NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.7979 8.4449 117.8265 56.2113 30.0242 172.9558 1D H 4.4831 8.7359 118.9174 56.0048 29.6051 173.1813 1E H 5.1084 7.6552 115.1609 53.4080 33.2758 171.9703 1F H 4.6227 8.8756 116.8259 55.9904 28.8976 174.4128 1G F 4.8510 8.4335 119.2209 57.8584 39.9066 174.1178 2 N 4.6103 8.5708 117.3506 52.3351 38.7724 174.4951 3 L 4.6703 8.0684 123.6345 52.3042 43.5662 174.8155 4 P 4.5200 0.0000 0.0000 61.4780 32.3510 174.1887 5 P 4.3531 0.0000 0.0000 62.4603 32.2504 174.5265 6 G 3.6871 8.7132 104.6431 44.5970 0.0000 171.5342 7 N 4.4130 7.8932 114.3810 51.9268 40.0395 174.0052 8 Y 4.8635 7.9736 114.8503 58.1245 38.5600 177.1548 9 K 4.1320 8.8915 122.2942 58.9899 32.2101 177.4875 10 K 4.6872 7.5982 115.4314 53.3436 34.7951 173.9701 11 P 4.7106 0.0000 0.0000 63.2573 32.3214 174.9120 12 K 4.9310 9.5178 119.6100 55.1203 37.4774 174.9615 13 L 5.0616 9.2157 121.1266 53.3203 44.4328 176.3337 14 L 4.9998 8.5971 123.3431 53.4257 42.6970 174.0894 15 Y 4.6559 9.2637 126.5334 56.9724 40.2918 173.5232 16 C 3.8539 8.6751 128.9060 57.8998 32.2267 173.9836 17 S 3.8577 8.1531 122.1549 61.4247 62.0121 174.6215 18 N 4.0484 7.6241 116.8838 56.3812 38.4669 175.1246 19 G 3.9351 7.5766 103.0129 44.4527 0.0000 172.4542 20 G 3.3160 7.7045 106.9631 44.8314 0.0000 173.4533 21 H 4.8797 7.3327 114.5642 53.5743 32.5663 173.9343 22 F 5.2897 8.9416 120.2370 55.8493 40.5921 175.3079 23 L 4.5924 9.0932 126.2059 55.4348 43.2352 175.6252 24 R 4.9276 9.5630 126.1432 54.6174 33.6260 173.9933 25 I 4.7190 8.2053 126.7701 59.3228 38.6664 175.6008 26 L 4.0534 8.8093 128.3322 53.5837 42.1714 177.0711 27 P 4.0584 0.0000 0.0000 65.6931 31.3170 177.0636 28 D 4.5041 7.9789 114.7923 53.6322 39.7121 177.0923 29 G 4.3270 8.9834 110.1946 45.4771 0.0000 173.9741 30 T 4.4143 8.2811 117.1534 63.1431 69.2345 173.7824 31 V 4.8765 7.7697 123.1081 61.3528 34.8582 174.7784 32 D 4.5572 8.3214 124.0593 53.2362 43.2522 174.2906 33 G 4.5705 8.6154 104.6180 45.3739 0.0000 172.3542 34 T 4.9950 8.8672 115.4827 60.3926 70.9813 174.7014 35 R 4.2440 8.8695 124.5951 56.8164 30.8689 176.5356 36 D 4.5995 8.3260 121.6297 53.7769 39.8947 177.3687 37 R 3.5746 8.6794 125.7985 58.1535 29.4799 175.4252 38 S 4.4578 9.2181 110.2556 59.0120 63.7266 174.2446 39 D 4.3598 7.9615 121.9137 55.1235 41.2052 176.0608 40 Q 4.2765 8.5146 123.2484 57.0328 29.4340 175.9391 41 H 4.8822 10.1519 116.0718 55.4731 29.0278 175.5054 42 I 4.5272 7.0729 110.3301 59.9903 38.3990 175.4050 43 Q 4.2551 7.7759 121.8944 55.6456 29.6014 174.6396 44 L 5.1323 8.9475 124.8713 52.7890 45.3808 175.3880 45 Q 4.7514 9.1562 124.7057 54.5591 30.7073 174.3373 46 L 5.2937 8.5988 126.5372 53.7099 43.8297 175.8967 47 S 4.4523 8.5635 114.8694 56.9465 66.9490 172.3799 48 A 4.7713 8.2529 122.1913 51.9990 20.7500 174.2052 49 E 3.9375 9.1364 123.3898 57.4497 28.0459 178.6217 50 S 4.5893 5.8100 115.4824 56.7011 65.1665 173.5265 51 V 3.8305 8.1932 121.3650 64.8795 31.4527 176.1953 52 G 3.9500 9.2622 115.3166 45.0486 0.0000 171.8741 53 E 5.1287 8.3901 120.2585 54.8158 31.9953 175.6290 54 V 5.4592 8.7065 115.9046 59.2313 36.9496 173.6698 55 Y 5.1376 8.4161 118.7562 56.4856 41.2096 175.2540 56 I 4.3598 8.5845 122.6923 59.6063 40.3311 173.9374 57 K 4.7135 8.5824 128.9621 54.0018 35.0296 175.1257 58 S 4.6077 8.9761 123.0161 58.5892 62.6763 174.9614 59 T 3.8715 8.7631 118.7389 64.7207 68.8668 176.0230 60 E 4.0296 8.3894 122.4417 58.7189 29.8434 177.2183 61 T 4.2807 8.6424 106.7951 60.9707 70.1283 175.6313 62 G 3.8348 8.2918 110.2039 44.9958 0.0000 173.5770 63 Q 4.3977 7.6821 119.4000 56.0877 30.1567 174.7689 64 Y 4.8468 9.0533 121.4313 56.3943 40.1243 174.9158 65 L 4.4168 9.3556 126.6474 55.2601 43.4535 175.5772 66 A 5.1129 8.8222 126.3409 50.7626 23.3632 174.3130 67 M 5.3257 8.5165 119.2542 53.7537 34.6793 175.6305 68 D 5.2167 9.5115 126.8085 52.6878 40.9385 176.9001 69 T 4.0325 8.5844 112.9867 65.0555 67.1964 174.0046 70 D 4.7240 8.4347 118.6123 53.8456 41.0961 176.8973 71 G 3.3614 8.6383 108.0033 45.5296 0.0000 173.1400 72 L 4.6966 8.4786 