NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3812 8.1927 115.4033 57.8806 63.3910 173.7121 2 I 3.2410 7.8395 128.8147 63.5714 38.1175 176.6609 3 Q 4.0519 8.1279 119.9284 58.2102 29.6269 176.6852 4 A 4.0911 7.4672 120.0092 53.9092 19.0240 177.8245 5 E 3.6697 7.6419 117.2732 55.8577 29.6779 178.1189 6 E 3.9416 8.2992 121.4690 58.2948 30.1046 177.5334 7 W 4.6019 7.2262 115.3391 56.6830 28.9004 174.7308 8 Y 5.1184 7.5181 121.7305 56.8818 37.9610 174.9191 9 F 4.4026 9.2756 126.5620 56.7915 40.7434 178.2078 10 G 3.4746 5.7713 110.1940 46.7984 0.0000 176.5437 11 K 4.7301 8.5490 119.4834 54.5483 30.3807 175.2213 12 I 4.6501 7.3442 114.4415 58.0359 41.0341 176.9212 13 T 4.3594 8.0961 112.7220 60.8815 71.2520 175.7632 14 R 3.7948 9.2786 121.2521 59.5822 29.9336 178.4356 15 R 3.8875 7.9105 117.9908 59.4004 30.1363 177.9244 16 E 3.9486 8.2141 119.3759 59.2419 29.6475 178.9082 17 S 4.1173 8.2508 114.4038 61.5404 62.9829 176.4289 18 E 3.9752 8.3317 122.2172 58.9728 28.9634 179.1326 19 R 3.9045 7.9052 118.0694 59.5030 30.2191 178.3305 20 L 4.1660 7.8265 117.5118 57.8235 41.7527 179.1631 21 L 4.2209 7.9041 117.4283 56.5470 42.0262 177.5615 22 L 4.5079 7.9208 119.0753 53.9223 42.7709 176.1510 23 N 4.7649 7.6328 117.2788 51.6020 40.3404 174.9866 24 A 4.1248 8.8094 128.8684 55.2955 18.4692 178.1099 25 E 4.1009 8.4597 113.9298 58.1214 29.8169 176.8289 26 N 4.5020 8.1925 118.4183 52.0006 38.9328 173.5464 27 P 4.5604 0.0000 0.0000 61.3075 32.8876 175.5419 28 R 3.9125 8.0826 117.5906 57.8326 30.3143 177.6846 29 G 4.1800 9.0642 109.6474 46.4560 0.0000 173.3931 30 T 4.6694 7.5611 117.8831 63.9468 69.6830 173.4738 31 F 5.6736 9.0941 119.6900 56.1071 42.2774 172.5058 32 L 4.5851 8.2203 116.7691 54.8758 43.4219 173.8346 33 V 5.1859 9.0823 120.3995 61.3604 34.7124 174.6070 34 R 4.8458 9.0406 122.7506 54.5019 33.5959 173.8256 35 E 4.7373 8.8518 118.7030 56.2305 30.1486 177.4298 36 S 4.2937 8.3442 117.6776 58.3557 62.6093 174.3599 37 E 4.1474 9.0079 126.3845 59.0273 29.4799 177.8688 38 T 4.5113 7.8417 104.5591 61.0736 69.7480 173.3010 39 T 4.4577 8.0484 119.9957 61.3754 70.1041 173.7499 40 K 4.1084 8.4944 126.4300 58.0214 33.0207 177.7238 41 G 3.7261 8.7734 108.6394 45.5364 0.0000 172.7569 42 A 4.7656 7.5105 121.2362 50.2321 22.5510 175.1256 43 Y 5.3834 8.6123 116.2613 56.3191 42.5016 174.2653 44 C 5.2699 9.4917 120.0100 57.8711 35.3603 172.2355 45 L 4.9922 9.3652 128.8752 54.0662 43.4775 174.9506 46 S 5.2216 8.9307 123.2271 56.9160 65.2353 173.6091 47 V 5.0754 8.8377 124.3733 61.1070 35.0438 174.5298 48 S 5.0413 9.2001 122.1731 57.8583 65.1413 172.3869 49 D 5.2686 9.2437 120.7908 53.1495 45.5194 173.6364 50 F 5.6349 8.7942 121.9408 57.7261 42.4656 172.5195 51 D 4.6335 7.4078 123.7440 52.1485 42.5275 175.8029 52 N 4.4731 8.7004 115.5182 55.4715 39.0175 176.9832 53 A 4.1195 8.0867 120.5935 54.5520 18.9324 178.4408 54 K 4.1930 8.9530 113.3686 55.7059 34.0797 179.2212 55 G 3.2600 7.9101 107.7423 45.0608 0.0000 172.1915 56 L 4.9654 8.5635 125.1585 55.1274 42.9578 176.8649 57 N 5.1121 9.2416 122.7089 51.7933 41.5651 173.0658 58 V 4.9119 8.2138 117.8970 61.0390 34.4977 174.5064 59 K 4.5596 8.9192 125.9897 54.7776 35.6177 174.6814 60 H 5.2069 8.1421 118.9511 54.1533 32.1788 172.6710 61 Y 4.7323 8.7608 119.8144 55.8187 41.2812 174.8478 62 K 4.6175 8.8962 126.1970 56.4588 34.0390 175.2584 63 I 4.7013 9.0137 128.4291 59.8461 39.4123 174.8732 64 R 4.6519 8.7631 126.8969 54.5522 32.3300 175.4733 65 K 4.4319 8.0852 122.8371 54.4203 34.5645 175.8206 66 L 4.2813 8.8640 128.1102 54.1475 42.4420 177.8211 67 D 4.2581 8.4735 120.7029 57.1841 41.3819 177.3149 68 S 4.3365 7.9368 112.5880 59.0359 62.8275 173.7139 69 G 4.0960 8.3186 110.2515 45.2085 0.0000 174.8557 70 G 3.9935 7.8930 106.0768 46.1144 0.0000 172.6434 71 F 