NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 18 S 4.4933 8.3344 115.4155 58.1154 65.0400 174.2348 19 T 4.2457 7.7143 113.2768 61.2323 69.4870 172.8059 20 L 4.0778 7.8804 122.0728 54.7221 43.1389 176.2657 21 T 4.7016 8.0488 113.2324 58.9465 73.1366 174.8471 22 K 3.8714 8.4029 121.9679 59.6758 32.2417 178.5905 23 E 3.9145 8.1123 118.2801 59.4105 29.4012 178.9731 24 L 3.9022 7.8981 120.0733 58.2792 42.1387 179.0964 25 I 3.6433 7.7617 119.6871 64.3166 37.0152 178.6434 26 K 3.9771 8.2306 119.4925 59.3470 31.8248 178.9726 27 D 4.4369 8.2825 118.2297 57.2240 41.2050 178.1534 28 A 3.9280 8.2128 121.2480 55.0473 18.2977 179.4167 29 A 3.9591 8.1382 119.3289 55.4898 18.2501 179.7559 30 E 4.0786 8.0276 117.2467 58.8186 29.5950 179.2546 31 K 4.2370 7.9956 117.0963 57.9282 32.3964 177.0124 32 C 4.9075 8.1016 114.4657 56.6808 42.5978 173.3296 33 C 5.2859 8.1074 116.1870 54.8025 40.9873 173.7373 34 T 4.3021 8.3006 112.0547 61.2856 68.9294 175.7617 35 R 3.9356 8.7373 121.4190 59.5339 30.0885 178.8304 36 N 4.4992 8.1083 112.5321 54.5549 37.8603 176.1279 37 R 4.4760 7.7652 117.6794 55.9282 30.0282 177.5044 38 Q 4.0197 7.6608 119.6456 59.3484 28.7157 178.7926 39 E 4.0349 8.1415 118.8406 59.5341 29.4804 179.8323 40 C 4.3027 8.1353 118.0148 59.9084 40.6922 176.1478 41 C 4.3045 8.4876 118.2786 60.0969 40.8649 176.1454 42 I 3.6603 8.0732 121.5941 64.3218 36.6769 178.3545 43 E 4.0927 8.4088 119.7865 59.5422 29.3900 179.5620 44 I 4.0431 8.0392 114.4112 63.5616 37.2273 178.2661 45 M 4.0995 8.1509 121.1086 58.1197 31.6215 178.7611 46 K 3.9511 8.1059 117.9526 59.4475 32.9106 178.5331 47 F 4.5264 8.2939 117.1404 56.7318 39.9777 175.2702 48 G 3.8765 7.8418 106.0450 46.8477 0.0000 172.3869 49 T 4.8380 7.8568 107.2154 57.3878 72.2710 171.8707 50 P 4.9381 0.0000 0.0000 61.7399 31.9360 176.3902 51 I 4.1526 8.2508 121.3090 61.1492 37.8822 174.2309 52 R 4.2887 8.4123 122.7169 53.5085 32.5528 176.8949 53 C 4.0884 9.7570 115.3143 58.1784 38.6336 173.9184 54 G 3.8258 8.2768 105.3223 46.5801 0.0000 175.0886 55 Y 4.4357 7.4386 119.4613 56.6347 36.3809 174.4316 56 D 4.7162 8.1028 121.9184 55.7977 42.8916 177.9906 57 R 3.9119 8.2767 117.7139 58.7356 30.1423 175.5212 58 D 4.8337 7.9062 120.0928 51.4955 41.6717 174.3474 59 P 4.4484 0.0000 0.0000 64.5990 31.4640 177.4212 60 K 4.0442 8.4764 118.6305 57.6056 32.8367 178.6373 61 L 3.9822 7.9248 121.2052 57.5934 41.7910 176.9059 62 P 4.1194 0.0000 0.0000 65.4923 31.3405 178.7012 63 G 3.3739 7.7124 103.9301 48.0233 0.0000 175.2617 64 Y 4.4706 7.0866 119.1232 60.7328 37.7995 178.5572 65 V 3.5686 8.1062 119.6975 65.9527 31.5023 177.3702 66 Y 4.0512 8.3214 119.6129 60.7699 38.6437 178.4412 67 K 4.1101 8.2785 118.9256 59.4570 32.1834 178.5594 68 C 4.2635 8.4799 118.9011 59.6981 42.3784 175.5813 69 L 3.8589 8.2227 120.8972 57.9694 41.1982 179.5190 70 Q 3.9754 8.0439 117.9591 59.1670 28.4091 178.8071 71 N 4.3839 8.0177 116.4058 55.9955 38.6333 177.4419 72 V 3.7428 7.7029 119.5801 65.8893 31.5799 178.1146 73 L 3.7532 7.8151 117.6220 56.6338 41.4655 178.1302 74 F 5.0613 7.8622 116.8862 56.8631 39.7454 177.7023 75 A 4.0479 7.7235 126.2387 55.3270 18.2125 180.2383 76 K 4.2721 7.9922 112.8487 58.0421 33.1233 177.0915 77 E 4.7562 7.8091 118.5406 53.2127 29.7951 174.3394 78 P 4.2629 0.0000 0.0000 65.6227 31.7540 179.3808 79 K 4.1667 7.9262 116.2989 58.0318 32.2715 177.6444 80 K 3.9549 8.1107 118.5307 57.2266 32.3775 177.2234 81 K 4.5708 7.4366 118.5160 55.8566 32.7916 176.4149 82 I 4.6258 8.3859 121.6138 59.1086 40.7800 175.2805 83 N 4.4551 8.8120 123.6068 53.5094 39.5777 175.0703 84 L 3.5959 