NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2039 8.1633 120.2849 54.5827 33.1960 174.2715 2 K 3.8463 8.6198 126.0426 56.8270 32.5484 175.2247 3 G 4.0428 8.4136 114.1745 44.5185 0.0000 171.4040 4 D 4.6583 8.4016 119.1503 53.5529 42.2502 177.4548 5 K 3.8651 8.9791 126.8580 59.9769 32.2992 179.0262 6 I 3.5939 7.8102 119.4315 64.1031 36.9981 178.4558 7 V 3.7224 8.3540 119.3724 66.1386 31.3837 178.2128 8 I 3.7722 8.0685 119.7382 64.3425 36.7764 178.5157 9 Q 3.9482 7.8113 118.6531 59.0011 28.5339 178.2328 10 H 4.0613 8.0430 117.2432 58.8566 28.8070 177.5970 11 L 4.0006 7.9698 120.6338 58.2103 41.4418 179.5332 12 N 4.4374 8.3091 116.1466 55.9107 38.4759 177.4025 13 K 3.8800 8.2861 121.4791 59.6420 32.3482 178.8660 14 I 3.7071 8.2130 120.3625 64.3447 37.0246 178.0775 15 L 4.0493 8.5150 121.6486 58.1108 41.3290 179.2015 16 G 3.6342 8.3603 105.9700 48.0141 0.0000 175.3645 17 N 4.3969 8.0265 118.5495 55.9068 38.4476 177.3913 18 E 3.9139 8.1737 119.9423 59.5235 29.5027 179.2428 19 L 3.9090 7.8396 118.9103 57.8809 41.6381 179.8552 20 I 3.6177 7.4124 118.2384 64.3909 37.0386 178.1454 21 A 3.3336 7.7268 121.5086 55.0124 17.9776 179.5286 22 I 3.5449 7.6955 118.1812 64.8153 37.1586 178.4162 23 N 4.3406 7.7926 117.1135 56.2375 38.3021 177.3474 24 Q 3.8607 7.9592 120.9072 59.5615 29.1280 178.0961 25 Y 4.7820 7.9626 119.2861 60.4060 37.7920 178.0960 26 F 3.9793 8.5578 121.8117 61.1227 39.5737 176.7454 27 L 3.9364 8.3548 120.2265 58.6337 41.8384 178.3351 28 H 3.9185 8.3467 115.9530 58.9091 28.7140 177.3309 29 A 4.1435 8.5394 122.5099 55.5947 18.3104 180.0413 30 R 3.8302 8.0443 116.1045 58.8235 29.9749 179.4134 31 M 3.4580 7.6414 119.1226 58.2308 31.8514 177.9942 32 Y 4.5167 7.5153 116.9646 61.2989 38.1555 178.3409 33 E 3.9318 8.2145 120.0178 59.6254 29.4807 178.5206 34 D 4.3425 7.7205 116.3000 56.5482 41.3086 177.3696 35 W 4.8746 7.8916 117.6687 57.0539 29.1184 177.1488 36 G 4.0071 8.2518 107.9388 45.2562 0.0000 174.3410 37 L 4.8194 8.1956 121.6708 52.8212 40.0901 176.8270 38 E 3.9130 8.1952 123.4587 59.5963 30.0142 179.2009 39 K 3.9042 8.0519 119.0949 59.5515 32.3009 178.5868 40 L 4.0594 7.8506 120.2327 57.8354 41.9364 179.0349 41 G 3.6932 8.5548 106.2029 47.7545 0.0000 175.6088 42 K 3.8835 8.5478 122.9612 59.3210 32.1363 178.3866 43 H 3.8015 8.1308 118.4218 59.2332 29.6617 177.1656 44 E 3.9224 8.2786 120.3755 59.2875 29.2295 178.7878 45 Y 4.0777 8.2227 119.8457 61.1417 38.8990 177.8552 46 H 4.0971 8.1365 116.9514 58.8380 28.7484 177.5288 47 E 3.8340 8.0031 120.4572 59.3252 29.2008 179.4307 48 S 4.2103 7.9520 112.9890 61.6754 62.5932 176.3016 49 I 3.6247 7.5711 122.4040 64.2604 36.6549 178.1828 50 D 4.2642 8.4272 120.1551 57.5483 40.6738 178.6181 51 E 3.9053 8.1129 118.8760 59.7539 29.3992 179.4506 52 M 4.0244 7.9682 118.6848 58.3753 32.0137 178.9920 53 K 4.0439 8.0407 118.6066 59.5075 32.1658 179.2452 54 H 4.2830 8.3988 116.7195 58.7184 28.5299 177.5998 55 A 3.9858 8.2192 122.7084 55.1047 18.1958 179.0189 56 D 4.2545 8.1774 116.4662 57.5457 41.2805 178.5556 57 K 3.9218 8.1137 118.7611 59.5136 32.0479 179.2202 58 L 3.9873 7.9273 118.9470 57.8756 41.5213 179.4129 59 I 3.6838 7.9276 119.7976 64.5367 37.0505 178.4313 60 K 3.9215 8.1581 118.9891 59.5469 31.8644 179.2675 61 R 4.0042 8.1827 118.7722 59.6928 30.0455 178.5862 62 I 3.7268 8.2110 119.9292 64.4201 37.0794 178.4617 63 L 4.0750 8.2581 120.0328 57.7200 41.2056 179.3413 64 F 4.3724 8.3101 119.9549 61.1523 39.6877 176.4893 65 L 4.3180 8.0252 117.6537 53.8890 41.3479 176.7697 66 E 3.6206 7.9944 117.6293 57.7370 27.0195 174.0244 67 G 4.1331 8.2423 109.2192 43.6812 0.0000 173.1611 68 L 4.5819 8.0708 119.3121 51.9632 42.9282 174.9745 69 P 4.4031 0.0000 0.0000 