NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8178 8.3393 109.7281 45.2292 0.0000 172.6572 2 I 3.8669 7.9650 113.9867 59.7981 38.5688 173.0474 3 S 4.5937 8.5938 116.2481 56.5188 67.6409 174.9004 4 Y 4.2841 8.5170 120.1976 58.3676 37.7841 176.6176 5 S 4.4583 9.2848 119.5385 58.7409 63.8173 174.2092 6 V 4.3864 7.3484 120.6135 60.7165 33.9299 174.7442 7 E 4.0772 8.7307 126.1745 56.3607 29.9921 176.2684 8 A 4.4750 8.0864 124.6236 50.1580 21.8897 175.1439 9 D 4.4695 8.6630 123.3882 53.0508 41.4772 175.1242 10 P 4.2883 0.0000 0.0000 65.6920 31.3567 177.2961 11 D 4.6703 8.4396 118.4753 56.4635 41.0248 176.6781 12 T 5.2528 7.9257 109.3484 61.4254 69.9727 173.6878 13 T 4.8869 8.0801 116.1533 62.7073 72.7698 173.1325 14 A 4.6062 9.1571 126.6743 50.0827 21.9452 175.4876 15 K 5.0403 8.2948 120.7710 54.9741 35.4738 175.2780 16 A 4.6311 8.6251 120.0968 52.0164 22.9269 175.4344 17 M 5.7811 8.5127 118.0520 53.6273 36.7065 174.2839 18 L 4.7803 8.3720 120.4064 53.0453 45.0635 175.4899 19 R 4.9128 8.2797 120.7701 54.9475 32.9228 175.4929 20 E 3.7688 10.0378 125.0894 57.2468 27.6094 175.3947 21 R 4.0888 8.3313 116.9221 56.4274 31.6866 177.1365 22 Q 5.3240 8.8816 122.9783 54.6767 28.4137 174.4706 23 M 4.6615 8.0872 119.6547 53.7492 34.6753 174.3696 24 S 4.0188 8.6664 113.9229 58.5976 62.8350 174.6176 25 F 4.3943 8.9228 130.4711 61.4011 39.3672 177.0675 26 K 3.6785 7.8787 117.6702 59.3704 31.7965 178.9087 27 H 4.1365 8.1177 116.8497 58.6124 28.5730 177.8845 28 S 4.0779 8.0231 117.0469 61.4023 62.6072 176.6114 29 K 3.6230 7.6576 120.8572 59.6443 31.9422 179.1747 30 A 3.8191 7.2167 119.3956 54.9584 17.9163 179.8270 31 I 3.4935 7.2324 117.4324 64.8103 37.4955 177.6717 32 A 3.8909 8.0775 121.1064 55.7573 17.6399 179.8908 33 R 3.5885 8.4354 115.2524 59.2590 30.4056 178.4078 34 E 3.7069 7.8387 118.2951 58.7233 30.0305 178.0900 35 I 3.9443 7.8326 111.6395 60.3709 38.2626 175.6901 36 K 4.1364 6.8445 122.8298 58.0217 32.3918 176.6025 37 G 3.9856 8.9014 114.9881 45.2932 0.0000 173.9656 38 K 4.3757 7.7250 118.9794 55.9065 33.1895 176.1812 39 T 4.4982 10.2054 118.4814 63.0218 69.9727 175.8638 40 A 4.0867 9.0140 128.8759 55.5685 18.4384 180.3774 41 G 3.5601 8.2273 103.8861 48.0460 0.0000 175.8074 42 E 4.0268 8.1373 120.5611 58.9581 29.5212 179.0848 43 A 4.0535 8.6555 121.1881 55.1420 18.4758 179.8660 44 V 3.5953 7.8834 116.6491 66.3517 31.4497 177.8727 45 D 4.4211 7.8977 117.2326 58.1831 40.8295 177.5310 46 Y 4.1410 8.4994 119.8903 60.4188 38.5885 177.8245 47 L 3.7364 8.6591 119.2494 58.3583 41.9958 179.8611 48 E 3.9963 8.3813 117.9003 59.2459 29.2791 179.2492 49 A 3.9336 8.2714 121.4168 54.8413 18.2892 179.7320 50 V 4.2637 7.1912 117.6528 65.9696 31.4733 177.9900 51 I 3.6696 7.8354 118.7460 64.6120 37.0211 177.7394 52 E 4.0945 8.1396 119.4024 57.1545 29.4433 177.6001 53 G 3.4210 8.1871 106.4251 45.3972 0.0000 173.5725 54 D 4.6479 8.0927 119.1683 53.9883 42.0193 176.4199 55 Q 4.5509 7.8228 120.6317 53.4324 31.5119 172.2174 56 P 4.4500 0.0000 0.0000 61.8702 33.5896 175.2387 57 V 4.5877 8.2161 121.6377 59.8031 33.1978 173.2622 58 P 4.7943 0.0000 0.0000 62.9923 31.8716 175.9471 59 F 4.7781 9.0499 124.6189 56.5002 38.8943 175.7290 60 K 3.6460 8.5540 123.5249 56.3653 33.5452 177.3309 61 Q 4.2547 7.9023 117.7069 57.4058 30.4537 175.7680 62 H 4.7997 7.5990 115.7509 54.0872 27.4213 173.9740 63 N 5.1763 7.9932 115.7909 51.6754 38.7549 175.4419 64 S 4.2244 8.2533 114.1967 60.3523 62.9702 174.8787 65 G 3.9047 8.9098 111.7850 45.6028 0.0000 173.4697 66 V 3.8813 8.0425 120.3032 62.2297 32.3401 175.6826 67 G 4.0106 8.3215 113.3698 45.5285 0.0000 172.7595 68 