8.9182 126.7707 58.5699 41.9931 178.8810 85 D 4.4105 8.0632 117.8956 57.0603 40.7879 177.9063 86 D 4.5144 8.2553 119.2970 56.3216 40.8008 178.4420 87 S 4.3598 8.1425 115.3111 61.2098 62.7743 176.7513 88 V 3.8121 7.7602 115.6016 64.1713 31.2876 177.5420 89 C 4.7558 8.4159 116.3328 59.7782 36.0577 175.0794 90 C 4.4349 8.5615 118.3547 60.0428 33.8612 175.9846 91 S 4.4869 8.4383 118.4332 60.7111 62.3359 176.9067 92 V 2.8270 7.2993 121.7431 64.1926 30.5622 178.3233 93 F 4.4030 7.7795 118.3237 59.6662 38.5138 176.8723 94 G 4.2336 7.6131 104.3642 45.2037 0.0000 174.9085 95 N 4.7198 7.7997 118.3580 54.5813 38.9466 175.0458 96 D 4.5475 7.6776 120.8360 53.1179 40.2627 176.4797 97 Q 4.5585 8.1295 129.9019 55.3527 27.2647 175.7882 98 E 4.8029 7.7837 115.4059 53.5874 34.5822 177.0201 99 D 4.4332 8.8706 121.0844 57.8923 40.6951 179.5901 100 S 4.2375 8.1214 114.2238 61.0820 62.9366 176.7287 101 G 3.6584 7.9840 110.8231 47.2730 0.0000 175.7509 102 R 3.9140 7.9419 121.2344 58.8621 30.1274 178.3926 103 R 3.8342 8.1474 118.7388 59.5659 30.0756 177.7607 104 C 4.1237 8.4775 118.6875 59.2781 38.9766 175.0701 105 E 4.0218 8.4738 121.3465 59.5380 29.2882 178.6755 106 N 4.3728 8.4151 116.6855 56.1262 38.4706 177.4447 107 R 3.8412 8.0898 120.2312 59.4610 30.1786 177.6952 108 C 4.1583 8.4330 118.6315 59.7340 43.4243 175.6646 109 K 3.9954 8.1366 118.9382 59.5207 31.8768 178.8693 110 N 4.5243 8.3436 116.6565 56.3222 38.5606 177.4335 111 L 4.0719 8.2047 120.6526 58.1626 41.6123 179.0980 112 M 4.5725 8.4927 116.0983 56.6364 32.1517 176.9297 113 T 4.3501 7.7888 108.7121 61.2167 69.5868 173.7630 114 S 4.9707 8.1351 120.1670 56.5587 62.4088 172.9999 115 P 3.9882 0.0000 0.0000 65.1610 30.9136 177.5674 116 S 4.4517 8.0732 111.5149 58.3306 63.6583 173.1462 117 I 4.4332 7.5506 123.3523 60.1977 37.7302 176.1373 118 D 4.3156 8.6146 125.4101 52.5018 41.3946 176.8430 119 A 3.9259 8.2166 122.3873 55.6672 18.2457 180.0148 120 A 3.9775 7.9428 118.2654 55.7239 18.3563 179.8589 121 T 3.8249 8.4915 114.3097 66.7122 68.4455 177.2304 122 R 3.9300 8.0000 119.9223 59.4478 30.1827 179.2219 123 L 4.1638 8.4075 119.1169 57.8655 41.5901 179.3568 124 D 4.3489 8.4237 119.2322 57.3633 40.7560 178.8011 125 S 4.0483 7.9042 113.4248 61.3268 62.2813 176.2936 126 I 3.4411 7.9295 122.7872 64.1117 36.5956 178.3382 127 K 3.2020 8.1022 119.8283 59.2427 32.1676 178.7701 128 S 4.1573 7.9861 115.7370 61.5913 62.5869 174.1289 129 C 4.4246 7.9757 115.3603 57.0861 40.1396 174.8928 130 S 4.6358 7.1903 116.4818 58.1835 62.7870 175.7391 131 L 3.9108 7.4874 124.3144 58.0073 41.4346 178.0805 132 L 4.5729 7.7766 115.6880 54.6065 42.4094 176.3991 133 D 4.8864 8.2774 118.7616 52.0534 41.9113 176.3099 134 N 4.3525 8.3775 119.8108 57.1481 39.1981 175.3915 135 V 3.6286 7.8694 118.8785 66.1565 31.5109 177.9055 136 L 3.8720 7.9919 118.5783 57.7597 41.4042 178.8116 137 Y 4.3715 8.1892 119.1695 60.7693 38.7699 178.0757 138 K 3.9665 8.4521 119.5859 59.4569 32.1111 178.5745 139 C 4.2488 8.0905 118.9771 59.4245 40.7332 175.2762 140 F 3.9704 8.1582 122.4815 61.4464 38.9384 177.0419 141 E 3.6270 8.1359 118.1565 59.0117 29.1089 179.2574 142 K 3.9187 8.2123 120.0733 59.5027 32.2997 177.9599 143 C 4.1801 8.7697 119.2438 59.8497 44.7643 175.8383 144 R 3.7156 7.6601 119.5055 59.2434 29.5631 179.2373 145 S 4.0490 8.0181 114.8767 61.5956 62.8258 176.7470 146 L 3.8384 8.0740 122.0269 57.5725 41.2646 179.5457 147 R 4.1224 7.8287 119.9373 58.8741 29.8388 178.4890 148 K 3.9434 7.8487 117.9742 59.4098 32.2138 177.5477 149 D 4.6326 7.7970 116.4326 54.5002 40.9173 177.0637 150 G 3.9471 