NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 4.1389 8.3544 109.7798 46.0376 0.0000 173.1285 3 F 3.9009 8.8330 124.1239 55.6863 39.4891 173.5679 4 K 4.5158 8.7303 126.7046 56.2906 34.7617 176.3436 5 G 3.4613 5.3800 106.1503 44.6774 0.0000 175.6313 6 V 3.9310 8.3782 117.6933 60.7481 32.2908 175.4027 7 G 3.7365 7.6008 110.8313 46.7895 0.0000 170.7454 8 T 5.1076 7.5615 116.3918 62.0608 70.0811 174.2853 9 Y 5.2432 9.1172 122.9740 56.3753 43.2485 174.0219 10 E 4.8124 9.4477 121.7811 56.0197 31.3870 175.6112 11 I 4.4691 8.5832 125.0983 59.6958 39.4380 174.5401 12 V 4.8672 8.7250 128.4727 60.1086 34.1496 173.0250 13 P 3.8793 0.0000 0.0000 62.5061 31.8796 176.7424 14 Y 3.8146 8.0238 124.8033 60.7716 38.7277 177.3823 15 Q 3.9251 7.7247 115.6508 57.1610 29.8598 176.0600 16 A 4.6341 7.7117 121.0915 49.8585 18.9928 174.9205 17 P 4.4471 0.0000 0.0000 64.3526 32.2403 178.4379 18 S 4.4575 8.0039 114.3986 59.5200 63.7579 173.3043 19 L 5.4316 8.0259 119.6193 52.9249 45.1013 174.5334 20 N 5.3676 9.2492 117.2423 51.2827 41.5285 172.9689 21 L 4.6794 8.9914 121.5757 54.9685 43.3361 175.0732 22 N 5.5390 9.4779 124.4202 51.8106 42.7188 172.8881 23 A 4.9019 9.1073 128.7291 50.9596 19.4733 176.6692 24 W 4.1343 9.0732 133.7209 59.4449 31.0288 176.4765 25 E 3.5149 8.2444 124.0752 55.3894 27.3145 174.1927 26 G 3.8541 7.4636 106.3197 46.3069 0.0000 173.7642 27 K 4.4893 7.8002 116.4251 54.8115 33.8727 177.4660 28 L 4.1901 8.2647 119.6488 56.6959 42.0572 177.7155 29 E 4.1454 8.0286 119.6581 55.0330 30.1656 174.5881 30 P 3.9020 0.0000 0.0000 63.4827 31.8633 176.3662 31 G 3.9250 8.6397 108.0840 44.7893 0.0000 173.7716 32 A 4.2183 7.9843 121.4933 52.4417 19.5063 178.2264 33 V 4.4741 8.5148 114.0751 61.0083 33.9736 175.0475 34 V 5.0738 8.3044 121.3408 61.5210 34.2498 174.7175 35 R 5.2819 9.1273 125.3202 54.4567 35.2107 174.5029 36 T 4.9485 8.9046 110.8867 62.5416 70.3964 172.9814 37 Y 5.6029 8.9677 122.3255 57.1783 42.9708 173.6655 38 T 3.9373 7.8483 119.8251 64.3977 68.3541 174.2804 39 R 3.8957 8.8860 125.9812 57.8171 30.3001 178.3546 40 G 3.9618 7.9053 105.2434 44.5061 0.0000 172.8561 41 D 4.5085 8.4769 117.3069 56.3095 41.0882 177.0073 42 K 4.6435 7.5335 118.3013 53.8464 35.2922 173.5161 43 P 4.5469 0.0000 0.0000 62.2876 32.3957 176.2950 44 S 4.4542 8.3365 115.0040 57.7552 64.2073 174.9879 45 D 4.2556 8.4418 121.3589 57.1581 40.9634 178.1309 46 N 4.4830 8.0395 115.0741 54.2342 37.6012 175.4531 47 A 5.1960 7.7669 120.4380 50.7367 20.0554 175.9953 48 K 4.9470 7.6303 117.1242 55.8561 35.9684 175.5188 49 W 5.3999 9.0868 122.1696 55.1051 33.6504 173.9674 50 Q 4.7815 9.4179 126.9195 55.0795 30.1909 174.6012 51 V 4.6014 9.1281 128.1857 62.4161 32.9405 174.4663 52 A 5.1085 9.1128 130.0755 49.8540 21.7739 174.5815 53 L 4.4066 8.8643 125.5494 55.2801 42.2694 176.7696 54 V 4.4518 8.5604 118.4665 61.6475 34.2301 175.6224 55 A 4.3242 7.8926 120.0508 51.9852 22.3689 178.1112 56 G 3.6060 9.4799 107.9764 46.4760 0.0000 172.8048 57 S 4.2099 8.7227 110.0256 58.4532 65.2874 174.3055 58 G 3.9542 8.7491 114.6468 45.4116 0.0000 171.6552 59 D 4.4720 8.6459 119.6959 54.8506 40.5894 177.2900 60 S 4.7467 8.4858 123.5709 57.3188 63.5412 174.3027 61 A 4.1948 7.8288 122.8092 53.4222 18.9583 178.0137 62 E 4.8330 8.9595 121.7464 54.6610 33.0978 174.8496 63 Y 5.3396 9.1734 120.9077 56.2270 42.3190 174.7927 64 L 4.9475 8.8479 122.1161 54.2525 43.9920 176.2222 65 I 4.8771 8.5754 122.5578 59.9298 39.5460 173.8539 66 I 5.1790 9.0486 129.0842 59.3376 39.3753 175.1138 67 N 3.7446 9.4735 127.2117 53.4698 39.1784 175.9602 68 V 3.4935 8.0545 126.8621 66.4232 31.7747 177.0502 69 H 4.2975 8.3271 119.4715 58.7560 