NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9321 8.3549 109.7477 45.1094 0.0000 173.5112 2 L 4.2666 7.7095 118.8805 51.0362 43.0957 175.6669 3 S 4.4961 9.6424 118.8479 57.9740 66.1534 174.9914 4 D 4.6503 8.6871 121.7925 57.5584 40.5554 179.3192 5 G 3.6288 8.0811 105.8035 47.6300 0.0000 175.5586 6 E 3.9967 8.1914 120.9292 58.9340 29.3526 179.2658 7 W 4.3729 8.3485 119.4406 59.9535 29.0091 178.5766 8 Q 4.1174 8.5670 118.1819 58.8726 28.1556 178.7549 9 L 4.0395 8.1307 120.1836 57.6619 41.6608 179.6969 10 V 3.7141 8.0493 118.2034 66.2431 31.6576 178.2218 11 L 4.2695 8.5077 118.9290 57.6911 41.1840 179.2894 12 N 4.4531 8.4567 116.7154 56.1642 38.8448 177.3685 13 V 3.8823 7.9892 119.6664 63.5451 31.7434 178.1110 14 W 4.1054 8.4988 129.7579 60.0891 30.4489 177.8922 15 G 3.6555 8.0991 105.4859 47.5941 0.0000 175.7866 16 K 3.8877 7.6775 119.9582 59.0856 32.1813 179.3040 17 V 2.8467 6.8627 118.1753 65.5904 30.9068 177.8271 18 E 3.7877 7.8775 118.1687 58.7911 29.0261 178.6356 19 A 4.1648 7.4508 119.0488 53.4085 20.0435 177.3938 20 D 4.5991 7.7593 114.8207 52.3555 43.4678 175.8633 21 V 3.4732 7.6920 123.8198 66.0166 32.1272 176.8379 22 A 4.1131 7.9872 120.1505 54.9734 18.2756 179.6940 23 G 3.5074 8.3078 104.4311 48.2456 0.0000 175.7698 24 H 4.1605 8.2976 118.7971 58.4362 28.7016 178.1906 25 G 3.5311 8.3847 108.0789 47.6336 0.0000 175.5331 26 Q 3.8562 8.3956 122.3981 59.1342 29.0445 178.3834 27 E 3.8807 8.0371 119.4912 59.0888 29.3048 179.5244 28 V 3.4750 7.9265 118.6819 66.0774 31.6017 178.2036 29 L 3.4384 7.7405 118.5840 57.3701 41.2189 179.5868 30 I 3.6221 7.6164 119.9858 64.3633 36.9333 178.6704 31 R 3.8348 8.0706 119.1472 58.9234 29.7909 178.8483 32 L 3.8977 7.9913 120.5630 58.2864 42.1486 179.0422 33 F 4.6054 8.0051 117.3830 59.8904 38.7087 177.7917 34 K 4.3475 8.2829 117.6430 58.3856 32.1706 179.1206 35 G 3.7633 8.1396 105.8939 46.4413 0.0000 173.6881 36 H 4.6420 8.1537 119.0097 51.5621 29.7474 171.7078 37 P 4.5120 0.0000 0.0000 64.7078 31.0550 177.5598 38 E 4.1560 8.2575 115.9357 59.3307 29.5310 179.0902 39 T 3.8196 8.0618 111.2106 64.6860 68.7368 176.1308 40 L 3.5997 7.9443 122.6583 57.7269 41.7462 178.5819 41 E 4.1737 7.7359 117.0537 58.3546 29.4786 178.3826 42 K 4.4780 8.1644 117.2006 56.5193 32.8715 177.4212 43 F 4.5440 8.0881 119.5544 55.4362 39.3662 175.5631 44 D 4.3736 8.4652 124.3026 57.1780 40.9473 178.7796 45 K 4.0274 7.8393 116.7915 58.3301 32.1341 177.5071 46 F 5.1769 7.8313 115.8731 57.1280 39.5974 176.6469 47 K 4.0164 8.2707 121.9947 59.8897 31.9044 178.7441 48 H 4.0133 8.4063 112.9172 57.8149 28.3216 174.8287 49 L 4.3622 7.6080 120.6508 54.2963 40.9759 176.6612 50 K 4.3816 9.1903 123.8742 56.5359 32.7491 177.0603 51 S 4.6060 7.2634 113.3777 56.0167 66.8739 174.5592 52 E 3.8850 8.6627 122.5333 59.5069 29.2767 178.5860 53 D 4.3391 8.0207 118.6023 57.3494 40.7043 178.4207 54 E 4.0002 8.1442 118.5131 59.5376 29.6054 178.9211 55 M 4.1096 8.3214 119.1307 58.3152 31.7770 178.9188 56 K 3.8992 8.1888 117.8317 59.2510 32.3078 178.7165 57 A 4.3815 7.6127 118.8332 52.5512 18.9539 177.2924 58 S 4.2253 7.5385 113.7144 57.7457 62.3565 174.6059 59 E 4.0901 8.8017 127.9704 59.4434 29.4717 178.6306 60 D 4.4610 8.1849 119.6781 56.9670 40.8836 178.1877 61 L 3.4995 8.2698 121.3682 57.7992 41.9600 178.8750 62 K 3.8592 7.8437 119.1141 59.5191 32.1306 178.8347 63 K 3.9770 8.3383 118.8994 59.8589 31.9823 178.8507 64 H 4.4473 8.6950 118.6815 58.9514 29.7767 177.6132 65 G 3.5501 8.4324 108.3544 47.4434 0.0000 175.1625 66 N 4.2922 8.3923 119.6124 57.0285 39.0214 177.0182 67 T 3.8778 8.0175 116.9838 66.5536 68.3815 176.8272 68 V 3.5794 7.8970 120.0677 66.1985 31.6545 178.2179 69 L 4.2025 