NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4139 8.3044 118.1944 55.4259 31.9449 174.2362 2 V 4.1260 8.0792 117.8532 60.2412 33.0181 173.8243 3 R 3.7598 8.7890 125.7311 55.7888 31.5141 180.4323 4 V 3.0474 7.7215 106.8157 63.4958 32.7937 176.3483 5 S 4.1419 8.2616 113.7941 61.4646 62.9028 176.6311 6 V 3.5632 7.7353 121.4310 65.5733 31.4169 177.5502 7 L 4.6726 7.7580 120.8393 57.8300 42.1278 178.5407 8 N 4.3184 8.0878 116.2613 56.5131 38.4793 176.9498 9 D 4.3611 8.7450 119.4807 57.2533 41.2902 178.0532 10 A 3.9878 8.4919 121.8379 54.8962 18.2704 179.4079 11 L 3.9375 7.8025 118.8340 58.3084 42.3225 179.4296 12 K 4.2107 8.0959 118.5532 60.2617 32.5026 178.9439 13 T 3.8871 8.3636 114.6909 65.0539 67.2394 175.7658 14 M 4.0040 8.1785 120.1894 58.7942 32.1863 177.7279 15 Y 3.9181 8.2960 116.9724 61.3116 37.8858 178.4784 16 N 4.3624 8.2107 115.6961 56.3756 38.7127 177.0834 17 A 4.0850 7.9635 121.2615 53.0854 18.3953 177.9566 18 E 3.8813 8.1528 114.7148 57.0939 27.4510 174.9168 19 K 4.1336 7.6735 117.9538 56.2126 32.5606 177.4148 20 R 3.9363 8.7279 122.9487 59.1574 30.1405 176.1483 21 G 4.1603 7.3546 100.9167 45.3948 0.0000 171.3251 22 K 4.9301 9.1463 118.8931 55.0872 36.3937 175.0717 23 R 5.5613 8.3609 119.1274 54.6687 33.7181 173.2325 24 Q 4.5535 8.0500 119.6210 55.6793 31.6076 172.8051 25 V 4.4183 8.4025 118.9515 62.9586 32.4078 174.8855 26 L 4.7481 8.2721 123.8023 53.5146 46.1179 174.5182 27 I 4.6710 7.7465 118.9574 59.1807 40.5344 174.8925 28 R 4.0174 8.0012 118.3787 58.2508 30.6062 176.9524 29 P 4.2561 0.0000 0.0000 64.9269 31.8117 177.3506 30 S 4.7112 7.7298 109.4067 57.2571 64.0074 174.9806 31 S 4.0970 8.3580 114.6002 62.0307 62.2130 175.9228 32 K 3.9079 8.6958 121.8780 59.3922 31.8215 179.7180 33 V 3.6469 7.4161 118.2381 64.9205 31.3573 178.4666 34 I 3.8504 7.5988 120.1456 64.0136 36.9342 178.0297 35 I 3.6089 8.1548 119.8062 64.0396 37.8400 178.0711 36 K 3.9025 7.8851 119.0151 59.3536 31.7194 179.2881 37 F 3.8468 8.0785 118.0492 60.4769 38.7346 177.7445 38 L 4.2062 8.1185 118.6111 57.8660 41.2208 179.5519 39 I 3.7077 7.9897 119.2393 63.7383 37.0292 177.6739 40 V 4.1068 7.3641 116.9937 62.0738 32.2491 175.0826 41 M 3.3013 8.0361 111.8636 55.8790 30.5039 178.4321 42 Q 4.1918 8.8689 119.9420 59.3009 29.1982 176.9684 43 K 4.8324 7.6098 114.0201 54.4756 35.8975 176.1168 44 H 4.2501 8.5991 117.3517 58.2777 28.7849 175.8627 45 G 4.3062 7.5931 103.6847 46.0892 0.0000 171.0709 46 Y 5.4830 8.0380 116.7783 55.4606 41.0970 174.1655 47 I 4.4452 9.4987 120.9919 59.2554 42.4049 174.4268 48 G 4.4914 8.6210 113.3859 43.6405 0.0000 172.5322 49 E 4.1559 8.8324 125.1766 55.4741 31.9035 176.3035 50 F 3.6737 7.8345 111.8657 58.9602 35.9935 175.2071 51 E 4.8120 8.3844 125.1256 52.4503 30.0734 176.8336 52 F 5.2712 7.8762 129.8726 55.9770 42.4558 171.1455 53 V 3.4943 8.0978 127.1615 62.6989 29.2247 169.9913 54 D 4.6492 7.7285 118.5065 53.1081 39.7431 175.7571 55 D 4.4399 8.4482 118.0458 56.5306 41.0892 175.6193 56 H 4.9446 7.7842 112.9834 54.5084 32.5670 171.1261 57 R 5.1556 8.3245 117.9909 55.5585 34.5025 173.6305 58 S 4.8126 8.6106 112.7931 57.7388 67.5316 173.2782 59 G 4.1798 8.9646 106.9115 45.2527 0.0000 172.4047 60 K 4.6773 9.2599 130.2476 55.4911 33.3023 175.3276 61 I 4.7639 8.9148 122.7910 59.2177 40.1268 174.7122 62 V 4.5872 8.7904 127.2083 61.4177 33.1479 175.3850 63 V 4.2006 7.8534 126.8655 60.9653 32.9711 174.8572 64 E 4.4345 9.5185 122.3593 55.6339 32.2988 171.8300 65 L 4.6422 10.7450 129.0810 51.3810 36.4393 172.0962 66 N 3.8915 9.3121 121.0536 54.4322 38.2855 170.7630 67 G 3.8532 8.2941 116.2356 43.5920 0.0000 173.6336 68 R 4.0801 8.6017 120.3021 55.6313 31.4561 178.0600 69 L 4.5928 8.4781 122.6306 54.0175 44.6272 175.2707 70 N 5.1684 8.2165 116.5192 51.5269 40.6361 175.6692 71 K 4.1128 8.7935 