NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 P 4.1223 0.0000 0.0000 63.1560 32.4916 174.7596 9 V 2.9342 8.2202 119.5338 61.8599 29.4202 171.5180 10 T 4.3914 8.5926 119.4643 59.9925 72.7105 174.6482 11 K 3.8416 8.5244 120.6861 59.9536 31.8474 178.2376 12 E 4.0779 8.1193 118.2276 59.4507 29.5232 178.7887 13 D 4.3830 7.8896 118.8658 57.0727 40.7772 178.5912 14 L 3.9644 8.1109 120.9797 58.0529 42.0735 179.0209 15 G 3.8051 8.0793 105.6439 48.2956 0.0000 175.7071 16 R 4.1849 8.3570 120.8130 58.7089 30.0826 179.1435 17 A 4.0326 8.1120 120.5318 55.5339 18.3880 179.8207 18 T 3.8617 8.1953 114.6183 66.5905 68.4365 176.8583 19 W 4.1829 8.1259 121.1104 60.1027 29.0434 178.5347 20 T 3.5705 7.9760 115.3912 66.5495 67.8640 176.3447 21 F 4.2574 8.2408 122.2105 61.2817 39.4065 177.0738 22 L 3.3629 8.2463 118.8951 58.1181 41.4501 179.3960 23 H 3.6536 8.1137 116.3589 58.8424 27.9691 178.1264 24 T 3.9292 7.5117 117.7027 66.3166 68.1271 176.5294 25 L 3.9331 7.7897 122.3549 58.1198 41.9067 178.9191 26 A 4.2225 7.8597 119.2060 54.5695 18.2569 179.0580 27 A 4.1907 7.7554 118.8271 54.5916 18.5909 178.8809 28 Q 4.3484 7.5704 114.3961 55.6941 29.9735 175.6988 29 Y 4.2380 7.4903 122.0071 57.1922 39.1627 174.1500 30 P 4.5953 0.0000 0.0000 62.3529 32.3451 176.9172 31 E 3.9689 8.8695 121.2192 58.9147 29.6598 177.6013 32 K 4.4555 7.4964 119.6334 53.3905 32.1065 173.7883 33 P 4.3358 0.0000 0.0000 62.1555 32.4720 177.7645 34 T 4.2268 9.1184 111.7867 61.0290 71.2384 175.7871 35 R 3.8731 8.3507 120.3279 59.4689 29.9832 178.1490 36 Q 3.9455 7.9275 119.0164 59.1867 29.2875 177.7394 37 Q 4.1086 7.9570 118.9056 58.7714 28.7995 178.9034 38 K 4.5481 7.9536 121.8710 58.9324 32.2196 178.8370 39 K 3.9053 7.8502 119.7198 59.6003 32.1159 178.5492 40 D 4.3094 8.6034 119.5955 57.2359 40.8684 178.7876 41 V 3.4380 7.6139 118.6232 66.0269 31.4465 178.3170 42 K 3.8372 7.7237 117.7342 59.3075 31.8071 179.0530 43 E 3.9449 8.4048 119.8919 58.9700 29.4513 178.5443 44 L 4.0118 8.5204 120.8437 58.5422 42.1384 178.9743 45 M 4.3679 8.0433 118.1493 58.7088 31.6415 178.9030 46 T 3.9407 7.9750 115.8601 66.6878 68.6727 176.6534 47 I 3.8249 8.2013 122.0652 64.5770 37.1536 178.4459 48 L 4.1367 8.3196 120.0940 57.8366 41.1995 179.7416 49 S 4.5652 8.4462 113.2634 60.9151 62.8480 175.8695 50 R 4.4288 7.4602 119.0244 57.8642 31.0979 177.6669 51 M 4.3884 8.4870 116.4289 54.9390 32.6149 175.9118 52 Y 4.0162 7.7518 121.0649 57.6079 39.0526 175.5219 53 P 4.0657 0.0000 0.0000 63.3303 31.3118 176.5354 54 C 4.6239 7.8324 118.9897 54.3425 38.9048 174.4029 55 R 3.6137 7.9819 124.8301 60.0430 29.6860 178.0463 56 E 3.9223 8.0932 116.3507 60.0887 29.8488 179.8426 57 C 4.2549 8.3586 116.8453 59.8375 39.1168 175.9627 58 A 4.0708 8.4707 122.3202 55.1061 17.9431 179.5201 59 D 4.3594 7.9613 117.2470 57.8852 40.8958 178.6334 60 H 4.3201 8.3730 116.7383 58.9566 28.7384 177.6350 61 F 4.2091 8.4462 122.4674 61.0119 39.0927 177.0349 62 K 3.9031 8.1914 119.3274 59.5196 32.0275 178.4855 63 E 3.9384 8.2731 118.6563 59.6499 29.4227 179.2317 64 I 3.6442 8.0622 120.0425 64.5590 36.9605 178.2745 65 L 3.9592 7.9059 120.1810 57.9691 41.9148 178.8512 66 R 4.0663 7.8461 117.6156 59.4737 30.2337 178.9470 67 S 4.4603 7.9102 111.7459 59.6007 64.6503 174.1070 68 N 5.0948 8.0465 119.4140 49.9654 38.7643 171.9884 69 P 4.3099 0.0000 0.0000 62.2686 32.2272 177.1774 70 A 2.0000 7.9189 122.9413 51.9860 18.4996 177.6184 71 Q 4.1078 7.2926 121.6916 54.6722 28.0453 175.3159 72 A 4.3906 7.9212 124.9034 51.4502 19.4517 178.7433 73 G 4.0304 8.4588 109.1568 49.0374 0.0000 174.3168 74 S 4.6875 7.5292 113.9214 56.5798 67.1919 176.3421 75 Q 4.3817 8.2295 121.1693 59.5702 28.6537 