NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.6915 8.4244 118.1244 53.0481 40.0284 173.7188 3 T 3.6589 8.2714 116.7598 61.3227 67.9868 172.0399 4 K 4.4207 8.9761 128.8912 55.0402 34.3046 175.2321 5 Y 4.6800 8.7511 122.5952 56.5117 39.4958 175.8126 6 N 4.5232 8.7585 121.1709 53.5905 40.8646 175.9510 7 K 4.0473 8.7367 127.7251 59.8775 32.4782 179.0557 8 E 3.9040 8.1731 118.3694 59.0368 29.3279 178.9404 9 F 4.2860 8.2316 120.4437 61.4332 39.5368 177.0804 10 L 3.7320 8.1026 118.6138 57.4609 41.2454 179.5064 11 L 3.5838 7.8293 119.1616 57.7900 41.5811 178.9234 12 Y 3.9490 7.9221 119.2826 60.6629 38.7122 177.7681 13 L 3.9810 8.1578 121.2837 58.0224 42.0296 178.6236 14 A 4.0604 8.3958 121.3125 55.2142 18.4237 179.8995 15 G 3.4298 7.7691 104.2657 47.8499 0.0000 175.7754 16 F 3.7378 7.9476 123.2647 60.7338 39.3002 177.4351 17 V 3.7256 8.7875 118.5948 66.2898 31.2050 177.7211 18 D 4.4383 8.3414 117.8382 57.1103 40.6102 178.9299 19 G 3.5705 7.5247 105.0463 46.9602 0.0000 174.3480 20 D 4.6877 8.2946 119.5415 53.0932 41.9155 176.3399 21 G 4.3396 7.8769 107.8805 45.4388 0.0000 173.2447 22 S 4.6937 8.6201 113.0975 57.0152 66.2902 173.0615 23 I 4.9075 8.5321 127.7158 59.9905 38.6446 174.7584 24 I 4.7049 9.0254 128.4778 59.2727 40.3162 174.8803 25 A 5.2063 8.5055 126.1374 50.4608 21.8576 175.3115 26 Q 4.5688 9.5450 120.2120 54.2939 34.0530 174.4060 27 I 4.8468 8.3863 121.9610 59.8283 39.3646 174.9886 28 K 4.6058 8.9063 128.5409 53.6927 33.9209 174.5616 29 P 4.5495 0.0000 0.0000 62.8893 32.0245 175.6724 30 N 4.7776 8.9316 123.3700 52.6263 41.7544 175.2589 31 Q 4.1143 9.0811 126.4373 58.6173 29.0392 177.5839 32 S 4.3167 8.3459 111.0381 59.4599 63.6154 173.7726 33 Y 4.3903 7.7888 120.1124 56.3249 39.3172 176.1850 34 K 3.5583 8.6632 124.3020 59.7402 31.7225 177.9179 35 F 4.7309 7.6081 115.3053 57.0391 38.9961 176.8024 36 K 4.1768 8.4056 118.0120 57.3877 30.3050 174.4863 37 H 5.2629 7.8951 113.6092 54.2779 33.1219 172.4434 38 Q 4.1726 8.8343 123.0308 54.2765 31.2426 174.3956 39 L 4.8653 8.6277 126.2277 53.9423 42.6994 175.6919 40 S 4.8565 9.3142 120.0899 56.2978 64.8640 172.6356 41 L 5.3531 8.6136 126.1288 53.3650 44.5100 176.0139 42 T 4.9038 9.2312 119.4444 61.8980 73.2495 172.4214 43 F 5.4811 9.2300 128.4530 56.4834 41.9332 174.1662 44 Q 5.2651 8.0826 122.4587 54.1887 32.7612 173.7158 45 V 4.5742 8.0573 118.9265 61.6319 34.7111 174.0605 46 T 5.0813 8.2187 124.4982 62.5051 70.3790 173.9260 47 Q 4.5989 8.8099 124.1293 54.4885 33.2776 173.2450 48 K 4.2610 8.7221 125.6404 57.2157 32.7848 177.7404 49 T 3.9488 8.8736 123.9013 66.6736 68.6179 176.4659 50 Q 4.1417 8.1785 117.9550 58.3217 28.8985 177.0173 51 R 4.7616 8.1660 118.2449 56.0050 30.5817 178.0115 52 R 3.9632 8.3593 122.3102 59.1076 29.7329 178.0606 53 W 4.3303 8.4218 116.3984 59.7589 27.6082 177.8606 54 F 3.1268 6.4103 120.2870 60.6125 38.7935 176.8512 55 L 4.0728 7.6308 118.1704 57.7202 41.4209 178.9338 56 D 4.3975 8.4177 119.2588 57.3342 40.7092 178.7480 57 K 3.9180 8.2440 120.1901 59.4512 32.1183 178.8286 58 L 3.6966 7.2852 119.2451 57.4309 41.3762 179.5270 59 V 3.7218 7.3606 118.1639 66.0266 31.2315 177.6850 60 D 4.3038 7.7621 116.2840 57.3712 41.2933 177.6077 61 E 3.8999 8.0981 118.3796 59.3601 29.5021 179.0346 62 I 3.9771 8.0626 119.2683 62.0154 37.3311 177.4855 63 G 4.0469 9.5187 106.8760 45.2585 0.0000 172.8099 64 V 4.3894 7.3779 117.0814 60.8295 34.3634 174.1094 65 G 3.8549 10.4447 107.0576 45.2124 0.0000 171.0978 66 Y 4.8959 7.3355 115.1974 56.2435 41.8675 173.5125 67 V 4.9680 8.5812 119.4512 61.0297 33.6858 174.6560 68 R 4.8891 9.0882 124.1235 54.4777 32.7050 173.8530 69 D 5.2083 8.6760 120.1716 51.9412 42.9623 176.7121 70 R 4.7097 8.3589 121.7326 54.9574 30.6118 174.7529 71 G 4.0531 8.4122 