NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3490 8.2649 123.5830 52.0274 19.8889 176.7462 3 R 4.0033 8.4070 118.4743 57.9957 30.6178 176.1951 4 R 3.9156 8.4223 117.8380 57.7683 30.7948 177.2877 5 R 4.3268 7.9956 120.0273 55.7646 31.8951 176.9852 6 R 3.7698 8.4567 118.6298 56.6983 30.3493 173.5202 7 A 3.5688 8.0150 124.4296 51.8561 16.2533 176.7661 8 E 4.1657 8.4328 120.4558 56.5920 30.3278 177.7935 9 V 3.6331 8.0261 120.9815 62.9490 32.1279 176.4048 10 R 4.0730 8.1710 124.8731 54.7595 28.6629 175.3154 11 Q 3.9747 8.3648 126.0526 55.8677 28.3908 175.9974 12 L 4.3065 8.0604 125.6635 54.5859 41.7037 176.4045 13 Q 4.0876 8.3379 120.7698 54.9584 29.3997 174.0329 14 P 4.4357 0.0000 0.0000 62.2018 30.8270 175.4265 15 D 4.4984 8.2177 118.3432 55.0798 41.5027 176.5583 16 L 4.6244 8.5714 124.1380 54.6010 41.9619 177.1627 17 V 4.3074 8.0583 117.5034 63.4245 35.0957 175.4120 18 Y 4.3672 8.6340 115.9413 57.5926 40.0268 175.8982 19 G 3.8540 9.3505 105.9278 44.6554 0.0000 172.4653 20 D 4.5186 7.4415 115.3959 52.4050 44.9833 176.5886 21 V 3.7315 8.4689 120.3246 64.2847 31.4483 178.2754 22 L 4.0274 8.8864 120.7174 58.0477 41.8470 179.3154 23 V 3.1955 7.8515 118.0089 66.0186 31.6514 177.9410 24 T 3.7612 7.8359 108.8909 64.7792 68.4362 175.9590 25 A 3.9771 8.0281 123.6204 54.8965 18.4587 179.4010 26 F 3.9874 7.9257 119.2674 61.3359 39.3850 177.3703 27 I 3.5879 7.3354 119.1319 64.4422 36.6501 178.0795 28 N 4.2692 7.7298 115.9683 56.3369 38.4400 177.3535 29 K 4.0037 7.4135 118.8784 59.3823 32.1162 179.2310 30 I 3.9665 7.0760 119.1681 62.9908 37.0917 175.3609 31 M 3.9305 7.6299 119.1678 56.0269 31.4670 175.2404 32 R 4.4108 8.4372 126.0028 55.7409 31.5518 176.6770 33 D 4.8684 9.4133 122.3245 55.3133 38.5905 173.5916 34 G 3.8702 8.2455 102.3041 47.3966 0.0000 176.2072 35 K 4.5385 7.1987 117.2520 53.8382 32.4739 177.3237 36 K 3.8899 8.1385 123.8865 59.7241 32.5525 177.5154 37 N 4.5027 8.1979 116.0625 56.0348 38.4202 177.1281 38 L 3.9582 7.8841 121.1873 58.2395 42.3377 178.7738 39 A 4.0689 8.1399 120.5578 54.7725 18.1758 179.2754 40 A 4.0140 8.7126 119.8304 55.5244 18.5591 179.6995 41 R 4.0917 7.9448 116.8949 59.9682 30.2934 178.6514 42 I 4.1803 7.9022 120.7473 63.6786 37.0367 178.2793 43 F 4.3116 8.4516 121.6083 61.5649 39.1978 177.0918 44 Y 3.9793 8.1695 116.0968 60.5137 37.0190 178.1293 45 D 4.3562 8.7153 120.6531 57.4015 40.9672 178.5949 46 A 4.0447 7.5585 120.3595 55.1068 17.9764 179.3996 47 C 3.9050 7.4819 115.0451 62.9268 28.0965 176.4116 48 K 4.1483 7.8985 119.8477 59.1413 31.7951 179.4362 49 I 3.8425 7.5475 119.6735 63.7520 36.9227 178.5919 50 I 3.6838 7.5847 121.2684 64.5509 36.8178 178.3325 51 Q 4.3464 7.5103 115.4046 58.0987 28.5503 178.3853 52 E 4.1036 7.6140 119.2226 59.8524 29.6767 178.8386 53 K 4.0412 7.7961 117.0172 57.2965 32.7263 176.5859 54 T 4.6094 7.6962 113.6247 60.1681 69.4277 175.8208 55 G 4.0947 8.5412 115.4146 45.9878 0.0000 173.2245 56 Q 4.6262 7.9206 118.9895 53.1903 30.7104 175.8711 57 E 4.1476 8.5045 119.4660 55.7390 30.3649 176.3892 58 P 4.2623 0.0000 0.0000 65.1511 31.4064 178.5364 59 L 3.7658 7.8556 119.2294 58.1808 42.1080 178.7513 60 K 4.0813 7.9694 118.8116 59.0233 32.2906 178.8166 61 V 3.5826 7.6741 118.5726 65.4164 31.3275 177.7291 62 F 4.3317 7.9583 120.4018 60.8585 39.3233 177.5280 63 K 3.8063 7.9706 117.8322 59.5563 31.9913 179.1757 64 Q 3.9469 8.3600 119.7762 58.8193 28.6525 178.2287 65 A 3.8413 7.2565 119.8066 55.2694 18.9662 179.6981 66 V 3.5489 7.3829 116.4980 65.6419 31.3183 177.9202 67 E 4.0305 8.1199 119.5110 59.1126 29.3660 177.7444 68 N 4.7341 7.8223 112.8573 54.0272 38.7929 175.6382 69 V 4.2025 7.0232 117.6715 62.1660 32.1421 175.3574 70 K 4.2496 7.6552 120.4875 54.6389 30.9500 174.5045 71 P 4.3774 0.0000 0.0000 62.9677 31.4863 176.6323 72 R 4.1303 