8.1614 118.5961 57.8004 41.4667 179.5421 70 T 4.0125 8.4032 116.2163 66.5264 68.4822 176.5122 71 A 3.9897 8.1318 122.7648 55.0115 18.4587 179.3976 72 L 3.7377 8.2632 119.3011 58.1138 42.0938 179.3461 73 G 3.3060 8.6140 106.2307 47.6253 0.0000 175.7690 74 G 3.6304 7.7118 107.0802 47.5236 0.0000 175.6636 75 I 3.8311 7.4682 121.5941 64.2746 37.1665 178.6175 76 L 3.9317 7.9933 120.0597 57.5734 41.1333 179.6323 77 K 3.9359 7.7741 117.2241 58.4038 32.2704 178.4759 78 K 4.0146 7.8279 117.7243 56.3806 32.4525 177.9173 79 K 2.0000 8.6273 119.7684 58.8415 31.3189 175.2870 80 G 4.1878 8.5571 111.7288 47.0919 0.0000 173.6640 81 H 4.5752 7.2150 117.8273 54.8424 27.2229 174.8411 82 H 5.2333 7.3350 111.6908 54.1270 29.7216 176.5115 83 E 3.9438 8.5354 122.6414 60.2090 29.1891 178.4039 84 A 4.0042 7.9433 118.9567 55.0777 19.0831 178.8821 85 E 4.1352 8.1108 116.7374 59.0277 29.6611 178.8901 86 L 3.9323 8.1871 120.7750 58.1634 42.2103 178.5900 87 T 3.9238 8.2014 116.4225 66.5318 68.4544 174.3939 88 P 4.3943 0.0000 0.0000 66.0002 31.0546 178.0407 89 L 4.0767 7.5546 118.5904 57.7520 42.0295 178.7412 90 A 4.1745 8.4370 121.2056 55.1005 18.3080 179.4913 91 Q 3.8627 8.6508 117.1790 59.3275 28.8679 179.4863 92 S 4.0345 8.2634 115.1559 61.6858 63.0840 176.1113 93 H 4.2078 8.6347 119.7105 58.3797 28.3337 177.5827 94 A 3.1349 8.0013 122.5212 54.6316 18.0958 178.0140 95 T 3.7789 7.6159 107.9032 62.6995 69.0101 176.8766 96 K 3.6995 7.7178 124.3232 58.8888 32.8542 177.9279 97 H 4.4372 7.8725 112.4933 55.3441 29.4024 175.0292 98 K 3.6247 7.0087 117.9888 57.3098 29.8146 175.6250 99 I 4.3221 7.6267 118.4987 58.8360 38.8053 175.0759 100 P 4.4223 0.0000 0.0000 62.0818 32.3910 177.3531 101 V 3.2790 8.2784 119.1823 66.2059 31.3278 178.2769 102 K 3.7697 7.8489 118.6159 59.5965 31.9248 178.1766 103 Y 3.9554 7.9997 117.0191 60.6006 37.7390 178.0576 104 L 4.1151 7.7793 119.9721 57.8055 41.5991 179.3323 105 E 4.0523 7.8900 118.1761 59.2857 29.4415 179.1888 106 F 4.4800 7.7167 117.4757 60.7612 38.9330 177.5671 107 I 3.9199 8.2345 118.0452 63.6366 37.7508 178.1080 108 S 4.1606 8.1499 116.4859 61.5422 62.6183 175.9665 109 E 3.9900 8.5233 121.8442 59.4732 29.3206 178.8306 110 A 4.3051 8.0204 121.9840 54.5088 18.3645 179.7502 111 I 3.6398 8.0605 118.5934 64.6286 37.1711 178.6288 112 I 3.7673 7.8910 120.5581 64.6516 36.6873 178.4205 113 Q 4.0401 8.4832 119.1878 59.0026 28.4449 179.3522 114 V 3.6043 7.8772 120.5753 65.4059 31.5316 178.1031 115 L 3.7691 7.8149 118.7597 57.7019 41.0700 179.3501 116 Q 4.2066 8.1273 119.1225 59.1549 28.9143 178.0753 117 S 4.2275 8.5492 115.7977 61.3773 62.8887 176.4213 118 K 3.9871 8.1157 121.0924 57.3895 33.0855 176.7613 119 H 5.0313 8.2271 116.2410 53.7066 29.5367 173.0130 120 P 4.3478 0.0000 0.0000 66.0325 31.5334 178.3003 121 G 3.7237 8.1664 106.6576 48.1450 0.0000 173.9839 122 D 4.6072 8.1028 117.2421 54.7869 41.9483 176.4222 123 F 5.0204 7.8921 121.8563 56.7411 38.9562 175.2317 124 G 3.8898 7.3896 110.0696 43.8771 0.0000 170.7818 125 A 3.8584 8.3783 120.7412 55.4329 18.4921 179.8511 126 D 4.2323 7.9658 116.6808 57.4255 40.8760 178.7662 127 A 4.0210 7.7872 120.8187 55.0342 18.3620 179.4874 128 Q 3.3596 8.0167 117.1295 58.8958 28.7699 179.3750 129 G 3.4989 7.9754 106.4073 47.6774 0.0000 175.6305 130 A 3.8985 7.9881 123.1788 55.0971 18.3093 179.4650 131 M 4.0501 8.4006 116.9863 58.7228 32.2358 178.6009 132 S 4.1698 8.4285 115.8038 61.6191 62.9384 176.8460 133 K 3.9135 8.1279 120.8921 59.1817 31.6707 179.3273 134 A 3.8101 8.0123 121.1498 55.2347 18.3252 179.7838 135 L 4.0668 8.3237 117.9045 57.6868 41.6380 179.2688 136 E 3.9757 8.5966 119.8831 59.1131 29.4883 178.6588 137 L 3.9643 8.2275 