NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8109 8.3393 109.7272 45.3078 0.0000 172.7518 2 I 3.8937 7.9289 113.9443 59.6276 38.6516 173.0107 3 S 4.6044 8.5886 116.4414 56.3952 67.6255 174.9492 4 Y 4.2889 8.5379 120.0985 58.4725 37.8635 176.6194 5 S 4.5237 9.0605 118.7607 58.5260 63.8411 174.1919 6 V 4.4492 7.3079 119.9647 60.9144 34.3304 174.5532 7 E 4.1634 8.6271 124.8777 56.0125 30.1271 176.2591 8 A 4.4817 8.1158 124.6445 50.1050 21.7402 175.1169 9 D 4.4865 8.6427 123.4308 52.9695 41.4258 175.0219 10 P 4.3259 0.0000 0.0000 65.8218 31.2609 177.3574 11 D 4.6398 8.5525 118.5398 56.6251 41.1986 176.7941 12 T 5.2582 7.9625 108.2023 60.2586 70.3179 173.5974 13 T 5.0088 8.0743 116.1730 62.4362 72.6564 173.0690 14 A 4.6612 8.7832 126.1565 50.0559 22.2345 175.3661 15 K 5.3122 8.4083 119.4510 54.0338 35.8273 175.1266 16 A 4.6048 8.2244 119.9633 52.1190 22.9209 175.4283 17 M 5.7476 8.5304 117.9066 53.9552 36.4333 174.2622 18 L 4.8180 8.3858 120.2906 53.0459 45.3092 175.5223 19 R 4.7135 8.2106 120.1751 54.9836 33.1100 175.4838 20 E 3.7501 10.1619 125.1301 57.2560 27.6961 175.5561 21 R 4.0587 8.7177 118.0337 56.5077 31.6982 177.4464 22 Q 5.3886 8.9212 123.1477 54.4579 28.2426 174.3192 23 M 4.7630 7.9545 120.1049 53.6599 34.9923 174.3601 24 S 4.1268 8.5895 113.7503 58.1200 62.9746 174.4631 25 F 4.4387 8.9079 130.1012 61.2465 38.8663 177.2054 26 K 3.5881 7.7962 117.8552 59.6329 31.9128 178.9138 27 H 3.9871 8.3525 116.7629 58.5829 28.5056 178.2181 28 S 4.0789 7.7385 117.0919 61.3853 62.7441 176.3340 29 K 3.6097 7.6543 121.0059 59.6016 31.7516 178.8120 30 A 3.8102 7.2830 120.0535 55.2982 18.1486 179.8163 31 I 3.4629 7.5670 117.7342 64.2685 37.0336 178.2675 32 A 3.9795 7.9980 121.9652 55.3141 17.9986 179.2628 33 R 3.7256 8.0961 115.8274 59.8808 30.1202 177.9098 34 E 3.9412 7.9716 117.6293 58.7438 30.0887 177.9053 35 I 3.9283 7.8582 111.3420 60.1595 38.2813 175.6073 36 K 4.1225 7.1188 122.8643 57.9164 32.5020 176.6884 37 G 3.9970 8.7378 114.5400 45.4222 0.0000 174.0360 38 K 4.3605 7.5494 118.7543 56.1587 33.0552 176.0827 39 T 4.6551 9.3441 117.6325 62.6507 70.5113 175.8986 40 A 4.1029 8.9978 128.0260 55.7044 18.4562 180.6648 41 G 3.5616 8.2323 103.7572 48.0059 0.0000 175.8130 42 E 4.0253 8.1251 120.4905 59.0588 29.5628 179.0977 43 A 4.0822 8.7034 121.1808 55.0668 18.4401 179.8995 44 V 3.5774 7.8548 116.6210 66.3761 31.7031 177.8162 45 D 4.4204 8.0295 118.4644 57.5973 40.5463 178.3219 46 Y 4.0300 8.2274 119.7228 60.9347 38.8080 178.3392 47 L 3.8407 8.1691 119.6715 57.6889 41.6238 179.4402 48 E 3.9581 8.3947 118.5766 59.1484 29.2830 179.1284 49 A 3.9509 7.8783 121.0641 54.7378 18.1362 179.8913 50 V 4.1841 7.2409 117.5771 65.9766 31.7442 177.9433 51 I 3.8084 7.7100 118.3816 64.5139 36.9729 177.7767 52 E 4.0726 8.0239 119.5059 57.4077 29.4534 177.6369 53 G 3.4885 8.1018 106.2030 45.2776 0.0000 173.5656 54 D 4.6450 7.7496 118.1498 54.0789 42.0674 176.2464 55 Q 4.5474 7.7839 120.6320 53.4426 31.7043 171.7607 56 P 4.5227 0.0000 0.0000 61.5964 33.6155 175.1974 57 V 4.4337 8.5586 123.1200 60.2245 32.8391 173.4390 58 P 4.7175 0.0000 0.0000 63.3355 31.7875 176.8598 59 F 4.7750 9.0489 124.7926 56.3472 37.5521 175.7343 60 K 3.3987 8.2684 122.8689 57.5726 32.7483 177.8533 61 Q 4.2166 7.8938 117.5715 57.7681 30.5063 176.0237 62 H 4.7087 7.5583 115.5033 54.4534 27.3803 174.4711 63 N 5.1311 7.8075 114.9855 52.0924 38.2991 175.2975 64 S 4.3292 8.1455 114.3121 60.2071 63.0587 174.7290 65 G 3.9230 8.9656 112.9443 45.3124 0.0000 173.3395 66 V 3.8331 7.6793 120.1116 62.2315 32.5499 175.8707 67 G 3.8773 8.3826 113.7940 46.1525 0.0000 172.8154 68 H 4.9906 8.6665 119.6295 55.6417 