8.8267 124.7303 59.0037 30.3946 175.7600 73 M 5.3967 7.6168 114.3543 53.9720 36.3499 174.2072 74 E 4.8487 9.0538 118.2882 55.0335 33.8990 174.2499 75 V 4.7621 8.4026 114.2576 60.5399 33.1381 175.6569 76 R 4.8011 9.2464 124.6200 54.3263 33.0865 175.7847 77 S 4.8200 8.6178 118.6395 58.3154 64.0714 173.5546 78 R 4.4677 8.1422 121.1650 55.2633 33.3046 174.0481 79 R 4.6677 8.2570 123.9886 55.8881 31.9119 177.4961 80 V 3.8693 8.1746 115.6967 60.9414 33.4593 176.0324 81 G 3.9860 8.4563 114.5447 44.9332 0.0000 171.8477 82 G 3.9197 6.3377 117.1937 45.4338 0.0000 172.1900 83 A 4.6666 7.2030 121.1302 49.8819 23.0285 175.6530 84 N 5.6074 8.6603 118.1641 51.5862 39.8257 174.0704 85 Y 4.8534 8.3493 121.8267 56.4510 40.4690 175.9395 86 Q 4.5653 8.1905 123.8765 54.9444 27.1429 174.3691 87 V 4.0037 8.4527 121.5005 62.0035 32.9876 173.8309 88 P 5.2724 0.0000 0.0000 62.4517 32.6487 175.1265 89 M 4.2876 8.3926 118.7770 54.7525 34.7340 174.1893 90 E 4.5295 8.9664 119.1130 57.0540 30.2383 177.0966 91 V 4.2250 7.6423 122.4275 61.5906 33.6799 175.3437 92 S 4.3146 8.3782 118.3895 57.3873 63.3784 172.8502 93 P 4.2528 0.0000 0.0000 66.0335 31.0142 179.1140 94 R 3.8701 7.8878 115.9431 59.3724 30.0715 178.9544 95 R 3.8381 7.9246 117.8912 59.3342 29.9806 178.3929 96 Q 3.9438 8.1583 117.9278 59.0273 28.7909 178.4754 97 Q 3.9206 7.9444 120.3424 59.2115 28.9728 178.4703 98 S 4.0205 8.2332 116.4287 61.6339 62.8634 176.6321 99 L 3.2508 8.0408 121.6095 57.5521 41.2044 179.1154 100 A 4.2757 8.0439 120.6843 55.4798 18.1828 179.3831 101 L 4.1086 8.1024 116.4869 58.0427 41.9024 180.0192 102 R 3.7381 7.9734 118.3285 59.2570 30.0616 178.3446 103 W 4.5341 8.5964 119.2044 59.9730 29.1207 178.2809 104 L 4.1066 8.1540 118.7191 58.0690 41.1133 179.6967 105 V 3.6471 7.6494 117.7327 66.3013 31.4021 178.1059 106 Q 4.0228 8.0906 117.1811 58.9854 28.3702 178.5800 107 A 4.2505 8.6734 120.8094 55.0202 18.4976 179.2719 108 A 4.1518 8.1370 119.5781 55.5078 18.2711 179.6582 109 N 4.3564 7.8054 113.5598 56.3906 38.6105 177.4142 110 Q 4.1273 7.9097 119.0539 57.8190 29.1708 177.3967 111 R 4.1100 7.0407 118.2041 55.7015 30.5636 175.2945 112 P 4.4235 0.0000 0.0000 64.0775 31.7884 176.9821 113 E 3.9467 8.0846 117.8177 56.8242 29.3055 176.9290 114 R 4.0232 8.1001 122.9152 59.1397 30.8923 177.6901 115 R 4.1658 7.6351 116.6670 55.8238 32.4163 177.7412 116 A 4.0231 8.5906 123.9346 55.3217 18.5420 180.1068 117 A 4.0305 8.0047 118.8232 55.4817 18.5467 180.1312 118 V 3.7385 7.7964 110.2816 64.1732 31.8036 179.0016 119 R 3.9694 7.7454 118.2490 59.4522 29.9800 179.1354 120 I 3.9500 8.0618 119.2945 64.2744 37.0095 178.0126 121 A 3.9811 8.1882 122.1486 55.4593 18.2853 179.2175 122 H 4.0791 8.6040 113.7659 58.9169 28.8695 177.8484 123 E 4.0208 8.2502 120.7348 59.2285 29.3934 178.8453 124 L 4.1458 8.1132 118.8778 57.4867 41.5229 179.4114 125 M 4.0206 7.7839 118.7774 58.6253 32.0854 178.4913 126 D 4.3553 8.1521 118.5058 56.9632 40.6675 179.0132 127 A 3.9500 7.8186 120.7373 55.1949 18.6107 179.3294 128 A 4.1856 7.5704 117.6462 55.6562 18.4240 178.5668 129 E 4.0745 8.5050 118.2318 56.5201 29.6402 177.2355 130 G 4.5980 6.8898 120.7539 45.6540 0.0000 171.9691 131 K 4.1322 7.8505 120.9532 54.8365 34.3965 175.2433 132 G 4.2087 8.2463 111.9919 42.5686 0.0000 173.0656 133 G 3.6651 8.3396 106.0865 47.8803 0.0000 175.9254 134 A 3.9600 8.0895 122.5887 54.6830 18.5573 179.6761 135 V 3.4854 7.6765 116.3133 66.1493 31.5898 178.3129 136 K 3.9077 8.2983 118.2729 59.0372 31.4726 179.3600 137 K 3.8182 7.2971 118.1697 58.2839 31.9431 179.3523 138 K 3.5065 7.1737 120.4761 59.3297 32.0973 178.5859 139 E 3.9318 8.1861 119.0318 59.4061 28.9917 179.0449 140 D 4.2167 7.7336 117.7680 57.3745 41.0925 178.5351 141 V 3.6091 7.2845 117.4698 65.9651 31.4865 177.8800 142 E 4.1156 8.1468 