NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.8237 8.3544 109.7212 44.8189 0.0000 173.9993 4 D 4.1354 8.6187 122.6975 53.8701 41.9669 175.9176 5 K 3.9728 9.4922 128.7508 59.5295 32.7549 178.5979 6 K 3.9612 8.1633 118.4874 58.9012 31.9762 179.2536 7 V 3.7111 8.2781 118.7413 66.3291 31.5387 178.2406 8 I 3.7303 7.7416 119.1421 64.3214 36.9330 178.4751 9 Q 4.0193 7.7049 118.7562 58.8953 28.4928 178.1242 10 H 4.1862 8.2814 117.2725 58.8318 28.7266 177.7062 11 L 3.9976 8.2423 121.0542 58.1315 41.4720 179.5211 12 N 4.4251 8.3028 115.7213 55.4491 38.2754 177.5816 13 K 3.9064 7.8267 121.3678 59.4938 32.3300 178.6189 14 I 3.6682 7.9100 120.3336 64.3672 36.9536 177.9362 15 L 4.0123 8.3479 121.4144 58.2546 41.8055 178.9604 16 G 3.8282 8.0762 105.7378 48.2181 0.0000 175.2435 17 N 4.3534 8.3771 118.8261 56.1145 38.2958 177.4324 18 E 3.9546 8.4957 120.3142 59.3685 28.9942 179.4176 19 L 4.0301 8.2719 119.4255 57.7674 41.5478 179.6609 20 I 3.6629 7.5187 119.6904 64.2137 37.0347 178.3454 21 A 3.2740 7.8949 121.5685 54.7951 18.1572 179.4442 22 I 3.5760 7.6948 118.5142 64.8533 37.1564 178.4413 23 N 4.3361 7.6897 115.7958 56.1959 38.3241 177.1048 24 Q 3.8833 8.1360 121.1910 59.7940 29.1726 178.4125 25 Y 4.4325 8.5293 117.7153 60.9021 37.8173 178.3217 26 F 4.0301 8.3599 121.9215 60.9578 39.6045 177.1426 27 L 3.9946 8.3917 120.3471 58.3501 41.8079 178.5931 28 H 3.7859 8.3427 116.3256 58.7760 28.6560 177.2979 29 S 4.2980 8.0449 114.9450 62.0067 62.1501 176.6623 30 R 3.9696 7.5911 118.9226 58.3648 29.7996 179.0335 31 M 3.4083 7.3949 119.0727 57.9335 31.8801 178.3576 32 W 4.5300 7.6876 119.2188 60.1477 29.2551 178.3686 33 N 4.3596 8.3051 116.1629 56.3750 37.7558 176.8775 34 D 4.3402 7.7105 118.3685 57.0862 41.3670 177.8014 35 W 4.8193 7.8630 117.1067 57.4142 29.3179 177.2760 36 G 4.0328 8.1141 107.3889 45.5097 0.0000 174.8362 37 L 4.5738 8.0813 122.3751 53.5369 40.2518 177.2415 38 K 4.1535 8.6037 122.0072 58.6053 32.3651 178.6847 39 R 3.8902 8.1219 119.4764 59.1150 29.9518 178.5043 40 L 3.8685 7.7473 118.7341 57.2979 41.5746 179.2319 41 G 3.8336 8.1795 105.5732 48.0785 0.0000 175.6238 42 A 4.0441 8.2571 123.6135 54.8359 18.3708 179.2778 43 H 4.0755 8.0635 117.1910 59.3253 29.8748 177.1923 44 E 3.9747 8.4243 121.2978 59.1932 29.4832 177.9507 45 Y 4.0184 8.0269 119.7600 61.2656 38.8293 178.1272 46 H 4.2206 8.0694 116.2971 58.5848 28.7958 177.6970 47 E 3.8777 8.1018 120.8244 59.1310 29.1556 179.2491 48 S 4.2336 8.3393 113.3367 61.6323 62.6008 176.0182 49 I 3.5708 7.4054 122.4462 64.7935 36.8204 178.1273 50 D 4.2934 7.9157 118.9616 57.3201 40.5526 178.6895 51 E 4.2265 8.0242 120.0301 58.8343 29.4143 179.0914 52 M 4.0464 8.1094 119.0344 58.4147 32.0108 178.9686 53 K 3.9982 8.0265 118.5586 59.6870 32.2266 179.2190 54 H 4.3176 8.2210 116.4102 58.6397 28.4887 177.7314 55 A 3.9860 8.4522 123.1585 55.0603 18.2341 178.9185 56 D 4.2735 8.1865 116.6205 57.5491 41.3166 178.6268 57 K 3.9134 8.0460 118.6008 59.5499 32.0391 178.9852 58 L 3.9766 7.9041 118.9105 58.1414 41.6110 179.6301 59 I 3.7056 7.9598 119.5568 64.6947 37.0555 178.3304 60 E 4.0087 8.3593 119.2052 59.2408 29.1411 179.5676 61 R 3.9520 7.9084 118.6093 59.4629 30.2467 178.4655 62 I 3.7097 8.0421 119.9041 64.6199 37.2522 178.2458 63 L 3.9926 8.0764 119.6571 57.9100 41.1796 179.6274 64 F 4.2814 7.9981 119.6204 61.2427 39.5801 176.8439 65 L 3.8196 8.0474 115.4011 54.7863 41.4362 176.6722 66 E 3.6368 7.7419 117.1896 57.5274 27.0017 174.4579 67 G 3.9699 7.9602 107.5955 44.0083 0.0000 173.4728 68 L 4.5579 8.0519 118.9447 52.2305 42.5701 175.2758 69 P 4.4798 0.0000 0.0000 62.2518 31.9696 176.1229 70 N 4.7064 9.1986 121.5394 52.3272 38.3021 173.9689 71 L 4.5369 8.1784 122.6538 54.3764 42.4499 177.6036 72 