30.1633 174.9803 69 K 4.6203 8.9019 119.9743 54.5426 35.0332 177.7252 70 S 4.1146 9.1132 120.1188 61.4380 62.9283 175.7849 71 K 4.1401 7.9088 117.9615 57.5956 32.1206 177.0591 72 V 3.8478 7.5304 120.0337 62.2542 32.2609 174.3850 73 D 4.8181 8.7454 126.3202 53.5934 42.8475 176.8913 74 G 3.9956 10.1128 113.8669 45.5093 0.0000 171.9591 75 W 5.1272 7.5227 127.2231 56.6271 34.2992 172.5049 76 D 4.4080 6.7669 114.8863 54.5215 40.6152 175.6470 77 A 4.6322 7.2015 122.8504 51.1221 19.8085 176.0181 78 G 3.9778 7.8956 105.8606 46.2448 0.0000 172.4927 79 R 3.8549 7.0550 117.4703 54.8099 34.6686 174.1130 80 Y 4.8643 7.7270 112.9546 56.2376 37.9989 175.3464 81 P 4.6178 0.0000 0.0000 62.5645 29.9503 177.3348 82 E 3.9159 8.5996 121.3643 59.5463 29.9042 178.3599 83 K 3.7697 8.3221 120.4195 59.2583 32.0798 177.7265 84 A 4.1660 8.1840 119.7806 55.8304 18.4621 179.6398 85 S 4.1918 8.1345 113.2484 61.7288 62.9081 177.1799 86 K 4.0845 8.5766 121.5206 59.3797 31.8490 179.3445 87 A 4.1035 8.4626 121.2039 55.0335 18.2261 179.6885 88 F 3.8364 8.5863 116.5401 60.3761 38.9533 177.9140 89 L 4.2463 7.9815 118.4991 57.5098 41.3703 179.2824 90 D 4.3296 7.9158 118.7234 57.2302 40.8330 178.3472 91 L 3.9172 7.8089 120.8102 58.2922 41.9616 179.0932 92 L 4.0636 8.4579 119.2770 57.5145 41.5266 179.0275 93 E 3.9563 8.3175 119.6393 59.0218 29.4740 178.4823 94 N 4.2229 8.3158 116.9085 56.6280 39.0783 176.6398 95 A 3.9843 8.0603 122.2104 55.4278 18.5073 179.8678 96 V 3.6551 8.3021 117.0948 65.8636 31.5125 178.5635 97 G 3.6132 8.0688 105.8571 47.7999 0.0000 175.5834 98 N 4.4332 8.6871 119.2229 55.8684 38.5423 177.3595 99 A 4.0265 8.2895 122.4411 55.3946 18.4157 179.4947 100 D 4.6711 8.1476 118.7227 57.2020 40.7796 177.9942 101 H 4.4276 8.2200 116.0346 57.6061 29.9188 175.8683 102 Q 4.5507 7.7342 117.2183 56.0491 29.6496 176.1405 103 G 3.7703 8.2828 109.2849 45.0024 0.0000 173.8741 104 F 4.4558 8.0206 119.0685 56.7808 40.0446 174.6774 105 D 4.8842 8.5047 121.8594 52.1645 39.2962 176.4752 106 G 3.9292 8.3973 111.3118 48.8163 0.0000 173.0377 107 E 3.8757 8.4458 118.2635 58.7961 29.7815 179.3770 108 A 4.2405 7.5940 118.7404 53.8391 18.9301 177.5468 109 M 4.4269 8.1715 117.1002 55.4772 33.3803 175.9161 110 T 4.6286 8.5833 118.9402 63.0752 70.7380 174.7597 111 I 4.1504 8.8026 127.2968 60.6964 36.2046 176.5210 112 K 4.0207 8.9003 128.9201 59.1093 32.9261 176.4762 113 H 5.1519 8.0620 118.6269 54.5538 33.6549 172.5215 114 V 5.3141 8.2946 123.4818 60.8481 34.1062 173.3313 115 A 4.7356 8.6021 124.9349 50.6456 22.5677 174.3449 116 A 5.3397 8.6181 122.0633 50.6582 21.8894 175.9285 117 H 4.9067 9.0208 117.0836 53.8223 33.1607 172.8196 118 K 4.1051 7.8149 124.4127 55.5900 31.6473 176.3722 119 V 3.8174 8.5781 128.2805 62.9571 32.4203 175.7195 120 G 4.0114 6.7552 105.4261 46.9110 0.0000 170.6407 121 E 5.1873 8.1270 118.0573 54.4243 33.5576 175.7247 122 Q 4.2352 9.1847 126.2299 55.4911 29.8432 175.1360 123 Q 4.7477 8.7373 126.3057 56.1088 29.9227 175.7528 124 G 4.7519 10.0988 109.0399 43.9604 0.0000 171.1287 125 R 5.1872 8.5492 119.3726 54.1748 33.4624 173.9944 126 K 4.2732 9.0433 127.5073 53.6876 34.3755 173.5474 127 P 4.6982 0.0000 0.0000 62.9095 32.1201 175.5675 128 R 4.7833 9.0366 121.3647 53.9578 34.0274 174.9155 129 A 4.1205 8.3412 122.0630 53.7309 18.9752 177.6490 130 M 3.6087 8.9145 117.0761 56.0894 28.8993 177.6306 131 G 3.8508 8.3214 104.4334 46.3231 0.0000 173.6423 132 R 4.8282 7.4198 118.4081 54.0632 33.5289 174.1512 133 A 5.3604 8.4323 123.0257 50.2870 22.6550 175.0362 134 S 4.8309 8.8271 112.8732 56.1332 67.2266 173.2950 135 A 4.5960 8.6297 121.9023 52.6127 19.3460 177.9863 136 W 4.8187 