H 4.7684 8.7091 119.4217 55.7997 29.9666 174.9686 69 K 4.6234 8.9696 121.1373 54.4590 34.6815 177.4195 70 S 4.1138 9.1416 120.2253 61.4784 62.8652 175.9898 71 K 4.1195 7.9283 118.2828 57.9201 32.1042 177.3053 72 V 3.7787 7.5528 119.8920 62.4829 32.2938 174.4072 73 D 4.8342 8.6948 126.2026 53.5409 42.9881 176.8671 74 G 4.0476 9.8656 113.4117 45.5976 0.0000 172.0602 75 W 5.0850 7.5627 126.9346 56.5654 34.2783 172.4487 76 D 4.3901 6.6540 114.5981 54.5232 40.5751 175.4951 77 A 4.6887 7.2693 122.8633 51.0502 19.7981 176.0180 78 G 3.9973 7.8101 106.5213 45.9920 0.0000 172.7267 79 R 3.9684 7.1086 117.8705 54.4242 34.6451 173.9752 80 Y 4.7598 7.7279 112.2713 56.2608 38.1545 175.2583 81 P 4.5551 0.0000 0.0000 62.7188 30.2605 177.2513 82 E 4.0297 8.5359 122.0753 58.9048 29.8829 179.0120 83 K 3.9150 8.0559 119.8599 59.3771 32.4897 178.5412 84 A 4.1940 8.1031 120.5353 55.3999 18.3339 179.6109 85 S 4.2126 8.1235 113.3029 61.6954 62.8535 177.0607 86 K 4.0875 8.2272 121.1506 59.2306 31.8078 179.2637 87 A 4.1123 8.1222 121.1596 54.8508 18.2512 179.7152 88 F 3.7651 8.4474 116.7514 60.4436 38.9481 177.8980 89 L 4.0961 8.2947 118.7640 57.8472 41.3718 179.3429 90 D 4.3232 8.1363 118.8310 57.1886 40.7751 178.3429 91 L 3.8562 7.7714 120.7462 58.4157 41.9874 179.1618 92 L 4.0305 8.6059 119.0180 57.6510 41.5023 179.1383 93 E 3.9532 8.5170 119.7153 59.1230 29.5734 178.4132 94 N 4.2304 8.2050 116.8519 56.5771 39.1374 176.3626 95 A 3.9576 8.0562 122.1789 55.6072 18.4910 179.8603 96 V 3.7980 8.2855 116.8297 65.9384 31.4877 178.5568 97 G 3.5996 8.1287 105.7065 47.8275 0.0000 175.5491 98 N 4.4050 8.8045 119.3015 55.9367 38.5641 177.3662 99 A 4.1563 8.5439 122.6388 55.3293 18.4071 179.5086 100 D 4.6426 8.2333 118.7929 57.2184 40.7984 178.1613 101 H 4.3470 8.3885 116.6955 57.9920 29.9171 175.9530 102 Q 4.4751 7.6414 117.1057 55.9606 29.4966 176.1730 103 G 3.7958 8.3712 109.4643 44.9773 0.0000 173.9068 104 F 4.4536 7.9210 118.9648 56.9918 39.8398 174.4892 105 D 4.9237 8.4888 121.6404 52.0893 39.6574 176.4450 106 G 3.9850 8.8476 112.9350 48.7308 0.0000 173.0818 107 E 3.8718 8.5299 118.9424 58.8733 29.6024 179.3502 108 A 4.2561 7.4786 116.8017 53.6474 18.7954 177.5052 109 M 4.4338 8.2026 117.3466 55.3969 33.4839 175.9285 110 T 4.5860 8.6870 119.3516 63.1582 70.6107 174.7734 111 I 4.4153 8.6683 127.2298 60.7273 36.0101 176.5112 112 K 4.0039 8.7155 128.1817 59.0898 32.9420 176.3892 113 H 5.1223 8.0495 118.6345 54.5540 33.7131 172.6941 114 V 5.0615 8.2758 123.8501 61.4743 33.7590 173.0610 115 A 4.7501 8.5374 126.4318 50.2352 22.6481 174.3335 116 A 5.1659 8.6228 123.1118 51.1404 21.1890 176.3206 117 H 4.9237 9.4077 117.2751 54.0480 33.3135 172.9380 118 K 4.1324 7.9066 124.7277 55.2082 31.2092 176.2940 119 V 3.7306 8.2776 127.3254 63.1903 32.3179 175.6616 120 G 4.0648 6.7942 106.1377 46.9127 0.0000 170.6884 121 E 5.2078 8.0760 118.1856 54.4055 33.4292 175.7848 122 Q 4.2696 9.3324 126.2231 55.3345 29.8579 175.0871 123 Q 4.7307 8.7206 126.2379 56.1597 29.7660 175.8796 124 G 4.8618 9.5329 108.4688 44.5459 0.0000 171.2999 125 R 5.1440 8.6291 120.7104 54.0697 33.0889 174.3020 126 K 4.3039 8.9763 127.7553 53.7621 34.3583 173.4264 127 P 4.6632 0.0000 0.0000 62.7676 32.0729 175.6564 128 R 4.7693 8.6786 122.1402 53.8292 34.2092 175.0510 129 A 4.1140 8.3327 121.9023 53.7576 18.9360 177.4677 130 M 3.1742 8.9698 117.0403 56.3719 28.9205 178.0046 131 G 3.8848 8.4301 104.2411 45.8320 0.0000 173.6760 132 R 4.7877 7.4891 118.5499 54.0953 33.2510 174.3955 133 A 5.4068 8.5354 124.8125 50.3333 22.3188 175.2968 134 S 4.7827 8.7423 112.3434 56.2729 66.9886 173.4914 135 A 4.5022 