Q 4.0517 8.2054 121.4523 58.3149 29.2882 175.7599 73 D 4.5460 8.0890 118.1119 53.0996 41.1276 175.3728 74 L 4.5043 8.2920 126.8913 52.6619 43.3823 176.6327 75 G 3.7840 8.4063 116.0503 45.1517 0.0000 171.2614 76 K 4.1815 8.3551 121.0200 55.1232 32.2490 177.1354 77 L 4.0254 8.4253 126.7675 54.9387 42.0759 177.2610 78 L 4.4929 8.8181 123.3242 53.2138 41.5182 175.4139 79 I 4.3141 8.0851 124.2643 59.3235 38.2417 176.7281 80 G 4.0379 8.6536 115.2414 44.7670 0.0000 172.3638 81 E 4.8114 8.5110 112.8237 54.9151 30.8958 175.3871 82 N 5.1036 7.7604 116.8179 50.6586 42.0588 174.9385 83 T 4.4290 8.6484 117.1823 67.1683 68.5681 176.5783 84 Q 4.0000 8.2006 120.8429 59.3169 29.1403 177.9677 85 E 4.0548 8.9068 119.9061 59.5706 29.4464 179.3055 86 M 3.9780 8.1048 118.9473 58.3405 31.9814 178.8156 87 L 4.1874 8.2477 119.2550 57.7851 41.6904 179.3725 88 Q 4.0056 8.1989 119.6508 59.2092 28.9986 177.7813 89 C 4.1758 8.5379 118.2687 63.0700 28.1115 175.9180 90 D 4.6523 8.2726 120.3830 57.2908 40.3255 178.5863 91 L 3.9565 8.0567 120.8852 58.1319 42.1279 178.5303 92 N 4.3101 8.5091 116.8561 56.5590 38.4781 177.1280 93 L 4.0324 8.0507 121.4222 58.2362 42.0977 178.8582 94 E 4.0811 8.6945 118.8912 59.1284 29.2710 179.2509 95 L 3.9957 8.3158 119.6074 57.5602 41.8161 179.4532 96 K 3.9068 8.0836 119.2354 59.5858 32.1400 178.6954 97 A 4.0559 8.3085 121.2839 55.6070 18.2698 179.7737 98 T 3.9036 8.2674 114.4650 66.3734 68.5691 176.9896 99 K 3.9367 7.9317 121.5293 59.7205 32.4634 178.7768 100 D 4.4605 8.0489 118.5884 56.9535 40.6232 178.9485 101 L 4.0084 7.6544 119.6741 57.8696 41.7593 179.5075 102 R 3.9646 7.9130 117.9131 59.3725 30.0886 179.0558 103 E 4.0120 8.1993 117.7667 59.1047 29.3774 179.1788 104 A 3.6851 7.8969 120.6907 54.9120 18.3988 179.8089 105 I 3.5959 7.8435 118.2940 64.4875 37.3134 178.4293 106 V 3.5639 7.7007 119.1415 66.6285 31.3167 177.5315 107 H 4.1147 7.9215 117.0204 59.4484 29.6696 176.8488 108 C 3.9799 8.2052 118.6525 62.8838 27.8155 175.8365 109 E 3.9036 8.1769 120.8367 59.1970 29.0317 178.5043 110 Q 4.0493 7.7462 118.3271 57.8692 29.1622 177.2651 111 V 4.0002 7.0552 110.9066 60.6262 31.9741 175.5737 112 H 3.1381 7.2492 114.1047 56.8198 26.5322 176.0609 113 D 4.4724 7.3187 121.5438 53.7346 39.4999 175.7775 114 Y 4.3693 7.7944 122.7935 59.6597 38.2946 177.3012 115 V 3.6780 7.8116 119.3143 65.9616 31.8705 177.8233 116 S 4.1452 8.2101 114.7002 61.6675 62.6001 176.5836 117 R 3.8779 7.8883 121.1796 59.7405 29.9326 178.0882 118 D 4.3181 8.2362 117.5506 57.0179 41.1587 178.0640 119 L 3.9767 7.7765 120.9074 58.1261 42.2034 178.9140 120 L 4.0198 7.8975 118.9205 57.4376 41.5000 179.3570 121 K 3.9286 8.3469 119.9696 59.6983 32.0387 178.6425 122 D 4.3790 7.9928 118.6316 57.2968 40.6357 178.8589 123 I 3.4825 7.6672 120.2510 64.2278 37.1534 178.0598 124 L 3.9215 8.3968 121.4993 58.3375 41.9096 178.6875 125 E 3.9762 8.3482 119.1133 59.3285 29.5978 178.7673 126 S 4.2039 7.8895 113.1050 61.2646 62.4755 175.9590 127 E 4.1809 8.5787 121.6293 59.1819 29.0840 179.0699 128 E 4.0860 8.3209 118.9756 59.2238 29.5195 178.9697 129 E 4.0162 8.2279 118.7143 59.6154 29.4349 178.8776 130 H 4.3358 8.2170 118.0338 59.5306 29.9236 177.1648 131 I 3.6907 7.9166 121.5817 64.5055 36.9330 177.8161 132 D 4.3081 8.4131 118.9183 57.5753 41.1435 177.5213 133 Y 4.1393 8.1811 119.9305 60.7527 38.7347 178.2164 134 L 3.7314 8.2222 119.7672 57.9674 41.8204 179.4514 135 E 3.9396 8.3800 118.6592 59.5451 29.3161 179.5447 136 T 3.7989 7.8531 115.8263 66.7487 68.5645 176.6686 137 Q 3.7756 7.6666 119.7654 58.8434 28.1493 178.6912 138 L 3.8961 7.7363 120.1448 57.7791 41.6045 179.9193 139 G 3.5800 7.9399 105.5766 47.5386 0.0000 175.8926 140 L 4.0821 7.7310 121.2337 57.4067 41.5838 179.5902 