7.9571 108.3557 45.0102 0.0000 173.6273 151 I 3.9736 7.6320 121.9472 59.7734 37.9369 175.3873 152 K 4.3996 8.4037 127.0063 55.4382 30.9610 176.6720 153 I 3.5436 8.2291 120.7697 63.6696 37.4222 178.4743 154 E 3.9671 8.0609 119.1056 58.7832 29.4659 178.2971 155 V 3.6973 7.9234 118.4721 64.5685 31.8006 175.9087 156 L 4.7621 7.5083 118.8885 52.6742 43.8464 175.8447 157 Q 4.2803 7.9512 119.7169 54.4172 30.5655 176.7013 158 F 3.3095 7.9412 118.0679 60.6471 39.0370 177.6790 159 E 4.3973 8.0185 117.8479 58.2882 29.3410 177.8059 160 E 4.2809 8.2036 117.9002 57.8011 29.8155 176.6014 161 Y 4.7495 7.4740 112.9142 56.0720 39.4141 175.7647 162 C 4.7942 8.3732 119.1769 55.6217 41.4197 173.3171 163 E 4.4752 8.7245 123.3256 56.0035 29.2303 176.9736 164 A 4.2602 7.6623 127.8579 52.3844 19.4026 176.6185 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 18 S 8.33 4.49 0.00 4.02 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 19 T 7.71 4.25 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 20 L 7.88 4.08 0.00 1.66 1.56 0.97 0.63 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 21 T 8.05 4.70 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 1.26 0.00 0.00 22 K 8.40 3.87 0.00 1.81 1.82 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.51 7.81 23 E 8.11 3.91 0.00 2.07 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 2.39 2.42 0.00 24 L 7.90 3.90 0.00 1.72 1.72 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.76 3.64 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.45 0.88 0.00 0.00 26 K 8.23 3.98 0.00 1.91 2.01 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.61 7.81 27 D 8.28 4.44 0.00 2.82 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 28 A 8.21 3.93 1.28 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 0.00 0.00 29 A 8.14 3.96 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 30 E 8.03 4.08 0.00 2.12 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 2.42 0.00 31 K 8.00 4.24 0.00 1.74 1.86 0.00 1.63 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.45 1.61 7.81 32 C 8.10 4.91 0.00 3.03 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 33 C 8.11 5.29 0.00 3.12 3.13 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 34 T 8.30 4.30 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 1.35 0.00 0.00 35 R 8.74 3.94 0.00 1.86 2.04 0.00 3.29 0.00 0.00 3.40 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.59 0.00 36 N 8.11 4.50 0.00 2.80 2.92 0.00 0.00 5.89 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 37 R 7.77 4.48 0.00 1.83 1.88 0.00 2.22 0.00 0.00 2.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.42 0.00 38 Q 7.66 4.02 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.42 6.80 0.00 0.00 0.00 0.00 0.00 2.71 2.57 0.00 39 E 8.14 4.03 0.00 1.98 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 2.41 2.32 0.00 40 C 8.14 4.30 0.00 2.99 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 C 8.49 4.30 0.00 3.26 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 8.07 3.66 2.04 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.69 0.90 0.00 0.00 43 E 8.41 4.09 0.00 2.28 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 0.00 2.43 2.64 0.00 44 I 8.04 4.04 2.23 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 1.62 1.54 1.09 0.00 0.00 45 M 8.15 4.10 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.52 0.00 46 K 8.11 3.95 0.00 1.70 1.82 0.00 1.35 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.39 0.65 7.81 47 F 8.29 4.53 0.00 3.21 3.09 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 48 G 7.84 