123.2621 59.8152 32.3805 177.5943 72 C 4.1945 7.4611 121.4004 57.9512 29.9701 172.8028 73 G 3.5323 8.1230 115.0303 47.7676 0.0000 172.0841 74 V 4.3255 6.8008 118.7485 61.1859 35.0995 172.9035 75 I 5.0787 8.1269 126.7536 59.5314 41.1735 173.9086 76 S 4.8916 8.4894 121.0254 56.0138 66.2500 171.4956 77 P 4.9422 0.0000 0.0000 61.9149 32.4459 175.9313 78 R 4.5211 7.4243 117.1548 54.9438 29.8142 172.8670 79 F 3.7856 8.2759 125.1005 58.1650 38.4039 172.9513 80 D 4.3669 7.6623 128.9382 51.8906 41.7717 174.8921 81 V 3.8802 7.7329 119.1229 62.4776 33.4687 176.5457 82 G 3.9946 8.9971 107.9535 45.6769 0.0000 173.4202 83 V 4.6981 7.4665 116.8684 59.8284 34.5964 175.0723 84 K 4.5250 8.5637 119.5504 55.1039 35.4320 175.7810 85 E 4.2757 7.0823 124.0867 54.5785 32.4266 173.6671 86 I 4.6217 7.8152 125.1841 59.3726 41.2787 173.3896 87 E 4.9468 9.0587 126.4238 54.6688 33.7285 174.6805 88 S 5.0176 8.3045 115.2877 56.0827 65.8350 175.1171 89 W 4.1716 9.1293 116.9934 59.2467 27.7640 177.0775 90 T 3.9490 7.4716 107.9020 62.4843 69.3471 176.7541 91 A 3.7709 8.6064 124.7890 55.1563 18.4459 177.6921 92 R 3.7946 6.9807 115.1664 56.1653 26.9363 175.4736 93 L 4.4252 7.8670 122.6979 54.7383 42.1565 176.3812 94 L 4.2254 7.6351 120.0664 54.6988 45.6757 171.2861 95 P 4.7013 0.0000 0.0000 62.2297 31.4938 176.8471 96 S 2.9662 8.7064 105.1242 56.6371 64.3051 173.0021 97 R 4.2414 8.4579 120.8780 56.9759 28.3437 177.0916 98 Q 3.9326 8.2945 116.4109 56.3320 28.5399 173.7998 99 F 4.0436 9.5487 116.9421 60.7810 39.1629 175.4141 100 G 4.1466 7.6652 108.0686 44.2393 0.0000 171.5268 101 Y 4.9140 8.5469 115.9235 55.2752 42.1453 174.1029 102 I 4.6510 8.1069 119.8716 59.1721 41.1337 174.6073 103 V 4.1551 8.1329 123.3984 61.1987 32.9333 175.2120 104 L 4.9897 9.1170 127.3261 53.6505 45.7069 174.6334 105 T 4.7347 8.9694 122.0232 61.5120 68.4618 173.6416 106 T 4.4589 8.1685 129.4802 62.9098 70.2384 174.3452 107 S 4.1843 8.7640 118.0903 62.7667 63.1347 176.5249 108 A 3.9016 8.1600 122.0798 53.0833 18.4627 177.4439 109 G 3.8190 6.8147 102.6721 45.4304 0.0000 170.5816 110 I 4.5788 7.8928 120.7394 60.7819 38.2134 174.7186 111 M 4.9966 8.8067 127.0901 53.3801 35.4803 174.1476 112 D 5.0249 8.4003 118.3755 52.6660 41.3876 177.3581 113 H 4.3014 8.9073 115.8442 58.7361 28.3320 177.5875 114 E 3.8689 8.1981 119.8627 59.2605 29.4341 178.8359 115 E 3.9244 8.8340 119.9690 58.9761 29.4691 179.2117 116 A 4.0271 8.0358 120.7782 55.0723 18.0479 179.5735 117 R 4.0151 8.1381 117.2505 59.7588 29.9466 179.0348 118 R 3.9524 7.7720 116.5775 59.3067 30.2054 179.0702 119 K 3.9273 7.9991 117.1408 57.1786 32.4433 176.4144 120 N 3.6481 7.4753 114.3569 54.2635 35.5987 174.3459 121 V 4.3391 8.4401 116.9880 60.9809 34.9570 175.2209 122 G 4.1308 8.2829 114.7362 45.4497 0.0000 171.6071 123 G 3.7583 7.0003 104.3898 45.6044 0.0000 171.0867 124 K 5.2796 8.2611 120.2097 54.7159 34.9698 176.4236 125 V 4.0759 9.0162 125.0207 62.2210 31.2467 175.9001 126 L 4.0973 9.0504 124.5893 56.1753 42.9066 176.8672 127 G 3.4617 6.7104 105.1357 45.3732 0.0000 171.6764 128 F 4.6938 7.6928 117.7511 55.2682 40.6024 173.8507 129 F 4.3380 8.1183 126.5072 57.4779 40.5729 174.5590 130 Y 3.9927 7.2179 126.2710 57.6620 38.1603 174.9112 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 M 8.30 4.41 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.60 0.00 2 V 8.08 4.13 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 0.79 0.00 0.00 0.95 0.00 0.00 3 R 8.79 3.76 0.00 1.91 1.84 0.00 3.32 0.00 0.00 3.34 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 4 V 7.72 3.05 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 0.77 0.00 0.00 0.90 0.00 0.00 5 S 8.26 4.14 0.00 4.06 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 V 7.74 3.56 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 1.03 0.00 