178.0107 76 E 4.0166 8.2622 119.7100 59.4457 29.9632 178.4917 77 E 4.1263 7.9563 118.0633 59.2757 29.4113 179.2102 78 F 4.8236 8.4020 122.0962 60.9058 39.6057 177.3279 79 S 3.9581 8.3291 114.8914 61.7377 62.5944 176.7594 80 Q 3.9330 8.1991 120.3593 58.7328 28.4736 178.3460 81 W 4.3159 8.5143 129.5505 60.8412 30.7084 177.7591 82 L 3.3775 8.3217 120.1081 57.9990 41.3742 178.1264 83 C 4.1165 7.8421 118.3306 59.7299 40.4053 175.2829 84 H 4.0581 8.1182 118.2775 58.5427 28.1068 177.9676 85 V 3.2980 7.4533 120.2597 66.2354 31.2551 177.5408 86 H 3.5704 7.9159 117.8785 59.1995 29.4187 176.9480 87 N 4.2228 8.0628 118.3297 56.4282 38.3123 177.4630 88 T 3.8474 7.8474 117.3098 66.4977 68.6049 176.8922 89 V 3.6318 7.5985 120.2380 65.9929 31.5839 177.6058 90 N 4.2783 8.2764 116.5296 56.4876 38.4561 177.2097 91 R 3.8663 8.5542 120.0094 59.7470 29.9973 178.7695 92 S 4.2278 7.9724 113.2846 60.7633 62.8142 175.6373 93 L 4.5911 7.5220 118.9811 53.3504 41.9580 176.3136 94 G 3.8634 8.0333 106.7937 46.8860 0.0000 174.0134 95 K 4.6182 8.0125 117.7261 53.4887 34.8861 176.6431 96 L 4.0513 8.2567 120.0568 55.1726 42.0496 177.0022 97 V 4.3273 7.9995 120.9672 60.9134 32.8997 175.2183 98 F 4.1318 8.9314 130.5596 56.8817 39.9692 173.1870 99 P 4.3007 0.0000 0.0000 62.3791 30.6235 177.4601 100 C 4.7399 8.7714 119.1158 58.3525 39.8649 174.5548 101 E 4.0919 7.9380 119.0346 57.3994 29.7898 177.4660 102 R 4.5152 8.0732 117.4228 55.7788 30.5331 177.9758 103 V 3.8862 8.0321 114.0549 65.0635 31.4197 177.9757 104 D 4.7661 8.2647 115.8158 56.8918 40.7079 177.9784 105 A 4.2348 8.1150 121.1520 54.3894 18.7813 179.0014 106 R 4.0892 7.8666 115.9544 56.7393 30.4285 175.9247 107 W 4.7797 8.5909 118.1166 54.8110 31.0896 175.4769 108 G 3.8303 8.8081 111.6157 45.5824 0.0000 172.4502 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 8 P 0.00 4.12 0.00 2.18 2.11 0.00 3.87 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.94 0.00 9 V 8.22 2.93 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 0.72 0.00 0.00 0.91 0.00 0.00 10 T 8.59 4.39 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 11 K 8.52 3.84 0.00 1.85 1.89 0.00 1.76 0.00 0.00 1.88 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.58 1.60 7.81 12 E 8.12 4.08 0.00 2.14 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 2.44 2.52 0.00 13 D 7.89 4.38 0.00 2.87 2.73 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 14 L 8.11 3.96 0.00 1.68 1.79 0.75 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.08 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 16 R 8.36 4.18 0.00 1.97 2.12 0.00 3.22 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.90 0.00 17 A 8.11 4.03 1.42 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 0.00 0.00 18 T 8.20 3.86 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 0.90 0.00 0.00 19 W 8.13 4.18 0.00 3.32 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 20 T 7.98 3.57 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 1.44 0.00 0.00 21 F 8.24 4.26 0.00 3.08 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 22 L 8.25 3.36 0.00 1.41 1.40 0.45 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.11 3.65 0.00 1.40 1.40 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 7.51 3.93 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 1.31 0.00 0.00 25 L 7.79 3.93 0.00 1.41 1.59 1.00 1.07 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 26 A 7.86 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.76 4.19 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Q 7.57 4.35 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.68 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 29 