NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9125 8.3544 109.7383 44.9277 0.0000 173.5410 2 S 4.3872 7.5935 112.1002 56.1314 65.6181 171.0283 3 S 4.7508 9.0416 118.0327 55.7206 65.5675 174.0099 4 G 4.2165 7.9868 117.6885 45.5219 0.0000 172.0675 5 S 4.5524 8.2123 116.3189 57.1280 63.8824 173.1189 6 S 4.7474 7.9771 116.5380 56.9934 65.5657 172.2327 7 G 4.0157 7.6003 114.4839 46.4736 0.0000 174.3658 8 T 4.2166 7.7107 124.3335 61.8471 67.7898 174.9690 9 A 4.3676 7.9635 135.0000 52.4031 19.3832 178.5172 10 H 4.4858 7.9955 117.2553 55.4632 28.4578 175.8545 11 G 3.7300 7.7503 106.6505 44.7620 0.0000 171.3723 12 T 4.2818 7.9645 113.1854 60.9115 68.6483 175.9249 13 T 4.1505 7.7168 116.3736 63.0528 69.6458 174.5659 14 F 4.8755 6.9942 114.8015 55.9671 40.7075 173.0536 15 E 4.8209 8.7911 121.1510 54.5829 32.2628 175.7952 16 L 4.6637 8.2225 120.3029 52.7367 43.8378 177.1349 17 V 3.6437 8.5021 117.4705 60.8186 32.2176 175.3720 18 P 4.4409 0.0000 0.0000 63.4385 29.5583 175.8594 19 T 4.1797 8.1201 122.1766 62.4792 67.6343 174.3672 20 S 4.7253 7.6995 112.7279 54.9659 66.0422 171.8269 21 P 4.4462 0.0000 0.0000 61.7533 31.8172 174.2063 22 P 4.5999 0.0000 0.0000 62.7534 32.2666 174.9797 23 K 4.6396 8.7027 117.8832 54.9440 35.5874 175.5623 24 D 4.3729 8.4675 115.9585 55.5836 37.9354 174.9663 25 V 4.2980 7.8748 119.1856 62.8577 32.0999 175.3570 26 T 4.7909 8.8941 118.4393 59.8314 72.3999 173.4644 27 V 4.4186 8.4216 122.5669 61.6117 33.9312 174.7342 28 V 4.4355 8.2499 121.6853 59.8668 34.8888 174.7783 29 S 4.9738 8.2929 116.6735 56.3172 65.1150 174.7306 30 K 3.8903 8.3679 125.2520 56.7454 32.9131 176.5563 31 E 4.1412 8.5957 126.4553 59.0433 28.7041 174.7253 32 G 4.0129 8.9051 115.3954 44.9505 0.0000 171.7413 33 K 4.3637 7.7639 120.9475 53.6449 32.3749 174.4902 34 P 4.2904 0.0000 0.0000 65.6153 31.6037 178.0589 35 K 4.1120 8.0480 116.8479 57.8086 32.5064 175.9873 36 T 5.5424 7.7071 116.6758 60.9325 71.4168 173.4187 37 I 4.7987 7.9175 116.9087 59.4039 41.7489 173.4546 38 I 4.7971 8.1436 124.0134 59.4790 40.2877 174.6922 39 V 4.6955 8.8649 126.8136 61.3733 33.7327 174.2151 40 N 5.2916 8.7042 125.6218 51.8395 41.5761 173.7892 41 W 5.7650 7.4260 116.8043 57.3179 31.6299 173.1561 42 Q 4.7776 9.5893 118.1676 53.3118 32.9146 173.3147 43 P 5.0488 0.0000 0.0000 62.0835 31.2702 174.6056 44 P 4.5232 0.0000 0.0000 62.5867 32.2808 177.3534 45 S 4.1532 8.7478 114.9332 61.7272 62.5873 175.0831 46 E 3.8445 8.6930 117.9722 59.8979 29.7591 178.2997 47 A 3.8162 7.8063 116.8298 53.9509 16.6322 178.0234 48 N 4.3050 7.8976 121.0801 56.1550 40.3530 176.0292 49 G 4.1009 7.5408 108.2393 44.9278 0.0000 173.0455 50 K 4.6929 8.6244 126.4503 54.6870 35.1000 174.9094 51 I 4.6681 8.0183 118.0269 59.9430 40.4667 175.4462 52 T 4.5026 8.0583 110.8312 62.6693 71.2520 173.1922 53 G 4.2234 7.4362 107.2090 46.1956 0.0000 171.6955 54 Y 5.0742 8.2214 116.0219 56.5210 43.2074 174.7945 55 I 4.9397 8.1202 119.2116 59.7237 41.5478 174.6000 56 I 4.8889 8.1567 126.4278 59.6345 40.5695 174.0653 57 Y 5.8364 9.4786 123.2710 55.7384 40.9052 174.3829 58 Y 5.7139 8.3300 119.9122 56.0600 40.4433 173.5561 59 S 4.3692 8.1543 114.0856 57.3275 65.1465 175.5038 60 T 3.0918 8.5426 116.9323 64.1059 68.2978 173.6640 61 D 4.7408 7.0872 120.1052 52.6314 42.5055 175.6902 62 V 4.1526 7.8054 120.5420 62.9599 33.0172 177.1655 63 N 4.3106 7.8995 114.8712 53.7455 38.6841 175.3668 64 A 4.2147 7.2960 121.4205 51.9298 19.2918 177.0950 65 E 4.1489 8.7411 119.8339 55.8936 30.4159 178.4231 66 I 3.4076 8.0967 123.2232 64.5014 38.5969 176.9908 67 H 4.3193 8.2245 116.5664 59.1611 28.6317 