120.5138 53.0170 42.9160 176.1849 73 L 5.0355 8.3641 123.2992 55.2124 42.5899 175.6667 74 Y 5.0028 9.1493 119.6148 55.9122 42.0514 173.6198 75 G 4.1711 8.7966 108.5916 45.3345 0.0000 173.1325 76 S 5.1016 9.0483 121.2894 56.7784 64.0652 175.3412 77 Q 4.2373 9.0683 125.5333 58.1091 28.9598 176.4579 78 T 4.7463 7.3631 105.8014 58.5017 71.5630 171.7938 79 P 3.7647 0.0000 0.0000 62.4090 32.0326 175.1926 80 N 5.0074 8.2277 118.3186 50.9785 40.6410 174.5616 81 E 4.1272 8.7928 115.0504 59.3400 29.5564 178.3369 82 E 4.1131 8.8558 118.0853 57.5005 29.7872 177.4409 83 C 4.9589 8.1445 115.6682 59.4044 29.0827 173.4726 84 L 4.3548 7.1397 120.9913 53.8112 42.6237 175.9188 85 F 5.2096 8.9032 121.5342 55.6002 43.4563 174.4873 86 L 4.7747 9.3200 123.3182 53.6343 42.5258 175.4930 87 E 4.3352 8.8529 126.9366 55.4584 30.1735 175.8644 88 R 4.7992 8.6569 125.4264 54.0482 34.9485 174.4627 89 L 4.7609 8.6842 123.4215 55.1748 43.1005 175.7767 90 E 4.7011 9.2411 124.9929 55.3113 33.6465 174.8100 91 E 4.0159 9.7357 123.5395 57.6878 27.3157 174.2438 92 N 4.3205 8.5045 110.7551 54.1218 36.5559 173.9933 93 H 4.8096 8.5970 116.9067 57.5917 37.3437 173.4239 94 Y 4.6985 7.8339 116.1208 57.3853 40.2572 173.5750 95 N 5.6448 9.5819 118.0665 51.9482 41.3198 174.5657 96 T 5.3031 8.9493 112.7767 60.1733 72.7593 172.6604 97 Y 4.9929 8.7807 119.9071 56.6229 41.3309 174.1726 98 I 4.5725 8.5349 126.0883 59.2859 39.4511 175.5072 99 S 3.7487 8.7545 122.4048 58.4005 62.3591 173.8521 100 K 3.9242 8.8732 129.7801 59.4521 32.2984 178.4830 101 K 3.6577 7.9415 117.9936 59.3558 32.1352 176.9453 102 H 4.5820 8.0576 114.3432 55.1391 29.3315 176.4735 103 A 3.9312 7.8575 125.7543 55.3015 18.2335 180.9072 104 E 3.5555 7.9107 111.9172 58.9077 29.4815 177.8719 105 K 4.0378 7.5252 116.6024 55.7843 32.7075 175.9249 106 N 3.9620 7.7758 115.7332 53.9754 36.3648 174.6498 107 W 5.1596 7.7207 117.7384 55.8242 31.0508 177.3306 108 F 5.4411 9.5711 123.7618 55.3063 41.3667 174.9943 109 L 4.4132 9.3926 123.3242 55.2090 43.0597 175.8562 110 G 4.3681 8.4983 110.6442 45.4560 0.0000 171.6578 111 L 5.2835 8.4716 120.9718 52.5219 45.5228 177.0773 112 K 4.1577 9.1490 122.7443 55.3896 32.9460 178.3880 113 K 3.9384 8.4589 119.8150 59.2709 31.9477 177.8215 114 N 4.5601 8.0706 113.9902 52.5891 37.7828 175.9581 115 G 3.5267 8.3856 109.0620 45.1660 0.0000 173.4531 116 S 4.8645 8.1336 115.1026 57.2956 64.9783 173.8463 117 C 4.7419 8.5385 119.1761 60.0360 28.7060 173.2879 118 K 4.4361 8.5434 121.6459 55.2653 33.4551 176.6256 119 R 4.1927 8.5724 123.5037 55.6284 30.9346 177.2236 120 G 3.1476 7.9981 114.2125 48.3629 0.0000 174.0211 121 P 4.4263 0.0000 0.0000 63.9477 31.5081 177.5207 122 R 4.3243 7.9552 116.3712 56.3496 30.4792 176.3617 123 T 4.9698 7.8848 108.6508 60.0267 70.7524 173.4965 124 H 4.8057 7.8835 114.9753 54.8111 30.6732 172.9965 125 Y 3.8490 8.6551 118.7236 59.9317 38.1039 177.1825 126 G 4.0338 9.1047 111.5121 45.2971 0.0000 173.5856 127 Q 4.3732 7.3878 118.9700 54.5881 30.3048 176.9990 128 K 3.7978 8.2717 118.7768 58.9535 32.8015 179.4142 129 A 3.9806 8.1531 121.2034 54.0721 18.2188 178.6096 130 I 4.3977 7.1562 105.6645 60.8258 38.5887 175.4187 131 L 4.3113 7.3513 123.4463 54.1362 42.5705 175.8785 132 F 5.5442 9.4111 122.3383 55.5946 43.4710 174.2038 133 L 5.3220 9.3740 121.4516 52.4023 44.6821 173.9760 134 P 5.1493 0.0000 0.0000 62.4603 32.2683 175.5605 135 L 4.9222 9.1377 124.8427 52.0674 44.7409 174.5644 136 P 4.7285 0.0000 0.0000 62.5823 32.4938 177.0312 137 V 3.8699 8.1382 113.9343 61.6469 31.7339 176.2161 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 1C H 8.44 4.80 0.00 3.13 3.53 0.00 5.67 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.74 4.48 0.00 3.22 3.25 0.00 5.64 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.66 5.11 0.00 3.18 3.35 0.00 5.71 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.88 4.62 0.00 3.33 3.41 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.43 4.85 0.00 2.88 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 N 8.57 4.61 0.00 2.94 2.79 0.00 0.00 6.93 