115.5162 46.4083 0.0000 175.0278 72 S 4.3598 8.7632 120.4496 58.7447 63.4439 173.2000 73 V 4.8944 7.4445 120.7998 61.4834 35.1094 174.2034 74 S 5.3323 9.2285 121.1244 57.0162 67.6873 172.5991 75 D 5.2486 8.9630 120.0033 53.0283 45.3845 174.0594 76 Y 4.7245 9.0631 124.8595 56.6929 40.5442 174.1093 77 I 4.4862 7.5009 127.1595 59.0831 41.0567 174.4209 78 L 4.5267 8.7590 127.6304 53.8395 44.2998 176.5809 79 S 4.6927 8.8509 121.2933 58.1693 65.5491 174.6524 80 E 3.9622 8.3674 120.0444 56.6966 29.9472 177.0951 81 I 3.7126 8.6096 124.4720 64.1447 38.0341 177.5392 82 K 3.9787 8.0161 119.5723 59.3200 32.1782 177.0359 83 P 4.4395 0.0000 0.0000 65.1034 31.1908 178.4761 84 L 4.0753 8.3144 119.8349 58.3810 42.0663 178.3976 85 H 4.0669 8.4799 118.2481 59.3071 29.5190 176.6244 86 N 4.3746 8.3277 118.7996 56.6843 38.8323 176.4701 87 F 4.4010 8.6837 122.2052 61.5849 39.5078 177.1221 88 L 3.5762 8.3222 118.8362 57.8738 41.0973 179.7473 89 T 3.7224 7.5861 115.1271 66.6109 68.4423 176.2076 90 Q 4.1065 7.4918 118.3009 57.8221 29.1067 177.8784 91 L 3.9486 7.4768 121.6764 57.9802 42.0331 178.4419 92 Q 3.7363 7.9220 120.1460 58.7703 28.7935 177.3493 93 P 4.1340 0.0000 0.0000 64.4880 31.4401 176.5692 94 F 4.9311 7.6224 116.1050 57.3006 39.9653 176.0211 95 L 4.3460 7.4332 121.4569 54.4556 42.1123 176.7774 96 K 4.4707 9.4437 120.5355 56.9191 34.4660 177.4453 97 L 4.4718 8.3310 116.4652 55.1682 43.0134 177.1851 98 K 4.7620 7.9859 116.4710 55.8339 33.1838 177.9337 99 Q 3.9382 8.2085 122.9104 59.1838 28.9144 178.1463 100 K 3.9314 7.9234 119.0768 59.4905 32.1836 179.0732 101 Q 3.9885 8.0946 117.6066 58.8679 28.6695 178.6624 102 A 3.9738 7.9815 121.6006 55.4603 18.5340 179.5191 103 N 4.2443 8.0970 114.8639 56.3716 38.4287 177.7326 104 L 3.8892 7.9756 120.5814 57.4418 41.6087 179.6644 105 V 3.6193 7.7334 118.3956 66.0529 31.5207 178.1030 106 L 4.0418 8.0173 118.7472 57.5936 41.1424 179.5450 107 K 4.1859 7.5624 120.1554 58.8929 32.5583 178.7377 108 I 4.1320 8.0462 120.4132 64.5750 36.9579 178.3181 109 I 3.8013 8.2081 121.0164 64.7443 36.9145 178.4287 110 E 4.1085 8.4544 118.9345 58.5272 29.3623 178.2901 111 Q 4.7248 7.7601 116.0308 55.6699 29.0231 177.3447 112 L 4.1222 7.7785 123.1020 57.3273 41.4707 177.5229 113 P 4.3383 0.0000 0.0000 65.6967 31.5620 177.5938 114 S 4.3198 8.1204 112.4361 59.8554 63.5193 175.5395 115 A 4.3192 7.6990 123.0110 54.0531 18.4515 178.1289 116 K 4.4807 7.9355 115.6206 57.5840 33.5512 176.6517 117 E 4.2123 8.1079 114.9458 56.9233 30.0850 176.7769 118 S 4.0927 9.2854 123.0402 58.9235 63.0292 172.4851 119 P 3.6719 0.0000 0.0000 64.9377 30.8599 177.5822 120 D 4.5290 7.8960 116.3883 55.3812 41.0425 177.8944 121 K 3.9589 8.3460 120.6474 58.4369 32.2447 178.4292 122 F 4.0326 7.8407 120.8955 61.1136 39.1451 177.0432 123 L 3.7750 7.2298 116.4327 57.4870 41.5202 178.7693 124 E 3.5696 7.5120 119.3967 58.6547 29.4584 178.9700 125 V 2.4933 6.8206 118.4010 65.3783 31.1028 177.4492 126 C 4.0729 7.5019 115.4850 61.7343 27.7745 175.9383 127 T 4.3977 6.8057 119.7861 65.5574 68.3236 176.8009 128 W 4.7115 7.5877 120.8360 60.0408 29.0087 178.7599 129 V 3.7047 7.8043 117.7522 65.8937 30.9589 177.6983 130 D 4.3611 7.7623 118.0727 57.4000 40.7540 178.7057 131 Q 4.0435 8.1811 118.5620 58.9616 28.8045 178.9617 132 I 3.6861 7.7737 120.2446 64.4546 36.9897 178.3498 133 A 4.0178 7.7943 119.9070 55.1599 18.2090 179.2460 134 A 4.0838 7.8246 118.5775 55.2176 18.5011 179.5426 135 L 4.1298 7.6348 116.4637 56.4801 41.9323 177.3712 136 N 4.7005 7.4771 115.5627 52.3905 40.2145 175.2677 137 D 4.6326 8.1246 119.8890 53.4326 39.6329 177.3063 138 S 4.2865 7.6076 113.8184 58.3054 63.3747 173.5068 139 K 4.6512 8.5970 124.3944 55.9495 34.1396 176.7203 140 T 4.6317 7.7398 107.1422 60.8305 69.4693 