NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4873 8.3044 120.3356 55.2457 32.2965 173.7151 2 F 4.2441 8.4272 124.8873 57.0179 40.4260 173.4323 3 K 4.0029 7.1305 125.8990 53.8661 36.4886 174.0371 4 P 4.4730 0.0000 0.0000 62.1731 33.4497 174.7157 5 H 4.6664 8.7664 117.3389 55.0210 30.2761 174.9129 6 V 4.9251 8.5855 123.6890 61.8955 32.8659 174.5042 7 T 5.2502 9.2886 118.6406 60.1046 72.1789 173.5680 8 V 5.1647 9.1489 115.3017 60.0919 35.8291 174.4632 9 A 5.2448 9.2012 122.9566 51.1767 23.1851 174.9101 10 C 5.3930 8.3765 115.3648 58.0579 31.8970 174.0645 11 V 4.1667 8.9974 124.0324 61.7510 32.9778 174.5650 12 V 4.8931 8.4903 127.6965 61.4866 33.9337 173.4414 13 H 5.2988 8.9726 127.6279 54.4514 33.4295 172.2872 14 A 4.2873 8.7271 121.2391 51.7575 23.0576 176.5075 15 E 3.4377 9.6539 124.0932 57.5106 27.0423 175.7598 16 G 3.9070 7.9075 101.8086 45.6969 0.0000 172.5053 17 K 4.9276 7.5935 117.9989 54.4115 37.1480 175.1355 18 F 5.2809 9.8196 120.6594 55.6172 42.8062 174.2105 19 L 3.9294 8.7026 126.4232 54.3498 42.6753 176.3750 20 V 4.7368 8.4264 125.0120 60.0953 35.0857 174.8799 21 V 4.9380 9.4282 116.6982 59.5276 35.6820 173.9292 22 E 4.2653 8.3932 123.4641 54.1924 31.9445 174.7627 23 E 5.3774 8.5467 124.8371 53.8811 34.1769 174.8247 24 T 4.8190 8.1556 117.1159 62.3659 69.4718 174.8471 25 I 3.8288 8.4865 127.6960 63.3149 38.4158 176.9320 26 N 4.7697 7.8140 122.0974 52.7197 39.5724 173.5270 27 G 4.1130 8.6057 113.2289 44.6485 0.0000 171.6475 28 K 4.3533 7.9130 118.9468 54.7255 33.3943 175.3679 29 A 4.6139 8.4963 125.4419 51.5938 19.2229 176.5774 30 L 5.0628 9.0524 123.0585 52.9085 45.2383 176.3398 31 W 5.4150 9.0774 122.5020 54.8436 32.2759 174.2068 32 N 4.7132 8.2554 117.1294 53.0564 41.7541 173.5635 33 Q 4.4626 8.2575 121.1494 55.0044 30.1571 173.9415 34 P 4.5775 0.0000 0.0000 63.3962 32.2325 175.2269 35 A 5.0923 9.4377 128.0135 50.3738 22.1459 174.8233 36 G 4.7758 7.1905 106.3088 45.5758 0.0000 171.1378 37 H 5.2010 8.2905 116.9153 54.3045 30.2090 175.3761 38 L 4.2139 8.8302 125.3267 55.3285 42.3730 176.5212 39 E 4.6110 9.3977 126.1290 54.8559 30.9946 176.2595 40 A 3.9397 8.9651 124.3812 53.7268 19.2897 179.0431 41 D 4.5699 8.1476 115.8449 54.2628 37.4528 173.5739 42 E 5.0376 7.7165 127.0011 54.8452 33.4942 174.2079 43 T 3.7803 8.7798 122.3887 62.5215 70.7356 175.9195 44 L 3.8659 8.1368 124.5577 58.3321 41.7066 180.3163 45 V 2.9831 7.5384 111.3478 64.2738 31.3561 178.1523 46 E 3.8447 8.0329 117.4039 59.4725 29.3099 179.0422 47 A 4.1963 8.3660 121.7419 54.5205 18.3165 179.3078 48 A 3.8957 7.8232 118.6793 55.3646 18.3812 179.3685 49 A 3.9297 7.9875 118.8914 55.4926 18.4109 179.9460 50 R 3.8897 8.2715 116.9364 59.7495 30.3563 178.2872 51 E 4.0408 8.5862 118.8783 59.5436 29.5048 179.3415 52 L 3.9573 8.3180 120.3438 57.8360 42.1362 178.7841 53 W 4.2490 8.4352 129.8417 60.1060 30.6306 177.5831 54 E 3.9055 8.9864 118.8389 59.4750 28.7526 178.8906 55 E 4.2133 8.3674 116.8223 57.5731 30.1425 177.1626 56 T 4.4045 7.6690 105.7255 60.0275 70.7234 175.7178 57 G 3.6735 8.3827 110.1289 46.0657 0.0000 173.6776 58 I 4.2114 7.1575 113.7255 59.7488 38.8647 175.0095 59 S 4.8252 8.6515 118.0613 57.0272 62.4277 173.0589 60 A 4.5981 8.1632 129.5930 50.9698 21.9353 175.1129 61 Q 4.2504 8.5564 124.2789 54.2425 30.1198 173.7050 62 P 4.3136 0.0000 0.0000 63.7943 32.0135 175.6937 63 Q 4.4594 8.9679 120.6268 57.8608 30.1489 175.6902 64 H 5.2031 8.1086 113.5106 54.3197 34.1807 172.0025 65 F 5.1378 9.3647 123.3354 57.3335 40.1412 176.5136 66 I 3.8918 8.7052 128.0135 61.5944 37.9498 176.4241 67 R 4.0363 5.8400 126.0084 55.9676 32.4632 172.5955 68 M 4.9119 7.9835 123.4462 