NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3649 8.1927 116.7838 57.9154 63.4156 173.4180 2 I 3.0916 8.0682 126.8730 63.6360 37.7931 176.1558 3 Q 4.0942 8.0881 119.1641 57.7707 29.6190 176.1557 4 A 4.2129 8.0047 119.9371 52.7523 19.4817 177.4000 5 E 3.7297 7.5371 117.6088 55.3046 29.7530 178.0490 6 E 3.8972 8.3513 121.8153 58.3847 29.9428 177.6418 7 W 4.6473 7.2161 115.3443 56.9535 28.9689 174.7785 8 Y 5.1070 7.5754 121.8380 57.1758 38.1221 174.7373 9 F 4.3469 9.2764 126.2095 56.4163 40.7330 178.0794 10 G 3.3544 5.6603 110.4421 46.8501 0.0000 176.5310 11 K 4.8163 8.5078 119.2747 54.4001 30.4561 175.1872 12 I 4.6250 7.3540 114.5672 58.1411 40.9609 176.9759 13 T 4.3435 8.0736 112.5467 60.9463 71.1302 175.7076 14 R 3.8086 9.3676 121.6154 59.6130 29.9839 178.5401 15 R 3.8528 7.9123 117.9504 59.4010 30.0828 177.9571 16 E 3.9512 8.0977 118.9134 59.2068 29.6762 178.8602 17 S 4.0663 8.1467 114.3846 61.6567 63.0051 176.4373 18 E 3.9994 8.4869 122.3147 58.7812 28.9123 179.2584 19 R 3.8948 7.8430 118.2971 59.4431 30.2485 178.3167 20 L 4.1393 7.8451 117.5970 57.8196 41.7214 179.1711 21 L 4.1728 7.8399 117.5351 56.5228 42.8929 178.3594 22 L 4.4448 7.7393 120.7701 53.0326 38.9905 176.2660 23 N 4.9200 7.2535 117.5982 51.2328 41.7567 174.5892 24 A 4.0489 8.8561 128.4920 55.2836 18.4839 178.1347 25 E 4.1341 8.4887 113.9001 57.9857 29.9086 176.7294 26 N 4.5252 8.1520 118.3234 51.9584 38.6707 173.4995 27 P 4.5350 0.0000 0.0000 61.4022 32.7484 175.6453 28 R 3.8225 8.1608 117.8194 58.1719 30.4212 177.5418 29 G 4.1257 9.0985 109.4742 46.5172 0.0000 173.2179 30 T 4.7755 7.5655 117.3392 63.6528 69.6338 173.6666 31 F 5.8272 9.1668 120.0672 55.5178 42.3558 172.6867 32 L 4.7264 8.3204 116.7726 54.8014 43.5186 173.9716 33 V 5.2251 9.1695 120.5735 61.4236 34.7010 174.6202 34 R 4.9644 9.1456 122.8288 54.7412 33.5750 173.7380 35 E 4.7221 8.8129 118.6774 55.9532 30.3078 177.3240 36 S 4.2799 8.2719 117.4220 58.3718 62.5769 174.4283 37 E 4.1520 8.9962 126.0626 58.7973 29.4696 177.7692 38 T 4.4127 7.8198 104.9047 61.1167 70.4260 173.5871 39 T 4.3860 8.1568 121.0610 61.1901 68.9990 173.9534 40 K 4.0465 8.4525 126.5647 58.1269 32.8760 177.6440 41 G 3.7225 8.8105 109.3764 45.5120 0.0000 172.6227 42 A 4.8197 7.5346 121.2392 50.2305 22.4545 175.2623 43 Y 5.3249 8.7129 116.2747 56.3833 42.4346 174.4085 44 C 5.4026 9.5729 117.0720 58.1790 32.6948 173.4070 45 L 5.0052 9.1756 125.6668 53.8400 43.6438 174.9878 46 S 5.1778 8.9406 123.5096 56.9911 65.0410 173.6440 47 V 5.0688 8.7951 124.7549 61.0401 34.8322 174.5839 48 S 4.9830 9.1761 122.6850 58.0075 64.9648 172.4738 49 D 5.2815 9.3068 121.0585 53.0793 45.5570 173.6901 50 F 5.6916 8.7432 122.1682 57.5454 42.3729 172.6272 51 D 4.7389 7.5413 123.9339 51.8074 42.6478 176.0219 52 N 4.3513 8.7539 116.0374 55.9304 38.9610 177.0802 53 A 4.0374 7.9973 120.5082 54.8300 18.5856 178.4389 54 K 4.2131 9.1355 113.7426 55.5297 34.1134 179.3822 55 G 3.2098 8.0550 107.9164 45.1877 0.0000 172.3263 56 L 4.9251 8.4702 125.2750 55.1022 42.9945 176.7798 57 N 5.0233 9.1637 122.5922 52.0067 41.4629 173.0515 58 V 4.8679 8.1959 118.1012 61.0224 34.3973 174.5095 59 K 4.5370 8.9118 126.2988 54.7802 35.4310 174.6862 60 H 5.1619 8.2030 119.3437 54.1678 31.6244 172.5639 61 Y 4.7795 8.8380 121.1223 55.8775 40.9070 174.8010 62 K 4.6811 8.8612 125.5537 56.1217 33.5749 175.7192 63 I 4.5938 8.9576 129.0447 59.9871 38.9876 175.3012 64 R 4.5860 8.7135 127.1906 55.0700 31.9369 175.6091 65 K 4.7046 8.1331 121.8881 54.6417 35.0906 175.3914 66 L 4.6261 8.6327 127.2245 53.5918 43.2329 177.7803 67 D 4.3091 8.7043 121.2664 57.1912 41.0540 177.8607 68 S 4.2485 7.9201 113.1475 59.3120 62.9020 174.6187 69 G 4.0116 8.2516 109.6688 44.9265 0.0000 174.4247 70 G 4.1217 7.8955 106.4449 45.7516 0.0000 