NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9529 8.3549 109.7378 45.5946 0.0000 172.7619 2 L 4.3274 8.1728 119.8661 51.2209 43.4507 175.3111 3 S 4.4916 9.9548 118.8193 57.7267 66.1007 174.9040 4 D 4.6512 8.7942 121.5883 57.7077 40.6493 179.3649 5 G 3.6941 8.1386 105.3557 47.9126 0.0000 175.1104 6 E 3.9108 7.9693 120.9080 59.0448 29.4202 179.5903 7 W 4.4724 8.2467 118.8626 59.8136 29.0654 178.3089 8 Q 4.1166 8.4519 118.1498 59.5350 28.2644 179.5109 9 Q 4.1809 8.0862 118.2941 58.8213 28.6964 178.9854 10 V 3.7870 7.9402 119.3909 66.1740 31.6560 178.1658 11 L 4.2615 8.5350 118.9978 57.3793 41.2299 178.7692 12 N 4.3157 8.5950 117.2700 56.9258 39.2809 177.0914 13 V 3.7979 7.8793 119.9718 64.4771 31.6398 178.0176 14 W 4.0402 8.5199 129.2678 60.0813 30.6274 178.0677 15 G 3.7017 8.1568 105.8984 47.7642 0.0000 175.8119 16 K 3.9772 7.5482 119.4158 58.9084 32.2174 179.3101 17 V 2.8487 7.0593 118.2012 65.7535 31.1103 177.7979 18 E 3.8675 7.4239 116.3344 59.1688 29.2967 178.9552 19 A 4.2004 7.2309 118.6122 53.9965 19.6267 177.7293 20 D 4.6655 7.7314 116.3470 52.4302 43.0408 175.2789 21 I 3.6920 7.9323 123.6619 63.5562 38.6169 176.3175 22 A 4.1449 7.5696 122.6915 54.5195 18.2244 179.6779 23 G 3.5779 8.0435 104.8398 47.6395 0.0000 175.5070 24 H 4.0909 8.0504 118.7387 58.5101 28.7695 177.8140 25 G 3.7736 8.4150 107.8065 48.2016 0.0000 175.6199 26 Q 3.9065 8.0757 120.2960 58.7488 28.7301 178.7730 27 E 3.8807 8.0091 119.3445 58.9869 29.3488 179.4520 28 V 3.5043 7.9786 118.7423 66.0727 31.5997 178.1725 29 L 3.3592 7.6880 118.4583 57.5509 41.3659 179.4327 30 I 3.6510 7.6685 119.9149 64.3772 36.9518 178.3784 31 R 3.7801 7.9581 119.3457 59.2151 29.9057 178.0533 32 L 3.8990 7.8235 120.2037 58.5037 41.5292 179.1141 33 F 4.5927 8.0779 118.1625 60.7172 38.5635 177.9115 34 T 4.0730 8.0769 109.0919 64.8012 68.8238 176.8983 35 G 3.5913 8.1263 107.8446 46.5229 0.0000 173.8731 36 H 4.7773 8.1799 117.5025 52.0635 30.3664 171.7833 37 P 4.4880 0.0000 0.0000 64.8115 31.3810 177.7351 38 E 4.1139 8.2518 115.9608 59.4428 29.5343 179.1399 39 T 3.9034 8.1127 110.9145 64.3646 68.7988 176.3665 40 L 3.4756 8.0077 123.2918 57.8268 41.7780 178.5631 41 E 4.0517 7.7183 116.3604 59.1651 29.4136 179.1304 42 K 4.3028 8.0738 117.3477 57.4009 32.8745 177.0982 43 F 4.2494 7.8802 118.9117 55.2139 37.9898 175.7640 44 D 4.3650 8.3338 125.9764 57.0896 41.0271 178.7760 45 K 4.1668 7.7453 117.7338 58.9945 32.3724 177.8755 46 F 5.0380 6.9802 110.5219 56.3708 38.8706 176.1169 47 K 3.9756 7.9952 122.1119 59.8565 32.1841 177.4518 48 H 4.4917 8.1441 113.9785 56.9980 29.1970 175.7885 49 L 4.2471 7.4559 120.6394 54.8557 41.9247 176.8865 50 K 4.4756 9.2449 120.3830 56.1444 34.7898 177.2141 51 T 4.6979 7.5993 107.8077 59.3015 72.6975 174.5229 52 E 3.8793 8.6218 122.0103 59.2975 29.7104 178.8992 53 A 3.9470 7.9395 120.3123 55.2730 18.5263 179.1576 54 E 3.8835 8.1561 116.9577 59.9988 29.3316 179.6239 55 M 4.0054 8.0986 117.6806 58.3752 32.0759 178.7765 56 K 4.0620 8.1389 117.6220 59.0481 32.2590 178.9491 57 A 4.2005 7.7504 120.3616 53.2879 18.5692 177.8126 58 S 4.1365 7.4643 113.2819 58.3198 63.0604 174.8333 59 E 3.9988 8.8585 127.8259 59.2639 29.3276 178.6663 60 D 4.4694 8.1349 118.6126 57.5387 40.9093 178.5973 61 L 3.0233 7.7527 120.7329 57.5330 41.9290 178.8507 62 K 3.8337 7.5927 119.6152 59.3729 32.1359 178.9303 63 K 3.9721 8.0482 118.6622 59.4769 32.0175 179.3275 64 V 3.8401 8.1179 118.7007 66.1947 31.5058 178.2277 65 G 3.6313 8.4240 105.6215 48.1450 0.0000 175.7504 66 T 3.9165 8.0747 118.1561 66.2862 68.4811 176.8606 67 V 3.6545 7.9972 120.1695 65.9665 31.5782 178.0529 68 V 3.6734 7.8287 117.8731 66.3490 31.3267 