29.9235 175.9684 70 S 4.1146 7.9531 111.5087 57.7990 63.6598 175.3343 71 G 3.7387 7.9292 107.8692 45.8044 0.0000 173.0227 72 Y 4.3862 7.3858 117.6255 57.2264 40.1305 174.2597 73 F 5.7326 7.9682 117.9833 55.8220 41.2594 175.3816 74 L 4.7141 9.4088 126.5290 56.1200 43.0428 175.9164 75 T 5.2937 9.4805 122.2448 61.9285 73.1010 172.5893 76 A 5.0172 8.6536 127.7952 51.1396 19.4892 177.2334 77 T 4.3909 8.6248 111.6912 61.9093 70.8267 174.3427 78 K 4.4887 7.5178 120.2507 54.7502 34.9498 174.6743 79 E 3.9773 8.6957 123.7666 58.0120 30.2483 176.9298 80 N 4.2582 8.7515 119.6870 54.2632 36.9546 172.8979 81 H 4.8620 7.4529 115.4941 54.1594 34.3755 172.8338 82 I 4.1559 8.0276 123.3825 61.6565 38.6581 175.9423 83 V 4.4810 8.8108 122.5621 61.2370 33.6616 174.7163 84 S 5.2085 8.8409 116.0412 57.6564 67.0188 173.6086 85 T 5.4732 8.9505 109.4355 58.5808 66.3305 171.5058 86 P 4.7161 0.0000 0.0000 62.7151 33.9068 176.4914 87 Q 4.0665 7.9461 121.5607 55.7746 29.3985 174.7896 88 I 4.4905 7.6276 123.2355 59.7160 41.1779 174.0281 89 S 4.4804 8.5530 121.9041 57.8850 63.2397 173.7519 90 P 4.5177 0.0000 0.0000 64.8527 31.2757 176.9779 91 T 4.2363 7.7319 107.9473 61.7828 69.7373 174.1609 92 D 4.4702 8.0770 124.5788 53.2957 41.6814 175.0931 93 P 4.2529 0.0000 0.0000 65.5573 31.6267 178.2299 94 S 4.1663 8.5100 112.9528 59.8635 63.1020 175.0098 95 A 4.8374 7.7335 122.3570 51.2721 19.2987 176.4847 96 R 5.0404 7.3823 116.2417 54.4403 33.3551 175.2691 97 W 5.7123 9.1958 121.2966 55.3170 33.9365 174.1677 98 T 5.0930 9.2294 113.3828 60.2447 71.2179 173.5919 99 I 4.9117 8.6031 123.7597 59.7284 39.7044 174.8922 100 K 4.8566 8.9036 126.5909 53.4962 35.7810 174.4127 101 P 3.9747 0.0000 0.0000 62.9780 31.2289 176.6044 102 A 4.0134 8.5964 127.7647 54.3586 18.5860 177.6626 103 T 4.6501 7.1707 103.3196 59.4879 71.9330 173.6151 104 T 4.0640 8.1067 112.1045 62.6701 69.5520 173.3176 105 H 4.2313 9.0965 116.4430 56.4061 25.9174 174.6379 106 Q 4.7384 7.7219 113.9522 56.0582 30.7888 172.5445 107 Y 4.7170 8.3078 117.9114 57.6260 39.2930 175.5384 108 E 4.8319 8.6813 118.3885 55.8802 32.5168 176.5618 109 V 4.4645 8.1537 119.2900 60.8818 34.0144 174.8351 110 F 5.2897 9.1024 125.7716 55.8495 43.3833 174.0574 111 T 5.1509 8.9196 111.5869 59.8179 71.5352 173.8433 112 I 4.9174 8.3847 123.4581 59.9459 40.1404 173.9125 113 N 5.5561 9.2932 125.7695 51.0716 41.1127 174.2362 114 N 4.0241 9.1640 123.6785 53.2177 39.1090 175.2984 115 K 3.9852 8.4002 125.0127 59.0799 33.1204 177.4594 116 V 3.7385 8.1779 120.7420 61.6633 31.0677 176.0384 117 S 4.0692 8.7371 123.4926 61.4785 62.3028 176.3670 118 E 4.0856 8.0143 117.8533 58.8837 29.3689 177.9804 119 L 4.1193 7.8180 118.1319 55.3853 42.9303 179.1309 120 G 3.9675 8.0172 106.4025 45.8368 0.0000 172.2786 121 Q 5.3209 8.6964 121.1844 53.5871 32.3504 175.0875 122 L 4.6687 8.9790 125.3514 55.8072 43.2529 175.9893 123 T 5.0033 9.0539 122.3473 61.9085 73.2559 173.1047 124 V 4.2411 8.6030 126.6055 61.4242 32.9921 175.3875 125 K 3.7408 8.9987 130.0949 58.2596 32.3714 176.2024 126 D 4.3302 9.2666 123.9758 55.3260 38.3189 172.9918 127 Y 3.5080 7.4615 113.3108 58.7059 36.0609 170.7586 128 S 4.2790 7.8751 113.5153 59.0644 62.8602 173.8576 129 T 4.5629 8.5434 114.6917 61.4818 69.0010 173.1362 130 H 4.8984 7.8806 118.1259 53.7128 32.1470 173.8028 131 S 4.1664 8.3417 115.7419 60.1826 62.6380 175.0619 132 G 3.9800 9.4019 114.7536 45.1511 0.0000 173.1832 133 A 4.2777 7.8475 121.7396 51.1609 19.8350 177.5272 134 D 4.5012 8.6758 121.6913 54.5299 42.4541 175.4019 135 V 4.7288 8.4264 122.9121 61.5171 33.3195 174.7621 136 L 5.2707 9.2088 128.2496 53.0634 45.1976 175.7845 137 S 5.2214 8.8565 116.2598 