118.1029 59.0517 29.1777 179.4745 143 R 3.8876 7.7464 118.2999 59.6830 30.1900 178.7415 144 M 4.0634 7.7607 117.8565 58.4029 31.6500 178.8233 145 A 3.9508 7.3228 118.5408 55.4633 18.8785 179.4441 146 E 4.0617 8.1124 116.2183 58.9590 29.2244 179.5356 147 A 4.0092 8.1669 120.9094 55.1840 18.7988 178.7710 148 N 4.7505 7.8947 113.5263 53.6346 38.9115 177.2892 149 R 3.9663 7.7533 123.1862 59.0463 29.6873 178.3264 150 A 4.0016 7.9238 119.4948 55.5698 18.4912 178.4050 151 Y 3.6906 8.2468 112.2494 58.4889 37.6769 177.0464 152 A 4.3339 7.6633 121.7687 53.4191 18.1538 179.2597 153 H 4.1267 7.2639 113.5579 58.0215 28.9691 176.1277 154 Y 4.9130 6.5720 116.6830 56.7109 36.2020 175.2756 155 R 4.1466 8.4314 122.1862 56.9467 31.0825 177.0218 156 W 4.1546 8.4684 118.4950 56.9188 29.6537 174.0026 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 A 8.26 4.35 1.27 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 0.00 0.00 0.00 3 R 8.41 4.00 0.00 1.90 2.00 0.00 3.21 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 4 R 8.42 3.92 0.00 1.80 1.77 0.00 3.20 0.00 0.00 3.23 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 5 R 8.00 4.33 0.00 1.78 1.86 0.00 3.25 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 6 R 8.46 3.77 0.00 1.77 1.94 0.00 3.38 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 7 A 8.02 3.57 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 8 E 8.43 4.17 0.00 1.97 1.89 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 2.31 2.29 0.00 9 V 8.03 3.63 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.92 0.00 0.00 10 R 8.17 4.07 0.00 1.80 1.85 0.00 3.28 0.00 0.00 3.14 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 11 Q 8.36 3.97 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.83 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 12 L 8.06 4.31 0.00 1.79 1.66 0.95 0.58 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 13 Q 8.34 4.09 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.03 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 14 P 0.00 4.44 0.00 2.11 2.02 0.00 3.76 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 2.05 2.10 0.00 15 D 8.22 4.50 0.00 3.04 2.86 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 16 L 8.57 4.62 0.00 1.75 1.70 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.06 4.31 2.43 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 0.36 0.00 0.00 0.67 0.00 0.00 18 Y 8.63 4.37 0.00 3.14 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 19 G 9.35 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.44 4.52 0.00 2.71 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 21 V 8.47 3.73 2.10 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 0.72 0.00 0.00 0.95 0.00 0.00 22 L 8.89 4.03 0.00 1.75 1.94 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.85 3.20 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 0.58 0.00 0.00 0.66 0.00 0.00 24 T 7.84 3.76 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 1.25 0.00 0.00 25 A 8.03 3.98 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 26 F 7.93 3.99 0.00 3.25 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 27 I 7.34 3.59 1.91 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.53 0.89 0.00 0.00 28 N 7.73 4.27 0.00 2.82 2.83 0.00 0.00 7.11 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 29 K 7.41 4.00 0.00 1.37 1.68 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.59 1.47 7.81 30 I 7.08 3.97 1.93 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.62 0.90 0.00 0.00 31 M 7.63 3.93 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.55 0.00 32 R 8.44 4.41 0.00 1.90 1.82 0.00 3.33 0.00 0.00 3.33 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.84 0.00 33 D 9.41 4.87 0.00 2.82 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 