176.3170 68 D 4.5134 8.6937 117.8090 56.8995 40.8288 177.5390 69 W 4.2587 7.8959 118.9027 57.0849 29.7555 177.1009 70 V 3.8637 8.0744 123.6233 61.6778 32.6225 175.2049 71 I 4.1239 8.2481 123.2114 60.1209 38.6627 175.6945 72 E 4.6645 8.7646 129.5511 53.6999 29.2565 172.4105 73 P 4.7163 0.0000 0.0000 62.5489 32.3618 176.1135 74 V 4.3767 9.0506 124.4756 61.4959 33.1828 175.5902 75 V 4.4919 8.4637 120.2205 60.6552 33.5743 175.5800 76 G 3.6569 8.6083 107.0482 47.6835 0.0000 173.4207 77 N 4.3832 8.4726 112.8125 53.2578 36.4983 174.2573 78 R 4.0245 7.6231 116.4140 57.6948 31.1068 175.5410 79 L 2.9618 7.7858 121.4539 54.0848 42.8722 175.5463 80 T 4.4318 6.6419 112.5039 60.4334 70.8008 172.2514 81 H 5.1073 9.1774 125.1729 54.7632 34.0284 171.7693 82 Q 5.0418 8.3436 122.0320 54.0679 31.7594 174.9289 83 I 4.4570 8.5065 124.1518 59.6142 40.1674 175.0159 84 Q 4.6888 8.5492 124.8846 53.8927 31.5301 174.5394 85 E 3.6373 8.3281 115.0324 57.7904 26.3915 173.7085 86 L 4.5201 7.3398 117.8795 53.3361 44.5482 176.4260 87 T 4.4348 7.6403 115.4972 62.6389 69.7531 174.8842 88 L 4.4231 8.1590 124.1706 53.4697 43.8452 175.4725 89 D 4.3711 7.8865 116.7684 55.1232 40.3086 173.9473 90 T 4.7994 8.0256 114.5663 61.1609 73.6144 172.7191 91 P 4.3830 0.0000 0.0000 63.2912 32.0901 175.0016 92 Y 4.1226 8.2245 122.6675 56.0255 40.7086 174.4952 93 Y 5.1535 7.5770 119.9354 56.6027 40.0916 174.8491 94 F 5.8544 9.1246 122.7746 55.9471 42.7630 174.7671 95 K 5.1637 9.5885 119.8470 54.9831 36.9077 175.3907 96 I 4.9110 8.2833 123.0201 59.5388 40.7352 174.5779 97 Q 4.8199 8.6000 122.2661 54.5952 33.3257 173.2662 98 A 4.4562 8.4496 119.8842 50.0042 21.9023 175.0219 99 R 4.9482 8.1866 122.7890 54.6187 33.7233 174.0190 100 N 5.0443 8.9010 122.0342 50.7877 40.2277 173.8458 101 S 4.1130 8.9240 112.3284 61.7815 61.7603 175.4195 102 K 4.1506 7.6028 118.8226 57.0299 33.2357 179.8196 103 G 3.8860 8.4485 110.0198 46.2294 0.0000 171.4077 104 M 4.8618 8.7135 122.6293 54.0046 35.0705 174.9557 105 G 5.0660 7.9413 105.5743 43.4216 0.0000 170.8938 106 P 4.5439 0.0000 0.0000 63.1190 32.0964 176.3030 107 M 4.5006 8.3298 121.8608 54.6890 33.1929 176.2124 108 S 4.6044 7.9978 116.2315 57.3450 64.5761 173.5658 109 E 4.1241 8.7265 118.0474 56.3154 29.9765 176.6251 110 A 4.0930 8.5893 123.5127 52.6596 19.2962 177.5375 111 V 4.0427 8.9103 124.3231 62.4856 32.3954 175.1370 112 Q 4.3688 8.8673 130.8250 55.5564 29.7106 174.9300 113 F 4.7352 8.8911 129.3832 56.0644 42.2794 173.9281 114 R 4.2497 8.2164 128.0624 56.0216 30.2263 176.2574 115 T 4.2951 8.0384 117.1054 61.5950 69.1109 173.9883 116 P 4.5953 0.0000 0.0000 62.5529 32.8203 174.9914 117 K 4.6742 8.1491 115.2291 54.8426 35.9849 175.8259 118 A 3.9658 8.6073 125.2605 52.4178 18.2496 177.5677 119 S 4.4300 8.7750 118.9069 58.7429 62.0495 173.9235 120 G 4.0282 8.4731 113.7567 44.7550 0.0000 170.7954 121 P 4.0559 0.0000 0.0000 64.0967 31.7859 176.4015 122 S 4.4981 7.1357 114.2492 57.3586 63.2523 173.1432 123 S 4.4288 7.7845 116.5739 56.6368 64.9940 176.0689 124 G 3.4632 9.0773 115.5434 45.5545 0.0000 172.4004 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 G 8.35 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 0.00 0.00 0.00 2 S 7.59 4.39 0.00 3.89 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 3 S 9.04 4.75 0.00 3.87 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 0.00 4 G 7.99 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.21 4.55 0.00 3.85 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 6 S 7.98 4.75 0.00 3.83 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 7 G 7.60 