178.0997 69 L 4.4100 7.9078 118.0244 57.9009 41.4223 179.7399 70 T 3.9640 8.3136 115.7334 66.6590 68.5873 176.3339 71 A 4.0086 8.0902 122.6446 55.3594 18.3745 179.4734 72 L 3.7118 8.4948 119.1551 58.1124 42.1271 179.4673 73 G 3.0013 8.4948 106.2192 47.0472 0.0000 175.7556 74 G 3.6844 7.7562 107.3249 47.8799 0.0000 175.2771 75 I 3.8342 7.3671 122.2148 64.0755 37.0880 178.5801 76 L 3.9818 7.5684 119.5095 57.7129 41.1565 179.7836 77 K 3.8442 7.6694 117.3405 58.9167 32.1570 178.8088 78 K 3.9429 7.7063 117.1164 56.1124 32.5017 176.6920 79 K 2.0000 8.3175 118.7401 56.2409 29.8839 175.0511 80 G 4.0351 7.7842 106.0129 45.9188 0.0000 173.8952 81 H 4.5090 7.6606 118.8932 55.3494 27.5219 174.9816 82 H 5.2155 7.1555 110.2595 54.4974 29.7866 176.6518 83 E 3.9001 8.4650 121.6859 60.2766 29.1440 178.0398 84 A 4.0026 8.0523 118.6202 55.6012 18.9393 178.9370 85 E 4.1326 8.0836 116.1421 59.1656 29.7737 178.9258 86 L 3.9050 8.3696 120.7160 57.5198 42.1672 178.8499 87 K 3.9055 7.9980 119.0997 59.1627 32.0915 177.3367 88 P 4.3185 0.0000 0.0000 65.6369 31.1302 178.2138 89 L 3.9420 7.5311 118.2503 57.9490 42.1255 178.2969 90 A 4.1165 8.0461 120.9013 55.5173 18.1573 179.2620 91 Q 3.9263 8.0503 117.5956 59.5161 29.1291 178.8378 92 S 4.0971 8.1501 115.2192 61.7411 63.0931 175.6324 93 H 5.0275 9.0141 119.5507 56.4738 28.4188 176.3637 94 A 3.3668 7.7938 121.5357 51.9813 19.5898 176.3263 95 T 4.1306 7.1567 103.9489 62.9874 70.7377 175.6616 96 K 3.7538 7.7000 123.6680 57.8602 32.7791 176.2375 97 H 4.6273 7.9572 119.0667 53.8052 30.9086 173.6757 98 K 3.8627 8.4629 124.2873 55.5617 31.6708 176.2552 99 I 4.3715 8.0884 126.6868 58.6279 38.1690 174.4802 100 P 4.4850 0.0000 0.0000 62.3150 32.1741 177.5084 101 I 3.6786 8.4454 122.7957 64.7585 36.9899 178.4000 102 K 3.6042 7.9858 119.5455 59.9965 31.8828 178.1521 103 Y 4.1300 7.6053 116.6969 60.9982 37.7101 178.5909 104 L 4.1967 8.0383 119.6465 57.5980 41.7638 178.7968 105 E 3.9545 8.2657 119.2583 59.4821 29.5621 178.6342 106 F 4.4379 7.9943 117.7266 61.1131 38.9523 177.7417 107 I 3.8225 8.2143 117.8185 63.9036 37.7136 178.0846 108 S 4.1997 8.2877 116.3289 61.7499 62.6387 176.2941 109 D 4.4362 8.4285 121.2627 57.3148 40.5416 178.5994 110 A 4.0204 8.2676 121.2641 55.3336 18.3258 179.6178 111 I 3.6346 8.0510 118.2552 64.6830 37.2520 178.3861 112 I 3.8131 7.9351 120.5475 64.9933 37.0500 177.7839 113 H 4.1319 8.5405 118.8604 59.4242 29.6867 177.4848 114 V 3.5007 8.0042 120.0385 65.7648 31.2667 177.8969 115 L 3.6922 7.8420 118.8991 57.9949 41.0967 179.0413 116 H 4.4132 7.8410 116.8707 59.3898 29.9114 176.9252 117 S 4.1538 7.7927 113.9641 60.6930 62.3258 175.5179 118 K 4.1452 8.1542 120.1141 57.2949 33.5303 176.6155 119 H 5.0196 8.2217 116.0335 53.9646 29.6438 172.9881 120 P 4.3772 0.0000 0.0000 65.7209 31.7894 179.2877 121 G 3.6981 8.1457 106.5837 47.5924 0.0000 173.6022 122 D 4.9054 7.9515 118.1923 54.0602 41.6055 176.9351 123 F 4.9758 7.9964 120.7321 56.0843 39.8704 173.9690 124 G 3.9552 7.5971 109.5861 43.8317 0.0000 171.5107 125 A 3.8894 8.4677 120.8190 55.4360 18.2475 179.7626 126 D 4.1515 7.9555 116.3380 57.5055 40.9305 178.6488 127 A 3.9113 7.8176 120.6337 55.2412 18.3258 179.2709 128 Q 3.2107 7.6652 118.0900 58.8580 29.0048 178.6460 129 G 3.5216 7.8641 106.5087 47.6564 0.0000 175.2574 130 A 3.8548 8.0729 123.8003 55.1356 18.3113 179.4746 131 M 4.0385 8.3029 116.7026 59.0185 32.3788 178.1980 132 T 3.9292 8.2827 116.4003 66.9988 68.6944 176.5960 133 K 4.2102 8.4192 121.1065 58.7587 32.0081 179.4129 134 A 3.8428 7.8634 121.1361 55.1581 18.3520 179.7704 135 L 4.1305 8.3953 117.8685 57.6815 41.3037 179.5253 136 E 4.0014 8.4020 118.9192 59.2415 29.3321 