NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4801 8.5404 118.1929 55.2930 33.4418 172.3996 2 A 3.6950 8.5502 125.9179 51.5747 17.8048 172.7843 3 V 3.8898 9.0560 124.9183 63.3665 33.4131 173.6372 4 E 4.4938 8.8021 124.1323 56.6388 33.0832 175.2748 5 Y 5.2082 8.8500 116.4438 55.9059 41.9324 174.6935 6 L 5.0094 8.8125 125.2140 53.5356 44.2064 174.9785 7 V 4.6297 9.0476 127.7632 61.5219 32.9225 175.3643 8 D 4.2871 8.1936 127.6093 51.8234 41.7044 177.1376 9 A 3.9229 8.2162 119.4273 55.4672 18.2523 179.8093 10 S 4.0537 7.9274 111.7374 61.0027 63.2708 176.4436 11 A 3.9283 8.0374 124.8590 54.7423 18.1357 179.2407 12 L 3.6606 8.0251 119.1968 58.3332 42.0111 178.4479 13 Y 3.8766 8.2708 119.3236 60.6632 38.8414 178.0705 14 A 4.0597 8.0528 121.4045 55.3815 18.5687 179.5765 15 L 4.0743 8.5831 117.5230 57.8766 41.3908 179.4095 16 A 4.5434 8.2316 119.6211 54.3083 18.2884 178.2947 17 A 4.6618 7.7200 117.1008 52.1487 19.4585 176.7737 18 H 4.9621 8.5537 114.9085 57.1308 30.2665 176.0684 19 Y 3.0778 7.4490 119.1290 60.0272 40.2162 177.5807 20 D 4.1509 8.1632 120.5762 57.4867 41.1348 178.9013 21 K 4.1753 8.1765 117.1435 58.0989 32.2601 177.6491 22 W 5.0456 7.5743 113.8936 55.6249 29.8663 177.1911 23 I 2.9337 6.7186 113.1978 63.5944 36.4556 177.9513 24 K 3.8074 7.6727 118.1811 58.8890 32.5560 176.9088 25 H 4.8522 8.8074 117.2934 55.1783 29.2749 176.3452 26 R 3.8740 8.0388 118.9472 59.1592 29.3768 178.6452 27 E 4.0789 8.2096 117.5721 58.7602 29.8882 177.8407 28 K 4.8080 8.4381 117.0273 56.0576 33.3970 176.3646 29 L 5.4118 7.8117 120.6737 53.3488 44.3469 175.3715 30 A 5.5120 8.9717 123.0375 51.2935 23.6806 174.5376 31 I 4.7486 8.9234 111.9865 59.9941 41.7527 173.8165 32 L 4.9642 8.3835 121.0739 53.0797 43.9855 178.0472 33 H 4.1799 8.8224 117.0019 59.0548 29.2430 177.7575 34 L 4.2068 8.3328 120.4698 58.7861 41.7360 178.8326 35 T 4.0161 7.8446 115.5039 66.8741 68.3939 176.1405 36 I 3.6075 7.4412 120.5356 64.8418 37.1600 178.0430 37 Y 4.0134 7.7969 116.5688 61.1815 37.8045 178.3396 38 E 3.9785 8.4437 119.3188 59.2658 29.4832 179.3478 39 A 4.1567 8.7131 121.4765 54.9539 18.4325 179.8917 40 G 3.6162 8.1928 104.3092 48.1608 0.0000 175.4519 41 N 4.5883 8.9191 120.1185 56.2223 38.7590 176.8264 42 A 3.9604 8.0882 122.4311 54.9463 18.4275 179.3865 43 L 4.3402 8.3086 120.3907 57.3732 42.1476 178.9331 44 W 4.1612 8.7667 128.9157 60.5850 30.5571 178.1208 45 K 3.2621 8.1652 118.2173 59.1393 31.3124 179.2871 46 E 3.8823 7.9051 118.8489 59.3791 28.9552 179.2417 47 A 3.9734 7.8882 120.6162 54.9823 18.0643 179.9026 48 R 3.7134 7.2853 116.1903 58.4154 30.0159 178.0241 49 L 4.4991 6.8017 116.6606 54.5755 42.0320 177.2540 50 G 3.9960 7.6701 106.1603 45.0914 0.0000 174.6685 51 R 3.9341 7.9526 120.6654 56.8844 30.3589 176.5966 52 V 3.9366 8.6682 119.4534 64.7193 31.9245 178.1082 53 D 4.6669 7.9423 119.1743 53.3046 40.5893 