54.0991 34.7677 174.4748 69 H 4.8751 8.8529 121.2428 53.9862 32.1523 172.3811 70 Q 5.1323 8.7717 124.9460 54.8385 30.2197 174.4111 71 W 5.2935 9.2372 122.0571 55.8252 32.3740 173.1565 72 I 4.6044 8.3020 120.8114 58.9880 38.8155 175.9376 73 A 3.4368 7.9859 130.5214 51.2175 18.9955 176.2509 74 P 4.2633 0.0000 0.0000 65.9599 31.3988 177.9310 75 D 4.5255 8.0329 113.4455 53.1179 38.8444 176.9580 76 K 3.7461 7.9554 116.4970 57.7799 32.3960 175.7193 77 T 3.7610 8.1955 118.7436 63.2578 69.2383 171.6947 78 P 4.8038 0.0000 0.0000 62.0852 33.5168 174.9645 79 F 5.4855 9.4452 120.4324 55.8087 43.6358 174.0224 80 L 5.0513 9.9050 122.4822 53.3207 44.3257 175.6910 81 R 5.1704 8.9110 126.2592 53.9531 31.9407 175.1769 82 F 4.8055 9.4282 127.5386 56.4054 40.2558 174.8604 83 L 4.9729 9.1420 128.0029 54.0913 43.2885 175.6260 84 F 5.6573 9.4779 124.4787 55.7665 42.9107 174.1239 85 A 5.4773 9.6346 121.6700 50.5645 22.4523 175.5206 86 I 4.8844 8.8817 121.4733 59.9899 41.7046 173.8641 87 E 5.1676 9.0988 126.5974 54.7490 31.1424 175.3903 88 L 4.8416 8.5119 123.8468 52.8938 44.3316 176.8950 89 E 4.0885 8.9495 121.0915 58.9831 29.7271 177.8639 90 Q 4.5319 7.4625 115.1678 53.3465 32.3433 174.8581 91 I 2.0000 7.8789 122.6067 61.5393 37.3837 174.8734 92 C 4.8793 7.6323 118.3467 54.9908 32.7662 171.7646 93 P 4.5501 0.0000 0.0000 63.1646 31.5290 175.4992 94 T 4.7377 8.2410 115.8439 62.0787 70.8932 175.0447 95 Q 4.5223 8.7343 126.1871 54.0479 29.9595 171.1916 96 P 4.2902 0.0000 0.0000 62.7829 32.1905 176.1517 97 H 4.5880 8.8107 119.6283 55.5131 30.2039 174.0022 98 D 4.7752 7.7604 119.4619 52.6177 42.3491 176.8421 99 S 4.3983 8.4910 119.9243 59.7939 63.7994 175.0144 100 D 4.2873 8.1258 120.9680 56.7744 40.5868 176.5144 101 I 4.2082 7.0179 119.2949 59.6329 36.2771 174.9151 102 D 4.3503 8.4959 127.2828 56.4362 41.0179 176.8833 103 C 5.0014 6.5902 111.1353 58.3527 31.4544 171.4356 104 C 5.5502 8.4498 116.0863 58.3589 31.5823 173.8464 105 R 4.7628 8.8091 119.7401 54.9227 33.7778 173.7351 106 W 5.0463 8.8980 125.3023 55.7809 29.9799 175.8172 107 V 4.6757 8.8164 124.7781 60.8662 34.9462 175.0875 108 S 4.6351 8.5818 119.2101 57.3454 64.3515 174.3869 109 A 3.8759 9.0106 123.4509 55.8993 17.7263 179.8913 110 E 3.8960 8.2696 114.6912 59.5477 29.1950 178.9014 111 E 3.9206 7.6525 119.7150 59.0685 30.1135 178.4373 112 I 3.7983 7.8743 120.0049 64.2408 36.9700 178.2621 113 L 4.1204 8.0875 118.6639 56.5500 41.5014 177.7282 114 Q 4.4484 7.3944 115.3516 55.2375 29.7992 175.7079 115 A 4.1960 7.7274 121.8594 52.0036 18.9011 177.7590 116 S 4.6504 8.5794 114.5978 58.1615 64.7570 174.0549 117 N 5.0619 7.8557 120.2832 52.4688 35.6062 174.1566 118 L 5.0227 7.5827 118.4087 54.2210 44.2228 179.2863 119 R 4.2609 8.8661 122.7836 59.5354 30.8718 176.7598 120 S 4.6714 7.6768 107.4695 56.6734 65.6154 174.4456 121 P 4.2058 0.0000 0.0000 65.1126 31.4202 178.3057 122 L 3.7335 7.1609 117.2749 56.3484 42.2187 179.1712 123 V 3.9365 7.7125 119.5901 65.4631 31.4198 177.6824 124 A 3.9654 7.7647 119.8323 55.1545 18.3046 178.8784 125 E 3.7879 7.7228 117.2748 59.6153 29.5406 179.3806 126 S 4.1164 7.9424 115.1985 61.4457 62.7526 176.6722 127 I 3.5215 7.1514 121.4224 64.1475 36.7468 178.5601 128 R 3.8577 7.8380 118.9565 59.5933 29.6970 178.8958 129 C 4.0924 7.7821 115.1521 62.7676 28.3241 175.3158 130 Y 4.0320 8.3658 121.4483 60.9766 38.2716 178.1293 131 Q 4.0893 8.8283 118.5785 58.9262 28.9126 178.7583 132 S 4.2416 7.9841 113.6613 59.0977 63.1379 175.5125 133 G 3.6840 7.8673 110.7562 45.2720 0.0000 173.6723 134 Q 3.7700 7.4502 118.4537 56.0707 28.6550 175.8765 135 R 4.4356 7.7348 121.2814 54.2094 33.6236 174.3660 136 Y 5.1026 