173.7234 141 R 4.0216 8.1425 122.0587 57.1655 30.7284 175.2035 142 K 4.3265 8.7295 122.6421 58.0883 34.3116 176.5869 143 T 4.2645 7.7859 116.1141 62.6544 68.6980 173.7979 144 T 4.6576 8.0152 120.3876 59.1952 70.8917 174.4570 145 S 4.0022 8.2886 116.8213 61.5502 62.3556 176.1086 146 E 3.9031 8.1348 121.3843 59.2954 29.2960 178.7135 147 T 4.0163 7.7483 115.2133 66.6526 68.8963 176.7766 148 V 3.6024 7.6647 119.3223 65.4453 31.1702 177.2710 149 R 4.2074 7.8736 115.4956 57.3789 29.2873 176.3951 150 A 4.6656 7.6869 119.4408 52.7514 18.5083 178.8249 151 V 3.8171 7.5861 116.8478 64.8005 31.8705 176.0997 152 L 4.1991 7.3114 119.4290 55.4842 41.1627 176.7351 153 D 4.5035 8.4909 122.9507 54.4026 41.6082 175.9549 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 2 N 8.42 4.69 0.00 2.74 3.00 0.00 0.00 6.89 6.65 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 3 T 8.27 3.66 4.10 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 0.99 0.00 0.00 4 K 8.98 4.42 0.00 1.70 1.68 0.00 1.83 0.00 0.00 1.95 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.37 7.81 5 Y 8.75 4.68 0.00 3.20 3.23 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 6 N 8.76 4.52 0.00 2.90 2.84 0.00 0.00 6.73 6.25 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 7 K 8.74 4.05 0.00 1.95 1.82 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.31 1.58 7.81 8 E 8.17 3.90 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 2.38 2.38 0.00 9 F 8.23 4.29 0.00 3.11 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.10 3.73 0.00 2.02 1.97 1.28 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.83 3.58 0.00 1.66 1.54 0.68 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.92 3.95 0.00 3.06 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 13 L 8.16 3.98 0.00 1.36 1.35 0.99 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.40 4.06 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 0.00 0.00 0.00 0.00 0.00 15 G 7.77 3.43 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 0.00 16 F 7.95 3.74 0.00 2.89 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.79 3.73 2.41 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 1.31 0.00 0.00 1.39 0.00 0.00 18 D 8.34 4.44 0.00 2.84 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 19 G 7.52 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 20 D 8.29 4.69 0.00 2.17 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 21 G 7.88 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.62 4.69 0.00 3.81 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 23 I 8.53 4.91 1.94 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 1.65 0.93 1.00 0.00 0.00 24 I 9.03 4.70 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.78 0.92 0.00 0.00 25 A 8.51 5.21 1.21 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 0.00 0.00 26 Q 9.54 4.57 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.68 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 27 I 8.39 4.85 1.85 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.54 0.93 0.00 0.00 28 K 8.91 4.61 0.00 1.58 1.68 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.35 7.81 29 P 0.00 4.55 0.00 2.02 2.02 0.00 3.78 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 30 N 8.93 4.78 0.00 2.70 2.60 0.00 0.00 6.78 6.26 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 31 Q 9.08 4.11 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 32 S 8.35 4.32 0.00 3.90 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 33 Y 7.79 4.39 0.00 2.98 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 34 K 8.66 3.56 0.00 1.37 1.18 0.00 1.41 0.00 0.00 0.89 0.00 0.00 2.65 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.41 1.08 7.81 35 F 7.61 4.73 0.00 2.30 2.49 