34 G 8.25 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 7.20 4.54 0.00 1.63 1.74 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.59 7.81 36 K 8.14 3.89 0.00 1.82 1.82 0.00 1.75 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.55 7.81 37 N 8.20 4.50 0.00 2.80 2.89 0.00 0.00 6.70 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.88 3.96 0.00 1.78 1.88 0.95 1.10 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 39 A 8.14 4.07 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 40 A 8.71 4.01 1.60 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 41 R 7.94 4.09 0.00 2.06 2.16 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 1.91 1.75 0.00 42 I 7.90 4.18 2.12 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 1.44 1.56 0.99 0.00 0.00 43 F 8.45 4.31 0.00 3.07 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 44 Y 8.17 3.98 0.00 3.26 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 45 D 8.72 4.36 0.00 2.90 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 7.56 4.04 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 C 7.48 3.90 0.00 3.12 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 48 K 7.90 4.15 0.00 1.86 1.85 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.62 1.63 7.81 49 I 7.55 3.84 1.98 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 1.81 1.20 0.89 0.00 0.00 50 I 7.58 3.68 2.06 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 1.68 1.05 0.96 0.00 0.00 51 Q 7.51 4.35 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.96 0.00 0.00 0.00 0.00 0.00 2.56 2.59 0.00 52 E 7.61 4.10 0.00 2.12 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 2.54 2.49 0.00 53 K 7.80 4.04 0.00 1.72 1.77 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.63 1.51 7.81 54 T 7.70 4.61 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 1.24 0.00 0.00 55 G 8.54 4.09 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 0.00 0.00 0.00 56 Q 7.92 4.63 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 57 E 8.50 4.15 0.00 2.21 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 2.39 2.36 0.00 58 P 0.00 4.26 0.00 2.11 2.00 0.00 3.71 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.32 0.00 59 L 7.86 3.77 0.00 1.82 1.72 0.93 0.42 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 60 K 7.97 4.08 0.00 1.93 1.80 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.56 7.81 61 V 7.67 3.58 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 0.94 0.00 0.00 0.98 0.00 0.00 62 F 7.96 4.33 0.00 3.14 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 63 K 7.97 3.81 0.00 2.05 1.82 0.00 1.72 0.00 0.00 1.90 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.49 7.81 64 Q 8.36 3.95 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 65 A 7.26 3.84 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 66 V 7.38 3.55 1.72 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 0.87 0.00 0.00 0.25 0.00 0.00 67 E 8.12 4.03 0.00 2.30 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 2.28 2.37 0.00 68 N 7.82 4.73 0.00 2.89 2.83 0.00 0.00 6.80 7.43 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 69 V 7.02 4.20 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 0.92 0.00 0.00 1.04 0.00 0.00 70 K 7.66 4.25 0.00 1.92 1.85 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.27 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.66 1.39 7.81 71 P 0.00 4.38 0.00 2.40 2.40 0.00 3.96 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.37 0.00 72 R 8.83 4.13 0.00 1.84 1.98 0.00 3.08 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 73 M 7.62 5.40 0.00 1.92 1.91 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 74 E 9.05 4.85 0.00 2.09 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 2.25 2.36 