57.4803 64.2953 173.0575 138 A 5.2399 8.7419 125.6542 48.1540 23.1796 174.8258 139 S 4.2833 9.1564 113.8159 59.2984 63.3988 174.6339 140 A 4.4169 8.6776 126.8176 51.9711 18.3264 177.1257 141 K 4.4323 8.9464 119.8394 55.1814 34.5863 176.1306 142 T 3.3494 8.2769 114.6698 64.2781 66.6635 171.8419 143 A 4.3778 8.1043 123.1447 51.5563 19.5513 179.0900 144 D 4.2936 8.6187 118.9710 57.1085 41.1232 177.5431 145 N 4.4743 8.0793 115.1069 53.1833 37.6319 175.4127 146 Q 5.1155 7.9931 116.8205 54.8722 30.7108 174.7373 147 K 4.8687 7.3569 118.4979 54.4763 35.4571 175.1553 148 W 5.3690 8.8088 121.9072 55.4645 33.9231 173.7298 149 Y 5.2043 9.2195 120.6495 56.6606 40.8254 175.0136 150 F 5.0780 9.0452 120.2309 56.2100 41.3801 173.9111 151 D 5.2245 9.0094 124.5241 52.9618 42.8022 175.8637 152 A 4.7458 8.3761 121.3057 51.2496 22.1641 176.1865 153 K 4.1033 8.6715 120.1853 56.4998 32.4689 176.0387 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 G 8.35 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 3 F 8.83 3.90 0.00 2.16 2.36 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 4 K 8.73 4.52 0.00 1.79 1.82 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.28 7.81 5 G 5.38 3.46 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 0.00 0.00 0.00 6 V 8.38 3.93 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 0.86 0.00 0.00 0.93 0.00 0.00 7 G 7.60 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 0.00 0.00 0.00 8 T 7.56 5.11 4.11 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 1.19 0.00 0.00 9 Y 9.12 5.24 0.00 3.09 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 10 E 9.45 4.81 0.00 2.05 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 2.58 2.40 0.00 11 I 8.58 4.47 1.49 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 0.83 0.75 0.11 0.00 0.00 12 V 8.73 4.87 2.31 0.00 0.00 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 1.14 0.00 0.00 13 P 0.00 3.88 0.00 1.80 1.51 0.00 4.09 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.98 0.00 14 Y 8.02 3.81 0.00 2.37 2.88 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 15 Q 7.72 3.93 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.11 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 16 A 7.71 4.63 1.21 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 17 P 0.00 4.45 0.00 2.15 2.23 0.00 3.70 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 1.94 1.94 0.00 18 S 8.00 4.46 0.00 3.76 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 19 L 8.03 5.43 0.00 1.56 1.77 0.97 0.77 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 20 N 9.25 5.37 0.00 3.03 3.02 0.00 0.00 7.06 6.32 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 21 L 8.99 4.68 0.00 1.78 1.53 0.57 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 22 N 9.48 5.54 0.00 3.02 3.07 0.00 0.00 6.68 7.34 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 23 A 9.11 4.90 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 24 W 9.07 4.13 0.00 3.45 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 25 E 8.24 3.51 0.00 2.13 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 1.75 2.19 0.00 26 G 7.46 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 27 K 7.80 4.49 0.00 1.79 1.77 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.44 7.81 28 L 8.26 4.19 0.00 1.64 1.72 0.88 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.03 4.15 0.00 1.93 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 2.30 2.36 0.00 30 P 0.00 3.90 0.00 1.74 0.65 0.00 3.74 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 1.80 1.70 0.00 31 G 8.64 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 32 A 7.98 