141 I 3.5441 7.2287 119.5536 64.4500 36.7823 178.4707 142 Q 3.9936 7.3995 116.7686 58.8462 28.5667 178.6859 143 K 4.1622 7.8554 118.7758 58.5873 32.2791 178.8499 144 V 4.3212 8.2695 109.6656 59.6428 33.6654 176.7612 145 G 4.0432 7.7285 106.1372 45.0698 0.0000 174.5438 146 L 3.9713 8.5932 122.1432 58.2270 42.1781 179.4667 147 E 4.0740 8.1174 117.9410 59.1690 29.4164 178.9734 148 N 4.3394 8.0992 116.3417 56.3542 38.5444 176.4548 149 Y 4.0322 7.9058 119.7018 60.8160 39.0562 178.1047 150 L 4.0661 8.1828 119.7134 57.6671 41.7343 178.8362 151 Q 3.9141 8.0996 119.6470 59.6365 28.7460 178.9104 152 S 4.3363 8.1572 112.9463 60.1123 62.9789 174.4175 153 H 4.6790 7.8444 118.6253 55.5879 30.0007 175.6383 154 M 4.0985 8.0696 122.0730 58.1642 31.8461 176.3510 155 H 5.2562 7.6187 112.8504 53.8630 31.6003 174.3624 156 E 4.1798 8.5445 118.9120 56.8223 29.4506 176.8399 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 3 G 8.35 3.82 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 0.00 0.00 0.00 4 D 8.62 4.14 0.00 2.85 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 5 K 9.49 3.97 0.00 1.84 1.77 0.00 1.75 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.51 7.81 6 K 8.16 3.96 0.00 1.94 1.60 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.42 7.81 7 V 8.28 3.71 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 1.02 0.00 0.00 8 I 7.74 3.73 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.82 0.90 0.00 0.00 9 Q 7.70 4.02 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 10 H 8.28 4.19 0.00 3.38 3.32 0.00 5.63 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 11 L 8.24 4.00 0.00 1.68 1.74 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.30 4.43 0.00 2.90 2.86 0.00 0.00 6.73 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.83 3.91 0.00 1.97 1.99 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.14 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 I 7.91 3.67 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 1.71 0.84 0.92 0.00 0.00 15 L 8.35 4.01 0.00 1.81 1.84 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.08 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.38 4.35 0.00 2.91 2.87 0.00 0.00 7.07 7.71 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 18 E 8.50 3.95 0.00 1.95 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 2.53 0.00 19 L 8.27 4.03 0.00 1.80 1.67 0.90 0.71 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 20 I 7.52 3.66 1.95 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.82 0.89 0.00 0.00 21 A 7.89 3.27 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.69 3.58 1.94 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.05 0.85 0.00 0.00 23 N 7.69 4.34 0.00 2.80 2.83 0.00 0.00 6.73 8.05 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 24 Q 8.14 3.88 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.52 2.40 0.00 25 Y 8.53 4.43 0.00 3.06 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 26 F 8.36 4.03 0.00 3.33 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 27 L 8.39 3.99 0.00 1.81 1.78 0.88 1.33 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 28 H 8.34 3.79 0.00 3.36 2.70 0.00 5.73 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.04 4.30 0.00 4.01 3.76 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 30 R 7.59 3.97 0.00 1.80 1.85 0.00 2.93 0.00 0.00 2.54 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 31 M 7.39 3.41 0.00 0.85 1.51 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.18 0.00 32 W 7.69 4.53 0.00 3.59 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 N 8.31 4.36 0.00 2.72 2.84 0.00 0.00 6.67 7.39 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 34 D 7.71 4.34 0.00 2.61 