0.00 75 V 8.40 4.76 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 0.79 0.00 0.00 0.96 0.00 0.00 76 R 9.25 4.80 0.00 1.86 1.90 0.00 3.25 0.00 0.00 3.43 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 77 S 8.62 4.82 0.00 3.74 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 78 R 8.14 4.47 0.00 1.57 1.55 0.00 2.42 0.00 0.00 3.02 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.13 0.00 79 R 8.26 4.67 0.00 1.58 1.69 0.00 3.31 0.00 0.00 3.24 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.51 0.00 80 V 8.17 3.87 1.75 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 0.21 0.00 0.00 0.15 0.00 0.00 81 G 8.46 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 82 G 6.34 3.92 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 0.00 0.00 0.00 83 A 7.20 4.67 1.10 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 0.00 0.00 84 N 8.66 5.61 0.00 2.61 2.78 0.00 0.00 7.20 7.46 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 85 Y 8.35 4.85 0.00 3.05 3.04 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 86 Q 8.19 4.57 0.00 1.80 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.96 0.00 0.00 0.00 0.00 0.00 2.27 2.22 0.00 87 V 8.45 4.00 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 1.30 0.00 0.00 1.22 0.00 0.00 88 P 0.00 5.27 0.00 2.02 2.04 0.00 3.88 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 89 M 8.39 4.29 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 90 E 8.97 4.53 0.00 1.84 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 2.39 0.00 91 V 7.64 4.22 2.10 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 0.72 0.00 0.00 1.03 0.00 0.00 92 S 8.38 4.31 0.00 3.92 3.68 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 93 P 0.00 4.25 0.00 2.18 2.10 0.00 3.63 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 2.11 2.19 0.00 94 R 7.89 3.87 0.00 1.83 1.95 0.00 3.11 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 95 R 7.92 3.84 0.00 1.84 2.03 0.00 3.17 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 96 Q 8.16 3.94 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.57 0.00 0.00 0.00 0.00 0.00 2.50 2.66 0.00 97 Q 7.94 3.92 0.00 2.13 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 98 S 8.23 4.02 0.00 3.92 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 99 L 8.04 3.25 0.00 1.10 0.13 0.78 0.35 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 0.00 100 A 8.04 4.28 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.10 4.11 0.00 1.85 1.86 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.97 3.74 0.00 1.77 1.77 0.00 2.80 0.00 0.00 3.03 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 103 W 8.60 4.53 0.00 3.56 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 0.00 104 L 8.15 4.11 0.00 2.15 2.06 1.01 1.09 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 0.00 105 V 7.65 3.65 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 0.93 0.00 0.00 0.64 0.00 0.00 106 Q 8.09 4.02 0.00 2.44 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.42 2.72 0.00 107 A 8.67 4.25 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 0.00 108 A 8.14 4.15 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.81 4.36 0.00 2.87 2.92 0.00 0.00 7.11 8.92 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 0.00 110 Q 7.91 4.13 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.87 0.00 0.00 0.00 0.00 0.00 2.42 2.73 0.00 111 R 7.04 4.11 0.00 1.98 1.87 0.00 3.37 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.92 0.00 112 P 0.00 4.42 0.00 2.03 2.10 0.00 3.69 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 113 E 8.08 3.95 0.00 1.96 1.90 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 2.30 2.28 0.00 114 R 8.10 4.02 0.00 1.81 1.92 0.00 3.21 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 115 R 7.64 4.17 0.00 1.84 1.87 0.00 3.31 0.00 0.00 3.36 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.65 0.00 116 A 8.59 4.02 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 0.00 117 A 8.00 4.