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 36 K 8.41 4.18 0.00 2.04 2.00 0.00 1.85 0.00 0.00 1.84 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.58 7.81 37 H 7.90 5.26 0.00 3.26 3.27 0.00 5.82 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.83 4.17 0.00 0.93 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.87 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 39 L 8.63 4.87 0.00 1.67 1.64 0.82 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 40 S 9.31 4.86 0.00 3.84 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 41 L 8.61 5.35 0.00 1.60 1.60 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 42 T 9.23 4.90 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 1.15 0.00 0.00 43 F 9.23 5.48 0.00 3.27 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 44 Q 8.08 5.27 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.54 0.00 0.00 0.00 0.00 0.00 2.20 1.96 0.00 45 V 8.06 4.57 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 1.36 0.00 0.00 0.96 0.00 0.00 46 T 8.22 5.08 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 47 Q 8.81 4.60 0.00 2.17 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.93 0.00 0.00 0.00 0.00 0.00 2.09 2.27 0.00 48 K 8.72 4.26 0.00 1.88 1.69 0.00 1.79 0.00 0.00 1.84 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.62 7.81 49 T 8.87 3.95 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 1.31 0.00 0.00 50 Q 8.18 4.14 0.00 2.23 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.46 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 51 R 8.17 4.76 0.00 1.94 1.73 0.00 3.09 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.60 0.00 52 R 8.36 3.96 0.00 1.99 2.03 0.00 3.16 0.00 0.00 3.28 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.70 0.00 53 W 8.42 4.33 0.00 3.70 3.40 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 54 F 6.41 3.13 0.00 1.51 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 55 L 7.63 4.07 0.00 2.01 1.76 1.06 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.42 4.40 0.00 2.92 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.24 3.92 0.00 1.86 1.85 0.00 1.64 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.38 1.39 7.81 58 L 7.29 3.70 0.00 1.41 0.83 0.64 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.36 3.72 2.33 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 1.17 0.00 0.00 1.24 0.00 0.00 60 D 7.76 4.30 0.00 2.68 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 61 E 8.10 3.90 0.00 1.73 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.26 0.00 62 I 8.06 3.98 1.80 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.42 0.63 0.00 0.00 63 G 9.52 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 0.00 0.00 0.00 0.00 64 V 7.38 4.39 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 0.82 0.00 0.00 1.06 0.00 0.00 65 G 10.44 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 7.34 4.90 0.00 3.12 3.03 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 0.00 0.00 0.00 67 V 8.58 4.97 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 0.96 0.00 0.00 1.04 0.00 0.00 68 R 9.09 4.89 0.00 2.00 2.20 0.00 2.86 0.00 0.00 3.13 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.70 0.00 69 D 8.68 5.21 0.00 2.71 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.36 4.71 0.00 1.89 1.89 0.00 3.13 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 71 G 8.41 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 0.00 0.00 0.00 0.00 72 S 8.76 4.36 0.00 4.03 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 73 V 7.44 4.89 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 1.04 0.00 0.00 0.93 0.00 0.00 74 S 9.23 5.33 0.00 3.75 3.80 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 75 D 8.96 5.25 0.00 