NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 V 4.1666 8.0549 120.4116 62.4366 31.4653 176.5685 8 K 4.1951 8.6733 129.7734 55.2897 31.2986 175.5839 9 W 4.8761 8.2994 126.6376 56.9408 32.2584 176.2459 10 S 4.4005 8.1120 110.5036 57.5334 60.8913 174.5708 11 E 4.2991 8.2298 113.4635 56.9118 28.7049 178.3591 12 D 4.3901 8.0148 121.4994 57.1287 41.0965 177.9836 13 L 3.6635 7.6645 118.2194 57.3086 41.7702 177.1937 14 A 4.2403 7.3450 120.4238 53.0973 19.2569 177.0826 15 N 4.9482 8.0249 115.9943 53.2402 43.0352 174.5497 16 L 4.2653 9.0239 117.8204 54.0203 43.6877 175.6993 17 P 4.2974 0.0000 0.0000 66.1483 31.3517 179.2679 18 S 4.2004 8.1582 111.9177 61.3164 62.8246 176.2980 19 I 4.0085 7.7082 123.1805 64.1584 37.0994 177.6544 20 D 4.7998 8.6272 120.2059 57.7751 40.4962 178.9609 21 T 3.7670 7.9985 116.2374 66.7893 68.5446 176.7069 22 Q 4.3084 7.6986 119.7932 58.4963 28.8021 178.3101 23 H 4.5205 8.5337 117.4463 58.9623 28.8392 178.0289 24 K 4.1015 8.4522 120.3594 59.4145 31.7581 179.6539 25 R 4.0334 7.6605 120.0058 58.4047 29.9066 178.9917 26 L 4.3479 8.0137 118.8667 57.7257 41.5772 179.6337 27 V 3.7834 8.0177 118.4657 65.8783 30.9145 177.9113 28 D 4.2870 8.0338 118.7788 57.6284 40.6443 178.3042 29 Y 4.3585 7.7925 117.1561 61.1889 37.9332 178.8229 30 I 3.8823 8.0174 120.7762 64.5296 37.2477 178.2664 31 N 4.5054 8.4340 117.4396 56.4711 38.3714 177.2002 32 D 4.4656 8.5747 120.7845 57.3494 40.8098 178.6478 33 L 4.0855 8.3419 120.9875 58.2774 42.0781 178.4292 34 Y 4.1603 8.0936 119.4261 60.3770 38.7131 177.6739 35 R 3.5387 8.1291 119.6769 59.0796 30.1261 178.3520 36 A 3.9103 8.0072 120.3451 55.0865 18.4106 179.3903 37 A 3.8567 7.6640 118.9805 55.2546 18.2333 179.5472 38 R 3.6903 7.4327 115.8785 59.6598 30.0910 178.0475 39 R 4.2628 7.5850 114.0853 55.1700 30.1664 176.3977 40 R 3.7370 7.9025 116.7820 57.1977 28.4679 176.9328 41 D 4.6732 8.0574 118.7350 53.1401 41.2384 175.4184 42 M 4.1309 8.2681 127.3218 58.0874 32.2333 178.1065 43 D 4.3857 8.1241 118.8835 57.0084 41.0498 178.4572 44 K 3.9918 8.3905 120.1833 59.1722 32.1305 178.7796 45 A 4.0528 8.0738 121.1785 55.3818 18.3432 179.9156 46 R 3.9213 8.1846 116.5428 59.0070 30.1211 178.9867 47 E 3.8818 8.0672 119.2042 59.3039 29.7244 178.9438 48 V 3.5825 8.2387 118.6721 66.0310 31.5345 177.5759 49 F 3.9840 8.5132 120.5237 61.2664 39.1559 176.3955 50 D 4.2946 8.2207 117.3151 57.4963 41.0547 178.2528 51 A 3.7881 7.7482 120.9306 54.9419 18.3110 179.3320 52 L 3.2441 8.0382 119.1471 57.6819 42.0750 179.2139 53 K 3.5734 7.7800 119.9092 59.5483 32.3179 178.6149 54 N 4.2335 8.0250 116.7783 56.4055 37.9369 176.8262 55 Y 3.8979 7.9868 120.7013 60.5032 38.8176 177.8862 56 A 3.6451 7.8794 121.7552 55.0441 18.4068 179.7833 57 V 3.3560 7.3830 116.5932 66.0744 31.5464 178.1290 58 E 3.9375 7.7460 118.1017 59.2999 29.2763 178.6722 59 H 4.1153 7.9334 118.5505 58.9619 29.7676 177.4436 60 F 4.4616 8.2707 120.1385 60.6247 38.8048 177.9349 61 G 3.6185 8.3600 105.3869 47.7080 0.0000 175.2343 62 Y 3.9475 8.0062 121.7724 60.5927 38.7815 177.7099 63 E 3.4745 8.0809 119.4781 59.3857 29.5571 179.2554 64 E 3.3756 7.9874 118.7204 59.1661 29.3555 179.4823 65 R 3.8578 7.7183 118.8039 59.1670 30.0978 178.5898 66 L 4.0436 7.3056 118.8666 57.5409 41.4872 179.3306 67 F 4.5935 8.0583 118.0134 60.5558 38.7195 177.5549 68 A 4.0322 8.2322 120.2442 55.4214 18.0669 179.2024 69 D 4.2334 8.1843 116.2798 57.2295 40.9243 178.1082 70 Y 4.5157 8.0332 113.3106 56.2799 39.3361 175.7347 71 A 3.7711 7.9229 121.1758 53.3307 16.8132 178.4829 72 Y 3.8311 8.3997 123.1091 56.9269 39.5242 174.3422 73 P 3.9854 0.0000 0.0000 65.4459 31.5299 176.8974 74 E 4.1789 5.9000 115.4390 56.0977 29.9956 178.0076 75 A 3.7528 7.3698 123.4903 55.5251 18.3642 180.2593 76 T 3.8008 7.8063 113.6312 