5.5616 9.1819 121.5780 55.7614 42.0003 174.2542 72 Y 5.2612 8.6186 119.2505 57.1143 41.0535 175.2607 73 I 4.2475 9.0032 120.6160 62.4924 38.4094 176.1139 74 T 4.7633 7.7942 114.5140 59.8059 69.0506 175.0008 75 S 2.7900 8.5188 122.7242 60.3332 63.0392 175.2958 76 R 3.9973 7.3333 118.6808 57.7347 30.0226 176.8874 77 T 4.1556 7.7902 114.1696 61.5373 69.6765 173.0177 78 Q 4.8682 7.6867 123.9082 53.8948 31.7200 175.1888 79 F 4.8612 8.6035 116.9526 55.8861 42.9004 176.0221 80 N 4.6928 8.9765 119.5588 55.2923 39.1850 175.7343 81 S 4.5201 7.6708 112.3243 55.9055 67.3805 174.9085 82 L 3.5016 7.2681 123.5756 57.9478 41.7569 179.0707 83 Q 4.1808 7.8989 117.8299 59.1388 28.7574 178.5808 84 Q 3.9684 8.2193 119.1171 58.5084 28.7256 178.4775 85 L 2.4400 7.4322 121.0471 57.6204 42.0327 179.1865 86 V 3.1745 7.5459 118.0611 65.7724 31.0783 177.7943 87 A 3.8744 7.6301 119.4648 55.1299 18.4981 178.7210 88 Y 3.9365 7.6910 117.9440 60.9977 38.8727 177.4963 89 Y 4.5279 7.6208 117.2692 59.0570 37.8026 177.3553 90 S 4.6530 7.2990 116.5317 58.8590 63.2392 174.5943 91 K 4.3050 7.6079 119.5679 56.1684 33.8596 176.0306 92 H 4.6736 7.4601 115.3821 53.5751 31.5999 174.3539 93 A 4.0305 8.7328 127.2469 54.1698 19.8594 179.3803 94 D 4.3390 7.7580 112.9873 55.9481 40.3225 175.3251 95 G 3.9133 8.9181 116.6362 46.4682 0.0000 173.4478 96 L 3.8459 7.8494 121.2927 53.8889 42.2243 177.9505 97 C 4.4264 8.7433 115.7620 61.4161 29.7729 173.3407 98 H 4.4982 7.1336 117.1217 54.8737 32.8490 173.4714 99 R 4.1465 7.7013 120.2138 55.6316 30.1693 175.8997 100 L 4.1169 8.6111 120.9869 55.0841 41.3250 175.8592 101 T 4.5972 8.1625 114.0597 61.4841 70.0841 173.9057 102 T 4.8442 7.7505 114.0535 58.8631 71.7561 173.2617 103 V 3.5552 8.2722 126.2606 62.4677 32.4042 175.2307 104 C 4.1952 8.2922 128.8458 59.0738 31.6984 171.8228 105 P 4.5432 0.0000 0.0000 62.6183 31.8764 176.4311 106 T 4.2747 8.3625 109.9841 61.9819 69.0121 174.6513 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 4.38 0.00 3.94 4.08 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 2 I 7.84 3.24 1.55 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.07 0.74 0.00 0.00 3 Q 8.13 4.05 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 4 A 7.47 4.09 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 5 E 7.64 3.67 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 2.11 1.52 0.00 6 E 8.30 3.94 0.00 2.01 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 2.26 0.00 7 W 7.23 4.60 0.00 3.51 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 7.52 5.12 0.00 2.72 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 9 F 9.28 4.40 0.00 2.74 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 5.77 3.47 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 0.00 0.00 0.00 0.00 11 K 8.55 4.73 0.00 1.78 1.78 0.00 1.75 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.62 7.81 12 I 7.34 4.65 1.92 0.00 0.00 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 1.54 0.88 0.98 0.00 0.00 13 T 8.10 4.36 4.41 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 1.22 0.00 0.00 14 R 9.28 3.79 0.00 1.74 1.97 0.00 2.98 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.19 0.00 15 R 7.91 3.89 0.00 1.91 1.91 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 8.21 3.95 0.00 2.16 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 2.35 2.42 0.00 17 S 8.25 4.12 0.00 4.06 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 18 E 8.33 3.98 0.00 2.22 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 2.38 2.54 0.00 19 R 7.91 3.90 0.00 1.92 2.13 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 1.66 1.69 0.00 20 L 7.83 4.17 0.00 1.82 1.73 1.10 0.98 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 21 L 7.90 4.22 0.00 1.67 1.71 0.89 