120.5391 58.0613 42.1823 178.4945 138 F 4.1490 8.4754 120.6419 61.5399 39.2166 177.1878 139 R 3.5300 8.4946 117.7952 59.3324 29.8963 178.8001 140 N 4.2450 8.4761 116.4913 56.5484 38.5324 177.2993 141 D 4.3989 8.3220 120.3604 57.3715 40.7885 178.7832 142 M 3.8769 8.0558 119.6050 58.2417 31.9077 178.6215 143 A 3.6830 8.0100 120.9296 54.9697 18.4587 179.5839 144 A 3.9993 8.0524 119.4586 55.0070 18.4404 179.8370 145 K 3.9835 8.1605 118.3955 59.7325 32.2971 178.5936 146 Y 4.1929 8.5263 117.3702 61.2415 37.8391 178.9333 147 K 4.5531 8.2808 120.5737 59.0102 31.9292 178.9446 148 E 3.9890 8.0609 118.6058 59.1420 29.6574 178.1027 149 L 4.3615 7.8600 116.0212 54.9381 41.8791 177.5254 150 G 3.6602 8.0185 107.4049 45.2804 0.0000 173.2616 151 F 4.9110 8.2874 117.7275 54.5408 42.0063 174.7640 152 Q 4.2787 8.9779 123.8021 56.5992 29.2801 176.6899 153 G 3.7461 8.6897 113.0306 45.6915 0.0000 172.7475 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 G 8.35 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 2 L 7.71 4.27 0.00 0.55 0.63 0.52 -0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.64 4.50 0.00 4.02 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 4 D 8.69 4.65 0.00 2.77 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.08 3.63 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 0.00 0.00 0.00 6 E 8.19 4.00 0.00 2.01 1.72 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 2.22 2.26 0.00 7 W 8.35 4.37 0.00 3.54 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 8 Q 8.57 4.12 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.71 2.61 0.00 9 L 8.13 4.04 0.00 1.89 1.75 0.90 0.59 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 10 V 8.05 3.71 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 1.23 0.00 0.00 0.91 0.00 0.00 11 L 8.51 4.27 0.00 1.83 1.80 0.93 0.97 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 12 N 8.46 4.45 0.00 2.93 2.93 0.00 0.00 7.05 8.07 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 13 V 7.99 3.88 2.24 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 1.12 0.00 0.00 0.93 0.00 0.00 14 W 8.50 4.11 0.00 3.66 3.30 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 15 G 8.10 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 16 K 7.68 3.89 0.00 1.48 1.39 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.26 7.81 17 V 6.86 2.85 0.67 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 0.18 0.00 0.00 0.09 0.00 0.00 18 E 7.88 3.79 0.00 2.09 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 2.37 2.34 0.00 19 A 7.45 4.16 1.22 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 0.00 0.00 20 D 7.76 4.60 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 21 V 7.69 3.47 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 1.06 0.00 0.00 0.93 0.00 0.00 22 A 7.99 4.11 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 23 G 8.31 3.51 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 0.00 24 H 8.30 4.16 0.00 3.25 3.23 0.00 5.82 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 25 G 8.38 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.40 3.86 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 27 E 8.04 3.88 0.00 2.09 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 2.23 2.38 0.00 28 V 7.93 3.48 2.16 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 1.07 0.00 0.00 0.97 0.00 0.00 29 L 7.74 3.44 0.00 1.54 0.97 0.87 0.51 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 30 I 7.62 3.62 1.76 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.71 0.86 0.00 0.00 31 R 8.07 3.83 0.00 1.86 1.92 0.00 3.23 0.00 0.00 3.