178.2998 54 W 4.3430 8.4186 120.3773 60.8573 28.0450 176.8120 55 A 3.6284 6.7066 120.5530 54.6883 17.8177 179.2240 56 A 3.8334 7.6832 118.3696 55.3268 18.5113 179.4662 57 A 4.0037 8.3774 119.8959 55.3537 18.2691 180.0074 58 S 4.1973 8.5247 113.2246 61.6577 63.0134 177.1016 59 R 3.9386 7.8652 121.4180 59.2921 29.7787 178.4234 60 H 4.1637 8.2312 118.1441 59.0854 29.7496 177.1071 61 L 3.8742 8.1666 122.3704 57.8331 42.0342 178.7985 62 K 3.9336 7.8770 119.6653 59.4103 31.9133 178.7212 63 K 3.9880 7.7591 118.8193 59.3739 32.5375 178.6775 64 V 4.1183 8.0110 118.6798 66.3061 31.2677 178.1333 65 L 4.3467 8.5350 119.0736 57.4912 41.1906 179.3475 66 S 4.3638 7.9086 112.8928 60.8508 63.1858 176.2116 67 S 4.3058 8.0991 117.7903 59.8362 62.9478 174.0242 68 F 4.8564 7.4283 119.6560 55.8684 40.4953 175.9080 69 K 4.3218 8.6838 122.9722 56.3701 33.5968 175.6626 70 V 4.7672 8.2600 125.7382 61.1775 33.0649 175.3076 71 L 4.4906 8.7265 128.4821 53.8302 42.7276 176.8840 72 E 4.2482 8.5951 119.9177 56.2697 30.1259 176.9141 73 D 4.5721 8.3904 120.8704 53.7029 41.5783 175.1004 74 P 4.6265 0.0000 0.0000 61.3874 32.5977 174.8995 75 P 4.4013 0.0000 0.0000 62.0622 32.6797 177.2559 76 L 4.1452 8.7627 124.1966 58.9408 41.9844 177.9705 77 D 4.2378 8.2748 116.1879 58.3630 40.9423 178.4599 78 E 3.8185 7.6950 117.4412 59.3241 29.6373 179.2396 79 V 3.2379 6.9716 117.7448 65.9698 31.2921 177.6830 80 L 4.0644 7.8911 119.7418 58.1484 41.8244 178.8024 81 R 3.8511 7.4918 117.6364 59.6464 30.0278 178.6608 82 V 3.5714 7.8379 117.6316 65.8292 31.3219 177.8790 83 A 3.9618 8.1876 120.9362 55.1961 18.0492 179.8445 84 V 3.5758 7.9475 116.0220 66.1493 31.6692 177.8031 85 E 4.2122 8.4386 117.7089 58.1174 29.4263 177.7683 86 R 4.4289 7.7474 115.2962 55.2481 30.7277 176.1679 87 G 3.8943 8.1433 105.0092 46.4897 0.0000 173.8483 88 L 4.6265 7.3786 118.9182 52.8386 43.7612 177.0758 89 T 4.3299 8.0294 110.9043 61.2016 71.2742 175.4138 90 F 3.9568 8.5628 122.8245 61.4504 39.0869 176.6080 91 Y 4.3609 7.6966 115.2403 61.3649 38.2692 177.6943 92 D 4.7719 8.5531 119.3563 57.6134 40.9360 178.8280 93 A 4.0503 8.2933 121.2367 55.2759 18.2330 179.8382 94 S 3.8430 7.7048 113.2714 61.8388 62.7509 176.5806 95 Y 3.9696 7.8551 118.7197 60.8298 37.6441 178.0531 96 A 4.0123 8.1224 121.2135 55.3774 18.5583 178.6443 97 Y 3.8851 8.2504 118.1926 61.0303 38.9273 178.6856 98 V 3.4070 7.8681 118.7351 65.6966 31.5799 177.7635 99 A 3.9133 8.1579 120.5615 55.2164 18.3215 179.4421 100 E 3.8121 8.1764 117.0444 59.6245 29.4470 179.9666 101 S 4.0224 7.6213 111.5909 60.4765 63.1103 174.9882 102 S 4.4428 7.7811 115.5039 57.2281 63.1130 173.9848 103 G 3.9324 7.6288 108.4035 47.0979 0.0000 173.1053 104 L 4.7431 8.1407 116.3790 52.4127 45.8493 177.6706 105 V 3.9642 8.1529 121.1652 61.8253 33.0074 174.8568 106 L 4.7408 8.5474 131.0780 54.5994 43.2130 175.5706 107 V 4.4279 