179.0002 137 L 4.0175 7.9249 120.2495 58.1323 42.2132 178.4955 138 F 4.0779 8.1853 120.4344 61.6514 39.2616 177.3496 139 R 3.5154 8.1385 117.3153 59.0848 29.8636 178.5968 140 N 4.2344 8.4432 117.2302 56.8275 38.9390 176.7211 141 D 4.3191 8.2724 120.4973 57.1365 40.8838 178.8130 142 I 3.2960 7.4073 120.0935 64.1286 37.1386 178.0461 143 A 3.6788 7.9390 121.6734 55.2774 17.9030 179.3918 144 A 3.9389 7.8802 118.9395 55.4167 18.3542 180.0683 145 K 3.8920 7.8148 116.4322 59.4697 32.1363 178.8791 146 Y 4.5236 8.4277 117.6369 61.3166 37.9782 178.7771 147 K 3.8928 8.0279 119.8203 59.8346 32.0681 178.6240 148 E 4.0362 7.5571 116.8890 59.2753 29.5046 178.7399 149 L 4.3266 7.9134 116.6106 55.0416 41.8421 177.6541 150 G 3.8255 7.8525 106.7917 45.8803 0.0000 172.7772 151 F 4.7580 8.1616 121.6944 55.9646 40.5611 175.3239 152 Q 4.0123 8.2003 127.9000 54.5251 28.2314 176.0882 153 G 3.2204 7.9808 111.4816 45.4145 0.0000 172.1383 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 G 8.35 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 0.00 0.00 0.00 2 L 8.17 4.33 0.00 0.54 0.82 0.50 -0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.95 4.49 0.00 4.01 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 4 D 8.79 4.65 0.00 2.77 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 5 G 8.14 3.69 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 0.00 0.00 0.00 6 E 7.97 3.91 0.00 1.99 1.72 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 2.22 2.28 0.00 7 W 8.25 4.47 0.00 3.47 3.15 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 8 Q 8.45 4.12 0.00 2.34 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.63 2.62 0.00 9 Q 8.09 4.18 0.00 2.31 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.58 0.00 10 V 7.94 3.79 2.51 0.00 0.00 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 0.91 0.00 0.00 11 L 8.54 4.26 0.00 1.84 1.79 0.92 0.88 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 12 N 8.59 4.32 0.00 2.81 3.08 0.00 0.00 7.24 7.70 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 13 V 7.88 3.80 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.87 0.00 0.00 14 W 8.52 4.04 0.00 3.72 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 15 G 8.16 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 16 K 7.55 3.98 0.00 1.31 1.41 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.63 1.43 7.81 17 V 7.06 2.85 0.67 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 0.20 0.00 0.00 0.00 0.00 0.00 18 E 7.42 3.87 0.00 2.02 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 2.45 2.50 0.00 19 A 7.23 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 20 D 7.73 4.67 0.00 2.73 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.93 3.69 1.81 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 1.59 1.01 0.90 0.00 0.00 22 A 7.57 4.14 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 23 G 8.04 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 24 H 8.05 4.09 0.00 3.25 3.22 0.00 5.84 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 25 G 8.41 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 0.00 0.00 0.00 26 Q 8.08 3.91 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.51 0.00 27 E 8.01 3.88 0.00 2.07 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 2.25 2.35 0.00 28 V 7.98 3.50 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 1.09 0.00 0.00 0.97 0.00 0.00 29 L 7.69 3.36 0.00 1.43 0.90 0.87 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.67 3.65 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.59 0.93 0.00 0.00 31 R 7.96 3.78 0.00 1.92 2.10 0.00 3.04 0.00 0.00 2.93 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 