66.9314 68.6034 176.4412 77 R 3.8521 7.8238 119.6622 59.7196 30.1855 177.7329 78 H 4.0816 7.9383 117.8742 59.3371 29.7967 177.1364 79 K 4.0740 8.4887 121.5438 59.4613 31.9534 178.4185 80 E 3.9992 8.1831 119.3510 59.0558 29.6401 178.8825 81 I 3.8053 7.9315 120.0848 64.5677 37.2789 177.9603 82 H 3.8357 8.3120 117.0897 58.8291 28.5182 177.6990 83 R 3.9372 8.3365 120.6638 59.6818 29.8900 178.7049 84 R 3.9104 8.2296 117.8521 59.2380 30.0340 178.8636 85 F 3.7934 8.0596 120.0514 60.9657 39.2147 177.3802 86 V 3.2893 7.7004 117.7969 65.7492 31.1795 177.5384 87 E 3.8035 7.9677 119.0427 59.6260 29.4406 179.0192 88 T 3.4155 7.4771 115.6628 66.3971 68.3868 176.8998 89 V 3.2294 7.2496 120.3142 65.7512 31.1587 178.1120 90 L 4.0846 7.5739 118.0986 57.3238 41.7580 179.3988 91 K 4.1166 7.5420 118.7198 59.3640 31.9136 179.3067 92 W 4.4627 8.1223 119.2360 59.8893 28.7864 178.0417 93 E 3.6384 8.4489 119.1963 59.3351 29.0374 179.1653 94 K 4.0167 8.0051 117.8845 59.4511 31.8681 179.2486 95 Q 4.1056 7.6516 117.1852 58.1836 28.3763 177.9567 96 L 4.0783 7.6372 119.5257 56.3008 41.4742 178.6907 97 A 3.9275 7.5629 121.3307 54.6194 18.3287 178.1387 98 A 4.6210 7.8055 114.1051 51.6323 19.8233 176.0954 99 G 3.8269 7.4971 106.4747 45.6967 0.0000 172.5460 100 D 4.9823 8.0222 118.0745 50.0624 42.4412 175.0497 101 P 4.2179 0.0000 0.0000 65.5710 30.9525 178.5203 102 E 3.9187 8.5395 118.5606 59.2192 29.6301 178.8919 103 V 3.5595 8.0378 118.3173 65.7204 31.4175 178.2365 104 V 3.4982 7.6082 117.7597 66.2062 31.4754 177.8066 105 M 4.1044 7.9368 118.1992 58.6468 31.8671 178.9643 106 T 3.8267 7.9364 115.9368 66.7891 68.5182 176.9678 107 T 3.0726 7.6727 117.6323 66.2757 68.4297 176.3138 108 L 3.9954 8.1112 122.5408 58.4296 41.9399 179.3553 109 R 4.0898 8.0061 118.1231 58.9969 29.9056 179.3009 110 G 3.5703 7.7451 105.3956 47.7021 0.0000 175.7069 111 L 4.7102 8.2164 122.0445 57.8113 41.7248 179.9066 112 V 3.7151 8.1220 118.0204 66.1043 31.3841 177.7000 113 D 4.3959 8.5122 118.9219 57.1641 40.7014 178.7077 114 W 3.9841 8.6560 128.7902 60.3000 30.6848 177.5264 115 L 3.9549 8.3912 120.3693 58.3867 41.5485 179.1145 116 V 3.4000 7.7140 117.9452 65.9063 31.4450 177.4940 117 N 4.0896 7.7143 116.8160 56.7211 38.7837 176.2128 118 H 3.5548 7.7951 119.9257 59.1120 29.6123 177.1630 119 I 3.4674 7.5346 121.5520 64.7894 36.7319 178.5112 120 M 4.0537 7.6173 117.8647 57.3023 31.7590 177.7476 121 K 4.2196 7.7609 118.1520 56.8609 33.8339 177.0380 122 E 4.2675 8.0869 117.9071 58.3962 30.4977 178.0772 123 D 4.0212 7.5374 118.1808 57.0426 40.7928 178.6441 124 K 3.7393 7.4758 120.0064 59.1063 31.8387 178.9601 125 K 4.1319 7.5358 118.3055 58.7248 32.1813 177.8479 126 Y 4.4041 7.3945 116.6836 57.6073 38.2169 176.9665 127 E 4.0368 7.6542 120.7508 59.6347 29.7269 178.2378 128 A 4.0097 8.0452 119.9131 55.3767 18.2712 178.5230 129 Y 3.9883 8.1336 116.0858 61.1832 39.1668 178.1681 130 L 3.9313 8.3694 119.7682 57.4781 41.7074 179.5569 131 R 3.9102 8.4429 118.8273 59.1769 29.9240 178.4058 132 E 4.2468 8.0778 113.8429 57.5933 29.6258 177.2970 133 R 4.3491 7.4988 118.1096 56.0189 30.5725 176.7725 134 G 3.8831 8.1008 105.7304 45.4688 0.0000 174.4529 135 V 3.8616 7.1445 118.5227 62.3082 32.3861 176.0203 136 S 4.2112 8.2265 117.9631 58.6975 62.8873 173.7583 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 7 V 8.05 4.17 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 1.03 0.00 0.00 0.99 0.00 0.00 8 K 8.67 4.20 0.00 1.92 1.91 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.53 7.81 9 W 8.30 4.88 0.00 3.27 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 10 S 8.11 4.40 0.00 3.81 3.73 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 11 E 8.23 4.30 0.00 1.95 1.93 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 2.31 2.40 