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 0.00 0.00 0.00 8 T 7.71 4.22 4.22 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 1.15 0.00 0.00 9 A 7.96 4.37 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 10 H 8.00 4.49 0.00 3.11 3.29 0.00 5.73 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 11 G 7.75 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.96 4.28 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 1.16 0.00 0.00 13 T 7.72 4.15 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 1.08 0.00 0.00 14 F 6.99 4.88 0.00 3.06 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 15 E 8.79 4.82 0.00 1.99 1.91 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 2.22 2.31 0.00 16 L 8.22 4.66 0.00 1.63 1.59 0.88 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.50 3.64 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 0.69 0.00 0.00 0.92 0.00 0.00 18 P 0.00 4.44 0.00 2.21 2.23 0.00 3.66 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.91 0.00 19 T 8.12 4.18 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 1.21 0.00 0.00 20 S 7.70 4.73 0.00 3.97 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 21 P 0.00 4.45 0.00 2.22 2.10 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 22 P 0.00 4.60 0.00 2.32 2.22 0.00 3.72 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 1.98 0.00 23 K 8.70 4.64 0.00 1.84 1.78 0.00 1.86 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.43 7.81 24 D 8.47 4.37 0.00 2.98 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 25 V 7.87 4.30 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 0.90 0.00 0.00 1.03 0.00 0.00 26 T 8.89 4.79 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 1.24 0.00 0.00 27 V 8.42 4.42 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.43 0.00 0.00 0.85 0.00 0.00 28 V 8.25 4.44 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 0.75 0.00 0.00 0.87 0.00 0.00 29 S 8.29 4.97 0.00 3.82 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 30 K 8.37 3.89 0.00 1.74 2.01 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.41 7.81 31 E 8.60 4.14 0.00 1.95 1.86 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 2.26 2.29 0.00 32 G 8.91 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.76 4.36 0.00 1.79 1.67 0.00 1.59 0.00 0.00 1.85 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.52 7.81 34 P 0.00 4.29 0.00 2.21 2.16 0.00 3.80 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 35 K 8.05 4.11 0.00 1.80 1.91 0.00 1.59 0.00 0.00 1.80 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.71 1.43 7.81 36 T 7.71 5.54 4.29 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 1.13 0.00 0.00 37 I 7.92 4.80 1.62 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.44 0.82 0.00 0.00 38 I 8.14 4.80 1.75 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.78 0.85 0.00 0.00 39 V 8.86 4.70 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.52 0.00 0.00 40 N 8.70 5.29 0.00 2.62 2.50 0.00 0.00 6.06 6.98 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 41 W 7.43 5.76 0.00 3.22 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 42 Q 9.59 4.78 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.88 0.00 0.00 0.00 0.00 0.00 2.24 2.43 0.00 43 P 0.00 5.05 0.00 2.20 2.31 0.00 3.82 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.07 0.00 44 P 0.00 4.52 0.00 2.29 2.49 0.00 3.84 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.01 0.00 45 S 8.75 4.15 0.00 3.88 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 46 E 8.69 3.84 0.00 2.02 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 