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 V 7.80 3.74 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 0.91 0.00 0.00 1.02 0.00 0.00 119 R 7.75 3.97 0.00 2.04 2.21 0.00 3.42 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.94 0.00 120 I 8.06 3.95 2.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.89 1.22 0.00 0.00 121 A 8.19 3.98 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 0.00 122 H 8.60 4.08 0.00 3.28 3.41 0.00 5.82 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.25 4.02 0.00 2.36 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 124 L 8.11 4.15 0.00 2.00 1.73 0.98 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 125 M 7.78 4.02 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 126 D 8.15 4.36 0.00 2.77 2.97 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 0.00 127 A 7.82 3.95 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 0.00 128 A 7.57 4.19 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 0.00 129 E 8.51 4.07 0.00 2.03 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 2.32 0.00 130 G 6.89 4.60 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 0.00 131 K 7.85 4.13 0.00 1.68 1.67 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.34 7.81 132 G 8.25 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.34 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 0.00 0.00 0.00 134 A 8.09 3.96 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 0.00 135 V 7.68 3.49 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 1.16 0.00 0.00 0.92 0.00 0.00 136 K 8.30 3.91 0.00 1.75 1.77 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.63 7.81 137 K 7.30 3.82 0.00 1.39 1.15 0.00 1.58 0.00 0.00 1.40 0.00 0.00 2.63 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.26 1.53 7.81 138 K 7.17 3.51 0.00 1.57 1.88 0.00 1.69 0.00 0.00 1.64 0.00 0.00 3.15 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.38 1.50 7.81 139 E 8.19 3.93 0.00 1.96 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 2.29 2.51 0.00 140 D 7.73 4.22 0.00 2.79 2.67 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 0.00 141 V 7.28 3.61 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 1.08 0.00 0.00 0.93 0.00 0.00 142 E 8.15 4.12 0.00 2.21 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 2.35 2.56 0.00 143 R 7.75 3.89 0.00 2.00 1.96 0.00 3.11 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.91 0.00 144 M 7.76 4.06 0.00 2.02 2.29 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.90 0.00 145 A 7.32 3.95 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 0.00 146 E 8.11 4.06 0.00 1.99 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 2.33 2.47 0.00 147 A 8.17 4.01 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 0.00 148 N 7.89 4.75 0.00 2.84 2.76 0.00 0.00 6.73 7.73 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 0.00 149 R 7.75 3.97 0.00 1.92 1.95 0.00 3.32 0.00 0.00 3.18 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 150 A 7.92 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.25 3.69 0.00 3.06 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 0.00 152 A 7.66 4.33 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 7.26 4.13 0.00 3.03 3.28 0.00 5.55 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 6.57 4.91 0.00 3.23 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 0.00 155 R 8.43 4.15 0.00 1.89 2.04 0.00 3.38 0.00 0.00 3.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.70 0.00 156 W 8.47 4.15 0.00 3.71 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