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 32 L 7.99 3.90 0.00 1.68 1.48 1.05 0.98 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 33 F 8.01 4.61 0.00 3.12 2.86 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 34 K 8.28 4.35 0.00 1.68 1.83 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.61 1.57 7.81 35 G 8.14 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 36 H 8.15 4.64 0.00 3.03 2.93 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.51 0.00 2.16 2.12 0.00 3.83 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 2.10 2.00 0.00 38 E 8.26 4.16 0.00 2.32 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 0.00 2.45 2.63 0.00 39 T 8.06 3.82 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 40 L 7.94 3.60 0.00 1.37 1.74 -0.15 1.17 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 41 E 7.74 4.17 0.00 2.19 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 0.00 2.51 2.55 0.00 42 K 8.16 4.48 0.00 1.64 1.70 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.15 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.74 1.87 7.81 43 F 8.09 4.54 0.00 3.23 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 44 D 8.47 4.37 0.00 2.61 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 45 K 7.84 4.03 0.00 1.23 1.03 0.00 1.60 0.00 0.00 1.52 0.00 0.00 2.86 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.30 1.31 7.81 46 F 7.83 5.18 0.00 2.86 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 47 K 8.27 4.02 0.00 1.82 1.88 0.00 1.95 0.00 0.00 1.90 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.73 1.41 7.81 48 H 8.41 4.01 0.00 3.28 3.48 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.61 4.36 0.00 1.55 1.57 0.79 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.19 4.38 0.00 1.84 1.83 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.78 1.51 7.81 51 S 7.26 4.61 0.00 3.98 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 52 E 8.66 3.88 0.00 2.03 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 2.34 2.37 0.00 53 D 8.02 4.34 0.00 2.71 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 54 E 8.14 4.00 0.00 2.00 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 2.34 2.33 0.00 55 M 8.32 4.11 0.00 1.98 2.25 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.52 0.00 56 K 8.19 3.90 0.00 1.80 1.84 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.58 7.81 57 A 7.61 4.38 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 58 S 7.54 4.23 0.00 3.80 3.83 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 59 E 8.80 4.09 0.00 2.26 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 2.40 2.44 0.00 60 D 8.18 4.46 0.00 3.00 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 61 L 8.27 3.50 0.00 1.11 1.56 0.69 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.84 3.86 0.00 1.86 1.93 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.60 7.81 63 K 8.34 3.98 0.00 2.09 1.92 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.69 7.81 64 H 8.70 4.45 0.00 3.73 3.58 0.00 5.78 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 65 G 8.43 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 66 N 8.39 4.29 0.00 2.77 3.02 0.00 0.00 7.20 7.80 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 67 T 8.02 3.88 4.38 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 1.25 0.00 0.00 68 V 7.90 3.58 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 1.16 0.00 0.00 1.01 0.00 0.00 69 L 8.16 4.20 0.00 1.80 1.89 0.89 0.80 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 70 T 8.40 4.01 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 71 A 8.13 3.99 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 72 L 8.26 3.74 0.00 1.57 1.62 0.19 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.61 