8.6059 125.2559 56.9816 32.7940 173.0070 137 N 5.4570 8.1773 120.7351 51.3656 41.4873 174.1786 138 S 4.7285 8.4064 115.9998 56.1337 65.7948 172.8325 139 P 4.8088 0.0000 0.0000 62.6229 33.1413 175.2450 140 Q 4.9102 8.7052 119.7698 54.3438 32.0741 174.7910 141 V 4.8995 9.7870 124.6921 61.1502 34.9548 174.0082 142 D 5.4547 8.4544 125.0525 52.8156 45.0900 175.3519 143 V 4.9028 7.9539 117.0774 60.9936 35.1435 171.9086 144 E 5.1064 8.7680 122.7717 54.7890 32.7682 174.6000 145 L 5.1907 8.7984 122.4790 53.8309 46.3718 174.7003 146 I 4.8368 9.1605 126.6690 59.6016 40.2881 174.5228 147 L 4.9182 9.4623 129.1089 53.8639 43.4302 175.8046 148 E 5.0018 9.0249 123.0025 54.0997 33.7598 174.5192 149 E 4.3559 8.6380 125.4291 55.4835 30.9085 175.6334 150 P 4.3949 0.0000 0.0000 63.1683 31.4146 176.1896 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 8.34 3.81 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 0.00 0.00 0.00 2 I 7.93 3.89 1.65 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.54 0.73 0.00 0.00 3 S 8.59 4.60 0.00 3.79 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 4 Y 8.54 4.29 0.00 2.96 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 5 S 9.06 4.52 0.00 4.00 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 6 V 7.31 4.45 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.61 0.00 0.00 7 E 8.63 4.16 0.00 1.98 1.84 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 2.31 2.29 0.00 8 A 8.12 4.48 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 9 D 8.64 4.49 0.00 2.68 2.57 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 10 P 0.00 4.33 0.00 2.23 2.18 0.00 3.81 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 2.00 2.00 0.00 11 D 8.55 4.64 0.00 2.91 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 12 T 7.96 5.26 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 1.35 0.00 0.00 13 T 8.07 5.01 4.51 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 1.09 0.00 0.00 14 A 8.78 4.66 0.96 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 15 K 8.41 5.31 0.00 1.48 1.60 0.00 1.38 0.00 0.00 0.67 0.00 0.00 2.23 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.83 0.96 7.81 16 A 8.22 4.60 1.20 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 0.00 0.00 0.00 17 M 8.53 5.75 0.00 1.73 1.86 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 18 L 8.39 4.82 0.00 1.44 1.44 0.66 0.74 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 19 R 8.21 4.71 0.00 1.60 1.76 0.00 3.46 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 20 E 10.16 3.75 0.00 1.87 1.95 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 2.22 2.22 0.00 21 R 8.72 4.06 0.00 1.65 1.86 0.00 3.27 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 22 Q 8.92 5.39 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.18 0.00 23 M 7.95 4.76 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.75 0.00 24 S 8.59 4.13 0.00 3.65 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.91 4.44 0.00 3.03 2.99 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 26 K 7.80 3.59 0.00 1.58 1.51 0.00 1.54 0.00 0.00 1.47 0.00 0.00 2.66 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.87 1.31 7.81 27 H 8.35 3.99 0.00 3.29 3.30 0.00 5.63 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 28 S 7.74 4.08 0.00 4.07 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 0.00 29 K 7.65 3.61 0.00 1.50 1.63 0.00 1.40 0.00 0.00 1.35 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.81 0.91 7.81 30 A 7.28 3.81 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 0.00 0.00 0.00 0.00 0.00 31 I 7.57 3.46 1.18 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.67 -0.01 0.00 0.00 32 A 8.00 3.98 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 0.00 0.00 33 R 8.10 3.73 0.00 1.74 2.09 0.00 3.09 0.00 0.00 2.96 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 34 E 7.97 3.94 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.80 0.00 35 I 7.86 3.93 1.86 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.48 0.88 0.00 0.00 36 K 7.12 4.12 0.00 1.68 1.71 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.43 1.38 7.81 37 G 8.74 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 0.00 0.00 0.00 38 K 7.55 4.36 0.00 2.08 1.72 0.00 1.44 0.00 0.00 1.54 0.00 0.00 2.75 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.37 1.30 7.81 39 T 9.34 4.66 4.46 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 1.36 0.00 0.00 40 A 9.00 4.10 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 41 G 8.23 3.56 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 0.00 0.00 0.00 0.00 42 E 8.13 4.03 0.00 2.15 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 2.42 2.39 0.00 43 A 8.70 4.08 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.85 3.58 2.27 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 1.06 0.00 0.00 1.02 0.00 0.00 45 D 8.03 4.42 0.00 2.97 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 46 Y 8.23 4.03 0.00 3.16 3.18 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 47 L 8.17 3.84 0.00 1.81 1.75 1.08 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.39 3.96 0.00 2.15 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 0.00 2.34 2.59 0.00 49 A 7.88 3.95 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 50 V 7.24 4.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.29 0.00 0.00 51 I 7.71 3.81 2.01 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.80 0.91 0.00 0.00 52 E 8.02 4.07 0.00 2.05 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 0.00 2.31 2.52 0.00 53 G 8.10 3.49 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 54 D 7.75 4.64 0.00 2.65 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 55 Q 7.78 4.55 0.00 2.01 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.94 0.00 0.00 0.00 0.00 0.00 2.30 2.45 0.00 56 P 0.00 4.52 0.00 1.81 1.66 0.00 3.87 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 1.93 1.93 0.00 57 V 8.56 4.43 2.29 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 1.45 0.00 0.00 1.00 0.00 0.00 58 P 0.00 4.72 0.00 1.94 2.05 0.00 3.76 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 59 F 9.05 4.78 0.00 2.91 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 60 K 8.27 3.40 0.00 1.29 0.93 0.00 1.35 0.00 0.00 1.20 0.00 0.00 2.13 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.30 0.96 7.81 61 Q 7.89 4.22 0.00 1.75 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.42 0.00 0.00 0.00 0.00 0.00 1.76 2.16 0.00 62 H 7.56 4.71 0.00 2.97 3.16 0.00 5.70 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 7.81 5.13 0.00 3.04 3.53 0.00 0.00 5.85 7.64 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 64 S 8.15 4.33 0.00 4.04 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 65 G 8.97 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 66 V 7.68 3.83 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.10 0.00 0.00 67 G 8.38 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 0.00 0.00 0.00 68 H 8.67 4.99 0.00 2.99 3.13 0.00 5.67 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 69 K 8.90 4.62 0.00 1.54 1.61 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.68 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.25 1.29 7.81 70 S 9.11 4.11 0.00 3.98 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 