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 3 L 8.07 4.67 0.00 1.49 1.41 0.63 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.52 0.00 2.16 2.14 0.00 3.69 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.89 0.00 5 P 0.00 4.35 0.00 2.17 2.07 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 6 G 8.71 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 7 N 7.89 4.41 0.00 2.61 2.65 0.00 0.00 5.82 7.55 0.00 0.00 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 Y 7.97 4.86 0.00 3.05 3.27 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 9 K 8.89 4.13 0.00 1.89 1.89 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.45 7.81 10 K 7.60 4.69 0.00 1.72 1.70 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.39 7.81 11 P 0.00 4.71 0.00 2.06 2.05 0.00 3.71 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 1.97 1.99 0.00 12 K 9.52 4.93 0.00 1.63 1.75 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.63 7.81 13 L 9.22 5.06 0.00 1.71 1.69 0.49 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.60 5.00 0.00 1.48 1.49 0.31 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.26 4.66 0.00 3.20 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 16 C 8.68 3.85 0.00 2.58 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 17 S 8.15 3.86 0.00 3.67 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.62 4.05 0.00 2.51 2.71 0.00 0.00 6.70 7.98 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 19 G 7.58 3.94 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 0.00 0.00 0.00 20 G 7.70 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 0.00 0.00 0.00 21 H 7.33 4.88 0.00 2.99 3.23 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 22 F 8.94 5.29 0.00 3.01 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 23 L 9.09 4.59 0.00 1.75 1.50 0.92 0.65 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 24 R 9.56 4.93 0.00 1.90 2.04 0.00 3.17 0.00 0.00 3.39 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.81 0.00 25 I 8.21 4.72 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.73 0.89 0.00 0.00 26 L 8.81 4.05 0.00 1.87 1.52 0.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.06 0.00 2.00 2.11 0.00 3.52 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 28 D 7.98 4.50 0.00 2.79 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.98 4.33 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 0.00 30 T 8.28 4.41 4.48 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 1.22 0.00 0.00 31 V 7.77 4.88 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 0.89 0.00 0.00 0.96 0.00 0.00 32 D 8.32 4.56 0.00 2.86 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 33 G 8.62 4.57 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 34 T 8.87 5.00 4.33 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 1.36 0.00 0.00 35 R 8.87 4.24 0.00 1.87 1.98 0.00 3.20 0.00 0.00 3.12 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.46 0.00 36 D 8.33 4.60 0.00 2.83 2.65 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 0.00 0.00 0.00 37 R 8.68 3.57 0.00 1.87 1.85 0.00 3.31 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 38 S 9.22 4.46 0.00 3.81 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 39 D 7.96 4.36 0.00 2.73 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 40 Q 8.51 4.28 0.00 1.85 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.17 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 41 H 10.15 4.88 0.00 3.36 3.48 0.00 5.78 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.07 4.53 1.87 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 1.42 1.01 1.01 0.00 0.00 43 Q 7.78 4.26 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 44 L 8.95 5.13 0.00 1.48 1.42 0.80 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 9.16 4.75 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 46 L 8.60 5.29 0.00 1.76 1.53 0.89 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.56 4.45 0.00 3.88 3.91 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 48 A 8.25 4.77 