62.6797 31.7784 176.2839 70 N 4.7631 8.3815 120.1113 52.2192 39.1727 173.8881 71 L 4.5352 8.2074 123.4552 54.3928 42.4331 177.7647 72 Q 4.0187 8.0971 121.1447 57.9327 29.2185 175.6715 73 E 4.4006 8.2174 117.4709 54.4476 30.4484 174.7600 74 L 4.4861 8.3364 126.2916 52.8132 43.3925 176.2991 75 G 3.8089 8.3597 115.6926 44.3894 0.0000 171.8116 76 K 4.0346 8.3304 120.6859 56.0420 32.2087 176.6201 77 L 4.2568 8.3635 126.6680 54.7034 42.3575 177.4698 78 L 4.5892 8.0535 122.6628 53.2371 40.8644 175.4804 79 I 4.0775 7.8739 122.4028 60.5971 38.1844 175.9559 80 G 4.1967 8.6843 112.6773 44.2199 0.0000 172.7477 81 E 4.8288 9.3493 117.4856 56.3813 31.5540 176.8476 82 H 4.8640 7.9076 113.6450 53.5438 32.6997 173.8334 83 T 4.1872 8.4562 118.4258 67.3002 68.4628 175.9499 84 K 3.7828 8.2190 120.7195 59.6774 32.1405 178.5244 85 E 4.0034 7.8337 118.8463 59.5482 29.7244 178.3167 86 M 3.9721 8.1980 118.8873 58.4330 31.9576 178.7012 87 L 4.0918 8.2232 119.0193 58.1203 41.8560 179.6220 88 E 4.0214 8.0791 117.6391 59.2320 29.2449 179.3200 89 C 4.2284 8.2501 117.3380 62.8529 28.2021 175.6840 90 D 4.7826 8.4217 120.5915 57.2260 40.2991 178.6223 91 L 4.0009 8.2398 120.9201 58.1589 42.1377 178.8999 92 K 3.8902 8.1828 118.4930 59.8922 31.9039 178.3883 93 L 3.9709 8.2165 120.1337 58.5072 41.7093 178.5557 94 E 4.0894 8.6894 118.7574 59.7963 29.8230 179.5424 95 Q 4.1403 8.4888 117.6319 59.1083 28.7040 178.6099 96 A 4.0985 8.2900 120.6817 55.0188 18.5823 179.3019 97 G 3.7721 7.9934 103.6791 46.7768 0.0000 176.0700 98 L 4.0140 8.0258 121.8136 57.6088 41.6791 177.6692 99 P 4.2687 0.0000 0.0000 65.6833 31.2338 178.4481 100 D 4.3820 8.0283 117.2875 57.2315 40.8451 178.6209 101 L 4.0066 7.9083 119.4797 57.9015 41.7164 179.8308 102 K 4.2053 8.3619 118.1901 59.1556 31.8812 179.3158 103 A 4.0877 8.1200 121.1164 54.6138 18.2756 179.6464 104 A 3.6736 8.0366 119.5832 55.2380 18.5457 179.7913 105 I 3.6329 8.2007 118.5472 64.6575 37.3299 178.5168 106 A 4.0249 8.0755 121.4263 55.3257 18.2426 179.1081 107 Y 3.8939 7.6832 119.0676 60.3079 38.8939 177.6419 108 C 4.0814 8.3050 117.7863 62.6487 28.2226 175.8477 109 E 3.9087 8.0970 120.3921 59.5712 29.0723 179.6598 110 S 4.0874 7.7658 113.3782 60.6065 62.5886 175.7701 111 V 4.2154 6.8515 112.7013 60.1888 31.8837 176.3851 112 G 3.0649 7.2185 106.6604 46.1878 0.0000 175.2567 113 D 4.4709 7.2607 121.4323 53.0357 38.8523 176.1700 114 Y 4.2902 7.5552 121.6629 60.2390 38.3659 177.2632 115 A 4.0675 8.0730 121.5584 55.2879 18.5645 179.5995 116 S 4.1158 8.8589 114.1823 61.6949 62.8174 176.8482 117 R 3.9149 7.8486 121.1921 59.6792 29.8243 178.4792 118 E 4.0203 8.3380 118.2907 59.0569 29.5018 179.0579 119 L 3.9045 8.0172 120.4851 58.3604 42.2223 179.1307 120 L 4.0350 8.3036 119.1796 57.7033 41.4348 179.4238 121 E 3.9822 8.5896 119.0613 59.4279 29.4246 179.0250 122 D 4.3242 8.0653 118.7478 57.5235 40.8842 178.6808 123 I 3.4744 7.5031 119.7990 64.3318 37.0513 177.9374 124 L 3.9125 8.2057 121.2941 58.4220 41.3945 178.5552 125 E 3.8994 8.3231 119.0627 59.5389 29.5457 178.8335 126 S 4.1094 8.1215 113.0495 61.3271 62.4504 175.9743 127 E 4.0443 8.4811 121.7765 59.4582 29.2147 179.1942 128 E 4.0660 8.5165 118.7410 59.1765 29.3424 179.2088 129 D 4.4140 7.7380 118.5977 57.5645 40.8313 178.2868 130 H 4.3467 8.0111 116.1617 59.2089 28.7722 177.6812 131 I 3.7836 8.0118 121.4959 64.5782 36.9257 177.9672 132 D 4.3190 8.2317 118.5543 57.0857 41.1489 177.9346 133 W 4.1463 8.5353 129.0607 60.5234 30.7057 177.5705 134 L 3.7335 8.5070 119.0769 58.0075 41.0756 179.1836 135 E 3.8840 8.2409 118.1460 60.0257 29.3725 179.7141 136 T 3.7311 7.8549 115.3547 66.7233 68.4698 176.6668 137 Q 3.5857 7.4874 119.7909 58.6876 28.6437 178.8444 