2.51 2.39 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 76 Y 9.06 4.72 0.00 3.04 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 77 I 7.50 4.49 0.71 0.00 0.00 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 0.69 0.91 0.68 0.00 0.00 78 L 8.76 4.53 0.00 1.69 1.70 0.98 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.85 4.69 0.00 3.93 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.37 3.96 0.00 2.08 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 2.48 2.48 0.00 81 I 8.61 3.71 1.95 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.43 0.97 0.00 0.00 82 K 8.02 3.98 0.00 1.95 1.84 0.00 1.69 0.00 0.00 1.84 0.00 0.00 3.09 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.64 7.81 83 P 0.00 4.44 0.00 2.30 2.19 0.00 3.86 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 2.18 2.21 0.00 84 L 8.31 4.08 0.00 1.97 2.00 1.11 1.21 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 85 H 8.48 4.07 0.00 3.42 3.48 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.33 4.37 0.00 3.10 3.11 0.00 0.00 6.91 7.83 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 87 F 8.68 4.40 0.00 3.23 3.23 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 88 L 8.32 3.58 0.00 1.68 1.58 0.98 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.59 3.72 4.41 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 1.17 0.00 0.00 90 Q 7.49 4.11 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.97 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 91 L 7.48 3.95 0.00 0.84 1.03 0.78 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 7.92 3.74 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.60 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 93 P 0.00 4.13 0.00 1.56 1.82 0.00 3.41 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.58 0.00 94 F 7.62 4.93 0.00 3.00 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 95 L 7.43 4.35 0.00 1.56 1.63 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 96 K 9.44 4.47 0.00 1.74 1.80 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.37 7.81 97 L 8.33 4.47 0.00 1.76 1.69 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.99 4.76 0.00 1.84 1.77 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.34 1.33 7.81 99 Q 8.21 3.94 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.92 6.91 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 100 K 7.92 3.93 0.00 1.81 1.80 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.49 7.81 101 Q 8.09 3.99 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.66 2.50 0.00 102 A 7.98 3.97 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 0.00 103 N 8.10 4.24 0.00 2.85 2.79 0.00 0.00 7.11 6.87 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 0.00 104 L 7.98 3.89 0.00 1.86 1.69 0.90 0.38 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 0.00 105 V 7.73 3.62 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 1.15 0.00 0.00 1.01 0.00 0.00 106 L 8.02 4.04 0.00 1.88 1.65 0.90 0.34 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 0.00 107 K 7.56 4.19 0.00 1.73 1.86 0.00 1.19 0.00 0.00 0.66 0.00 0.00 2.13 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.12 1.14 7.81 108 I 8.05 4.13 2.12 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.33 1.00 0.00 0.00 109 I 8.21 3.80 2.15 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 1.61 1.35 1.01 0.00 0.00 110 E 8.45 4.11 0.00 2.22 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 2.37 2.71 0.00 111 Q 7.76 4.72 0.00 2.27 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.65 2.79 0.00 112 L 7.78 4.12 0.00 1.81 1.82 1.01 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.34 0.00 2.22 2.23 0.00 3.80 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.00 