32 L 7.82 3.90 0.00 1.71 1.40 1.06 1.32 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 33 F 8.08 4.59 0.00 3.02 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 34 T 8.08 4.07 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 1.25 0.00 0.00 35 G 8.13 3.59 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 0.00 0.00 0.00 36 H 8.18 4.78 0.00 3.12 2.87 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.49 0.00 2.16 2.13 0.00 3.84 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.02 0.00 38 E 8.25 4.11 0.00 2.29 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.54 0.00 39 T 8.11 3.90 4.45 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 0.80 0.00 0.00 40 L 8.01 3.48 0.00 1.26 1.73 0.03 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.72 4.05 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 42 K 8.07 4.30 0.00 1.84 1.65 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.25 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.70 1.93 7.81 43 F 7.88 4.25 0.00 2.82 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 0.00 0.00 0.00 44 D 8.33 4.36 0.00 2.59 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 45 K 7.75 4.17 0.00 1.46 2.04 0.00 1.88 0.00 0.00 1.95 0.00 0.00 3.16 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.50 1.44 7.81 46 F 6.98 5.04 0.00 3.03 3.22 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 47 K 8.00 3.98 0.00 1.90 2.20 0.00 1.57 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.39 7.81 48 H 8.14 4.49 0.00 3.31 3.47 0.00 5.53 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 49 L 7.46 4.25 0.00 1.63 1.59 0.92 0.76 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 50 K 9.24 4.48 0.00 1.67 1.79 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.49 7.81 51 T 7.60 4.70 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 52 E 8.62 3.88 0.00 2.04 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 2.36 2.37 0.00 53 A 7.94 3.95 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 54 E 8.16 3.88 0.00 2.17 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 2.32 2.35 0.00 55 M 8.10 4.01 0.00 1.95 2.23 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 2.74 2.61 0.00 56 K 8.14 4.06 0.00 1.81 1.83 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.59 7.81 57 A 7.75 4.20 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 58 S 7.46 4.14 0.00 3.78 3.74 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 59 E 8.86 4.00 0.00 2.03 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 2.39 2.34 0.00 60 D 8.13 4.47 0.00 2.88 3.12 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 61 L 7.75 3.02 0.00 0.61 1.24 0.74 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.59 3.83 0.00 1.87 1.91 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.44 7.81 63 K 8.05 3.97 0.00 2.06 1.90 0.00 1.77 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.72 7.81 64 V 8.12 3.84 2.44 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 1.38 0.00 0.00 1.33 0.00 0.00 65 G 8.42 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 66 T 8.07 3.92 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 67 V 8.00 3.65 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 1.08 0.00 0.00 1.00 0.00 0.00 68 V 7.83 3.67 2.31 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 1.02 0.00 0.00 1.19 0.00 0.00 69 L 7.91 4.41 0.00 1.83 1.89 0.87 1.05 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 70 T 8.31 3.96 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 1.26 0.00 0.00 71 A 8.09 4.01 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 72 L 8.49 3.71 0.00 1.60 1.71 