138 L 3.7444 7.5832 119.9401 57.7586 41.6324 179.3025 139 D 4.2713 8.1245 118.9825 57.2938 40.6707 178.7214 140 L 3.9355 7.9938 119.7555 57.8535 41.5667 179.6617 141 I 3.5018 7.3418 119.5186 64.5484 36.8159 178.3312 142 D 4.3327 7.6050 117.6145 56.6970 40.5934 178.7306 143 K 4.1447 7.7317 118.8890 58.6821 32.4835 178.4697 144 I 4.2326 8.0778 110.5985 59.7100 39.1009 176.6544 145 G 3.9643 7.9377 108.3339 45.5448 0.0000 174.0858 146 L 3.9562 8.6997 123.2669 58.1766 41.9506 179.2436 147 E 3.9255 8.1655 117.6609 59.7317 29.4994 178.9233 148 N 4.2960 8.1402 115.7097 56.5081 38.4345 176.7007 149 Y 3.9743 8.2675 120.2124 60.8042 39.2954 177.9254 150 L 4.0226 8.5331 120.3189 57.5769 41.7375 179.2136 151 Q 3.9304 8.2721 119.8947 59.3228 28.7857 178.5608 152 S 4.1386 7.7797 114.8497 60.8608 63.1124 175.6426 153 Q 4.1725 7.4912 119.1600 55.3435 28.9170 175.3626 154 M 4.6098 7.2747 120.2614 55.2362 32.8184 175.9024 155 D 4.8303 8.8514 121.1290 54.8530 42.2814 173.2466 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 8.16 4.20 0.00 1.31 1.76 0.00 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.44 0.00 2 K 8.62 3.85 0.00 1.70 1.71 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.46 7.81 3 G 8.41 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.40 4.66 0.00 2.86 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 5 K 8.98 3.87 0.00 1.85 1.78 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.51 7.81 6 I 7.81 3.59 1.92 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.07 -0.33 0.00 0.00 7 V 8.35 3.72 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 1.14 0.00 0.00 1.24 0.00 0.00 8 I 8.07 3.77 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.76 0.89 0.00 0.00 9 Q 7.81 3.95 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.48 0.00 10 H 8.04 4.06 0.00 3.35 3.33 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.97 4.00 0.00 2.02 1.74 0.96 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.31 4.44 0.00 2.85 2.84 0.00 0.00 6.71 7.30 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 13 K 8.29 3.88 0.00 1.91 2.04 0.00 1.51 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.53 7.81 14 I 8.21 3.71 2.01 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 1.71 0.68 0.92 0.00 0.00 15 L 8.51 4.05 0.00 1.76 1.87 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.36 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 17 N 8.03 4.40 0.00 2.99 2.89 0.00 0.00 7.07 7.61 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 18 E 8.17 3.91 0.00 2.15 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 2.59 2.53 0.00 19 L 7.84 3.91 0.00 1.79 1.68 0.89 0.86 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 20 I 7.41 3.62 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.09 0.85 0.00 0.00 21 A 7.73 3.33 1.03 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 0.00 0.00 22 I 7.70 3.54 2.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.73 0.83 0.00 0.00 23 N 7.79 4.34 0.00 2.63 2.84 0.00 0.00 6.77 7.59 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 24 Q 7.96 3.86 0.00 2.05 1.94 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 2.65 2.33 0.00 25 Y 7.96 4.78 0.00 3.04 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 26 F 8.56 3.98 0.00 3.36 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 27 L 8.35 3.94 0.00 1.88 1.79 0.89 1.06 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 28 H 8.35 3.92 0.00 3.58 3.20 0.00 5.69 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 29 A 8.54 4.14 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 30 R 8.04 3.83 0.00 1.76 1.85 0.00 3.17 0.00 0.00 3.08 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.62 0.00 31 M 7.64 3.46 0.00 0.88 1.67 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.14 0.00 32 Y 7.52 4.52 0.00 3.22 3.19 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 33 E 8.21 3.93 0.00 2.16 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 2.26 2.28 0.00 34 D 7.72 4.34 0.00 2.62 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 35 W 7.89 4.87 0.00 3.75 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 36 G 8.25 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.20 4.82 0.00 2.10 1.68 0.