NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2368 8.4449 120.2166 55.8960 31.3742 176.2856 3 L 3.9323 7.9273 120.0246 53.1469 39.5041 175.4484 4 T 4.2690 7.9662 113.7695 60.0218 72.8769 173.2685 5 P 4.1118 0.0000 0.0000 66.0741 31.0384 178.2936 6 E 3.8505 8.1319 116.2623 59.5156 29.4840 178.7191 7 V 3.6448 7.0269 114.1903 65.4582 31.9503 176.6852 8 L 4.2401 7.8681 116.6843 55.1870 42.2126 175.9495 9 T 4.8868 7.7364 116.7922 62.2637 69.2530 174.2287 10 V 4.6254 8.2835 118.8720 58.4246 36.7715 173.1856 11 P 4.7078 0.0000 0.0000 62.9932 31.8213 177.5475 12 L 4.1178 9.8460 128.9274 57.5681 43.1150 175.9057 13 N 5.3443 7.7259 113.9126 51.3088 40.3684 174.2590 14 S 4.1340 8.5283 111.0146 60.0768 63.4737 174.7397 15 E 4.0854 8.3854 120.3339 57.0354 29.3642 177.4143 16 G 4.0892 7.6003 106.3194 44.8485 0.0000 174.5021 17 K 4.3365 8.2346 119.9693 56.6418 33.3552 176.0736 18 T 5.3559 8.3157 112.7776 60.1443 72.3982 172.6062 19 I 4.5447 8.4978 120.3008 60.0257 41.9443 173.6838 20 T 4.9075 8.3900 125.6487 61.6225 69.1919 174.3038 21 L 4.4763 8.5149 127.2419 54.9890 42.6227 177.7266 22 T 4.3610 8.9913 112.3433 60.5251 70.4517 175.5661 23 E 3.9771 8.7062 122.5295 59.5634 29.6157 179.1455 24 K 4.0534 8.0429 117.6211 59.0747 32.0837 179.0842 25 Q 4.1041 8.0373 118.8363 58.5741 28.7374 177.7410 26 Y 4.1065 8.0668 120.7619 60.6895 38.8892 178.0521 27 L 3.8215 8.2652 120.1377 57.7901 41.7565 179.0861 28 E 4.0289 8.3196 119.3974 59.1482 29.4798 179.0997 29 G 3.5733 8.2397 105.9104 47.6550 0.0000 175.7962 30 K 3.5372 7.6199 120.8522 58.9676 32.0430 179.2154 31 R 3.8421 7.8719 118.7940 59.6455 29.9950 178.4925 32 L 4.1286 8.5733 118.9332 57.9024 41.5536 179.4677 33 F 4.0814 8.7591 121.0362 61.2925 39.0908 177.2394 34 Q 4.0714 8.1721 117.0751 58.5291 28.5667 177.6968 35 Y 4.2452 7.9503 120.0167 60.1122 39.1128 176.7401 36 A 4.3230 7.9766 117.4854 51.9609 20.4024 176.4772 37 C 4.3395 7.3492 112.9173 60.0088 31.0048 176.1268 38 A 4.3355 7.8520 122.9298 54.8408 18.1373 179.6045 39 S 4.1068 8.0062 109.7413 60.7197 63.1455 174.6437 40 C 4.6061 7.9216 118.7877 59.2360 33.5016 174.1927 41 H 5.9038 8.7690 115.8687 54.4588 28.9206 173.8802 42 V 3.8191 7.4855 119.7842 63.6975 30.8253 176.6518 43 G 4.0181 10.1834 110.4438 46.3087 0.0000 174.9202 44 G 2.5380 8.3601 108.0635 45.2022 0.0000 174.2824 45 I 4.2362 6.9445 113.9161 59.8196 39.2195 174.6315 46 T 4.7060 7.8870 115.5143 61.8879 71.0101 174.8859 47 K 3.9864 8.7186 127.7688 59.6373 32.3440 179.8395 48 T 4.0487 7.5850 108.4953 64.0082 69.0621 174.5276 49 N 4.8410 7.8262 119.5680 51.3595 40.2623 172.2736 50 P 4.3019 0.0000 0.0000 64.5371 31.7811 178.1629 51 S 4.1277 7.9594 110.6013 60.6366 63.3475 174.8940 52 L 4.1327 7.3346 123.4655 53.1652 39.6576 175.1519 53 D 4.8339 7.3725 120.5839 51.8512 41.4773 177.0342 54 L 4.5668 7.9713 116.7112 54.6556 41.8369 177.7704 55 R 4.2536 8.7056 120.5250 56.6053 31.5823 177.1485 56 T 3.9511 8.8694 122.4830 67.0093 68.5604 176.1935 57 E 3.9445 8.2153 120.3353 59.6489 29.5398 178.6890 58 T 3.9999 7.9437 113.9031 66.7717 68.7650 175.9832 59 L 4.2157 8.1556 120.4792 57.8986 41.4720 179.4108 60 A 4.1510 8.0598 119.5589 54.7050 18.3328 178.6482 61 L 4.3665 7.4467 113.9973 54.1049 42.2494 176.5027 62 A 3.0264 7.4118 121.9007 51.3844 20.0653 177.3413 63 T 4.5340 7.9992 114.5024 61.2062 71.9512 172.9295 64 P 4.7292 0.0000 0.0000 61.2443 32.8265 174.4348 65 P 4.1627 0.0000 0.0000 63.8268 31.4841 176.5938 66 R 4.6635 8.6239 120.3107 56.0894 30.7007 175.4467 67 D 4.9591 7.9154 116.6760 53.0878 40.3413 176.1239 68 N 5.1620 7.7264 115.5448 51.4865 41.8493 173.5342 69 I 3.6714 8.5636 122.2532 64.7791 37.2416 178.2157 70 E 4.0345 8.8348 119.4060 59.8358 29.5503 179.7929 71 G 3.8396 9.6204 106.3601 48.1354 0.0000 175.5967 72 L 4.1083 8.1478 121.1811 57.3314 41.8091 179.5086 73 V 3.6403 8.2951 118.6821 66.2733 31.3823 177.5346 74 D 4.4578 8.7126 117.9202 57.5457 40.7589 177.6699 75 Y 3.8044 7.7229 