8.6312 122.4457 53.0867 19.1605 178.0007 136 W 4.8794 9.0373 126.3267 56.8698 32.8313 172.9839 137 N 5.4421 8.2003 120.6685 51.1463 41.5859 173.9210 138 S 4.7071 8.5750 116.3462 56.0631 65.8509 172.6630 139 P 4.7982 0.0000 0.0000 62.6911 32.9144 175.3034 140 Q 4.9106 8.8295 120.4467 54.3103 32.1007 174.6143 141 V 4.7458 9.7876 124.7809 61.1890 34.4964 174.0958 142 D 5.5607 8.8643 126.3401 52.8242 44.6276 175.8496 143 V 5.2570 8.4310 119.8982 61.4703 34.8259 173.0340 144 E 4.8638 8.8432 123.7044 55.3805 32.3360 174.9047 145 L 5.0413 8.7736 122.5374 53.9924 46.4273 174.3899 146 I 4.7782 9.2422 127.1855 59.6242 40.1256 174.4978 147 L 4.9041 10.1688 127.7011 53.6239 43.5483 175.6494 148 E 5.2050 8.7298 122.5606 52.9633 33.4567 174.4864 149 E 4.3269 8.7298 125.3183 55.5183 30.4483 175.3113 150 P 4.3950 0.0000 0.0000 63.1111 31.4024 176.2076 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 G 8.34 3.82 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 0.00 0.00 0.00 2 I 7.97 3.87 1.66 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.53 0.73 0.00 0.00 3 S 8.59 4.59 0.00 3.79 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 4 Y 8.52 4.28 0.00 2.95 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 5 S 9.28 4.46 0.00 3.98 3.99 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 6 V 7.35 4.39 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 0.81 0.00 0.00 0.53 0.00 0.00 7 E 8.73 4.08 0.00 1.98 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 2.31 2.30 0.00 8 A 8.09 4.47 1.06 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 9 D 8.66 4.47 0.00 2.68 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.29 0.00 2.23 2.17 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 2.00 1.99 0.00 11 D 8.44 4.67 0.00 2.88 2.81 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 12 T 7.93 5.25 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 13 T 8.08 4.89 4.52 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 1.09 0.00 0.00 14 A 9.16 4.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.29 5.04 0.00 1.51 1.65 0.00 1.31 0.00 0.00 0.61 0.00 0.00 2.18 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.88 1.13 7.81 16 A 8.63 4.63 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 17 M 8.51 5.78 0.00 1.72 1.84 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.10 0.00 18 L 8.37 4.78 0.00 1.44 1.44 0.65 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.28 4.91 0.00 1.61 1.77 0.00 3.46 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 20 E 10.04 3.77 0.00 1.94 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 2.22 2.22 0.00 21 R 8.33 4.09 0.00 1.69 1.85 0.00 3.27 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 22 Q 8.88 5.32 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.73 0.00 0.00 0.00 0.00 0.00 2.30 2.18 0.00 23 M 8.09 4.66 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.73 0.00 24 S 8.67 4.02 0.00 3.65 3.67 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 0.00 0.00 0.00 0.00 25 F 8.92 4.39 0.00 2.99 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 26 K 7.88 3.68 0.00 1.59 1.50 0.00 1.52 0.00 0.00 1.33 0.00 0.00 2.67 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.92 1.34 7.81 27 H 8.12 4.14 0.00 3.32 3.29 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 28 S 8.02 4.08 0.00 4.09 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 29 K 7.66 3.62 0.00 1.49 1.60 0.00 1.41 0.00 0.00 1.37 0.00 0.00 2.26 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.84 0.76 7.81 30 A 7.22 3.82 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 