172.6661 71 F 5.5923 9.2363 120.1882 55.8645 42.4210 174.1877 72 Y 5.1684 8.5386 118.1005 57.2213 40.9935 175.0518 73 I 4.2137 9.0584 121.2337 63.0346 38.6200 176.1817 74 T 4.7934 7.7758 114.3512 59.7283 69.3290 174.8303 75 S 3.1129 8.6774 122.7759 60.7189 63.0133 175.6216 76 R 3.9204 7.7626 118.6521 58.0001 30.0516 176.4750 77 T 4.1327 7.7094 113.6218 61.4368 69.4891 172.9129 78 Q 4.7977 7.7021 123.9726 53.8099 31.6426 175.3318 79 F 4.9148 8.7188 118.0072 55.7334 42.7300 176.1484 80 N 4.8400 8.9713 119.6064 55.5021 39.1390 175.8965 81 S 4.7092 7.8465 111.8058 55.6618 67.5062 174.7280 82 L 3.4111 7.3438 123.6364 58.0472 41.7528 179.0491 83 Q 4.2060 7.9571 117.6390 59.2746 28.6918 178.7886 84 Q 3.9737 8.1213 118.9869 58.5638 28.7190 178.5031 85 L 2.4400 7.4149 120.9813 57.5854 41.9769 179.1848 86 V 3.1807 7.5564 118.0210 65.7868 30.6570 177.8280 87 A 3.8890 7.7569 120.5162 55.1812 18.1824 179.0523 88 Y 3.8259 7.7850 118.0865 60.8900 38.8635 177.1453 89 Y 4.5457 7.5966 116.8919 58.6872 37.8719 177.1863 90 S 4.5749 7.3201 117.0470 58.8507 63.2602 174.6241 91 K 4.3254 7.0274 116.2666 56.2062 33.9614 176.0703 92 H 4.7071 7.7542 115.4843 53.6567 31.6450 174.5659 93 A 4.0870 8.6921 126.5085 53.9216 20.1572 179.9187 94 D 4.3605 7.8420 112.7194 55.9477 40.2534 174.8615 95 G 3.9513 9.0164 115.9345 46.1993 0.0000 173.3885 96 L 3.9780 7.8589 121.3617 53.5329 42.4288 177.8544 97 C 4.4286 8.7411 115.4418 61.4118 29.7579 173.3030 98 H 4.4816 7.1197 117.0678 54.9416 32.5635 173.4725 99 R 4.1745 7.6770 119.9999 55.6019 30.1824 175.8947 100 L 4.3745 8.6486 120.9660 55.2212 42.0649 176.3559 101 T 4.6233 9.1386 113.0107 62.8934 70.5223 174.4286 102 T 4.8419 7.7850 112.4551 58.6105 72.4839 172.6777 103 V 3.3539 8.4045 124.3424 62.5538 32.3696 175.1164 104 C 3.9967 8.3623 128.7595 59.1656 31.9422 171.8586 105 P 4.4821 0.0000 0.0000 62.9314 30.9423 176.1355 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 S 8.19 4.36 0.00 3.84 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 2 I 8.07 3.09 1.51 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.34 0.71 0.00 0.00 3 Q 8.09 4.09 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.26 0.00 4 A 8.00 4.21 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 0.00 0.00 5 E 7.54 3.73 0.00 1.16 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 1.90 1.47 0.00 6 E 8.35 3.90 0.00 2.00 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 2.33 2.27 0.00 7 W 7.22 4.65 0.00 3.56 3.17 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 8 Y 7.58 5.11 0.00 2.74 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 9 F 9.28 4.35 0.00 2.79 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 10 G 5.66 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 0.00 0.00 0.00 11 K 8.51 4.82 0.00 1.77 1.77 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.59 7.81 12 I 7.35 4.62 1.91 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 0.88 1.00 0.00 0.00 13 T 8.07 4.34 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 1.21 0.00 0.00 14 R 9.37 3.81 0.00 1.75 1.99 0.00 2.94 0.00 0.00 3.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.23 0.00 15 R 7.91 3.85 0.00 1.90 1.90 0.00 3.23 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 1.70 1.69 0.00 16 E 8.10 3.95 0.00 2.14 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 2.34 2.39 0.00 17 S 8.15 4.07 0.00 4.06 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 0.00 18 E 8.49 4.00 0.00 2.17 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 2.37 2.55 0.00 19 R 7.84 3.89 0.00 1.93 2.11 0.00 3.27 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 1.65 1.68 0.00 20 L 7.85 4.14 0.00 1.75 1.67 1.