NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.3560 8.1233 123.5820 51.9737 20.1982 177.8802 1 M 3.9855 8.4479 120.6405 57.7843 31.9155 177.5915 2 A 4.0184 8.7191 122.0122 55.1137 19.1295 179.0000 3 E 3.9202 8.1268 116.6999 59.4750 29.4965 179.2430 4 L 3.9632 7.6301 119.1707 57.9979 42.1785 178.6713 5 Q 3.9525 8.1202 119.6081 59.4425 28.8959 178.2188 6 M 4.0607 8.0132 119.6034 58.4471 32.0446 178.8207 7 L 3.9829 7.8186 118.8407 57.8219 41.5970 179.6699 8 L 4.0066 8.1011 118.0783 57.5190 41.7299 178.6795 9 E 4.3849 8.1606 116.4418 57.0381 30.1097 176.1012 10 E 4.5344 7.8198 115.3240 57.7043 32.2455 177.9344 11 E 3.9856 8.6278 118.4550 59.3619 29.4977 179.5841 12 I 3.7928 7.9098 119.8739 63.8253 37.2471 176.6670 13 P 4.3746 0.0000 0.0000 65.3567 31.1802 178.9143 14 G 3.7003 8.4853 105.0574 47.8338 0.0000 176.0974 15 G 3.6727 8.3062 108.4862 47.4247 0.0000 176.1380 16 R 4.0170 8.2152 120.3983 59.0752 30.0427 179.2093 17 R 3.9806 8.2565 117.7830 59.3829 30.1169 179.0118 18 A 4.0502 8.2273 120.3258 54.8800 18.3690 179.4134 19 L 4.0362 7.6801 119.0152 58.1365 42.3826 178.8205 20 F 4.2066 8.5603 120.7301 61.1964 39.2772 176.9563 21 D 4.4443 8.6232 119.0034 57.4207 40.6357 178.5528 22 S 4.1764 8.1718 113.6784 61.4589 62.4071 175.6843 23 Y 4.0556 7.7964 122.0588 60.8127 38.1238 178.1008 24 T 3.3900 7.4887 110.3127 64.5354 68.9750 176.5416 25 N 4.2590 8.4148 119.8426 56.0492 38.5630 177.4606 26 L 4.0342 7.8395 119.8969 57.1630 41.6800 179.1445 27 E 3.8151 7.5364 119.1075 59.1959 29.4240 179.0029 28 R 3.9076 7.6005 117.7212 58.9466 30.1106 179.0860 29 V 3.2995 8.0734 118.3439 65.7845 31.4976 177.9653 30 A 3.9397 8.1365 120.6217 55.1715 18.1901 179.1371 31 D 4.2694 7.9055 117.2746 57.7263 40.8660 178.3841 32 Y 4.0022 8.1513 119.9066 61.1485 38.2978 177.9460 33 C 3.8157 8.1936 117.4648 62.7291 28.0574 176.0052 34 E 3.9013 8.1506 120.6948 59.3294 29.3432 178.6407 35 N 4.2556 8.3805 116.8850 56.3141 38.7067 176.6742 36 N 4.0121 8.4155 119.1285 56.9434 38.5723 176.1369 37 Y 3.8771 7.3263 118.2562 60.8110 39.0172 177.6734 38 I 3.8619 7.4285 119.2593 64.4833 37.3013 178.0629 39 Q 4.1016 8.3819 117.6197 56.7502 29.1159 176.4164 40 S 4.5629 7.1359 115.4695 57.0061 64.2860 174.3196 41 A 4.0325 8.3726 126.7117 54.9464 18.6722 177.9884 42 D 4.5991 7.6575 116.4566 53.4712 39.8272 176.4686 43 K 3.6591 8.0680 124.0205 58.6368 32.4771 178.1511 44 Q 4.0012 8.0068 119.4536 59.3534 29.1563 178.3272 45 R 3.9519 7.8918 118.2844 59.1454 30.0948 178.3545 46 A 4.0642 7.7617 121.0125 54.9692 18.4123 179.3881 47 L 3.9606 8.3372 118.9916 58.3820 42.3014 178.6125 48 E 4.0711 8.1924 119.1573 59.4617 29.4131 178.5415 49 E 4.0442 8.1567 118.8717 59.2903 29.7032 178.8752 50 T 4.0170 8.0618 115.8183 66.6730 68.5945 176.4055 51 K 3.8512 8.5352 120.5861 59.7751 32.1393 179.0265 52 A 3.9450 7.9441 120.3570 55.5398 18.3470 179.3949 53 Y 4.1364 8.2321 115.0638 61.1039 37.7461 178.9237 54 T 3.9140 8.1245 117.0904 66.9384 68.6848 176.6432 55 T 3.8620 7.8150 117.5630 66.9046 68.5356 176.2683 56 Q 3.9789 8.0598 121.1582 59.3623 29.0373 178.6778 57 S 4.1512 8.2378 116.0938 61.4718 62.9613 176.3399 58 L 3.9659 8.2688 123.1019 58.1976 41.9675 178.9362 59 A 4.0427 8.1323 120.7061 55.0532 18.2794 179.6446 60 S 4.0613 8.1496 111.7287 61.4836 62.5641 176.5252 61 V 3.5973 7.9622 120.6825 66.0123 31.2766 177.6002 62 A 4.0251 7.9396 120.3940 55.4130 18.1172 178.9904 63 Y 3.9011 7.9840 117.3370 61.0259 39.1092 178.3412 64 L 4.0385 8.2656 119.8498 57.6417 41.5591 179.7709 65 I 3.7192 7.8584 119.9789 64.3267 37.1336 177.7146 66 N 4.1967 8.1996 117.9885 57.0687 38.7999 177.0352 67 T 3.6573 7.7661 117.0082 66.5551 68.5515 176.6388 68 L 3.9730 7.7757 121.5949 57.7226 42.0221 178.8283 69 A 3.9159 8.2974 121.2573 55.3262 18.4171 179.1790 