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.20 3.91 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 39 K 8.05 3.90 0.00 1.98 1.94 0.00 1.60 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.45 7.81 40 L 7.85 4.06 0.00 1.60 1.44 1.07 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.55 3.69 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 0.00 0.00 0.00 42 K 8.55 3.88 0.00 1.78 1.76 0.00 1.59 0.00 0.00 1.52 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.25 1.37 7.81 43 H 8.13 3.80 0.00 3.20 3.01 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.28 3.92 0.00 2.50 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 3.15 0.00 45 Y 8.22 4.08 0.00 3.07 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 H 8.14 4.10 0.00 3.19 3.19 0.00 5.70 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.00 3.83 0.00 1.97 1.63 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 2.22 2.04 0.00 48 S 7.95 4.21 0.00 4.07 4.02 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 49 I 7.57 3.62 1.78 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.47 0.81 0.00 0.00 50 D 8.43 4.26 0.00 2.83 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 51 E 8.11 3.91 0.00 2.13 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 2.84 2.51 0.00 52 M 7.97 4.02 0.00 2.03 2.25 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.51 0.00 53 K 8.04 4.04 0.00 1.96 1.86 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.62 7.81 54 H 8.40 4.28 0.00 3.43 3.33 0.00 5.64 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 55 A 8.22 3.99 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 56 D 8.18 4.25 0.00 2.94 2.83 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 57 K 8.11 3.92 0.00 2.02 1.86 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.70 7.81 58 L 7.93 3.99 0.00 1.88 1.73 0.96 0.83 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 59 I 7.93 3.68 2.03 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.85 0.92 0.00 0.00 60 K 8.16 3.92 0.00 1.97 1.88 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.47 1.65 7.81 61 R 8.18 4.00 0.00 2.06 2.16 0.00 3.36 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 62 I 8.21 3.73 2.02 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 1.54 0.62 0.94 0.00 0.00 63 L 8.26 4.07 0.00 1.90 1.77 0.93 1.06 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 64 F 8.31 4.37 0.00 2.97 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 65 L 8.03 4.32 0.00 1.96 1.60 0.81 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.99 3.62 0.00 2.05 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 2.16 2.15 0.00 67 G 8.24 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 0.00 0.00 0.00 68 L 8.07 4.58 0.00 1.59 1.59 0.91 0.97 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 69 P 0.00 4.40 0.00 2.03 1.99 0.00 3.61 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 2.03 2.09 0.00 70 N 8.38 4.76 0.00 2.56 2.69 0.00 0.00 7.07 7.72 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 71 L 8.21 4.54 0.00 1.64 1.64 0.90 0.96 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 72 Q 8.10 4.02 0.00 