.06 4.03 1.45 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 0.00 0.00 0.00 141 L 7.89 3.74 0.00 0.90 0.13 0.06 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.46 4.58 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 0.00 143 H 7.70 4.11 0.00 3.28 3.59 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.12 4.44 0.00 1.83 1.81 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.50 1.70 7.81 145 Y 8.02 4.12 0.00 3.22 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 H 8.35 4.47 0.00 3.21 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00