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 35 W 7.86 4.82 0.00 3.69 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 36 G 8.11 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 0.00 0.00 0.00 37 L 8.08 4.57 0.00 2.08 1.63 1.31 0.75 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 38 K 8.60 4.15 0.00 2.03 1.85 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.63 7.81 39 R 8.12 3.89 0.00 2.04 1.88 0.00 2.85 0.00 0.00 3.07 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 40 L 7.75 3.87 0.00 1.26 0.22 0.31 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.18 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 8.26 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 43 H 8.06 4.08 0.00 3.18 3.25 0.00 5.79 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 44 E 8.42 3.97 0.00 2.61 2.18 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 2.73 2.61 0.00 45 Y 8.03 4.02 0.00 3.06 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 46 H 8.07 4.22 0.00 3.32 3.25 0.00 5.87 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 47 E 8.10 3.88 0.00 1.99 1.75 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 2.27 2.12 0.00 48 S 8.34 4.23 0.00 4.08 4.05 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 49 I 7.41 3.57 1.72 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 1.08 0.41 0.84 0.00 0.00 50 D 7.92 4.29 0.00 2.84 2.60 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 0.00 0.00 0.00 0.00 0.00 51 E 8.02 4.23 0.00 2.10 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 2.74 2.43 0.00 52 M 8.11 4.05 0.00 2.01 2.24 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.52 0.00 53 K 8.03 4.00 0.00 1.86 1.83 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.62 7.81 54 H 8.22 4.32 0.00 3.34 3.33 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.45 3.99 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 56 D 8.19 4.27 0.00 2.88 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 57 K 8.05 3.91 0.00 1.99 1.87 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.66 7.81 58 L 7.90 3.98 0.00 1.86 1.75 0.98 0.60 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 59 I 7.96 3.71 2.01 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 0.84 0.92 0.00 0.00 60 E 8.36 4.01 0.00 2.17 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 2.34 2.42 0.00 61 R 7.91 3.95 0.00 2.09 2.13 0.00 3.31 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 62 I 8.04 3.71 2.03 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 1.54 0.48 0.94 0.00 0.00 63 L 8.08 3.99 0.00 1.97 1.79 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.00 4.28 0.00 3.00 3.34 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 65 L 8.05 3.82 0.00 1.75 1.65 1.02 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.74 3.64 0.00 2.02 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 2.17 2.14 0.00 67 G 7.96 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.05 4.56 0.00 1.62 1.61 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.48 0.00 2.04 1.98 0.00 3.64 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 2.03 2.07 0.00 70 N 9.20 4.71 0.00 2.59 2.80 0.00 0.00 7.09 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 71 L 8.18 4.54 0.00 1.63 1.64 0.91 0.95 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 72 Q 8.21 4.05 0.00 2.01 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.63 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 73 D 8.09 4.55 0.00 2.69 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 74 L 8.29 4.50 0.00 1.52 1.53 0.91 1.07 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 75 G 8.41 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 76 K 8.36 4.18 0.00 1.70 