0.00 114 S 8.12 4.32 0.00 4.08 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 0.00 115 A 7.70 4.32 1.53 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 0.00 116 K 7.94 4.48 0.00 2.02 1.91 0.00 1.80 0.00 0.00 1.91 0.00 0.00 3.22 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.51 1.51 7.81 117 E 8.11 4.21 0.00 2.24 1.76 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 2.29 2.30 0.00 118 S 9.29 4.09 0.00 3.88 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 0.00 119 P 0.00 3.67 0.00 2.13 1.93 0.00 3.67 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.57 0.00 120 D 7.90 4.53 0.00 2.72 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 0.00 121 K 8.35 3.96 0.00 1.81 2.01 0.00 1.46 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.49 7.81 122 F 7.84 4.03 0.00 2.83 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 0.00 123 L 7.23 3.78 0.00 1.56 1.56 0.85 0.81 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 0.00 124 E 7.51 3.57 0.00 1.83 1.69 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 1.47 1.87 0.00 125 V 6.82 2.49 1.79 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 0.89 0.00 0.00 0.85 0.00 0.00 126 C 7.50 4.07 0.00 2.86 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 0.00 127 T 6.81 4.40 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 1.32 0.00 0.00 128 W 7.59 4.71 0.00 3.41 3.02 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 0.00 0.00 0.00 129 V 7.80 3.70 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 1.06 0.00 0.00 0.96 0.00 0.00 130 D 7.76 4.36 0.00 2.96 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 0.00 131 Q 8.18 4.04 0.00 2.41 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.71 0.00 132 I 7.77 3.69 2.03 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 1.48 1.32 0.93 0.00 0.00 133 A 7.79 4.02 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 0.00 134 A 7.82 4.08 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 0.00 135 L 7.63 4.13 0.00 1.83 1.86 0.91 0.94 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 0.00 136 N 7.48 4.70 0.00 2.75 2.76 0.00 0.00 7.02 7.84 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 0.00 137 D 8.12 4.63 0.00 2.65 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 S 7.61 4.29 0.00 3.89 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 0.00 139 K 8.60 4.65 0.00 1.71 1.75 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.58 7.81 140 T 7.74 4.63 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 1.21 0.00 0.00 141 R 8.14 4.02 0.00 1.79 1.88 0.00 3.17 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 142 K 8.73 4.33 0.00 1.74 1.79 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.12 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.36 7.81 143 T 7.79 4.26 4.34 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 1.28 0.00 0.00 144 T 8.02 4.66 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 1.23 0.00 0.00 145 S 8.29 4.00 0.00 4.03 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 0.00 146 E 8.13 3.90 0.00 1.94 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 2.28 2.46 0.00 147 T 7.75 4.02 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 0.00 148 V 7.66 3.60 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 1.12 0.00 0.00 0.82 0.00 0.00 149 R 7.87 4.21 0.00 2.03 2.00 0.00 3.27 0.00 0.00 3.15 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 150 A 7.69 4.67 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 0.00 151 V 7.59 3.82 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.01 0.00 0.00 152 L 7.31 4.20 0.00 1.76 1.63 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.49 4.50 0.00 2.63 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