0.20 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.49 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 0.00 0.00 0.00 74 G 7.76 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 75 I 7.37 3.83 1.84 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 1.55 0.98 0.89 0.00 0.00 76 L 7.57 3.98 0.00 1.35 1.59 0.05 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.67 3.84 0.00 1.85 1.79 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.46 1.44 7.81 78 K 7.71 3.94 0.00 1.85 1.78 0.00 1.90 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.78 7.81 79 K 8.32 2.00 0.00 1.12 0.74 0.00 1.44 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.54 1.04 7.81 80 G 7.78 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 H 7.66 4.51 0.00 3.00 3.24 0.00 5.81 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 82 H 7.16 5.22 0.00 3.30 3.44 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.46 3.90 0.00 2.10 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 2.39 2.46 0.00 84 A 8.05 4.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 4.13 0.00 2.23 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 2.39 2.42 0.00 86 L 8.37 3.91 0.00 2.02 1.66 1.03 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.00 3.91 0.00 1.88 1.88 0.00 1.89 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.58 7.81 88 P 0.00 4.32 0.00 2.30 2.34 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.05 0.00 89 L 7.53 3.94 0.00 1.91 1.88 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.05 4.12 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 91 Q 8.05 3.93 0.00 2.24 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 92 S 8.15 4.10 0.00 4.10 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 93 H 9.01 5.03 0.00 3.58 3.60 0.00 5.80 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 94 A 7.79 3.37 1.22 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 0.00 0.00 95 T 7.16 4.13 4.13 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 1.17 0.00 0.00 96 K 7.70 3.75 0.00 1.55 1.52 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.11 1.30 7.81 97 H 7.96 4.63 0.00 2.95 2.99 0.00 5.86 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.46 3.86 0.00 1.39 1.33 0.00 1.54 0.00 0.00 1.54 0.00 0.00 2.75 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.53 1.03 7.81 99 I 8.09 4.37 2.12 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 0.98 1.18 0.00 0.00 100 P 0.00 4.48 0.00 1.73 1.79 0.00 2.79 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 0.82 1.74 0.00 101 I 8.45 3.68 1.82 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 1.51 1.04 0.84 0.00 0.00 102 K 7.99 3.60 0.00 1.67 1.62 0.00 1.84 0.00 0.00 1.82 0.00 0.00 3.20 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.60 1.28 7.81 103 Y 7.61 4.13 0.00 3.15 3.12 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 0.00 104 L 8.04 4.20 0.00 1.93 1.86 0.76 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.27 3.95 0.00 2.00 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 2.41 2.41 0.00 106 F 7.99 4.44 0.00 3.27 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 0.00 107 I 8.21 3.82 2.04 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 1.14 0.00 0.00 108 S 8.29 4.20 0.00 4.21 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.43 4.44 0.00 3.02 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 0.00 110 A 8.27 4.02 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 0.00 111 I 8.05 3.63 2.11 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 1.60 0.73 1.07 0.00 0.00 112 I 7.94 3.81 2.08 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.73 1.17 0.00 