0.00 12 D 8.01 4.39 0.00 2.52 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 7.66 3.66 0.00 1.00 0.66 0.55 0.54 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 14 A 7.35 4.24 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 15 N 8.02 4.95 0.00 2.70 2.78 0.00 0.00 7.38 7.78 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 16 L 9.02 4.27 0.00 1.79 1.66 0.98 1.23 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 17 P 0.00 4.30 0.00 2.18 2.13 0.00 3.65 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 2.15 2.20 0.00 18 S 8.16 4.20 0.00 4.08 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 19 I 7.71 4.01 2.22 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.31 1.06 0.00 0.00 20 D 8.63 4.80 0.00 2.90 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 21 T 8.00 3.77 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 1.15 0.00 0.00 22 Q 7.70 4.31 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 23 H 8.53 4.52 0.00 3.76 3.75 0.00 5.64 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 24 K 8.45 4.10 0.00 1.75 1.59 0.00 1.17 0.00 0.00 1.12 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.59 7.81 25 R 7.66 4.03 0.00 1.95 1.33 0.00 2.98 0.00 0.00 3.19 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.66 0.00 26 L 8.01 4.35 0.00 2.19 1.95 1.12 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.02 3.78 2.38 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 1.17 0.00 0.00 1.28 0.00 0.00 28 D 8.03 4.29 0.00 2.56 2.46 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 29 Y 7.79 4.36 0.00 3.24 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 30 I 8.02 3.88 2.17 0.00 0.00 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 1.70 1.54 1.02 0.00 0.00 31 N 8.43 4.51 0.00 2.99 2.95 0.00 0.00 7.05 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 32 D 8.57 4.47 0.00 2.98 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.34 4.09 0.00 2.01 2.01 1.05 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 8.09 4.16 0.00 3.20 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.13 3.54 0.00 2.25 1.91 0.00 3.27 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 36 A 8.01 3.91 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 37 A 7.66 3.86 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 38 R 7.43 3.69 0.00 1.31 1.88 0.00 2.66 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 39 R 7.58 4.26 0.00 1.79 1.89 0.00 3.33 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 40 R 7.90 3.74 0.00 1.86 1.96 0.00 3.28 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 41 D 8.06 4.67 0.00 2.68 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.27 4.13 0.00 2.04 2.08 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 2.78 2.55 0.00 43 D 8.12 4.39 0.00 2.85 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 44 K 8.39 3.99 0.00 2.04 1.96 0.00 1.55 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.52 7.81 45 A 8.07 4.05 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 46 R 8.18 3.92 0.00 2.03 2.01 0.00 3.12 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 47 E 8.07 3.88 0.00 2.16 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 0.00 2.33 2.33 0.00 48 V 8.24 3.58 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 1.09 0.00 0.00 1.02 0.00 0.00 49 F 8.51 3.98 0.00 3.31 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 50 D 8.22 4.29 0.00 2.97 2.85 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 51 A 7.75 3.79 1.13 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 52 L 8.04 3.24 0.00 1.54 1.51 1.01 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 53 K 7.78 3.57 0.00 1.46 1.78 0.00 1.62 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.27 1.24 7.81 54 N 8.02 