31 I 7.23 3.49 1.17 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.59 -0.00 0.00 0.00 32 A 8.08 3.89 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 33 R 8.44 3.59 0.00 1.83 1.99 0.00 2.92 0.00 0.00 2.90 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 34 E 7.84 3.71 0.00 2.04 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 2.15 1.88 0.00 35 I 7.83 3.94 1.87 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.67 0.92 0.00 0.00 36 K 6.84 4.14 0.00 1.53 1.71 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.43 1.39 7.81 37 G 8.90 3.99 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 0.00 0.00 0.00 38 K 7.72 4.38 0.00 2.05 1.71 0.00 1.45 0.00 0.00 1.53 0.00 0.00 2.74 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.37 1.29 7.81 39 T 10.21 4.50 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 1.36 0.00 0.00 40 A 9.01 4.09 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 41 G 8.23 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.14 4.03 0.00 2.10 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 2.41 2.39 0.00 43 A 8.66 4.05 1.43 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 44 V 7.88 3.60 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 1.06 0.00 0.00 1.02 0.00 0.00 45 D 7.90 4.42 0.00 2.91 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 46 Y 8.50 4.14 0.00 3.10 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 47 L 8.66 3.74 0.00 1.79 1.77 1.08 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.38 4.00 0.00 2.17 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 2.34 2.68 0.00 49 A 8.27 3.93 1.34 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 50 V 7.19 4.26 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 1.02 0.00 0.00 0.21 0.00 0.00 51 I 7.84 3.67 2.02 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 1.42 0.82 0.91 0.00 0.00 52 E 8.14 4.09 0.00 2.03 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 2.32 2.38 0.00 53 G 8.19 3.42 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 0.00 54 D 8.09 4.65 0.00 2.64 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 55 Q 7.82 4.55 0.00 2.04 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.94 0.00 0.00 0.00 0.00 0.00 2.42 2.54 0.00 56 P 0.00 4.45 0.00 1.83 1.65 0.00 3.86 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 57 V 8.22 4.59 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.95 0.00 0.00 58 P 0.00 4.79 0.00 1.95 2.07 0.00 3.77 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.18 0.00 59 F 9.05 4.78 0.00 2.90 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 60 K 8.55 3.65 0.00 1.24 0.82 0.00 1.36 0.00 0.00 1.21 0.00 0.00 2.14 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.30 0.95 7.81 61 Q 7.90 4.25 0.00 1.76 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.30 0.00 0.00 0.00 0.00 0.00 1.79 2.17 0.00 62 H 7.60 4.80 0.00 2.97 3.13 0.00 5.69 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 7.99 5.18 0.00 3.05 3.46 0.00 0.00 5.84 7.64 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 64 S 8.25 4.22 0.00 4.04 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.91 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.04 3.88 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.10 0.00 0.00 67 G 8.32 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 68 H 8.71 4.77 0.00 2.98 3.15 0.00 5.66 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.97 4.62 0.00 1.55 1.65 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.39 1.31 7.81 70 S 9.14 4.11 0.00 3.98 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 