1.74 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.51 7.81 77 L 8.43 4.03 0.00 1.64 1.57 0.93 0.97 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 78 L 8.82 4.49 0.00 1.75 1.66 0.96 0.99 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 79 I 8.09 4.31 1.88 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.80 0.91 0.00 0.00 80 G 8.65 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.51 4.81 0.00 2.17 2.06 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 2.50 2.24 0.00 82 N 7.76 5.10 0.00 2.92 2.85 0.00 0.00 6.22 7.22 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 83 T 8.65 4.43 4.49 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 0.00 0.00 0.00 1.47 0.00 0.00 84 Q 8.20 4.00 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 85 E 8.91 4.05 0.00 2.35 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 2.35 2.51 0.00 86 M 8.10 3.98 0.00 1.44 2.27 0.00 0.00 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.15 0.00 87 L 8.25 4.19 0.00 1.75 1.73 0.83 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 8.20 4.01 0.00 2.27 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 89 C 8.54 4.18 0.00 3.34 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 90 D 8.27 4.65 0.00 2.93 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 91 L 8.06 3.96 0.00 1.87 1.87 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.51 4.31 0.00 2.98 2.90 0.00 0.00 6.69 6.52 0.00 0.00 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 L 8.05 4.03 0.00 1.93 1.96 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.69 4.08 0.00 2.08 2.06 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 2.69 2.56 0.00 95 L 8.32 4.00 0.00 1.85 1.74 0.94 0.72 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 96 K 8.08 3.91 0.00 1.91 2.07 0.00 1.54 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.52 7.81 97 A 8.31 4.06 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 98 T 8.27 3.90 4.61 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 0.00 0.00 0.00 1.23 0.00 0.00 99 K 7.93 3.94 0.00 1.80 2.00 0.00 1.65 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 1.45 1.49 7.81 100 D 8.05 4.46 0.00 2.86 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 0.00 101 L 7.65 4.01 0.00 1.98 1.71 0.92 1.39 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 0.00 102 R 7.91 3.96 0.00 2.01 1.99 0.00 3.13 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 103 E 8.20 4.01 0.00 2.05 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 2.34 2.33 0.00 104 A 7.90 3.69 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 0.00 105 I 7.84 3.60 2.03 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 0.79 0.93 0.00 0.00 106 V 7.70 3.56 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 1.00 0.00 0.00 1.00 0.00 0.00 107 H 7.92 4.11 0.00 3.25 3.30 0.00 5.85 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 0.00 108 C 8.21 3.98 0.00 3.18 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 0.00 109 E 8.18 3.90 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 110 Q 7.75 4.05 0.00 2.09 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 111 V 7.06 4.00 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 0.71 0.00 0.00 0.77 0.00 0.00 112 H 7.25 3.14 0.00 3.12 3.24 0.00 5.66 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.32 4.47 0.00 2.63 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 0.00 114 Y 7.79 4.37 0.00 3.10 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 7.81 3.68 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 1.09 0.00 0.00 0.99 0.00 0.00 116 S 8.21 4.15 0.00 4.23 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 0.00 117 R 7.89 3.88 0.00 1.94 2.22 0.00 3.26 