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.84 4.17 0.00 1.66 1.70 0.86 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.74 4.44 0.00 1.70 1.65 0.94 0.73 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 23 N 7.25 4.92 0.00 2.67 2.63 0.00 0.00 6.91 8.55 0.00 0.00 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 A 8.86 4.05 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 25 E 8.49 4.13 0.00 2.07 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 2.32 2.27 0.00 26 N 8.15 4.53 0.00 2.79 2.76 0.00 0.00 7.00 7.58 0.00 0.00 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 P 0.00 4.53 0.00 2.19 2.14 0.00 3.71 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 2.07 1.98 0.00 28 R 8.16 3.82 0.00 1.52 1.61 0.00 3.22 0.00 0.00 3.44 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.66 0.00 29 G 9.10 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 30 T 7.57 4.78 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 1.17 0.00 0.00 31 F 9.17 5.83 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 32 L 8.32 4.73 0.00 1.01 1.02 0.78 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 33 V 9.17 5.23 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 1.20 0.00 0.00 1.08 0.00 0.00 34 R 9.15 4.96 0.00 2.03 2.00 0.00 3.02 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 1.71 1.68 0.00 35 E 8.81 4.72 0.00 1.96 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 2.49 2.51 0.00 36 S 8.27 4.28 0.00 3.93 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 37 E 9.00 4.15 0.00 1.98 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 0.00 2.31 2.28 0.00 38 T 7.82 4.41 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 39 T 8.16 4.39 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 40 K 8.45 4.05 0.00 1.83 1.80 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.37 7.81 41 G 8.81 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 0.00 0.00 0.00 42 A 7.53 4.82 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 43 Y 8.71 5.32 0.00 3.15 3.21 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 44 C 9.57 5.40 0.00 2.87 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 45 L 9.18 5.01 0.00 1.80 1.67 0.95 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.94 5.18 0.00 3.82 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 47 V 8.80 5.07 2.24 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 1.18 0.00 0.00 1.08 0.00 0.00 48 S 9.18 4.98 0.00 3.93 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 49 D 9.31 5.28 0.00 2.75 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 50 F 8.74 5.69 0.00 3.07 2.87 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 51 D 7.54 4.74 0.00 2.65 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 52 N 8.75 4.35 0.00 2.71 2.90 0.00 0.00 6.90 7.35 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 53 A 8.00 4.04 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 54 K 9.14 4.21 0.00 1.64 1.78 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.30 7.81 55 G 8.06 3.21 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 0.00 56 L 8.47 4.93 0.00 1.92 1.69 1.09 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 57 N 9.16 5.02 0.00 2.80 2.83 0.00 0.00 5.97 7.21 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 58 V 8.20 4.87 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 0.65 0.00 0.00 0.91 0.00 0.00 59 K 8.91 4.54 0.00 1.52 1.04 0.00 1.52 0.00 0.00 1.54 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.54 7.81 60 H 8.20 5.16 0.00 2.87 3.10 0.00 5.64 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 Y 8.84 4.78 0.00 2.91 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 62 K 8.86 4.68 0.00 1.81 1.76 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.66 7.81 63 I 8.96 4.59 2.15 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 1.32 0.84 1.18 0.00 0.00 64 R 8.71 4.59 0.00 0.67 1.40 0.00 3.13 0.00 0.00 3.03 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.52 0.00 65 K 8.13 4.70 0.00 1.39 1.55 0.00 1.24 0.00 0.00 0.61 0.00 0.00 2.89 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.20 1.33 7.81 66 L 8.63 4.63 0.00 1.68 1.63 1.