0.00 0.93 0.00 0.00 7 L 7.76 4.67 0.00 1.75 1.82 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 8 N 8.09 4.32 0.00 2.98 2.92 0.00 0.00 6.70 8.09 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 9 D 8.75 4.36 0.00 2.67 2.68 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 10 A 8.49 3.99 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.80 3.94 0.00 1.77 1.91 0.98 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 12 K 8.10 4.21 0.00 2.07 2.08 0.00 1.36 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.48 7.81 13 T 8.36 3.89 4.49 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 0.00 0.00 0.00 1.29 0.00 0.00 14 M 8.18 4.00 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.56 0.00 15 Y 8.30 3.92 0.00 3.28 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 16 N 8.21 4.36 0.00 2.90 2.91 0.00 0.00 7.07 6.90 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 17 A 7.96 4.08 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 18 E 8.15 3.88 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.43 0.00 19 K 7.67 4.13 0.00 1.72 1.84 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.51 7.81 20 R 8.73 3.94 0.00 1.86 1.90 0.00 3.23 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 21 G 7.35 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 0.00 0.00 0.00 0.00 22 K 9.15 4.93 0.00 1.73 1.85 0.00 1.26 0.00 0.00 1.46 0.00 0.00 2.78 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.27 1.33 7.81 23 R 8.36 5.56 0.00 1.80 1.78 0.00 3.16 0.00 0.00 3.98 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 24 Q 8.05 4.55 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 25 V 8.40 4.42 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 0.87 0.00 0.00 0.92 0.00 0.00 26 L 8.27 4.75 0.00 1.66 1.53 0.98 0.80 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 27 I 7.75 4.67 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.95 0.00 0.00 28 R 8.00 4.02 0.00 1.96 1.88 0.00 3.27 0.00 0.00 3.34 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 29 P 0.00 4.26 0.00 2.16 2.11 0.00 3.53 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 30 S 7.73 4.71 0.00 3.77 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 31 S 8.36 4.10 0.00 4.05 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 32 K 8.70 3.91 0.00 1.86 1.82 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.57 7.81 33 V 7.42 3.65 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 0.97 0.00 0.00 1.20 0.00 0.00 34 I 7.60 3.85 1.45 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.79 0.22 0.00 0.00 35 I 8.15 3.61 1.89 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.22 0.88 0.00 0.00 36 K 7.89 3.90 0.00 1.71 1.47 0.00 1.63 0.00 0.00 1.83 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.58 1.50 7.81 37 F 8.08 3.85 0.00 3.26 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 38 L 8.12 4.21 0.00 1.97 1.83 1.17 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.99 3.71 1.86 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.71 0.84 0.00 0.00 40 V 7.36 4.11 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.55 0.00 0.00 41 M 8.04 3.30 0.00 2.30 2.22 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 2.56 2.52 0.00 42 Q 8.87 4.19 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.47 6.73 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 43 K 7.61 4.83 0.00 1.75 2.02 0.00 1.71 0.00 0.00 1.78 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.54 7.81 44 H 8.60 4.25 0.00 3.19 3.39 0.00 5.89 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 45 G 7.59 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 0.00 0.00 0.00 0.00 46 Y 8.04 5.48 0.00 3.01 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 47 I 9.50 4.45 1.80 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.63 0.98 0.00 0.00 48 G 8.62 4.