3.31 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 0.00 74 G 7.71 3.63 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 0.00 0.00 0.00 75 I 7.47 3.83 1.84 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.89 0.89 0.00 0.00 76 L 7.99 3.93 0.00 0.96 1.51 -0.01 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.77 3.94 0.00 1.70 1.80 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.45 1.52 7.81 78 K 7.83 4.01 0.00 1.84 1.84 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.52 1.78 7.81 79 K 8.63 2.00 0.00 1.08 0.74 0.00 1.49 0.00 0.00 1.55 0.00 0.00 2.79 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.51 0.97 7.81 80 G 8.56 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 0.00 0.00 0.00 81 H 7.21 4.58 0.00 3.07 3.22 0.00 5.80 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 82 H 7.33 5.23 0.00 3.25 3.39 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.54 3.94 0.00 2.06 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 2.41 2.35 0.00 84 A 7.94 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 85 E 8.11 4.14 0.00 2.09 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 2.38 2.42 0.00 86 L 8.19 3.93 0.00 1.82 1.69 0.81 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.20 3.92 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 1.23 0.00 0.00 88 P 0.00 4.39 0.00 2.30 2.34 0.00 3.71 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 2.11 2.06 0.00 89 L 7.55 4.08 0.00 1.91 1.92 1.03 1.16 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 90 A 8.44 4.17 1.48 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 0.00 0.00 0.00 91 Q 8.65 3.86 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 92 S 8.26 4.03 0.00 3.93 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 93 H 8.63 4.21 0.00 3.55 3.58 0.00 5.81 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 94 A 8.00 3.13 -0.23 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 95 T 7.62 3.78 4.17 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 1.21 0.00 0.00 96 K 7.72 3.70 0.00 1.60 1.59 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.30 1.39 7.81 97 H 7.87 4.44 0.00 3.05 3.12 0.00 5.86 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.01 3.62 0.00 1.93 1.78 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.48 7.81 99 I 7.63 4.32 2.04 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 1.41 0.98 1.10 0.00 0.00 100 P 0.00 4.42 0.00 1.87 1.89 0.00 3.29 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 1.02 0.00 101 V 8.28 3.28 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 0.86 0.00 0.00 0.43 0.00 0.00 102 K 7.85 3.77 0.00 1.68 1.62 0.00 1.79 0.00 0.00 1.86 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.75 1.29 7.81 103 Y 8.00 3.96 0.00 3.22 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 0.00 104 L 7.78 4.12 0.00 1.80 1.78 0.57 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 105 E 7.89 4.05 0.00 2.05 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 2.40 2.34 0.00 106 F 7.72 4.48 0.00 3.12 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 8.23 3.92 1.99 0.00 0.00 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 1.57 1.59 1.07 0.00 0.00 108 S 8.15 4.16 0.00 4.18 3.98 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 0.00 109 E 8.52 3.99 0.00 2.14 2.28 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 2.37 2.40 0.00 110 A 8.02 4.31 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 0.00 111 I 8.06 3.64 2.09 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.79 1.01 0.00 0.00 112 I 7.89 3.77 2.11 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.83 1.13 0.00 