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 49 T 7.86 4.84 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 1.27 0.00 0.00 50 P 0.00 4.94 0.00 2.11 2.08 0.00 3.77 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.28 0.00 51 I 8.25 4.15 1.96 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 1.51 0.59 1.08 0.00 0.00 52 R 8.41 4.29 0.00 1.87 1.72 0.00 3.29 0.00 0.00 3.35 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 53 C 9.76 4.09 0.00 3.26 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.28 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 0.00 0.00 0.00 55 Y 7.44 4.44 0.00 3.08 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 56 D 8.10 4.72 0.00 2.67 2.72 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 57 R 8.28 3.91 0.00 1.80 2.03 0.00 3.22 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 58 D 7.91 4.83 0.00 2.74 2.59 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 59 P 0.00 4.45 0.00 2.20 2.17 0.00 3.83 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 1.99 1.99 0.00 60 K 8.48 4.04 0.00 1.99 1.64 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.35 1.35 7.81 61 L 7.92 3.98 0.00 1.80 1.72 0.95 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.12 0.00 2.14 2.10 0.00 3.60 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 63 G 7.71 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 0.00 0.00 0.00 64 Y 7.09 4.47 0.00 3.11 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 65 V 8.11 3.57 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 1.05 0.00 0.00 0.56 0.00 0.00 66 Y 8.32 4.05 0.00 3.18 3.12 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 67 K 8.28 4.11 0.00 2.19 1.97 0.00 2.00 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.73 1.93 7.81 68 C 8.48 4.26 0.00 3.10 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 69 L 8.22 3.86 0.00 1.71 1.59 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 70 Q 8.04 3.98 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.12 1.60 0.00 71 N 8.02 4.38 0.00 2.93 2.89 0.00 0.00 7.03 7.01 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 72 V 7.70 3.74 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 0.98 0.00 0.00 0.97 0.00 0.00 73 L 7.82 3.75 0.00 0.70 0.68 0.63 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 74 F 7.86 5.06 0.00 3.25 3.13 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 75 A 7.72 4.05 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 76 K 7.99 4.27 0.00 1.79 1.90 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.47 7.81 77 E 7.81 4.76 0.00 2.04 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 2.25 2.28 0.00 78 P 0.00 4.26 0.00 2.23 2.36 0.00 3.80 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.02 0.00 79 K 7.93 4.17 0.00 1.74 1.88 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.40 7.81 80 K 8.11 3.95 0.00 1.15 0.82 0.00 1.73 0.00 0.00 1.49 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.27 1.38 7.81 81 K 7.44 4.57 0.00 1.87 1.88 0.00 1.73 0.00 0.00 1.98 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.65 1.57 7.81 82 I 8.39 4.63 2.00 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 1.22 0.61 0.99 0.00 0.00 83 N 8.81 4.46 0.00 2.83 2.71 0.00 0.00 6.83 6.66 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 84 L 8.92 3.60 0.00 1.32 1.52 0.10 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.06 4.41 0.00 2.70 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 86 D 8.26 4.51 0.00 2.92 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 87 S 8.14 4.36 0.00 4.10 