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.83 4.16 0.00 1.82 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 0.00 2.53 2.88 0.00 50 F 7.83 3.67 0.00 3.18 3.22 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 51 E 8.38 4.81 0.00 1.96 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 2.21 2.43 0.00 52 F 7.88 5.27 0.00 3.23 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 53 V 8.10 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 0.79 0.00 0.00 0.77 0.00 0.00 54 D 7.73 4.65 0.00 2.83 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.45 4.44 0.00 2.68 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 H 7.78 4.94 0.00 3.04 3.16 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 R 8.32 5.16 0.00 1.69 1.89 0.00 3.24 0.00 0.00 3.33 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 58 S 8.61 4.81 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 59 G 8.96 4.18 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 0.00 60 K 9.26 4.68 0.00 1.87 1.74 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.40 7.81 61 I 8.91 4.76 1.88 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.03 1.00 0.00 0.00 62 V 8.79 4.59 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 0.96 0.00 0.00 0.93 0.00 0.00 63 V 7.85 4.20 1.71 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 0.58 0.00 0.00 -0.24 0.00 0.00 64 E 9.52 4.43 0.00 2.06 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 2.04 1.81 0.00 65 L 10.75 4.64 0.00 2.14 1.97 0.91 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 66 N 9.31 3.89 0.00 2.87 2.88 0.00 0.00 6.86 7.65 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 67 G 8.29 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 68 R 8.60 4.08 0.00 1.83 1.75 0.00 3.22 0.00 0.00 3.25 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 69 L 8.48 4.59 0.00 1.66 1.64 0.92 0.96 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 70 N 8.22 5.17 0.00 2.79 3.10 0.00 0.00 6.81 7.61 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 71 K 8.79 4.11 0.00 1.94 2.27 0.00 1.90 0.00 0.00 1.80 0.00 0.00 3.47 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.83 1.80 7.81 72 C 7.46 4.19 0.00 2.85 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 73 G 8.12 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 74 V 6.80 4.33 1.83 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 0.83 0.00 0.00 0.64 0.00 0.00 75 I 8.13 5.08 1.93 0.00 0.00 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 1.40 1.29 0.96 0.00 0.00 76 S 8.49 4.89 0.00 3.93 3.79 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 77 P 0.00 4.94 0.00 2.13 2.05 0.00 3.81 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 2.02 1.99 0.00 78 R 7.42 4.52 0.00 1.59 1.83 0.00 3.62 0.00 0.00 3.71 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.88 0.00 79 F 8.28 3.79 0.00 3.27 3.29 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 80 D 7.66 4.37 0.00 2.64 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 81 V 7.73 3.88 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 0.78 0.00 0.00 0.79 0.00 0.00 82 G 9.00 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 83 V 7.47 4.70 2.41 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 1.14 0.00 0.00 1.12 0.00 0.00 84 K 8.56 4.53 0.00 1.73 1.67 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.37 7.81 85 E 7.08 4.28 0.00 1.50 1.12 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 1.93 1.78 0.00 86 I 7.82 4.62 1.83 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.23 0.87 0.00 0.00 87 E 9.06 4.95 0.00 1.98 1.83 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 2.22 2.21 0.00 88 S 8.30 5.02 0.00 3.96 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 