70 N 4.2216 8.0049 114.9531 56.7652 38.5913 177.4294 71 N 4.3500 8.0634 117.3361 56.1207 38.6270 177.7205 72 V 3.5769 7.7823 119.7308 65.9864 31.6541 178.0520 73 L 3.9911 8.0603 118.8347 57.8836 41.4342 179.3372 74 Q 3.9494 8.0676 119.4672 59.3280 28.9668 177.9800 75 M 4.0356 8.0348 119.3147 58.6251 32.2672 178.2690 76 L 4.0439 8.0692 119.2099 57.7160 41.9159 179.1073 77 D 4.3677 8.2679 118.9972 57.3979 40.7312 178.9648 78 I 3.7492 7.7673 120.3057 64.5275 37.0952 178.5763 79 Q 4.8323 8.3935 120.0573 58.2111 28.4764 178.5953 80 A 3.9658 8.1668 122.1997 55.3362 18.5807 179.9738 81 S 4.1379 7.9642 111.9931 61.4009 62.9375 176.6725 82 Q 3.9765 8.0097 122.0846 58.9576 28.3955 178.6339 83 L 4.0433 7.8049 119.6318 57.6251 41.5213 179.6012 84 R 3.9250 8.0963 118.1311 59.5091 30.0207 179.3611 85 R 3.9652 7.9876 117.6624 59.2368 29.9736 178.7782 86 M 4.0488 8.0122 118.2895 58.3071 32.2073 177.9132 87 E 3.8706 8.5525 120.0390 59.3354 29.7322 178.5492 88 S 4.0257 7.7508 113.2564 61.7376 62.2159 176.4779 89 S 4.1859 7.9800 117.6544 61.5386 62.4968 176.7665 90 I 3.7351 8.1270 123.0339 64.2158 36.7671 177.8549 91 N 4.2469 8.5509 118.3755 57.1882 38.7603 176.6601 92 H 4.4537 7.9462 117.3806 58.8734 28.6562 177.9103 93 I 3.7355 7.6418 121.7337 64.2894 36.8343 178.4159 94 S 4.0646 8.3061 114.1179 61.5207 62.2003 176.0828 95 Q 4.0089 8.3110 120.9243 59.4944 28.5955 179.2122 96 T 3.8743 8.0035 116.6294 66.5464 68.4407 177.0104 97 V 3.6419 8.1294 120.4799 65.8532 31.5665 177.6667 98 D 4.3726 8.3797 119.0031 57.6275 40.7416 178.6935 99 I 3.6775 7.9115 120.1967 64.9302 37.1494 177.9704 100 H 4.1614 8.1540 118.3298 59.2829 29.8100 177.5399 101 K 3.9880 8.2644 120.3265 59.1853 31.7726 179.0664 102 E 3.9508 8.1781 119.8798 59.0662 29.5683 178.8991 103 K 3.9447 8.0201 118.6544 59.4590 32.1046 179.4443 104 V 3.5267 7.6960 118.2369 65.8348 31.4190 177.9624 105 A 3.9738 7.7488 120.0142 55.3358 18.2650 179.8964 106 R 3.8999 8.4172 117.0539 59.2467 30.2231 179.2970 107 R 3.8811 8.1519 118.7177 59.3153 29.8463 178.2656 108 E 4.0143 7.9819 118.2700 59.2941 30.0808 178.3419 109 I 3.9871 7.9824 118.6676 63.5596 38.1184 177.9800 110 G 3.6721 8.1592 106.8971 47.7094 0.0000 175.6351 111 I 3.8061 7.2192 120.0328 63.8000 37.0986 176.8026 112 L 4.4851 7.5533 117.2910 54.5723 41.6194 176.2242 113 T 4.6581 7.4335 108.6061 60.1907 70.9490 173.3449 114 T 4.6834 7.8737 115.5692 60.0491 70.7688 173.1312 115 N 4.4170 8.6167 122.8177 53.0615 39.0241 174.9074 116 K 4.2882 8.4640 122.4590 56.0878 34.1794 177.6305 117 N 4.6569 8.5350 125.3346 52.4138 37.4577 174.7317 118 T 4.5724 7.4540 112.2279 60.0964 69.9512 172.9630 119 S 4.7549 8.3603 121.5755 56.5324 66.4528 172.6924 120 R 4.5757 8.2644 120.2627 54.9462 31.8647 174.6784 121 T 4.5109 7.8356 116.6758 61.3851 70.4603 172.2474 122 H 4.7182 8.4083 118.6104 54.6016 29.9872 175.9440 123 K 4.1003 8.8368 121.7167 59.1477 32.0412 177.5919 124 I 4.4953 7.5784 116.8945 59.3207 40.0216 174.8244 125 I 4.2748 8.2552 125.5814 59.0913 38.3095 175.4444 126 A 4.1923 8.3659 128.9478 50.9158 18.9750 175.2734 127 P 4.4077 0.0000 0.0000 62.2510 32.2328 176.3222 128 A 4.0639 8.7384 123.1262 54.8070 18.2758 177.7834 129 N 4.9440 7.8038 112.3501 51.0762 40.5769 174.6003 130 L 4.1204 8.3615 123.7207 54.0825 42.4448 176.6768 131 E 3.9569 8.5830 123.5225 55.9487 29.9535 176.4905 132 R 4.0079 8.4766 127.2274 55.4437 30.7039 174.0436 133 P 4.3794 0.0000 0.0000 62.3537 31.8345 175.8687 134 V 4.2591 8.1585 123.1941 59.7791 32.9978 175.7245 135 R 4.1047 8.3588 124.4281 55.8747 30.7350 174.9216 136 Y 4.3974 8.5432 125.8746 57.1502 39.2488 174.4992 137 I 4.1895 7.6045 127.6471 59.0211 39.8301 175.4958 138 R 3.8267 8.0865 125.0338 55.6381 30.5422 176.1651 139 K 4.5746 8.0808 120.8748 54.1107 35.6118 