Y 7.49 4.24 0.00 3.23 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 30 P 0.00 4.60 0.00 2.07 2.01 0.00 2.65 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.78 0.00 31 E 8.87 3.97 0.00 1.95 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 2.31 2.41 0.00 32 K 7.50 4.46 0.00 1.71 1.68 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.37 7.81 33 P 0.00 4.34 0.00 1.95 1.26 0.00 3.74 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.12 0.00 34 T 9.12 4.23 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 1.16 0.00 0.00 35 R 8.35 3.87 0.00 1.88 1.95 0.00 3.16 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 36 Q 7.93 3.95 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.66 0.00 0.00 0.00 0.00 0.00 2.58 2.44 0.00 37 Q 7.96 4.11 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 38 K 7.95 4.55 0.00 1.97 1.94 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.41 7.81 39 K 7.85 3.91 0.00 1.96 1.96 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.46 7.81 40 D 8.60 4.31 0.00 2.69 2.72 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 41 V 7.61 3.44 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 -0.22 0.00 0.00 0.51 0.00 0.00 42 K 7.72 3.84 0.00 1.90 1.72 0.00 1.61 0.00 0.00 1.43 0.00 0.00 2.71 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.19 1.44 7.81 43 E 8.40 3.94 0.00 2.15 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 0.00 2.31 2.37 0.00 44 L 8.52 4.01 0.00 1.87 1.95 1.07 1.02 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 45 M 8.04 4.37 0.00 2.44 2.28 0.00 0.00 0.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 3.04 0.00 46 T 7.98 3.94 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 1.24 0.00 0.00 47 I 8.20 3.82 2.08 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 1.55 0.92 0.95 0.00 0.00 48 L 8.32 4.14 0.00 1.97 1.43 0.74 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.45 4.57 0.00 4.16 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 50 R 7.46 4.43 0.00 2.00 2.04 0.00 3.19 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 51 M 8.49 4.39 0.00 1.92 2.29 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 52 Y 7.75 4.02 0.00 2.99 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 53 P 0.00 4.07 0.00 1.67 1.86 0.00 2.81 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.90 0.00 54 C 7.83 4.62 0.00 2.80 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 55 R 7.98 3.61 0.00 1.89 1.88 0.00 3.18 0.00 0.00 3.38 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 56 E 8.09 3.92 0.00 2.09 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 0.00 2.37 2.41 0.00 57 C 8.36 4.25 0.00 3.44 3.31 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 58 A 8.47 4.07 1.54 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 0.00 0.00 59 D 7.96 4.36 0.00 2.86 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 60 H 8.37 4.32 0.00 3.43 3.40 0.00 5.64 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 F 8.45 4.21 0.00 3.16 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 62 K 8.19 3.90 0.00 2.20 1.98 0.00 1.89 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.54 7.81 63 E 8.27 3.94 0.00 2.28 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 2.36 2.54 0.00 64 I 8.06 3.64 1.85 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 1.39 0.72 0.80 0.00 0.00 65 L 7.91 3.96 0.00 1.31 1.72 1.00 1.04 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 66 R 7.85 4.07 0.00 1.99 1.98 0.00 3.38 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.79 0.00 67 S 7.91 4.46 0.00 4.05 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 68 N 8.05 5.09 0.00 2.94 