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.70 4.31 0.00 2.66 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 68 S 7.92 4.25 0.00 3.86 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 69 G 8.25 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 70 G 7.90 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 0.00 0.00 0.00 71 F 9.24 5.59 0.00 3.18 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 72 Y 8.54 5.17 0.00 3.41 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 73 I 9.06 4.21 1.93 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.67 0.91 0.00 0.00 74 T 7.78 4.79 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 1.32 0.00 0.00 75 S 8.68 3.11 0.00 3.50 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 76 R 7.76 3.92 0.00 1.77 1.96 0.00 3.12 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 77 T 7.71 4.13 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 0.69 0.00 0.00 78 Q 7.70 4.80 0.00 1.81 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.80 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 79 F 8.72 4.91 0.00 3.22 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 80 N 8.97 4.84 0.00 3.06 2.98 0.00 0.00 6.73 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 81 S 7.85 4.71 0.00 4.07 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 82 L 7.34 3.41 0.00 0.84 1.48 0.69 0.29 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 83 Q 7.96 4.21 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.56 2.84 0.00 84 Q 8.12 3.97 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 85 L 7.41 2.44 0.00 1.55 1.63 1.22 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.56 3.18 1.70 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 0.32 0.00 0.00 -0.03 0.00 0.00 87 A 7.76 3.89 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 88 Y 7.78 3.83 0.00 2.83 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 89 Y 7.60 4.55 0.00 2.95 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 90 S 7.32 4.57 0.00 3.83 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 91 K 7.03 4.33 0.00 1.53 1.51 0.00 1.54 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.24 1.39 7.81 92 H 7.75 4.71 0.00 2.68 3.12 0.00 5.61 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.69 4.09 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 94 D 7.84 4.36 0.00 3.10 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 0.00 0.00 0.00 95 G 9.02 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 96 L 7.86 3.98 0.00 1.59 1.29 0.39 -0.22 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 97 C 8.74 4.43 0.00 3.35 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 98 H 7.12 4.48 0.00 3.26 3.18 0.00 5.75 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 R 7.68 4.17 0.00 2.08 1.94 0.00 3.22 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 100 L 8.65 4.37 0.00 1.24 0.53 0.10 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 101 T 9.14 4.62 4.30 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 1.35 0.00 0.00 102 T 7.79 4.84 4.28 0.00 0.00 0.00 0.00 0.00 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 0.00 103 V 8.40 3.35 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 0.82 0.00 0.00 0.97 0.00 0.00 104 C 8.36 4.00 0.00 2.85 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.48 0.00 2.10 1.97 0.00 3.75 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 2.14 2.08 0.00