119.1199 60.8542 39.1921 177.5008 76 M 4.3316 8.5188 118.7033 57.1664 32.1187 177.8733 77 K 4.1659 7.5315 117.3288 57.7866 34.4024 175.7480 78 N 5.1823 8.6729 119.2095 51.1002 39.6641 171.6898 79 P 3.2635 0.0000 0.0000 62.0172 32.9822 175.6627 80 T 5.1768 7.5399 111.1811 59.6951 73.1082 173.1121 81 T 4.3838 8.5944 112.8514 61.1539 69.9567 174.8319 82 Y 4.2656 8.6827 121.7381 60.2080 38.8065 176.4709 83 D 4.5467 8.2630 116.8725 52.6075 40.0255 177.1392 84 G 4.3955 8.0913 107.2456 45.4880 0.0000 174.7666 85 E 4.1501 9.4371 120.6013 58.0349 30.0006 176.9693 86 Q 4.5014 7.8063 118.7597 53.9072 32.1046 173.9539 87 E 4.5608 8.7307 124.8535 56.4381 30.6040 176.6222 88 I 4.6990 8.6085 115.6531 60.3804 37.8603 177.3972 89 A 4.4033 8.0177 124.3928 55.5231 18.7036 179.6015 90 E 4.1047 8.2377 114.9888 57.7543 30.0643 177.0580 91 V 4.3500 7.4694 116.8013 63.7616 33.6079 174.8059 92 H 4.5410 8.2842 120.2002 53.1110 30.9118 171.9726 93 P 3.2592 0.0000 0.0000 62.9140 31.4820 175.3945 94 S 4.6803 7.6511 114.7513 57.7536 65.8357 176.1217 95 L 4.1940 8.6267 120.8616 57.8020 41.4416 179.4971 96 R 4.1336 7.6638 116.7425 58.4070 30.4012 177.3733 97 S 4.8403 7.9656 112.3893 57.8848 63.5393 176.0638 98 A 4.4052 8.1683 125.7900 55.7513 18.5231 179.4924 99 D 4.4929 8.1874 115.3232 55.5868 39.7167 177.2524 100 I 4.0393 7.5509 110.7380 60.7678 39.1558 175.5778 101 F 5.0084 7.6162 119.9530 54.7713 38.8351 173.6694 102 P 4.2562 0.0000 0.0000 65.7715 31.8185 179.2049 103 K 4.1115 8.0508 115.4510 59.0984 32.2051 177.8307 104 M 4.3362 8.5224 118.8844 57.3830 32.3819 178.6852 105 R 3.9695 8.1129 118.0226 59.3665 30.2482 177.1046 106 N 4.8266 8.1780 112.4616 53.1750 38.5643 174.2158 107 L 4.7474 7.6140 118.9642 53.6750 43.2321 177.1534 108 T 4.5275 9.2113 114.4772 60.0469 72.1064 175.4485 109 E 3.9466 8.6284 121.5961 59.4671 29.5138 178.7943 110 K 3.9243 8.0219 118.9438 59.5998 32.3148 178.2070 111 D 4.3958 8.1249 119.0745 57.5928 40.7908 178.9027 112 L 4.0620 8.4272 119.7245 57.7508 41.4546 179.8616 113 V 3.6281 7.8589 118.2032 65.6727 31.3971 178.0177 114 A 3.9801 8.1030 120.5413 55.2895 18.4366 179.4000 115 I 3.7424 7.9424 118.1692 64.7255 37.2346 178.4315 116 A 4.1643 8.1834 121.4530 55.2361 18.2437 179.8421 117 G 3.6307 8.3448 104.4942 48.1398 0.0000 175.3399 118 H 3.9870 8.5165 120.7906 59.1715 29.6654 177.4315 119 I 3.4019 7.3050 119.8901 64.2574 37.0321 178.0342 120 L 4.1263 7.6182 118.2207 56.5524 41.8702 179.1586 121 V 3.7093 7.5692 118.5074 65.4915 31.7095 177.5010 122 E 3.5754 7.4096 118.6934 59.0159 29.1361 177.9612 123 P 4.4712 0.0000 0.0000 65.6864 30.9067 178.0146 124 K 4.0566 8.2202 117.0515 58.0020 32.0571 178.2750 125 I 4.1439 7.2852 118.7362 62.9886 38.2642 177.1080 126 L 4.3439 8.3498 118.3174 54.9094 42.4610 178.9910 127 G 3.9574 8.7261 107.6711 46.2147 0.0000 176.1944 128 D 4.4316 8.8728 120.9616 57.0789 41.3009 178.3774 129 K 4.2474 8.3330 118.3099 59.2514 32.4629 178.3014 130 W 4.6522 7.7392 128.0510 58.7057 31.7212 178.2237 131 G 3.6565 8.9270 107.5286 46.2925 0.0000 173.8319 132 G 3.8083 8.8892 105.2400 44.3090 0.0000 172.3646 133 G 4.2328 7.9993 112.9484 45.5095 0.0000 174.4483 134 K 4.2306 8.1306 124.5380 58.7803 32.9596 180.0391 135 V 3.3305 7.7787 117.8476 65.5458 31.6661 176.1976 136 Y 4.5437 7.8757 118.4549 58.5085 39.3321 174.4973 137 Y 4.4633 8.5218 122.4327 59.0446 39.8558 173.5079 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 2 E 8.44 4.24 0.00 1.93 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 2.18 2.31 0.00 3 L 7.93 3.93 0.00 1.57 1.41 0.60 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.97 4.27 4.20 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 1.17 0.00 0.00 5 P 0.00 4.11 0.00 2.14 2.12 0.00 3.58 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 2.09 2.13 0.00 6 E 8.13 3.85 0.00 1.91 1.96 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 2.27 2.41 0.00 7 V 7.03 3.64 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 