4.22 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 33 V 8.51 4.47 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 0.73 0.00 0.00 0.89 0.00 0.00 34 V 8.30 5.07 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 1.05 0.00 0.00 1.15 0.00 0.00 35 R 9.13 5.28 0.00 1.83 1.76 0.00 2.21 0.00 0.00 2.69 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.21 0.00 36 T 8.90 4.95 4.38 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 1.34 0.00 0.00 37 Y 8.97 5.60 0.00 3.30 2.93 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 0.00 0.00 0.00 38 T 7.85 3.94 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 1.11 0.00 0.00 39 R 8.89 3.90 0.00 1.82 2.04 0.00 3.40 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 1.75 1.72 0.00 40 G 7.91 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.48 4.51 0.00 2.68 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 42 K 7.53 4.64 0.00 1.66 1.61 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.43 7.81 43 P 0.00 4.55 0.00 2.25 2.25 0.00 3.83 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 44 S 8.34 4.45 0.00 4.00 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 45 D 8.44 4.26 0.00 2.64 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 46 N 8.04 4.48 0.00 2.86 2.91 0.00 0.00 5.96 7.02 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 47 A 7.77 5.20 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 48 K 7.63 4.95 0.00 1.54 1.65 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.54 7.81 49 W 9.09 5.40 0.00 3.35 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 50 Q 9.42 4.78 0.00 2.19 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 51 V 9.13 4.60 2.30 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 0.54 0.00 0.00 1.12 0.00 0.00 52 A 9.11 5.11 1.26 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 0.00 0.00 53 L 8.86 4.41 0.00 1.74 1.61 0.58 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.56 4.45 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 0.67 0.00 0.00 0.92 0.00 0.00 55 A 7.89 4.32 1.14 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 0.00 0.00 0.00 0.00 0.00 56 G 9.48 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 S 8.72 4.21 0.00 3.95 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 58 G 8.75 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 59 D 8.65 4.47 0.00 2.69 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 60 S 8.49 4.75 0.00 3.98 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 7.83 4.19 1.14 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 0.00 0.00 0.00 0.00 0.00 62 E 8.96 4.83 0.00 1.76 1.76 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 2.17 2.33 0.00 63 Y 9.17 5.34 0.00 2.91 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.85 4.95 0.00 1.51 1.33 0.31 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 65 I 8.58 4.88 1.62 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.86 0.67 0.00 0.00 66 I 9.05 5.18 2.04 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.86 1.20 0.00 0.00 67 N 9.47 3.74 0.00 2.48 2.56 0.00 0.00 6.44 7.36 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 68 V 8.05 3.49 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.89 0.00 0.00 69 H 8.33 4.30 0.00 2.94 3.37 0.00 5.96 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 70 S 7.95 4.11 0.00 4.05 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 7.93 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 0.00 0.00 0.00 72 Y 7.39 4.39 0.00 2.97 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 73 F 7.97 5.73 0.00 3.10 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 