2.01 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.67 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 73 E 8.22 4.40 0.00 1.97 1.86 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 2.22 2.39 0.00 74 L 8.34 4.49 0.00 1.54 1.52 0.89 1.06 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 75 G 8.36 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 76 K 8.33 4.03 0.00 1.71 1.75 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.53 7.81 77 L 8.36 4.26 0.00 1.66 1.56 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.05 4.59 0.00 1.84 1.66 1.01 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 79 I 7.87 4.08 1.90 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 1.35 0.73 0.94 0.00 0.00 80 G 8.68 4.20 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 0.00 0.00 0.00 81 E 9.35 4.83 0.00 2.03 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 2.32 2.28 0.00 82 H 7.91 4.86 0.00 3.24 3.25 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.46 4.19 4.36 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 1.42 0.00 0.00 84 K 8.22 3.78 0.00 1.81 1.88 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.46 7.81 85 E 7.83 4.00 0.00 1.59 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 2.36 2.37 0.00 86 M 8.20 3.97 0.00 1.86 2.35 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.38 0.00 87 L 8.22 4.09 0.00 1.91 1.69 1.06 0.87 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 88 E 8.08 4.02 0.00 2.16 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 2.59 0.00 89 C 8.25 4.23 0.00 3.27 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 90 D 8.42 4.78 0.00 3.04 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 91 L 8.24 4.00 0.00 1.91 1.88 0.97 0.73 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 92 K 8.18 3.89 0.00 2.03 1.90 0.00 1.78 0.00 0.00 1.60 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.88 7.81 93 L 8.22 3.97 0.00 2.15 1.85 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.69 4.09 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.69 0.00 95 Q 8.49 4.14 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.42 2.64 0.00 96 A 8.29 4.10 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 97 G 7.99 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 0.00 0.00 0.00 0.00 98 L 8.03 4.01 0.00 1.88 1.76 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.27 0.00 2.17 2.12 0.00 3.70 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 100 D 8.03 4.38 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 0.00 101 L 7.91 4.01 0.00 1.89 1.73 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 102 K 8.36 4.21 0.00 1.81 1.87 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.73 7.81 103 A 8.12 4.09 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 0.00 104 A 8.04 3.67 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 0.00 105 I 8.20 3.63 1.89 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 1.47 0.67 0.93 0.00 0.00 106 A 8.08 4.02 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 7.68 3.89 0.00 3.13 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 0.00 108 C 8.30 4.08 0.00 3.15 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 0.00 109 E 8.10 3.91 0.00 2.14 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 0.00 2.40 2.52 0.00 110 S 7.77 4.09 0.00 3.88 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 0.00 111 V 6.85 4.22 1.92 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 0.17 0.00 0.00 0.79 0.00 0.00 112 G 7.22 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 0.00 0.00 0.00 113 D 7.26 4.47 0.00 2.65 2.48 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 0.00 114 Y 