4.23 0.00 2.71 2.81 0.00 0.00 6.75 7.05 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 55 Y 7.99 3.90 0.00 3.15 2.95 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 56 A 7.88 3.65 1.05 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 57 V 7.38 3.36 2.12 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 1.00 0.00 0.00 0.90 0.00 0.00 58 E 7.75 3.94 0.00 1.89 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 2.27 2.46 0.00 59 H 7.93 4.12 0.00 2.91 3.18 0.00 5.78 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 60 F 8.27 4.46 0.00 3.19 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 61 G 8.36 3.62 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 0.00 0.00 0.00 62 Y 8.01 3.95 0.00 3.14 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 63 E 8.08 3.47 0.00 1.90 1.15 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 2.32 2.49 0.00 64 E 7.99 3.38 0.00 2.12 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 2.44 2.30 0.00 65 R 7.72 3.86 0.00 1.90 1.84 0.00 3.07 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 66 L 7.31 4.04 0.00 1.60 1.59 0.70 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 67 F 8.06 4.59 0.00 3.22 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 68 A 8.23 4.03 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 D 8.18 4.23 0.00 2.79 2.25 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 0.00 70 Y 8.03 4.52 0.00 3.24 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.92 3.77 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 Y 8.40 3.83 0.00 2.93 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 73 P 0.00 3.99 0.00 1.60 1.88 0.00 2.72 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.98 0.00 74 E 5.90 4.18 0.00 1.29 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.99 0.00 75 A 7.37 3.75 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 76 T 7.81 3.80 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 1.20 0.00 0.00 77 R 7.82 3.85 0.00 1.83 1.86 0.00 3.15 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 78 H 7.94 4.08 0.00 3.32 3.44 0.00 5.66 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 79 K 8.49 4.07 0.00 2.03 1.94 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.70 7.81 80 E 8.18 4.00 0.00 2.15 2.12 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 2.32 2.42 0.00 81 I 7.93 3.81 2.07 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 1.59 0.99 1.11 0.00 0.00 82 H 8.31 3.84 0.00 3.32 3.01 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 83 R 8.34 3.94 0.00 1.98 2.13 0.00 3.12 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 84 R 8.23 3.91 0.00 2.09 1.99 0.00 3.23 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.97 0.00 85 F 8.06 3.79 0.00 2.24 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 86 V 7.70 3.29 2.23 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 0.87 0.00 0.00 1.13 0.00 0.00 87 E 7.97 3.80 0.00 2.20 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 88 T 7.48 3.42 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 -0.03 0.00 0.00 89 V 7.25 3.23 1.77 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 0.81 0.00 0.00 -0.32 0.00 0.00 90 L 7.57 4.08 0.00 1.75 1.67 0.87 0.80 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 91 K 7.54 4.12 0.00 1.77 1.86 0.00 1.57 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.57 7.81 92 W 8.12 4.46 0.00 3.65 2.98 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 93 E 8.45 3.64 0.00 2.58 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 2.56 0.00 94 K 8.01 4.02 0.00 1.99 1.84 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.68 7.81 95 Q 7.65 4.11 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.01 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 