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.92 4.51 0.00 1.70 1.70 0.96 0.86 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 23 N 7.63 4.76 0.00 2.72 2.68 0.00 0.00 6.91 8.49 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 24 A 8.81 4.12 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 8.46 4.10 0.00 2.09 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 26 N 8.19 4.50 0.00 2.80 2.77 0.00 0.00 6.99 7.62 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 27 P 0.00 4.56 0.00 2.19 2.15 0.00 3.70 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 28 R 8.08 3.91 0.00 1.51 1.62 0.00 3.36 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.66 0.00 29 G 9.06 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 30 T 7.56 4.67 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 1.19 0.00 0.00 31 F 9.09 5.67 0.00 3.20 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 32 L 8.22 4.59 0.00 0.81 0.83 0.71 -0.29 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 33 V 9.08 5.19 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 1.32 0.00 0.00 1.07 0.00 0.00 34 R 9.04 4.85 0.00 2.00 1.96 0.00 3.02 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 35 E 8.85 4.74 0.00 1.97 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 2.54 2.52 0.00 36 S 8.34 4.29 0.00 3.94 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 37 E 9.01 4.15 0.00 1.98 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 2.31 2.28 0.00 38 T 7.84 4.51 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 8.05 4.46 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 1.17 0.00 0.00 40 K 8.49 4.11 0.00 1.83 1.79 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.36 7.81 41 G 8.77 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 42 A 7.51 4.77 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 43 Y 8.61 5.38 0.00 3.17 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 44 C 9.49 5.27 0.00 2.98 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 45 L 9.37 4.99 0.00 1.82 1.78 0.97 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.93 5.22 0.00 3.80 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 47 V 8.84 5.08 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 1.16 0.00 0.00 1.07 0.00 0.00 48 S 9.20 5.04 0.00 3.93 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 49 D 9.24 5.27 0.00 2.76 2.67 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 0.00 0.00 0.00 0.00 50 F 8.79 5.63 0.00 3.07 2.86 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 51 D 7.41 4.63 0.00 2.66 2.64 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 0.00 0.00 0.00 0.00 52 N 8.70 4.47 0.00 2.70 2.89 0.00 0.00 6.87 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 8.09 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 54 K 8.95 4.19 0.00 1.58 1.79 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.30 7.81 55 G 7.91 3.26 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 0.00 56 L 8.56 4.97 0.00 1.95 1.72 1.09 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 57 N 9.24 5.11 0.00 2.80 2.83 0.00 0.00 5.96 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 8.21 4.91 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 0.67 0.00 0.00 0.92 0.00 0.00 59 K 8.92 4.56 0.00 1.59 1.09 0.00 1.54 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 1.56 7.81 60 H 8.14 5.21 0.00 2.86 3.08 0.00 5.64 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 61 Y 8.76 4.73 0.00 2.89 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 8.90 4.62 0.00 1.88 1.73 0.00 1.69 0.00 0.00 1.81 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.52 1.63 7.81 63 I 9.01 4.70 2.16 0.00 0.00 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 1.33 0.75 1.24 0.00 0.00 64 R 8.76 4.65 0.00 0.67 1.47 