8.8505 120.4037 55.0501 42.2921 173.4500 137 P 4.7317 0.0000 0.0000 63.0412 32.4271 177.2928 138 L 4.1695 9.0269 122.3160 58.1014 42.0902 179.3326 139 E 4.0126 8.4411 115.9946 59.1430 29.5202 178.5992 140 M 4.0419 8.0447 119.3839 58.1582 32.1538 177.4210 141 I 4.3519 7.3926 110.1463 60.2686 37.9005 175.8436 142 G 3.7796 7.5039 110.6393 45.5639 0.0000 173.4609 143 D 4.6210 8.0209 119.2828 52.5575 40.5668 175.5437 144 F 4.8323 8.4759 120.4838 58.3140 42.2325 173.3780 145 N 3.8584 8.1882 125.0162 53.5240 36.0965 174.4606 146 W 4.3369 8.2088 126.9430 57.0975 31.2950 173.5990 147 P 4.1425 0.0000 0.0000 63.0637 31.4073 175.6655 148 F 4.9252 6.0912 117.5588 55.8232 41.2095 175.3787 149 T 4.1567 8.5458 116.9938 62.5107 67.1829 174.1777 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 M 8.30 4.49 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 2 F 8.43 4.24 0.00 3.10 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 3 K 7.13 4.00 0.00 1.47 1.44 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.23 1.28 7.81 4 P 0.00 4.47 0.00 2.13 2.19 0.00 3.62 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 5 H 8.77 4.67 0.00 2.93 3.39 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 V 8.59 4.93 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 1.33 0.00 0.00 1.09 0.00 0.00 7 T 9.29 5.25 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 1.23 0.00 0.00 8 V 9.15 5.16 2.41 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 1.19 0.00 0.00 1.11 0.00 0.00 9 A 9.20 5.24 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 10 C 8.38 5.39 0.00 2.94 2.91 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 11 V 9.00 4.17 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 0.75 0.00 0.00 0.95 0.00 0.00 12 V 8.49 4.89 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 1.00 0.00 0.00 0.97 0.00 0.00 13 H 8.97 5.30 0.00 2.88 3.22 0.00 5.67 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.73 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 9.65 3.44 0.00 1.87 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 2.08 2.04 0.00 16 G 7.91 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 17 K 7.59 4.93 0.00 1.83 1.89 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.40 7.81 18 F 9.82 5.28 0.00 2.78 2.82 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 0.00 0.00 0.00 0.00 19 L 8.70 3.93 0.00 0.27 1.06 -0.34 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.43 4.74 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 0.81 0.00 0.00 1.15 0.00 0.00 21 V 9.43 4.94 1.97 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 0.80 0.00 0.00 0.92 0.00 0.00 22 E 8.39 4.27 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 1.58 1.47 0.00 23 E 8.55 5.38 0.00 1.81 1.71 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 2.22 1.96 0.00 24 T 8.16 4.82 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 1.23 0.00 0.00 25 I 8.49 3.83 1.87 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 1.21 0.63 0.92 0.00 0.00 26 N 7.81 4.77 0.00 2.79 2.63 0.00 0.00 7.06 7.90 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 27 G 8.61 4.11 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 0.00 0.00 0.00 28 K 7.91 4.35 0.00 1.80 1.75 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.53 7.81 29 A 8.50 4.61 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 30 L 9.05 5.06 0.00 1.53 1.53 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 31 W 9.08 5.41 0.00 3.24 3.23 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 32 N 8.26 4.71 0.00 2.79 2.59 0.00 0.00 6.88 7.12 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 