174.4699 140 P 4.3752 0.0000 0.0000 62.0482 31.9565 176.2906 141 I 3.5213 8.0681 121.2876 61.6051 37.2060 175.2498 142 D 4.6374 8.3038 124.6029 52.8011 42.7516 174.5201 143 Y 4.8214 8.5315 123.6797 58.4082 38.1794 176.0881 144 T 4.6414 8.2681 110.6944 61.5493 69.8006 176.0048 145 I 3.9471 7.8310 115.0138 62.5706 37.8779 176.1909 146 L 4.6892 7.6584 120.1280 54.6400 42.8932 177.7636 147 D 4.4146 8.2805 120.6310 57.1080 40.8215 177.5172 148 D 4.6403 8.0192 116.0740 54.4246 41.3182 175.8233 149 I 4.2301 7.5233 121.7066 60.3271 38.6260 176.7333 150 G 3.7937 8.4914 115.5415 46.4199 0.0000 174.3009 151 H 4.5122 8.6644 113.3178 54.4371 27.3680 175.2009 152 G 4.3016 8.2344 111.6735 44.4259 0.0000 170.8802 153 V 4.4292 7.9494 118.3607 59.5528 34.0322 175.3970 154 K 4.5374 8.4270 122.9619 54.5749 33.8970 176.8906 155 V 3.8169 8.1906 119.5020 62.1218 31.4716 176.0652 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 0 A 8.12 4.36 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 1 M 8.45 3.99 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.61 0.00 2 A 8.72 4.02 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 3 E 8.13 3.92 0.00 2.18 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 2.40 2.37 0.00 4 L 7.63 3.96 0.00 1.80 1.81 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 8.12 3.95 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 6 M 8.01 4.06 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.73 0.00 7 L 7.82 3.98 0.00 1.88 1.71 0.92 0.67 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 8 L 8.10 4.01 0.00 1.63 1.72 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.16 4.38 0.00 2.09 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 2.29 2.33 0.00 10 E 7.82 4.53 0.00 2.17 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 0.00 2.28 2.28 0.00 11 E 8.63 3.99 0.00 1.99 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 2.33 2.35 0.00 12 I 7.91 3.79 1.98 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 1.52 0.77 0.91 0.00 0.00 13 P 0.00 4.37 0.00 2.15 2.09 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.14 0.00 14 G 8.49 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.31 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 16 R 8.22 4.02 0.00 2.10 2.00 0.00 3.14 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 17 R 8.26 3.98 0.00 2.12 2.03 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 18 A 8.23 4.05 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 19 L 7.68 4.04 0.00 2.08 1.84 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.56 4.21 0.00 3.23 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 21 D 8.62 4.44 0.00 2.97 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 22 S 8.17 4.18 0.00 4.06 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 23 Y 7.80 4.06 0.00 2.94 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 24 T 7.49 3.39 4.07 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 0.98 0.00 0.00 25 N 8.41 4.26 0.00 2.74 2.87 0.00 0.00 7.06 6.47 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 26 L 7.84 4.03 0.00 1.71 1.69 0.97 0.87 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 27 E 7.54 3.82 0.00 2.00 1.82 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 2.19 2.21 0.00 28 R 7.60 3.91 0.00 1.98 1.89 0.00 3.14 0.00 0.00 3.