74 L 9.41 4.71 0.00 1.79 1.55 0.60 -0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 75 T 9.48 5.29 4.39 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 1.34 0.00 0.00 76 A 8.65 5.02 1.17 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 77 T 8.62 4.39 4.24 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 1.25 0.00 0.00 78 K 7.52 4.49 0.00 1.58 1.54 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.40 7.81 79 E 8.70 3.98 0.00 2.00 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 2.48 2.33 0.00 80 N 8.75 4.26 0.00 2.90 2.84 0.00 0.00 6.19 8.19 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 81 H 7.45 4.86 0.00 3.37 3.27 0.00 5.87 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 8.03 4.16 1.75 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.04 0.82 0.00 0.00 83 V 8.81 4.48 2.31 0.00 0.00 0.00 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 0.96 0.00 0.00 84 S 8.84 5.21 0.00 4.03 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 85 T 8.95 5.47 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 1.61 0.00 0.00 86 P 0.00 4.72 0.00 2.08 2.20 0.00 4.04 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 2.00 0.00 87 Q 7.95 4.07 0.00 1.63 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 88 I 7.63 4.49 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.75 1.12 0.00 0.00 89 S 8.55 4.48 0.00 3.99 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.52 0.00 2.17 2.23 0.00 3.89 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 91 T 7.73 4.24 4.25 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 1.23 0.00 0.00 92 D 8.08 4.47 0.00 2.83 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.25 0.00 2.16 2.24 0.00 3.72 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.92 0.00 94 S 8.51 4.17 0.00 4.16 4.07 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 95 A 7.73 4.84 1.51 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 0.00 0.00 96 R 7.38 5.04 0.00 1.77 1.75 0.00 3.02 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 97 W 9.20 5.71 0.00 3.26 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 98 T 9.23 5.09 4.35 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 1.29 0.00 0.00 99 I 8.60 4.91 1.49 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.67 -0.41 0.00 0.00 100 K 8.90 4.86 0.00 1.74 1.72 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.47 7.81 101 P 0.00 3.97 0.00 1.94 1.92 0.00 3.78 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.28 0.00 102 A 8.60 4.01 1.07 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 0.00 0.00 103 T 7.17 4.65 4.16 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 1.09 0.00 0.00 104 T 8.11 4.06 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 1.15 0.00 0.00 105 H 9.10 4.23 0.00 3.33 3.44 0.00 5.76 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.72 4.74 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.53 0.00 0.00 0.00 0.00 0.00 2.18 2.45 0.00 107 Y 8.31 4.72 0.00 2.97 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 0.00 108 E 8.68 4.83 0.00 2.09 2.21 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 2.37 2.41 0.00 109 V 8.15 4.46 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 0.46 0.00 0.00 0.84 0.00 0.00 110 F 9.10 5.29 0.00 3.03 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 0.00 111 T 8.92 5.15 4.31 0.00 0.00 0.00 0.00 0.00 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 0.00 112 I 8.38 4.92 1.41 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.66 0.35 0.00 0.00 113 N 9.29 5.56 0.00 2.70 2.77 0.00 0.00 6.29 6.83 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 