0.00 2.34 2.36 0.00 47 A 7.81 3.82 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 48 N 7.90 4.30 0.00 2.94 2.95 0.00 0.00 7.31 7.67 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 49 G 7.54 4.10 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 0.00 50 K 8.62 4.69 0.00 1.85 1.83 0.00 1.52 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.41 7.81 51 I 8.02 4.67 1.92 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 1.50 1.04 0.69 0.00 0.00 52 T 8.06 4.50 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 1.23 0.00 0.00 53 G 7.44 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 8.22 5.07 0.00 3.08 2.69 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 55 I 8.12 4.94 1.99 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 1.14 1.04 0.28 0.00 0.00 56 I 8.16 4.89 1.86 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 0.81 0.43 1.16 0.00 0.00 57 Y 9.48 5.84 0.00 3.04 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 58 Y 8.33 5.71 0.00 3.15 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 59 S 8.15 4.37 0.00 3.13 2.63 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 0.00 0.00 0.00 0.00 60 T 8.54 3.09 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 1.01 0.00 0.00 61 D 7.09 4.74 0.00 2.43 2.39 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 62 V 7.81 4.15 0.67 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 0.58 0.00 0.00 0.52 0.00 0.00 63 N 7.90 4.31 0.00 2.66 2.88 0.00 0.00 6.96 8.45 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 64 A 7.30 4.21 1.15 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 65 E 8.74 4.15 0.00 1.96 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 2.31 2.25 0.00 66 I 8.10 3.41 1.53 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.02 0.85 0.00 0.00 67 H 8.22 4.32 0.00 3.21 3.37 0.00 5.78 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 68 D 8.69 4.51 0.00 2.76 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 69 W 7.90 4.26 0.00 3.34 3.35 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 70 V 8.07 3.86 1.66 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 -0.57 0.00 0.00 0.86 0.00 0.00 71 I 8.25 4.12 1.86 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.77 0.80 0.00 0.00 72 E 8.76 4.66 0.00 2.10 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 2.55 2.69 0.00 73 P 0.00 4.72 0.00 2.08 2.04 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 74 V 9.05 4.38 2.44 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 1.17 0.00 0.00 1.05 0.00 0.00 75 V 8.46 4.49 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 0.90 0.00 0.00 0.98 0.00 0.00 76 G 8.61 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 N 8.47 4.38 0.00 3.10 3.21 0.00 0.00 6.27 7.70 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 78 R 7.62 4.02 0.00 2.05 1.90 0.00 3.22 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.46 0.00 79 L 7.79 2.96 0.00 0.96 0.78 0.74 0.07 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 80 T 6.64 4.43 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 0.97 0.00 0.00 81 H 9.18 5.11 0.00 3.63 3.26 0.00 5.77 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 82 Q 8.34 5.04 0.00 1.80 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.38 0.00 0.00 0.00 0.00 0.00 2.16 2.31 0.00 83 I 8.51 4.46 1.64 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 1.27 0.59 0.60 0.00 0.00 84 Q 8.55 4.69 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.86 0.00 0.00 0.00 0.00 0.00 2.17 2.31 0.00 85 E 8.33 3.64 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 