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 29 V 8.07 3.30 2.10 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 0.74 0.00 0.00 0.79 0.00 0.00 30 A 8.14 3.94 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 31 D 7.91 4.27 0.00 2.88 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 32 Y 8.15 4.00 0.00 2.96 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 33 C 8.19 3.82 0.00 3.13 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 34 E 8.15 3.90 0.00 2.09 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 2.29 2.32 0.00 35 N 8.38 4.26 0.00 2.71 2.79 0.00 0.00 6.71 6.48 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 36 N 8.42 4.01 0.00 1.73 2.34 0.00 0.00 6.92 6.79 0.00 0.00 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 Y 7.33 3.88 0.00 3.06 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 38 I 7.43 3.86 2.00 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 1.60 0.87 0.91 0.00 0.00 39 Q 8.38 4.10 0.00 1.96 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.73 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 40 S 7.14 4.56 0.00 3.85 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 41 A 8.37 4.03 1.23 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 42 D 7.66 4.60 0.00 2.66 2.55 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 0.00 0.00 0.00 0.00 43 K 8.07 3.66 0.00 1.71 1.59 0.00 0.61 0.00 0.00 0.98 0.00 0.00 2.75 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.47 1.24 7.81 44 Q 8.01 4.00 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 45 R 7.89 3.95 0.00 2.21 1.92 0.00 3.17 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 46 A 7.76 4.06 1.43 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 0.00 0.00 0.00 47 L 8.34 3.96 0.00 1.95 1.94 0.87 0.75 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 48 E 8.19 4.07 0.00 2.32 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 0.00 2.33 2.39 0.00 49 E 8.16 4.04 0.00 2.42 2.23 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 2.67 2.47 0.00 50 T 8.06 4.02 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 1.22 0.00 0.00 51 K 8.54 3.85 0.00 1.94 1.90 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.50 7.81 52 A 7.94 3.95 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 53 Y 8.23 4.14 0.00 3.31 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 54 T 8.12 3.91 4.42 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 1.23 0.00 0.00 55 T 7.82 3.86 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 1.21 0.00 0.00 56 Q 8.06 3.98 0.00 2.19 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 57 S 8.24 4.15 0.00 4.14 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 58 L 8.27 3.97 0.00 1.76 1.86 0.94 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.13 4.04 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 60 S 8.15 4.06 0.00 4.01 4.06 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 61 V 7.96 3.60 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 0.99 0.00 0.00 0.98 0.00 0.00 62 A 7.94 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 63 Y 7.98 3.90 0.00 3.27 3.16 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 64 L 8.27 4.04 0.00 1.80 1.76 1.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 65 I 7.86 3.72 1.96 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 1.41 0.74 0.90 0.00 0.00 66 N 8.20 4.20 0.00 2.87 2.76 0.00 0.00 7.29 6.84 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 67 T 7.77 3.66 4.07 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 1.13 0.00 0.00 68 L 7.78 3.97 0.00 1.91 1.64 0.97 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 69 A 8.30 3.92 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 70 N 8.00 4.22 0.00 2.95 2.86 0.00 0.00 7.12 6.95 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 71 N 8.06 4.35 0.00 2.91 2.85 0.00 0.00 6.65 6.96 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 72 V 7.78 3.58 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 1.02 0.00 0.00 0.95 0.00 0.00 73 L 8.06 3.99 0.00 1.88 1.69 0.91 0.71 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 74 Q 8.07 3.95 0.00 2.27 2.25 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 