7.56 4.29 0.00 3.10 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 0.00 115 A 8.07 4.07 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 0.00 116 S 8.86 4.12 0.00 4.08 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 0.00 117 R 7.85 3.91 0.00 1.98 2.26 0.00 3.19 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 118 E 8.34 4.02 0.00 2.22 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.49 0.00 119 L 8.02 3.90 0.00 1.89 1.88 0.95 0.52 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 0.00 120 L 8.30 4.04 0.00 1.72 1.71 0.94 0.87 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 0.00 121 E 8.59 3.98 0.00 2.18 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 2.35 2.60 0.00 122 D 8.07 4.32 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 I 7.50 3.47 1.93 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.80 0.78 0.00 0.00 124 L 8.21 3.91 0.00 1.78 1.87 0.99 0.76 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 0.00 125 E 8.32 3.90 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 126 S 8.12 4.11 0.00 3.98 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 0.00 127 E 8.48 4.04 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.54 0.00 128 E 8.52 4.07 0.00 2.16 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 2.36 2.50 0.00 129 D 7.74 4.41 0.00 2.89 2.76 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 0.00 130 H 8.01 4.35 0.00 3.45 3.42 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.01 3.78 2.08 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.89 0.96 0.00 0.00 132 D 8.23 4.32 0.00 3.00 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 0.00 133 W 8.54 4.15 0.00 3.48 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 0.00 134 L 8.51 3.73 0.00 1.95 1.73 1.05 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.24 3.88 0.00 2.10 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 2.33 2.68 0.00 136 T 7.85 3.73 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 1.12 0.00 0.00 137 Q 7.49 3.59 0.00 1.62 1.59 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 1.16 1.16 0.00 138 L 7.58 3.74 0.00 1.72 1.59 0.86 0.90 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 0.00 139 D 8.12 4.27 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 0.00 140 L 7.99 3.94 0.00 1.83 1.66 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.34 3.50 1.77 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 -0.28 0.78 0.00 0.00 142 D 7.61 4.33 0.00 2.73 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 0.00 143 K 7.73 4.14 0.00 1.85 1.84 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.50 7.81 144 I 8.08 4.23 1.89 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.67 0.93 0.00 0.00 145 G 7.94 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.70 3.96 0.00 1.75 1.68 0.93 0.93 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 0.00 147 E 8.17 3.93 0.00 2.09 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 2.39 2.46 0.00 148 N 8.14 4.30 0.00 2.92 2.88 0.00 0.00 6.62 7.48 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 0.00 149 Y 8.27 3.97 0.00 2.91 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 0.00 150 L 8.53 4.02 0.00 1.87 1.69 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.27 3.93 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 152 S 7.78 4.14 0.00 3.80 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 0.00 153 Q 7.49 4.17 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.02 0.00 0.00 0.00 0.00 0.00 1.84 2.06 0.00 154 M 7.27 4.61 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.43 0.00 155 D 8.85 4.83 0.00 2.79 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