0.00 114 N 9.16 4.02 0.00 2.20 2.60 0.00 0.00 7.29 6.23 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 0.00 115 K 8.40 3.99 0.00 1.77 1.76 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.46 7.81 116 V 8.18 3.74 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 0.93 0.00 0.00 0.87 0.00 0.00 117 S 8.74 4.07 0.00 3.87 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 0.00 118 E 8.01 4.09 0.00 1.95 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 2.30 2.38 0.00 119 L 7.82 4.12 0.00 1.66 1.66 0.85 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 120 G 8.02 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 Q 8.70 5.32 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 6.94 0.00 0.00 0.00 0.00 0.00 2.44 2.33 0.00 122 L 8.98 4.67 0.00 1.36 1.24 0.49 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 123 T 9.05 5.00 4.26 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 1.09 0.00 0.00 124 V 8.60 4.24 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 0.95 0.00 0.00 0.72 0.00 0.00 125 K 9.00 3.74 0.00 1.83 1.68 0.00 1.81 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.41 7.81 126 D 9.27 4.33 0.00 2.89 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Y 7.46 3.51 0.00 3.01 3.12 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 0.00 128 S 7.88 4.28 0.00 3.88 3.78 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 0.00 129 T 8.54 4.56 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 1.31 0.00 0.00 130 H 7.88 4.90 0.00 3.16 3.24 0.00 5.67 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 0.00 131 S 8.34 4.17 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 0.00 132 G 9.40 3.98 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 0.00 0.00 0.00 133 A 7.85 4.28 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 0.00 134 D 8.68 4.50 0.00 2.56 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 0.00 135 V 8.43 4.73 2.20 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 1.04 0.00 0.00 1.09 0.00 0.00 136 L 9.21 5.27 0.00 1.59 1.56 0.90 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 0.00 137 S 8.86 5.22 0.00 4.21 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 0.00 138 A 8.74 5.24 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 0.00 139 S 9.16 4.28 0.00 3.77 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 0.00 140 A 8.68 4.42 1.25 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 0.00 0.00 141 K 8.95 4.43 0.00 1.86 1.81 0.00 1.94 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.61 7.81 142 T 8.28 3.35 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 1.18 0.00 0.00 143 A 8.10 4.38 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 0.00 144 D 8.62 4.29 0.00 2.82 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 0.00 145 N 8.08 4.47 0.00 2.63 2.87 0.00 0.00 6.08 7.44 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 0.00 146 Q 7.99 5.12 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.03 0.00 147 K 7.36 4.87 0.00 1.35 1.10 0.00 0.96 0.00 0.00 1.14 0.00 0.00 2.62 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.12 1.35 7.81 148 W 8.81 5.37 0.00 2.97 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 0.00 149 Y 9.22 5.20 0.00 2.87 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 0.00 150 F 9.05 5.08 0.00 2.73 2.37 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 0.00 151 D 9.01 5.22 0.00 2.73 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 0.00 152 A 8.38 4.75 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 0.00 153 K 8.67 4.10 0.00 1.72 1.67 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.41 7.81