0.00 113 H 8.54 4.13 0.00 3.33 3.55 0.00 5.78 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.00 3.50 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 0.85 0.00 0.00 0.92 0.00 0.00 115 L 7.84 3.69 0.00 1.06 0.13 0.69 0.55 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 0.00 116 H 7.84 4.41 0.00 3.60 3.57 0.00 5.75 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.79 4.15 0.00 3.78 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 0.00 118 K 8.15 4.15 0.00 1.36 1.36 0.00 1.57 0.00 0.00 1.36 0.00 0.00 2.48 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.22 1.35 7.81 119 H 8.22 5.02 0.00 3.07 3.16 0.00 5.62 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.38 0.00 2.21 2.34 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.92 0.00 121 G 8.15 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 0.00 122 D 7.95 4.91 0.00 2.73 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 0.00 123 F 8.00 4.98 0.00 3.01 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 0.00 124 G 7.60 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 0.00 125 A 8.47 3.89 1.27 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 0.00 0.00 126 D 7.96 4.15 0.00 2.65 2.87 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 0.00 0.00 0.00 127 A 7.82 3.91 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 0.00 128 Q 7.67 3.21 0.00 1.18 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 129 G 7.86 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.07 3.85 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 0.00 131 M 8.30 4.04 0.00 2.45 2.47 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.94 0.00 132 T 8.28 3.93 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 1.23 0.00 0.00 133 K 8.42 4.21 0.00 1.79 1.70 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.34 7.81 134 A 7.86 3.84 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 0.00 135 L 8.40 4.13 0.00 1.76 1.83 1.01 0.73 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 0.00 136 E 8.40 4.00 0.00 2.16 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 2.35 2.48 0.00 137 L 7.92 4.02 0.00 1.82 1.95 1.03 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.19 4.08 0.00 3.13 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 0.00 139 R 8.14 3.52 0.00 2.04 1.88 0.00 3.19 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.96 0.00 140 N 8.44 4.23 0.00 2.81 2.90 0.00 0.00 7.26 8.04 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 0.00 141 D 8.27 4.32 0.00 2.65 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 0.00 142 I 7.41 3.30 1.33 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 -0.36 0.07 0.00 0.00 143 A 7.94 3.68 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 0.00 144 A 7.88 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 0.00 145 K 7.81 3.89 0.00 1.87 1.90 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.60 1.59 7.81 146 Y 8.43 4.52 0.00 3.10 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 0.00 147 K 8.03 3.89 0.00 1.91 2.03 0.00 1.52 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.54 7.81 148 E 7.56 4.04 0.00 2.09 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 2.36 2.58 0.00 149 L 7.91 4.33 0.00 1.88 1.75 1.11 1.04 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 0.00 150 G 7.85 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 0.00 151 F 8.16 4.76 0.00 2.82 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 0.00 152 Q 8.20 4.01 0.00 1.87 1.88 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 2.23 2.26 0.00 153 G 7.98 3.22 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 0.00 0.00 0.00