2.35 2.36 0.00 75 M 8.03 4.04 0.00 2.28 2.03 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 76 L 8.07 4.04 0.00 1.74 1.69 0.91 0.83 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 77 D 8.27 4.37 0.00 2.84 2.71 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 0.00 0.00 0.00 78 I 7.77 3.75 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.71 0.91 0.00 0.00 79 Q 8.39 4.83 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.54 2.37 0.00 80 A 8.17 3.97 1.38 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 0.00 0.00 0.00 81 S 7.96 4.14 0.00 4.09 4.14 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 82 Q 8.01 3.98 0.00 2.38 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 83 L 7.80 4.04 0.00 1.82 1.70 0.92 1.31 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 84 R 8.10 3.93 0.00 1.98 1.98 0.00 3.12 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 85 R 7.99 3.97 0.00 2.02 1.97 0.00 3.12 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 86 M 8.01 4.05 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 87 E 8.55 3.87 0.00 2.10 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 0.00 2.28 2.30 0.00 88 S 7.75 4.03 0.00 3.84 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 89 S 7.98 4.19 0.00 4.08 3.90 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 0.00 0.00 0.00 0.00 90 I 8.13 3.74 1.98 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 1.40 0.69 0.90 0.00 0.00 91 N 8.55 4.25 0.00 2.85 2.84 0.00 0.00 7.24 7.76 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 92 H 7.95 4.45 0.00 3.32 3.31 0.00 5.69 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 93 I 7.64 3.74 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.83 0.91 0.00 0.00 94 S 8.31 4.06 0.00 3.99 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 95 Q 8.31 4.01 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.61 0.00 96 T 8.00 3.87 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 97 V 8.13 3.64 2.21 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 1.05 0.00 0.00 1.00 0.00 0.00 98 D 8.38 4.37 0.00 2.91 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 99 I 7.91 3.68 2.04 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 1.41 0.62 0.92 0.00 0.00 100 H 8.15 4.16 0.00 3.30 3.48 0.00 5.78 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 0.00 101 K 8.26 3.99 0.00 1.96 1.84 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.65 1.61 7.81 102 E 8.18 3.95 0.00 2.20 2.09 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 2.30 2.38 0.00 103 K 8.02 3.94 0.00 1.98 1.81 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.63 7.81 104 V 7.70 3.53 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 0.98 0.00 0.00 0.83 0.00 0.00 105 A 7.75 3.97 1.38 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 0.00 0.00 0.00 106 R 8.42 3.90 0.00 1.91 1.98 0.00 3.29 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.77 0.00 107 R 8.15 3.88 0.00 1.96 2.09 0.00 3.09 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 108 E 7.98 4.01 0.00 2.19 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 2.31 2.35 0.00 109 I 7.98 3.99 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.05 0.94 0.00 0.00 110 G 8.16 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 0.00 111 I 7.22 3.81 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.84 0.91 0.00 0.00 112 L 7.55 4.49 0.00 1.81 1.68 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 113 T 7.43 4.66 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 1.28 0.00 0.00 114 T 7.87 4.68 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 1.21 0.00 0.00 115 N 8.62 4.42 0.00 2.75 2.74 0.00 0.00 6.92 7.61 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 0.00 116 K 8.46 4.29 0.00 