33 Q 8.26 4.46 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.84 0.00 0.00 0.00 0.00 0.00 2.53 2.42 0.00 34 P 0.00 4.58 0.00 2.08 2.00 0.00 3.74 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 35 A 9.44 5.09 1.28 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 0.00 0.00 0.00 36 G 7.19 4.78 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 0.00 0.00 0.00 37 H 8.29 5.20 0.00 3.10 3.33 0.00 5.72 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.83 4.21 0.00 1.69 1.65 1.03 0.84 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 39 E 9.40 4.61 0.00 2.12 1.87 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 2.33 2.30 0.00 40 A 8.97 3.94 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 41 D 8.15 4.57 0.00 3.08 3.24 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 42 E 7.72 5.04 0.00 2.11 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 2.29 2.36 0.00 43 T 8.78 3.78 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 1.03 0.00 0.00 44 L 8.14 3.87 0.00 1.54 1.74 -0.11 0.59 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 45 V 7.54 2.98 1.87 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 0.63 0.00 0.00 0.77 0.00 0.00 46 E 8.03 3.84 0.00 2.11 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 2.37 2.32 0.00 47 A 8.37 4.20 1.47 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 48 A 7.82 3.90 1.14 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 0.00 0.00 0.00 0.00 0.00 0.00 49 A 7.99 3.93 1.29 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 0.00 0.00 50 R 8.27 3.89 0.00 1.91 2.05 0.00 3.17 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 51 E 8.59 4.04 0.00 2.24 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 0.00 2.56 2.61 0.00 52 L 8.32 3.96 0.00 1.79 1.87 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 53 W 8.44 4.25 0.00 3.47 3.27 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 0.00 54 E 8.99 3.91 0.00 2.22 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 2.75 2.63 0.00 55 E 8.37 4.21 0.00 1.95 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 2.29 2.48 0.00 56 T 7.67 4.40 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 1.13 0.00 0.00 57 G 8.38 3.67 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 0.00 0.00 0.00 58 I 7.16 4.21 1.99 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 1.23 0.92 1.02 0.00 0.00 59 S 8.65 4.83 0.00 4.05 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 60 A 8.16 4.60 1.28 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 0.00 0.00 0.00 61 Q 8.56 4.25 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.78 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 62 P 0.00 4.31 0.00 1.82 1.65 0.00 3.58 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 63 Q 8.97 4.46 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.69 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 64 H 8.11 5.20 0.00 3.21 3.36 0.00 5.80 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 65 F 9.36 5.14 0.00 3.10 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 66 I 8.71 3.89 1.82 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.71 0.85 0.00 0.00 67 R 5.84 4.04 0.00 1.72 1.52 0.00 2.95 0.00 0.00 2.83 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.16 0.00 68 M 7.98 4.91 0.00 1.81 1.56 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.02 0.00 69 H 8.85 4.88 0.00 3.04 3.07 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 Q 8.77 5.13 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 71 W 9.24 5.29 0.00 3.65 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 72 I 8.30 4.60 