96 L 7.64 4.08 0.00 1.58 1.56 0.08 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.56 3.93 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 A 7.81 4.62 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 99 G 7.50 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 0.00 100 D 8.02 4.98 0.00 2.85 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 0.00 101 P 0.00 4.22 0.00 2.15 2.31 0.00 3.57 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 102 E 8.54 3.92 0.00 2.01 2.27 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 2.28 2.29 0.00 103 V 8.04 3.56 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 0.83 0.00 0.00 0.95 0.00 0.00 104 V 7.61 3.50 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.88 0.00 0.00 105 M 7.94 4.10 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.94 0.00 106 T 7.94 3.83 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 1.12 0.00 0.00 107 T 7.67 3.07 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 0.75 0.00 0.00 108 L 8.11 4.00 0.00 1.89 1.94 1.09 1.02 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 0.00 109 R 8.01 4.09 0.00 2.00 1.97 0.00 3.35 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.78 0.00 110 G 7.75 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 0.00 111 L 8.22 4.71 0.00 2.11 2.08 1.24 1.49 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 0.00 112 V 8.12 3.72 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 1.08 0.00 0.00 1.07 0.00 0.00 113 D 8.51 4.40 0.00 3.17 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 0.00 114 W 8.66 3.98 0.00 3.59 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 0.00 115 L 8.39 3.95 0.00 2.21 1.80 1.19 0.95 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 0.00 116 V 7.71 3.40 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 0.91 0.00 0.00 117 N 7.71 4.09 0.00 2.69 2.74 0.00 0.00 6.87 7.94 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 0.00 118 H 7.80 3.55 0.00 1.40 2.57 0.00 5.84 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 0.00 119 I 7.53 3.47 1.61 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.51 0.66 0.00 0.00 120 M 7.62 4.05 0.00 1.87 2.06 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 2.49 2.37 0.00 121 K 7.76 4.22 0.00 1.60 1.78 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.23 1.34 7.81 122 E 8.09 4.27 0.00 1.54 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 2.00 2.28 0.00 123 D 7.54 4.02 0.00 2.67 2.42 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 0.00 124 K 7.48 3.74 0.00 1.82 1.70 0.00 1.40 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.43 7.81 125 K 7.54 4.13 0.00 1.97 1.93 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.44 1.55 7.81 126 Y 7.39 4.40 0.00 2.44 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 0.00 0.00 0.00 0.00 127 E 7.65 4.04 0.00 2.19 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 2.34 2.40 0.00 128 A 8.05 4.01 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 0.00 129 Y 8.13 3.99 0.00 3.13 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 0.00 130 L 8.37 3.93 0.00 1.75 1.51 0.64 0.95 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 0.00 131 R 8.44 3.91 0.00 2.07 1.97 0.00 3.15 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 132 E 8.08 4.25 0.00 2.07 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 2.56 2.24 0.00 133 R 7.50 4.35 0.00 1.63 1.96 0.00 2.55 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.26 0.00 134 G 8.10 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 0.00 135 V 7.14 3.86 1.93 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 0.73 0.00 0.00 -0.01 0.00 0.00 136 S 8.23 4.21 0.00 3.97 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