86 L 7.34 4.52 0.00 1.50 1.18 0.77 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.64 4.43 4.47 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 1.29 0.00 0.00 88 L 8.16 4.42 0.00 1.63 1.60 0.92 1.12 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 89 D 7.89 4.37 0.00 2.54 2.66 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 0.00 0.00 0.00 0.00 90 T 8.03 4.80 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 91 P 0.00 4.38 0.00 1.74 1.98 0.00 3.70 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 1.89 1.96 0.00 92 Y 8.22 4.12 0.00 2.98 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 0.00 0.00 0.00 93 Y 7.58 5.15 0.00 3.10 3.10 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 94 F 9.12 5.85 0.00 3.14 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 95 K 9.59 5.16 0.00 1.86 1.68 0.00 1.27 0.00 0.00 1.31 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.54 7.81 96 I 8.28 4.91 1.72 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 0.98 0.99 -0.21 0.00 0.00 97 Q 8.60 4.82 0.00 2.13 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.30 0.00 98 A 8.45 4.46 1.23 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 0.00 0.00 99 R 8.19 4.95 0.00 1.75 1.63 0.00 3.01 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.57 0.00 100 N 8.90 5.04 0.00 2.61 2.87 0.00 0.00 6.96 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 S 8.92 4.11 0.00 3.84 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 0.00 102 K 7.60 4.15 0.00 2.00 1.74 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.34 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.40 7.81 103 G 8.45 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 0.00 0.00 0.00 0.00 104 M 8.71 4.86 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 105 G 7.94 5.07 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 0.00 106 P 0.00 4.54 0.00 2.05 2.02 0.00 3.97 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 1.97 2.06 0.00 107 M 8.33 4.50 0.00 1.73 1.77 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 108 S 8.00 4.60 0.00 3.99 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 0.00 109 E 8.73 4.12 0.00 2.02 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 2.35 2.33 0.00 110 A 8.59 4.09 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.91 4.04 2.49 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 1.21 0.00 0.00 1.15 0.00 0.00 112 Q 8.87 4.37 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.67 0.00 0.00 0.00 0.00 0.00 2.33 2.17 0.00 113 F 8.89 4.74 0.00 3.33 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 0.00 114 R 8.22 4.25 0.00 1.71 1.60 0.00 3.26 0.00 0.00 3.21 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 115 T 8.04 4.30 4.27 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 1.34 0.00 0.00 116 P 0.00 4.60 0.00 2.26 2.32 0.00 3.76 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.07 0.00 117 K 8.15 4.67 0.00 1.69 1.68 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.32 1.35 7.81 118 A 8.61 3.97 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 S 8.77 4.43 0.00 3.81 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 0.00 120 G 8.47 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 0.00 121 P 0.00 4.06 0.00 2.19 2.19 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 122 S 7.14 4.50 0.00 3.75 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 0.00 123 S 7.78 4.43 0.00 3.79 3.65 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 0.00 124 G 9.08 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