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.66 0.84 0.00 0.00 73 A 7.99 3.44 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 74 P 0.00 4.26 0.00 2.08 2.18 0.00 3.71 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 2.13 2.21 0.00 75 D 8.03 4.53 0.00 2.76 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 76 K 7.96 3.75 0.00 2.01 2.00 0.00 1.58 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.28 1.33 7.81 77 T 8.20 3.76 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 0.05 0.00 0.00 78 P 0.00 4.80 0.00 2.20 2.18 0.00 3.25 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.13 0.00 79 F 9.45 5.49 0.00 2.80 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.91 5.05 0.00 1.78 1.81 1.05 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.91 5.17 0.00 2.02 1.86 0.00 3.05 0.00 0.00 3.16 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.46 0.00 82 F 9.43 4.81 0.00 3.16 2.85 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 83 L 9.14 4.97 0.00 1.74 1.63 1.02 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 84 F 9.48 5.66 0.00 3.34 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 85 A 9.63 5.48 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 86 I 8.88 4.88 2.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.85 1.06 0.00 0.00 87 E 9.10 5.17 0.00 1.93 1.97 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 2.42 2.40 0.00 88 L 8.51 4.84 0.00 1.54 1.57 1.12 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 89 E 8.95 4.09 0.00 1.92 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 2.27 0.00 90 Q 7.46 4.53 0.00 1.86 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.75 0.00 0.00 0.00 0.00 0.00 2.15 2.30 0.00 91 I 7.88 2.00 1.47 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.26 -0.30 0.16 0.00 0.00 92 C 7.63 4.88 0.00 3.06 2.85 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 93 P 0.00 4.55 0.00 2.24 2.12 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 94 T 8.24 4.74 4.34 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 1.21 0.00 0.00 95 Q 8.73 4.52 0.00 2.05 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.98 0.00 0.00 0.00 0.00 0.00 2.18 2.11 0.00 96 P 0.00 4.29 0.00 1.84 1.97 0.00 3.58 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.02 0.00 97 H 8.81 4.59 0.00 2.71 3.13 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 D 7.76 4.78 0.00 2.74 2.46 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 99 S 8.49 4.40 0.00 3.99 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 0.00 100 D 8.13 4.29 0.00 2.74 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 0.00 101 I 7.02 4.21 1.89 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 1.22 0.84 0.85 0.00 0.00 102 D 8.50 4.35 0.00 2.67 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 0.00 103 C 6.59 5.00 0.00 3.11 3.03 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 0.00 104 C 8.45 5.55 0.00 2.83 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.81 4.76 0.00 2.00 1.53 0.00 2.70 0.00 0.00 3.06 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.66 0.00 106 W 8.90 5.05 0.00 3.19 3.14 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 0.00 0.00 0.00 0.00 107 V 8.82 4.68 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 1.00 0.00 0.00 0.73 0.00 0.00 108 S 8.58 4.64 0.00 4.12 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 0.00 109 A 9.01 3.88 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 0.00 110 E 8.27 3.90 0.00 2.17 2.25 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 2.37 2.33 0.00 111 E 7.65 3.92 0.00 1.93 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 