71 K 7.91 4.14 0.00 1.81 1.95 0.00 1.85 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.46 7.81 72 V 7.53 3.85 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 0.92 0.00 0.00 0.95 0.00 0.00 73 D 8.75 4.82 0.00 2.79 2.51 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 74 G 10.11 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 0.00 0.00 0.00 75 W 7.52 5.13 0.00 3.39 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 76 D 6.77 4.41 0.00 2.06 2.29 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 77 A 7.20 4.63 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 78 G 7.90 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 79 R 7.05 3.85 0.00 0.67 1.40 0.00 2.96 0.00 0.00 3.11 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.04 0.00 80 Y 7.73 4.86 0.00 2.84 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 81 P 0.00 4.62 0.00 2.20 1.96 0.00 3.63 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 82 E 8.60 3.92 0.00 2.21 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 0.00 2.40 2.41 0.00 83 K 8.32 3.77 0.00 1.90 1.91 0.00 1.79 0.00 0.00 1.87 0.00 0.00 3.10 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.58 1.58 7.81 84 A 8.18 4.17 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 0.00 0.00 85 S 8.13 4.19 0.00 4.09 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 86 K 8.58 4.08 0.00 2.01 1.90 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.70 7.81 87 A 8.46 4.10 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 88 F 8.59 3.84 0.00 3.37 3.20 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 0.00 89 L 7.98 4.25 0.00 1.99 1.76 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 90 D 7.92 4.33 0.00 3.00 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 91 L 7.81 3.92 0.00 1.56 1.72 0.88 0.17 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 92 L 8.46 4.06 0.00 1.75 1.74 1.08 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.32 3.96 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 94 N 8.32 4.22 0.00 2.97 2.96 0.00 0.00 7.06 7.82 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 95 A 8.06 3.98 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 96 V 8.30 3.66 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.97 0.00 0.00 97 G 8.07 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 98 N 8.69 4.43 0.00 2.91 2.92 0.00 0.00 6.91 7.08 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 99 A 8.29 4.03 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 0.00 100 D 8.15 4.67 0.00 2.93 2.78 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 0.00 101 H 8.22 4.43 0.00 3.25 3.53 0.00 5.90 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.73 4.55 0.00 2.59 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.21 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 103 G 8.28 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 0.00 0.00 0.00 104 F 8.02 4.46 0.00 3.26 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 0.00 105 D 8.50 4.88 0.00 2.80 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 0.00 106 G 8.40 3.93 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 0.00 0.00 0.00 107 E 8.45 3.88 0.00 2.06 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 2.44 2.37 0.00 108 A 7.59 4.24 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 0.00 109 M 8.17 4.43 0.00 1.89 2.13 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 110 T 8.58 4.63 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 0.00 111 I 8.80 4.15 1.87 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 1.13 1.02 0.93 0.00 0.00 112 K 8.90 4.02 