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 88 V 7.76 3.81 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 0.83 0.00 0.00 0.99 0.00 0.00 89 C 8.42 4.76 0.00 3.15 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 90 C 8.56 4.43 0.00 3.27 3.33 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 91 S 8.44 4.49 0.00 4.24 4.15 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 92 V 7.30 2.83 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 -0.09 0.00 0.00 0.09 0.00 0.00 93 F 7.78 4.40 0.00 3.19 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 94 G 7.61 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 0.00 0.00 0.00 0.00 95 N 7.80 4.72 0.00 2.75 2.84 0.00 0.00 6.89 8.17 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 96 D 7.68 4.55 0.00 2.69 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 97 Q 8.13 4.56 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.58 0.00 0.00 0.00 0.00 0.00 2.55 2.33 0.00 98 E 7.78 4.80 0.00 2.06 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 2.22 2.31 0.00 99 D 8.87 4.43 0.00 2.67 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 0.00 100 S 8.12 4.24 0.00 4.02 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 0.00 101 G 7.98 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 0.00 102 R 7.94 3.91 0.00 1.90 2.09 0.00 3.20 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 103 R 8.15 3.83 0.00 1.99 2.03 0.00 3.12 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 104 C 8.48 4.12 0.00 2.96 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 0.00 105 E 8.47 4.02 0.00 2.26 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 0.00 2.37 2.65 0.00 106 N 8.42 4.37 0.00 2.76 2.85 0.00 0.00 6.71 8.25 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 0.00 107 R 8.09 3.84 0.00 1.87 2.09 0.00 3.10 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 108 C 8.43 4.16 0.00 2.87 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.14 4.00 0.00 1.93 1.90 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.56 1.77 7.81 110 N 8.34 4.52 0.00 2.90 2.89 0.00 0.00 7.03 6.34 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 0.00 111 L 8.20 4.07 0.00 1.85 1.78 0.94 1.06 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 0.00 112 M 8.49 4.57 0.00 2.06 2.28 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.94 0.00 113 T 7.79 4.35 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 1.20 0.00 0.00 114 S 8.14 4.97 0.00 4.19 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 0.00 115 P 0.00 3.99 0.00 1.96 1.75 0.00 4.08 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 116 S 8.07 4.45 0.00 4.02 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 0.00 117 I 7.55 4.43 1.97 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 1.43 0.67 0.97 0.00 0.00 118 D 8.61 4.32 0.00 2.61 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 0.00 119 A 8.22 3.93 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 0.00 120 A 7.94 3.98 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 T 8.49 3.82 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 1.24 0.00 0.00 122 R 8.00 3.93 0.00 2.09 2.06 0.00 3.23 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.97 0.00 123 L 8.41 4.16 0.00 1.76 1.93 1.03 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 124 D 8.42 4.35 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 0.00 125 S 7.90 4.05 0.00 3.83 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 0.00 126 I 7.93 3.44 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.58 0.43 0.00 0.00 127 K 8.10 