0.71 0.00 0.00 0.92 0.00 0.00 8 L 7.87 4.24 0.00 1.70 1.77 0.88 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 9 T 7.74 4.89 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 1.23 0.00 0.00 10 V 8.28 4.63 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 0.78 0.00 0.00 0.92 0.00 0.00 11 P 0.00 4.71 0.00 2.07 1.98 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 12 L 9.85 4.12 0.00 1.56 1.71 0.93 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 13 N 7.73 5.34 0.00 3.07 3.21 0.00 0.00 5.98 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 14 S 8.53 4.13 0.00 4.00 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 15 E 8.39 4.09 0.00 2.12 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 2.34 2.30 0.00 16 G 7.60 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 4.34 0.00 1.70 1.74 0.00 1.62 0.00 0.00 1.87 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.64 1.38 7.81 18 T 8.32 5.36 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 1.26 0.00 0.00 19 I 8.50 4.54 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 1.23 1.25 0.95 0.00 0.00 20 T 8.39 4.91 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 1.19 0.00 0.00 21 L 8.51 4.48 0.00 1.55 1.64 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.99 4.36 4.25 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 1.28 0.00 0.00 23 E 8.71 3.98 0.00 2.05 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 2.44 2.44 0.00 24 K 8.04 4.05 0.00 1.86 1.86 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.55 7.81 25 Q 8.04 4.10 0.00 2.45 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 26 Y 8.07 4.11 0.00 3.00 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 27 L 8.27 3.82 0.00 1.73 1.69 0.96 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.32 4.03 0.00 2.23 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 2.31 2.37 0.00 29 G 8.24 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 0.00 0.00 0.00 30 K 7.62 3.54 0.00 1.79 1.73 0.00 1.44 0.00 0.00 1.26 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.25 0.88 7.81 31 R 7.87 3.84 0.00 1.86 2.08 0.00 3.05 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 32 L 8.57 4.13 0.00 1.79 1.81 1.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.76 4.08 0.00 3.09 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 34 Q 8.17 4.07 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.74 0.00 0.00 0.00 0.00 0.00 2.54 2.77 0.00 35 Y 7.95 4.25 0.00 2.98 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 36 A 7.98 4.32 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 37 C 7.35 4.34 0.00 1.30 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 0.00 0.00 0.00 0.00 38 A 7.85 4.34 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 S 8.01 4.11 0.00 3.93 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 40 C 7.92 4.61 0.00 2.80 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.77 5.90 0.00 3.25 3.39 0.00 5.72 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 V 7.49 3.82 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 0.93 0.00 0.00 0.97 0.00 0.00 43 G 10.18 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 0.00 0.00 0.00 44 G 8.36 2.54 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 0.00 45 I 6.94 4.24 1.81 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 1.58 0.87 0.95 0.00 0.00 46 T 7.89 4.71 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 1.21 0.00 0.00 47 K 8.72 3.99 0.00 1.74 1.78 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.57 7.81 48 T 7.59 4.05 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 1.18 0.00 0.00 49 N 7.83 4.84 0.00 2.74 2.65 0.00 0.00 6.98 7.59 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 50 P 0.00 4.30 0.00 1.99 2.05 0.00 3.73 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 51 S 7.96 4.13 0.00 3.85 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 52 L 7.33 4.13 0.00 1.62 