2.24 2.30 0.00 112 I 7.87 3.80 1.74 0.00 0.00 0.76 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 0.92 0.81 0.00 0.00 113 L 8.09 4.12 0.00 1.55 1.69 0.93 0.72 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 0.00 114 Q 7.39 4.45 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 115 A 7.73 4.20 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 0.00 116 S 8.58 4.65 0.00 3.98 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 0.00 117 N 7.86 5.06 0.00 3.16 3.11 0.00 0.00 6.16 6.67 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 0.00 118 L 7.58 5.02 0.00 1.63 1.63 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 119 R 8.87 4.26 0.00 1.89 1.98 0.00 3.38 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 120 S 7.68 4.67 0.00 4.15 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 0.00 121 P 0.00 4.21 0.00 1.87 2.03 0.00 3.52 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 2.12 2.11 0.00 122 L 7.16 3.73 0.00 1.15 1.30 -1.24 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 123 V 7.71 3.94 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 1.33 0.00 0.00 0.99 0.00 0.00 124 A 7.76 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 0.00 125 E 7.72 3.79 0.00 2.04 1.83 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 2.09 2.25 0.00 126 S 7.94 4.12 0.00 3.96 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 0.00 127 I 7.15 3.52 1.77 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 1.43 0.86 0.53 0.00 0.00 128 R 7.84 3.86 0.00 1.97 1.93 0.00 3.08 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.78 0.00 129 C 7.78 4.09 0.00 3.08 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 0.00 130 Y 8.37 4.03 0.00 3.08 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 0.00 131 Q 8.83 4.09 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.71 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 132 S 7.98 4.24 0.00 3.97 4.11 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 0.00 133 G 7.87 3.68 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 0.00 0.00 0.00 134 Q 7.45 3.77 0.00 1.91 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.54 0.00 0.00 0.00 0.00 0.00 2.19 2.16 0.00 135 R 7.73 4.44 0.00 1.38 1.61 0.00 3.29 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.37 0.00 136 Y 8.85 5.10 0.00 3.08 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 0.00 137 P 0.00 4.73 0.00 2.23 2.30 0.00 4.03 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 2.23 2.12 0.00 138 L 9.03 4.17 0.00 1.81 1.85 1.01 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 139 E 8.44 4.01 0.00 2.17 2.28 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 2.43 2.37 0.00 140 M 8.04 4.04 0.00 2.17 2.48 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 2.69 2.60 0.00 141 I 7.39 4.35 1.57 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.57 0.64 0.00 0.00 142 G 7.50 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 0.00 0.00 0.00 143 D 8.02 4.62 0.00 2.46 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 0.00 0.00 0.00 144 F 8.48 4.83 0.00 2.93 3.01 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 0.00 145 N 8.19 3.86 0.00 2.51 2.61 0.00 0.00 7.03 7.68 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 0.00 146 W 8.21 4.34 0.00 3.24 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 0.00 147 P 0.00 4.14 0.00 1.36 1.59 0.00 2.20 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.00 0.00 148 F 6.09 4.93 0.00 3.05 2.88 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 0.00 149 T 8.55 4.16 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 1.26 0.00 0.00