3.20 0.00 1.21 1.57 0.00 1.49 0.00 0.00 1.51 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.07 0.49 7.81 128 S 7.99 4.16 0.00 4.00 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 0.00 129 C 7.98 4.42 0.00 2.99 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 0.00 130 S 7.19 4.64 0.00 4.18 3.78 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 0.00 131 L 7.49 3.91 0.00 1.59 1.74 0.85 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 132 L 7.78 4.57 0.00 1.62 1.67 0.91 0.93 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 0.00 133 D 8.28 4.89 0.00 2.70 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 0.00 134 N 8.38 4.35 0.00 2.86 2.88 0.00 0.00 6.67 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 0.00 135 V 7.87 3.63 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 1.00 0.00 0.00 0.95 0.00 0.00 136 L 7.99 3.87 0.00 2.02 1.48 0.96 0.67 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 0.00 137 Y 8.19 4.37 0.00 3.27 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 0.00 138 K 8.45 3.97 0.00 2.04 1.87 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.56 1.76 7.81 139 C 8.09 4.25 0.00 2.98 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 0.00 140 F 8.16 3.97 0.00 2.58 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 0.00 141 E 8.14 3.63 0.00 2.00 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 1.85 2.07 0.00 142 K 8.21 3.92 0.00 1.94 2.09 0.00 1.73 0.00 0.00 1.88 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.64 1.49 7.81 143 C 8.77 4.18 0.00 3.49 3.33 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 0.00 144 R 7.66 3.72 0.00 1.82 1.78 0.00 2.56 0.00 0.00 2.93 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.04 0.00 145 S 8.02 4.05 0.00 3.95 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 0.00 146 L 8.07 3.84 0.00 1.46 1.41 -0.04 0.52 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 0.00 147 R 7.83 4.12 0.00 1.91 2.01 0.00 3.27 0.00 0.00 3.16 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 148 K 7.85 3.94 0.00 1.72 1.98 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.50 7.81 149 D 7.80 4.63 0.00 2.76 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.96 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 0.00 0.00 0.00 151 I 7.63 3.97 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.89 0.78 0.00 0.00 152 K 8.40 4.40 0.00 1.75 1.68 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.44 7.81 153 I 8.23 3.54 1.79 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 1.35 0.48 0.82 0.00 0.00 154 E 8.06 3.97 0.00 1.92 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 2.29 2.32 0.00 155 V 7.92 3.70 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 0.73 0.00 0.00 0.92 0.00 0.00 156 L 7.51 4.76 0.00 1.77 1.72 0.84 0.93 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 0.00 157 Q 7.95 4.28 0.00 2.42 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.28 0.00 158 F 7.94 3.31 0.00 3.02 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 0.00 159 E 8.02 4.40 0.00 1.90 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 2.31 2.36 0.00 160 E 8.20 4.28 0.00 2.14 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 2.33 2.23 0.00 161 Y 7.47 4.75 0.00 2.98 2.96 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 0.00 162 C 8.37 4.79 0.00 2.87 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 0.00 163 E 8.72 4.48 0.00 1.95 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 2.29 2.31 0.00 164 A 7.66 4.26 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00