0.00 113 Q 8.48 4.04 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 114 V 7.88 3.60 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 1.20 0.00 0.00 0.93 0.00 0.00 115 L 7.81 3.77 0.00 0.96 0.36 0.72 0.59 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 0.00 116 Q 8.13 4.21 0.00 2.33 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.96 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 117 S 8.55 4.23 0.00 3.99 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 0.00 118 K 8.12 3.99 0.00 1.40 1.50 0.00 1.69 0.00 0.00 1.34 0.00 0.00 2.47 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.26 1.41 7.81 119 H 8.23 5.03 0.00 3.15 3.21 0.00 5.64 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 0.00 120 P 0.00 4.35 0.00 2.20 2.24 0.00 3.84 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 121 G 8.17 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 0.00 122 D 8.10 4.61 0.00 2.75 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 0.00 123 F 7.89 5.02 0.00 2.95 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 0.00 124 G 7.39 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.38 3.86 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 0.00 126 D 7.97 4.23 0.00 2.66 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 0.00 127 A 7.79 4.02 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 8.02 3.36 0.00 1.98 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.34 1.55 0.00 129 G 7.98 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 0.00 0.00 0.00 130 A 7.99 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 0.00 131 M 8.40 4.05 0.00 2.41 2.36 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 2.75 2.85 0.00 132 S 8.43 4.17 0.00 4.04 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 0.00 133 K 8.13 3.91 0.00 1.81 1.68 0.00 1.73 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.54 7.81 134 A 8.01 3.81 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 0.00 135 L 8.32 4.07 0.00 1.75 1.82 0.99 0.73 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 0.00 136 E 8.60 3.98 0.00 2.12 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 0.00 2.45 2.33 0.00 137 L 8.23 3.96 0.00 1.84 1.94 1.11 1.40 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 0.00 138 F 8.48 4.15 0.00 3.11 3.28 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 0.00 139 R 8.49 3.53 0.00 1.98 1.87 0.00 3.17 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.05 0.00 140 N 8.48 4.24 0.00 2.91 2.85 0.00 0.00 7.10 7.77 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 0.00 141 D 8.32 4.40 0.00 2.68 2.74 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 0.00 142 M 8.06 3.88 0.00 1.55 1.71 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 2.01 0.00 143 A 8.01 3.68 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 0.00 144 A 8.05 4.00 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 0.00 145 K 8.16 3.98 0.00 1.95 2.06 0.00 1.59 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.60 7.81 146 Y 8.53 4.19 0.00 3.22 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 0.00 147 K 8.28 4.55 0.00 2.02 1.89 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.54 7.81 148 E 8.06 3.99 0.00 2.17 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 0.00 2.34 2.37 0.00 149 L 7.86 4.36 0.00 2.08 1.87 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.02 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 0.00 151 F 8.29 4.91 0.00 3.07 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 0.00 152 Q 8.98 4.28 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 153 G 8.69 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00