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 49 E 9.14 3.94 0.00 1.73 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 2.26 2.37 0.00 50 S 5.81 4.59 0.00 4.07 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 51 V 8.19 3.83 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 0.95 0.00 0.00 1.04 0.00 0.00 52 G 9.26 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.39 5.13 0.00 2.10 1.73 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 2.22 2.29 0.00 54 V 8.71 5.46 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.21 0.00 0.00 55 Y 8.42 5.14 0.00 3.01 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.58 4.36 1.67 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.87 0.65 0.00 0.00 57 K 8.58 4.71 0.00 1.26 1.46 0.00 1.08 0.00 0.00 0.61 0.00 0.00 2.64 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.95 0.78 7.81 58 S 8.98 4.61 0.00 3.84 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 59 T 8.76 3.87 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 1.16 0.00 0.00 60 E 8.39 4.03 0.00 1.99 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 2.21 2.36 0.00 61 T 8.64 4.28 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 62 G 8.29 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 63 Q 7.68 4.40 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.79 0.00 0.00 0.00 0.00 0.00 2.53 2.34 0.00 64 Y 9.05 4.85 0.00 2.94 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 65 L 9.36 4.42 0.00 1.60 1.48 0.81 0.25 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 66 A 8.82 5.11 0.62 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 67 M 8.52 5.33 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.64 0.00 68 D 9.51 5.22 0.00 2.93 2.87 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 69 T 8.58 4.03 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 70 D 8.43 4.72 0.00 2.70 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 71 G 8.64 3.36 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 0.00 72 L 8.48 4.70 0.00 1.94 1.62 0.91 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.36 5.04 0.00 1.57 1.62 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 9.15 5.00 0.00 2.98 3.02 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 75 G 8.80 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 0.00 0.00 0.00 0.00 76 S 9.05 5.10 0.00 3.94 3.74 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 77 Q 9.07 4.24 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.54 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 78 T 7.36 4.75 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 1.23 0.00 0.00 79 P 0.00 3.76 0.00 1.63 0.56 0.00 3.53 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.31 0.00 80 N 8.23 5.01 0.00 2.92 2.93 0.00 0.00 6.00 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.79 4.13 0.00 2.12 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 2.36 2.31 0.00 82 E 8.86 4.11 0.00 2.31 2.32 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 2.40 2.35 0.00 83 C 8.14 4.96 0.00 3.22 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.14 4.35 0.00 1.50 1.33 0.79 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.90 5.21 0.00 3.10 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 9.32 4.77 0.00 1.49 1.60 0.89 0.07 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 87 E 8.85 4.34 0.00 2.05 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 2.15 1.77 0.00 88 R 8.66 4.80 0.00 1.76 1.80 0.00 3.04 0.00 0.00 2.86 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.63 0.00 89 L 8.68 4.76 0.00 1.73 1.68 0.93 0.99 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 90 E 9.24 4.70 0.00 2.22 1.87 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 2.30 2.44 0.00 91 E 9.74 4.02 0.00 2.42 2.14 0.00 0.00 0.00 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 2.40 0.00 92 N 8.50 4.32 0.00 2.84 2.89 0.00 0.00 6.86 8.16 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 93 H 8.60 4.81 0.00 2.84 2.94 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.83 