0.00 3.18 0.00 0.00 3.08 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.62 0.00 65 K 8.09 4.43 0.00 1.11 1.50 0.00 1.09 0.00 0.00 0.61 0.00 0.00 2.91 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.17 1.27 7.81 66 L 8.86 4.28 0.00 1.74 1.62 1.02 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.47 4.26 0.00 2.60 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 68 S 7.94 4.34 0.00 3.91 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 69 G 8.32 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 70 G 7.89 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 71 F 9.18 5.56 0.00 3.20 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 8.62 5.26 0.00 3.42 3.11 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 0.00 0.00 0.00 73 I 9.00 4.25 1.93 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.06 0.96 0.00 0.00 74 T 7.79 4.76 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 8.52 2.79 0.00 3.45 3.50 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 0.00 0.00 0.00 0.00 76 R 7.33 4.00 0.00 1.78 1.95 0.00 3.06 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 77 T 7.79 4.16 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 0.76 0.00 0.00 78 Q 7.69 4.87 0.00 1.85 2.03 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 2.12 2.18 0.00 79 F 8.60 4.86 0.00 3.26 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 8.98 4.69 0.00 3.03 2.97 0.00 0.00 6.75 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 7.67 4.52 0.00 3.78 3.94 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 82 L 7.27 3.50 0.00 0.74 1.40 0.85 0.53 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 83 Q 7.90 4.18 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.69 0.00 0.00 0.00 0.00 0.00 2.56 2.84 0.00 84 Q 8.22 3.97 0.00 2.33 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 85 L 7.43 2.44 0.00 1.57 1.61 1.18 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.55 3.17 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 0.24 0.00 0.00 -0.04 0.00 0.00 87 A 7.63 3.87 1.31 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 88 Y 7.69 3.94 0.00 2.87 2.30 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 89 Y 7.62 4.53 0.00 2.95 2.75 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 90 S 7.30 4.65 0.00 3.84 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 91 K 7.61 4.30 0.00 1.49 1.50 0.00 1.53 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.37 7.81 92 H 7.46 4.67 0.00 2.58 3.15 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 8.73 4.03 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 94 D 7.76 4.34 0.00 3.11 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 0.00 0.00 0.00 95 G 8.92 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 96 L 7.85 3.85 0.00 1.59 1.26 0.39 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 97 C 8.74 4.43 0.00 3.40 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 98 H 7.13 4.50 0.00 3.27 3.17 0.00 5.76 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 7.70 4.15 0.00 2.07 1.93 0.00 3.19 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 100 L 8.61 4.12 0.00 1.23 0.48 0.13 0.42 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 0.00 101 T 8.16 4.60 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 1.34 0.00 0.00 102 T 7.75 4.84 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 1.23 0.00 0.00 103 V 8.27 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 0.90 0.00 0.00 0.93 0.00 0.00 104 C 8.29 4.20 0.00 2.90 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 0.00 105 P 0.00 4.54 0.00 2.11 1.98 0.00 3.78 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 2.03 2.08 0.00 106 T 8.36 4.27 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 1.12 0.00 0.00