1.85 1.82 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.45 7.81 117 N 8.54 4.66 0.00 2.73 2.83 0.00 0.00 6.91 7.54 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 0.00 118 T 7.45 4.57 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 1.21 0.00 0.00 119 S 8.36 4.75 0.00 3.94 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 0.00 120 R 8.26 4.58 0.00 1.72 1.79 0.00 3.25 0.00 0.00 3.13 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 121 T 7.84 4.51 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 1.21 0.00 0.00 122 H 8.41 4.72 0.00 3.19 3.21 0.00 5.77 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 K 8.84 4.10 0.00 1.76 1.89 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.48 7.81 124 I 7.58 4.50 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.61 0.91 0.00 0.00 125 I 8.26 4.27 1.88 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 1.36 0.62 0.91 0.00 0.00 126 A 8.37 4.19 1.23 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 0.00 127 P 0.00 4.41 0.00 2.32 2.07 0.00 3.79 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 1.98 1.96 0.00 128 A 8.74 4.06 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 0.00 129 N 7.80 4.94 0.00 2.68 2.73 0.00 0.00 6.92 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 0.00 130 L 8.36 4.12 0.00 1.63 1.60 0.92 0.96 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 0.00 131 E 8.58 3.96 0.00 1.93 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 2.29 2.30 0.00 132 R 8.48 4.01 0.00 1.81 1.83 0.00 3.29 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 133 P 0.00 4.38 0.00 2.09 1.99 0.00 3.72 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 134 V 8.16 4.26 2.10 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 0.73 0.00 0.00 0.95 0.00 0.00 135 R 8.36 4.10 0.00 1.81 1.87 0.00 3.24 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 136 Y 8.54 4.40 0.00 2.90 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 0.00 137 I 7.60 4.19 1.71 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.00 0.79 0.00 0.00 138 R 8.09 3.83 0.00 1.67 1.79 0.00 3.23 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 1.64 1.45 0.00 139 K 8.08 4.57 0.00 1.73 1.64 0.00 1.54 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.21 1.38 7.81 140 P 0.00 4.38 0.00 2.00 1.97 0.00 3.63 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.06 0.00 141 I 8.07 3.52 1.62 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.38 0.28 0.00 0.00 142 D 8.30 4.64 0.00 2.49 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 0.00 143 Y 8.53 4.82 0.00 3.03 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 0.00 144 T 8.27 4.64 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 1.25 0.00 0.00 145 I 7.83 3.95 1.88 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 1.62 0.62 0.94 0.00 0.00 146 L 7.66 4.69 0.00 1.72 1.70 0.95 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 147 D 8.28 4.41 0.00 2.84 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 0.00 148 D 8.02 4.64 0.00 2.66 2.70 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 0.00 0.00 0.00 0.00 149 I 7.52 4.23 2.01 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 0.55 0.92 0.00 0.00 150 G 8.49 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 H 8.66 4.51 0.00 3.12 3.30 0.00 5.90 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 G 8.23 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 0.00 0.00 0.00 0.00 153 V 7.95 4.43 2.09 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 0.80 0.00 0.00 0.93 0.00 0.00 154 K 8.43 4.54 0.00 1.77 1.77 0.00 1.77 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.36 7.81 155 V 8.19 3.82 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 0.69 0.00 0.00 0.95 0.00 0.00