2.97 0.00 0.00 6.97 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 69 P 0.00 4.31 0.00 2.06 2.02 0.00 3.83 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 70 A 7.92 2.00 0.33 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 71 Q 7.29 4.11 0.00 2.31 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.87 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 72 A 7.92 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.46 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 74 S 7.53 4.69 0.00 4.33 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 75 Q 8.23 4.38 0.00 2.55 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.85 0.00 0.00 0.00 0.00 0.00 2.75 2.69 0.00 76 E 8.26 4.02 0.00 2.15 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 2.45 2.47 0.00 77 E 7.96 4.13 0.00 2.29 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 2.40 2.40 0.00 78 F 8.40 4.82 0.00 2.81 2.92 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 79 S 8.33 3.96 0.00 3.96 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 80 Q 8.20 3.93 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 81 W 8.51 4.32 0.00 3.56 3.57 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 82 L 8.32 3.38 0.00 1.62 1.54 0.91 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 83 C 7.84 4.12 0.00 3.04 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 84 H 8.12 4.06 0.00 3.18 3.23 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.45 3.30 1.61 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 1.09 0.00 0.00 -0.29 0.00 0.00 86 H 7.92 3.57 0.00 2.47 2.87 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 N 8.06 4.22 0.00 2.87 2.81 0.00 0.00 6.98 6.66 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 88 T 7.85 3.85 4.36 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 1.20 0.00 0.00 89 V 7.60 3.63 2.38 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 1.22 0.00 0.00 1.16 0.00 0.00 90 N 8.28 4.28 0.00 2.86 2.95 0.00 0.00 6.71 8.50 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 91 R 8.55 3.87 0.00 1.93 2.04 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 92 S 7.97 4.23 0.00 4.06 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 93 L 7.52 4.59 0.00 1.81 1.73 1.01 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 94 G 8.03 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 95 K 8.01 4.62 0.00 1.84 1.71 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.39 7.81 96 L 8.26 4.05 0.00 1.63 1.60 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.00 4.33 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 0.79 0.00 0.00 0.91 0.00 0.00 98 F 8.93 4.13 0.00 2.90 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 99 P 0.00 4.30 0.00 2.02 1.99 0.00 2.53 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.55 0.00 100 C 8.77 4.74 0.00 2.97 3.13 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 0.00 101 E 7.94 4.09 0.00 1.91 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 2.28 2.32 0.00 102 R 8.07 4.52 0.00 1.66 1.91 0.00 2.75 0.00 0.00 2.96 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.49 0.00 103 V 8.03 3.89 2.22 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 0.89 0.00 0.00 1.08 0.00 0.00 104 D 8.26 4.77 0.00 2.71 2.80 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 0.00 105 A 8.12 4.23 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 R 7.87 4.09 0.00 1.84 1.91 0.00 2.73 0.00 0.00 2.97 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.50 0.00 107 W 8.59 4.78 0.00 3.19 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 0.00 108 G 8.81 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00