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 1.68 1.69 0.00 118 D 8.24 4.32 0.00 3.08 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 0.00 119 L 7.78 3.98 0.00 1.91 1.78 0.94 1.08 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 0.00 120 L 7.90 4.02 0.00 1.92 1.70 0.92 0.84 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 0.00 121 K 8.35 3.93 0.00 2.12 1.82 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.36 7.81 122 D 7.99 4.38 0.00 2.92 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 0.00 123 I 7.67 3.48 1.97 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 1.14 0.73 0.82 0.00 0.00 124 L 8.40 3.92 0.00 1.76 1.91 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.35 3.98 0.00 2.10 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 0.00 2.33 2.34 0.00 126 S 7.89 4.20 0.00 3.96 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 E 8.58 4.18 0.00 2.18 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 2.61 2.53 0.00 128 E 8.32 4.09 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 2.36 2.57 0.00 129 E 8.23 4.02 0.00 2.29 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 2.38 2.36 0.00 130 H 8.22 4.34 0.00 3.30 3.49 0.00 5.62 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 0.00 131 I 7.92 3.69 2.09 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.58 0.93 0.00 0.00 132 D 8.41 4.31 0.00 2.91 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 0.00 133 Y 8.18 4.14 0.00 3.19 3.25 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 0.00 134 L 8.22 3.73 0.00 1.98 1.65 0.98 0.98 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 0.00 135 E 8.38 3.94 0.00 1.97 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 2.31 2.57 0.00 136 T 7.85 3.80 4.31 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 1.18 0.00 0.00 137 Q 7.67 3.78 0.00 1.82 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.78 0.00 0.00 0.00 0.00 0.00 1.27 1.91 0.00 138 L 7.74 3.90 0.00 1.88 1.62 0.81 1.05 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 0.00 139 G 7.94 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.73 4.08 0.00 1.83 1.85 1.01 0.84 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 0.00 141 I 7.23 3.54 1.84 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.31 0.79 0.00 0.00 142 Q 7.40 3.99 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.98 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 143 K 7.86 4.16 0.00 1.74 1.86 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.68 7.81 144 V 8.27 4.32 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 0.79 0.00 0.00 1.08 0.00 0.00 145 G 7.73 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.59 3.97 0.00 1.76 1.68 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.12 4.07 0.00 2.06 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 2.40 2.40 0.00 148 N 8.10 4.34 0.00 2.92 2.89 0.00 0.00 6.78 7.48 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 0.00 149 Y 7.91 4.03 0.00 3.02 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 0.00 150 L 8.18 4.07 0.00 1.77 1.73 0.97 0.93 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 0.00 151 Q 8.10 3.91 0.00 2.27 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.87 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 152 S 8.16 4.34 0.00 3.78 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 7.84 4.68 0.00 2.90 3.02 0.00 5.81 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 M 8.07 4.10 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.47 0.00 155 H 7.62 5.26 0.00 3.08 3.16 0.00 5.71 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 E 8.54 4.18 0.00 1.95 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 2.27 2.29 0.00