71 K 7.93 4.12 0.00 1.81 1.96 0.00 1.86 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.46 7.81 72 V 7.55 3.78 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 0.91 0.00 0.00 0.95 0.00 0.00 73 D 8.69 4.83 0.00 2.79 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.87 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 75 W 7.56 5.08 0.00 3.38 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 76 D 6.65 4.39 0.00 1.98 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.27 4.69 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 78 G 7.81 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 R 7.11 3.97 0.00 0.67 1.41 0.00 2.94 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.15 0.00 80 Y 7.73 4.76 0.00 2.85 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 81 P 0.00 4.56 0.00 2.18 1.91 0.00 3.59 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 82 E 8.54 4.03 0.00 2.21 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 2.39 2.40 0.00 83 K 8.06 3.92 0.00 1.90 1.91 0.00 1.76 0.00 0.00 1.87 0.00 0.00 3.12 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.56 1.55 7.81 84 A 8.10 4.19 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 85 S 8.12 4.21 0.00 4.16 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 86 K 8.23 4.09 0.00 2.05 1.89 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.81 7.81 87 A 8.12 4.11 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 88 F 8.45 3.77 0.00 3.36 3.21 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 89 L 8.29 4.10 0.00 1.93 1.77 0.96 1.00 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 90 D 8.14 4.32 0.00 2.97 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 91 L 7.77 3.86 0.00 1.63 1.75 0.81 0.15 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 92 L 8.61 4.03 0.00 1.88 1.75 1.07 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.52 3.95 0.00 2.13 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 0.00 2.32 2.33 0.00 94 N 8.20 4.23 0.00 2.90 2.97 0.00 0.00 7.08 7.92 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 95 A 8.06 3.96 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 96 V 8.29 3.80 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 1.07 0.00 0.00 0.97 0.00 0.00 97 G 8.13 3.60 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 0.00 0.00 0.00 98 N 8.80 4.41 0.00 2.91 2.92 0.00 0.00 6.94 7.49 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 99 A 8.54 4.16 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 0.00 100 D 8.23 4.64 0.00 2.91 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 0.00 101 H 8.39 4.35 0.00 3.21 3.53 0.00 5.92 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.64 4.48 0.00 2.71 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.12 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 103 G 8.37 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 0.00 0.00 0.00 104 F 7.92 4.45 0.00 3.28 3.01 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 0.00 105 D 8.49 4.92 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 0.00 106 G 8.85 3.99 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 0.00 0.00 0.00 107 E 8.53 3.87 0.00 2.06 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 2.44 2.37 0.00 108 A 7.48 4.26 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 0.00 109 M 8.20 4.43 0.00 1.89 2.11 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 110 T 8.69 4.59 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 1.24 0.00 0.00 111 I 8.67 4.42 1.99 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.80 0.93 0.00 0.00 112 K 8.72 4.00 0.00 1.79 1.97 0.00 1.86 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.39 7.81 113 H 8.05 5.12 0.00 3.19 3.11 0.00 5.74 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.28 5.