4.70 0.00 3.01 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 9.58 5.64 0.00 2.93 2.60 0.00 0.00 6.96 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.95 5.30 4.57 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 1.39 0.00 0.00 97 Y 8.78 4.99 0.00 2.85 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 98 I 8.53 4.57 1.66 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.29 0.62 0.53 0.00 0.00 99 S 8.75 3.75 0.00 3.93 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 0.00 100 K 8.87 3.92 0.00 1.68 1.62 0.00 1.61 0.00 0.00 1.47 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.31 7.81 101 K 7.94 3.66 0.00 1.72 1.65 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.17 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.04 1.18 7.81 102 H 8.06 4.58 0.00 3.12 2.24 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.86 3.93 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 0.00 104 E 7.91 3.56 0.00 1.78 1.70 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 2.06 2.11 0.00 105 K 7.53 4.04 0.00 0.89 1.45 0.00 1.50 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.17 0.94 7.81 106 N 7.78 3.96 0.00 3.03 3.10 0.00 0.00 6.89 7.99 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 0.00 107 W 7.72 5.16 0.00 3.26 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 0.00 108 F 9.57 5.44 0.00 2.82 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 0.00 109 L 9.39 4.41 0.00 1.53 1.70 0.79 0.24 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 0.00 110 G 8.50 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.47 5.28 0.00 1.46 1.43 1.02 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.15 4.16 0.00 1.92 1.66 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.45 7.81 113 K 8.46 3.94 0.00 1.70 1.85 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.64 1.37 7.81 114 N 8.07 4.56 0.00 2.78 2.89 0.00 0.00 6.18 7.00 0.00 0.00 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 G 8.39 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.13 4.86 0.00 3.87 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 0.00 117 C 8.54 4.74 0.00 2.88 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 0.00 118 K 8.54 4.44 0.00 1.73 1.68 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.33 7.81 119 R 8.57 4.19 0.00 1.73 1.62 0.00 3.23 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.56 0.00 120 G 8.00 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 0.00 0.00 0.00 121 P 0.00 4.43 0.00 2.02 2.25 0.00 3.07 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 122 R 7.96 4.32 0.00 1.81 1.92 0.00 3.29 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 123 T 7.88 4.97 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 124 H 7.88 4.81 0.00 3.37 3.51 0.00 5.47 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.66 3.85 0.00 3.17 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 0.00 126 G 9.10 4.03 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 0.00 127 Q 7.39 4.37 0.00 1.84 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.77 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 128 K 8.27 3.80 0.00 1.75 1.65 0.00 1.57 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.27 7.81 129 A 8.15 3.98 1.18 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 0.00 0.00 130 I 7.16 4.40 1.69 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.05 0.53 0.00 0.00 131 L 7.35 4.31 0.00 0.95 0.55 0.40 0.87 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 0.00 132 F 9.41 5.54 0.00 3.38 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 0.00 133 L 9.37 5.32 0.00 1.99 1.75 0.87 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.15 0.00 2.16 2.20 0.00 3.81 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 2.05 2.14 0.00 135 L 9.14 4.92 0.00 1.66 1.63 1.04 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.73 0.00 1.93 1.98 0.00 3.68 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 137 V 8.14 3.87 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.90 0.00 0.00