89 W 9.13 4.17 0.00 3.37 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 90 T 7.47 3.95 3.89 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 0.00 0.00 0.04 0.00 0.00 91 A 8.61 3.77 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 92 R 6.98 3.79 0.00 1.95 1.92 0.00 3.45 0.00 0.00 3.57 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.86 0.00 93 L 7.87 4.43 0.00 1.73 1.65 0.92 0.65 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 94 L 7.64 4.23 0.00 1.59 1.55 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.70 0.00 1.91 1.69 0.00 3.79 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.24 0.00 96 S 8.71 2.97 0.00 3.16 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 97 R 8.46 4.24 0.00 2.09 2.49 0.00 3.47 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 98 Q 8.29 3.93 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 7.06 0.00 0.00 0.00 0.00 0.00 2.12 2.36 0.00 99 F 9.55 4.04 0.00 2.88 3.23 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 0.00 100 G 7.67 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Y 8.55 4.91 0.00 3.02 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 0.00 102 I 8.11 4.65 1.98 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.38 0.88 0.00 0.00 103 V 8.13 4.16 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 0.49 0.00 0.00 0.92 0.00 0.00 104 L 9.12 4.99 0.00 1.84 1.50 1.03 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 105 T 8.97 4.73 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 1.20 0.00 0.00 106 T 8.17 4.46 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 1.32 0.00 0.00 107 S 8.76 4.18 0.00 3.84 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 0.00 108 A 8.16 3.90 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 0.00 109 G 6.81 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 0.00 110 I 7.89 4.58 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.84 0.89 0.00 0.00 111 M 8.81 5.00 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 112 D 8.40 5.02 0.00 2.78 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 0.00 113 H 8.91 4.30 0.00 3.36 3.68 0.00 5.29 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 0.00 114 E 8.20 3.87 0.00 2.23 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 2.33 2.89 0.00 115 E 8.83 3.92 0.00 2.24 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 0.00 2.30 2.44 0.00 116 A 8.04 4.03 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 0.00 117 R 8.14 4.02 0.00 2.12 2.24 0.00 3.17 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.91 0.00 118 R 7.77 3.95 0.00 1.98 1.95 0.00 3.33 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 1.69 1.92 0.00 119 K 8.00 3.93 0.00 1.76 1.82 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.55 1.59 7.81 120 N 7.48 3.65 0.00 2.61 2.52 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 0.00 121 V 8.44 4.34 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 0.81 0.00 0.00 0.90 0.00 0.00 122 G 8.28 4.13 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 0.00 123 G 7.00 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 0.00 0.00 0.00 124 K 8.26 5.28 0.00 2.00 2.33 0.00 1.36 0.00 0.00 1.80 0.00 0.00 3.11 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.53 7.81 125 V 9.02 4.08 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 0.97 0.00 0.00 0.63 0.00 0.00 126 L 9.05 4.10 0.00 1.52 1.68 0.90 0.63 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 0.00 127 G 6.71 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 0.00 128 F 7.69 4.69 0.00 3.02 2.89 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 0.00 0.00 0.00 129 F 8.12 4.34 0.00 2.88 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 7.22 3.99 0.00 2.98 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00