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.12 0.00 0.00 115 A 8.54 4.75 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 0.00 0.00 0.00 0.00 0.00 116 A 8.62 5.17 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 0.00 117 H 9.41 4.92 0.00 3.06 3.14 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.91 4.13 0.00 0.79 0.89 0.00 1.40 0.00 0.00 1.34 0.00 0.00 2.57 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.06 1.05 7.81 119 V 8.28 3.73 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 0.71 0.00 0.00 0.99 0.00 0.00 120 G 6.79 4.06 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 0.00 121 E 8.08 5.21 0.00 1.77 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 0.00 2.13 2.21 0.00 122 Q 9.33 4.27 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.99 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 123 Q 8.72 4.73 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 124 G 9.53 4.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.63 5.14 0.00 1.80 1.79 0.00 3.29 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 126 K 8.98 4.30 0.00 1.12 1.69 0.00 1.09 0.00 0.00 1.07 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.56 1.09 7.81 127 P 0.00 4.66 0.00 1.88 1.90 0.00 3.47 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.04 0.00 128 R 8.68 4.77 0.00 1.83 1.81 0.00 3.31 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 129 A 8.33 4.11 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 M 8.97 3.17 0.00 2.20 2.23 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 131 G 8.43 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 0.00 132 R 7.49 4.79 0.00 2.00 1.74 0.00 3.04 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 133 A 8.54 5.41 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 S 8.74 4.78 0.00 3.95 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 0.00 135 A 8.63 4.50 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 W 9.04 4.88 0.00 3.43 2.91 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 0.00 137 N 8.20 5.44 0.00 2.57 2.78 0.00 0.00 7.02 7.57 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 0.00 138 S 8.58 4.71 0.00 3.71 3.71 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 0.00 139 P 0.00 4.80 0.00 2.27 1.93 0.00 3.50 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 140 Q 8.83 4.91 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.76 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 141 V 9.79 4.75 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 1.17 0.00 0.00 1.12 0.00 0.00 142 D 8.86 5.56 0.00 2.64 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 0.00 143 V 8.43 5.26 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 0.67 0.00 0.00 0.78 0.00 0.00 144 E 8.84 4.86 0.00 2.12 1.78 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 2.39 2.36 0.00 145 L 8.77 5.04 0.00 1.77 1.53 1.08 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 146 I 9.24 4.78 1.94 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 1.25 1.22 0.86 0.00 0.00 147 L 10.17 4.90 0.00 1.55 1.44 0.89 0.57 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 0.00 148 E 8.73 5.20 0.00 1.94 1.67 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 0.00 2.16 2.21 0.00 149 E 8.73 4.33 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 150 P 0.00 4.40 0.00 2.05 1.99 0.00 3.74 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00