0.00 1.77 1.99 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.39 7.81 113 H 8.06 5.15 0.00 3.19 3.10 0.00 5.73 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.29 5.31 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 1.00 0.00 0.00 1.15 0.00 0.00 115 A 8.60 4.74 1.22 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 0.00 116 A 8.62 5.34 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 0.00 117 H 9.02 4.91 0.00 3.08 3.13 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.81 4.11 0.00 0.79 0.99 0.00 1.43 0.00 0.00 1.37 0.00 0.00 2.61 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.09 1.05 7.81 119 V 8.58 3.82 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 0.72 0.00 0.00 0.92 0.00 0.00 120 G 6.76 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 0.00 121 E 8.13 5.19 0.00 1.77 1.78 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 2.14 2.22 0.00 122 Q 9.18 4.24 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.99 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 123 Q 8.74 4.75 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 124 G 10.10 4.75 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 0.00 0.00 0.00 125 R 8.55 5.19 0.00 1.78 1.76 0.00 3.29 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 126 K 9.04 4.27 0.00 1.13 1.57 0.00 1.08 0.00 0.00 1.05 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.57 1.09 7.81 127 P 0.00 4.70 0.00 1.88 1.90 0.00 3.47 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 1.94 2.05 0.00 128 R 9.04 4.78 0.00 1.75 1.81 0.00 3.33 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 129 A 8.34 4.12 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 0.00 130 M 8.91 3.61 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 131 G 8.32 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 0.00 132 R 7.42 4.83 0.00 1.75 1.90 0.00 3.05 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 133 A 8.43 5.36 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 0.00 134 S 8.83 4.83 0.00 3.94 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 0.00 135 A 8.63 4.60 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 136 W 8.61 4.82 0.00 3.46 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 0.00 137 N 8.18 5.46 0.00 2.60 2.81 0.00 0.00 7.03 7.57 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 0.00 138 S 8.41 4.73 0.00 3.74 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 P 0.00 4.81 0.00 2.27 1.94 0.00 3.51 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 2.09 2.07 0.00 140 Q 8.71 4.91 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.73 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 141 V 9.79 4.90 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 1.17 0.00 0.00 1.05 0.00 0.00 142 D 8.45 5.45 0.00 2.64 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 V 7.95 4.90 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 0.39 0.00 0.00 0.79 0.00 0.00 144 E 8.77 5.11 0.00 2.15 1.78 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 2.20 2.29 0.00 145 L 8.80 5.19 0.00 1.77 1.52 1.05 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 146 I 9.16 4.84 1.93 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.06 0.86 0.00 0.00 147 L 9.46 4.92 0.00 1.41 1.45 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 148 E 9.02 5.00 0.00 1.91 1.68 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 2.16 2.35 0.00 149 E 8.64 4.36 0.00 2.06 1.92 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 2.58 2.42 0.00 150 P 0.00 4.39 0.00 2.05 2.00 0.00 3.74 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 2.05 2.17 0.00