1.58 0.90 0.69 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 53 D 7.37 4.83 0.00 2.85 2.59 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 54 L 7.97 4.57 0.00 1.69 1.95 1.07 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 55 R 8.71 4.25 0.00 2.20 1.85 0.00 3.12 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.74 0.00 56 T 8.87 3.95 4.29 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 1.24 0.00 0.00 57 E 8.22 3.94 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 2.41 2.51 0.00 58 T 7.94 4.00 4.44 0.00 0.00 0.00 0.00 0.00 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 59 L 8.16 4.22 0.00 1.94 1.77 1.07 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 60 A 8.06 4.15 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.45 4.37 0.00 1.79 1.76 0.99 0.94 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 62 A 7.41 3.03 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 63 T 8.00 4.53 4.15 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 1.20 0.00 0.00 64 P 0.00 4.73 0.00 2.08 2.05 0.00 3.83 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 2.02 2.01 0.00 65 P 0.00 4.16 0.00 2.06 2.17 0.00 3.62 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 66 R 8.62 4.66 0.00 1.77 1.88 0.00 3.60 0.00 0.00 3.39 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.54 0.00 67 D 7.92 4.96 0.00 2.79 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 68 N 7.73 5.16 0.00 3.01 2.90 0.00 0.00 6.11 7.83 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 69 I 8.56 3.67 2.05 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 1.71 0.78 0.93 0.00 0.00 70 E 8.83 4.03 0.00 2.19 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 2.36 2.44 0.00 71 G 9.62 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 0.00 0.00 0.00 72 L 8.15 4.11 0.00 1.89 1.78 0.98 0.62 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 73 V 8.30 3.64 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 1.05 0.00 0.00 0.99 0.00 0.00 74 D 8.71 4.46 0.00 2.80 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 75 Y 7.72 3.80 0.00 3.20 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.52 4.33 0.00 2.18 2.31 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.69 0.00 77 K 7.53 4.17 0.00 1.96 1.83 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.55 7.81 78 N 8.67 5.18 0.00 2.57 2.61 0.00 0.00 7.30 8.26 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 79 P 0.00 3.26 0.00 1.59 1.44 0.00 3.55 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 1.96 1.96 0.00 80 T 7.54 5.18 4.24 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 1.18 0.00 0.00 81 T 8.59 4.38 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 1.28 0.00 0.00 82 Y 8.68 4.27 0.00 2.96 3.05 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 0.00 0.00 0.00 83 D 8.26 4.55 0.00 2.81 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 84 G 8.09 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.44 4.15 0.00 2.14 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 2.35 2.25 0.00 86 Q 7.81 4.50 0.00 2.10 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 7.00 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 87 E 8.73 4.56 0.00 1.98 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 2.28 2.28 0.00 88 I 8.61 4.70 1.91 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.91 1.00 0.00 0.00 89 A 8.02 4.40 1.35 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 90 E 8.24 4.10 0.00 1.97 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 2.29 2.28 0.00 91 V 7.47 4.35 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 0.89 0.00 0.00 0.99 0.00 0.00 92 H 8.28 4.54 0.00 3.23 3.17 0.00 5.66 0.00 0.00 0.00 0.00 6.68 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 3.26 0.00 1.70 1.38 0.00 3.13 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.44 0.00 94 S 7.65 4.68 0.00 4.23 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 95 L 8.63 4.19 0.00 1.67 1.80 0.99 0.81 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 96 R 7.66 4.13 0.00 1.94 2.01 0.00 3.14 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 97 S 7.97 4.84 0.00 4.26 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 0.00 98 A 8.17 4.41 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.19 4.49 0.00 2.78 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 0.00 100 I 7.55 4.04 1.45 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 -0.13 0.77 0.00 0.00 101 F 7.62 5.01 0.00 3.27 2.89 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 0.00 102 P 0.00 4.26 0.00 2.20 2.17 0.00 3.64 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 2.13 2.16 0.00 103 K 8.05 4.11 0.00 1.61 1.59 0.00 1.35 0.00 0.00 0.66 0.00 0.00 2.78 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.19 1.34 7.81 104 M 8.52 4.34 0.00 2.09 2.31 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.77 0.00 105 R 8.11 3.97 0.00 1.91 2.04 0.00 3.19 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 106 N 8.18 4.83 0.00 2.79 2.83 0.00 0.00 6.83 7.85 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 0.00 107 L 7.61 4.75 0.00 1.67 1.65 1.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 108 T 9.21 4.53 4.25 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 1.28 0.00 0.00 109 E 8.63 3.95 0.00 2.11 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 2.40 2.46 0.00 110 K 8.02 3.92 0.00 1.87 1.80 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.55 7.81 111 D 8.12 4.40 0.00 3.05 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 0.00 112 L 8.43 4.06 0.00 1.82 1.77 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.86 3.63 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 1.12 0.00 0.00 1.00 0.00 0.00 114 A 8.10 3.98 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 0.00 115 I 7.94 3.74 2.11 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.35 1.12 0.00 0.00 116 A 8.18 4.16 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 0.00 117 G 8.34 3.63 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 0.00 0.00 0.00 118 H 8.52 3.99 0.00 3.11 3.43 0.00 5.79 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 0.00 119 I 7.31 3.40 2.05 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.93 1.07 0.00 0.00 120 L 7.62 4.13 0.00 1.59 1.68 0.92 0.95 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 0.00 121 V 7.57 3.71 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 0.91 0.00 0.00 1.01 0.00 0.00 122 E 7.41 3.58 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 1.52 1.47 0.00 123 P 0.00 4.47 0.00 2.26 2.38 0.00 3.16 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.92 0.00 124 K 8.22 4.06 0.00 1.77 1.84 0.00 1.75 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.40 7.81 125 I 7.29 4.14 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.45 0.92 0.00 0.00 126 L 8.35 4.34 0.00 1.67 1.83 1.05 1.01 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 0.00 127 G 8.73 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 0.00 0.00 0.00 128 D 8.87 4.43 0.00 2.77 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 0.00 129 K 8.33 4.25 0.00 1.93 2.02 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.62 1.64 7.81 130 W 7.74 4.65 0.00 3.28 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 0.00 131 G 8.93 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 G 8.89 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 0.00 133 G 8.00 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 0.00 0.00 0.00 134 K 8.13 4.23 0.00 1.86 1.88 0.00 1.73 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.56 1.41 7.81 135 V 7.78 3.33 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 0.79 0.00 0.00 0.97 0.00 0.00 136 Y 7.88 4.54 0.00 2.83 2.95 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 0.00 137 Y 8.52 4.46 0.00 3.22 2.45 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