8.7456 128.6355 62.3189 32.6864 174.7482 108 T 5.1164 8.7348 121.8999 60.7376 71.2858 173.6503 109 Q 4.5180 8.4068 122.8533 55.5456 30.2981 175.1477 110 D 4.5564 8.1783 118.1172 54.8160 41.9938 177.0822 111 R 4.0664 8.4478 124.0012 58.5384 30.3211 178.9542 112 E 3.9329 9.2681 119.9913 59.1541 29.6928 178.8075 113 L 3.9476 7.9645 118.4360 57.9529 41.6111 179.0690 114 L 3.9559 7.3893 117.2824 58.0918 41.6590 179.2756 115 A 4.2328 7.7390 119.1900 53.6978 18.5759 178.6997 116 K 4.5851 7.7008 114.5243 55.3151 32.9726 176.0130 117 T 4.6195 7.4980 117.6304 61.1738 70.4399 173.5060 118 K 3.9517 8.9833 127.4580 59.3740 31.7552 177.4928 119 G 3.9389 8.9384 112.7425 44.5024 0.0000 172.6329 120 A 4.4914 7.6388 122.3568 51.9639 19.1810 176.9580 121 I 4.7705 8.5436 114.5991 59.1714 41.9293 173.7458 122 D 5.6450 8.2361 120.9911 50.8405 42.1442 177.5220 123 V 3.4468 8.2771 118.1156 66.2452 31.2422 177.3914 124 E 3.8545 8.1637 118.0817 59.7623 29.4861 178.6181 125 T 3.8366 8.7573 115.8702 66.6672 68.5320 176.1614 126 L 3.8160 8.1167 122.3061 58.0474 41.9361 179.0524 127 L 3.9459 7.9526 118.9409 57.8990 41.7358 179.8399 128 V 3.6236 7.7071 112.2380 64.6125 31.2795 178.8125 129 R 3.9775 7.7179 116.4535 59.3214 29.9594 178.8731 130 L 3.9886 7.8333 117.6202 57.6083 42.0824 179.1442 131 A 4.1954 8.4920 120.6786 54.3142 17.9859 177.7774 132 A 4.7311 7.5973 118.2885 52.4327 19.7786 177.4146 133 Q 4.0597 7.8762 125.6580 57.9274 30.1124 175.0484 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.54 4.48 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.08 0.00 2 A 8.55 3.69 1.44 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 0.00 0.00 0.00 3 V 9.06 3.89 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 0.88 0.00 0.00 0.99 0.00 0.00 4 E 8.80 4.49 0.00 1.79 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.24 0.00 5 Y 8.85 5.21 0.00 2.87 2.90 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 6 L 8.81 5.01 0.00 1.83 1.60 1.08 0.78 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 7 V 9.05 4.63 1.86 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 0.54 0.00 0.00 0.96 0.00 0.00 8 D 8.19 4.29 0.00 1.58 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 0.00 0.00 0.00 9 A 8.22 3.92 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 10 S 7.93 4.05 0.00 4.01 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 11 A 8.04 3.93 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 12 L 8.03 3.66 0.00 1.59 1.81 0.96 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 13 Y 8.27 3.88 0.00 3.26 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 14 A 8.05 4.06 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 15 L 8.58 4.07 0.00 1.74 1.38 0.49 0.42 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 16 A 8.23 4.54 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 7.72 4.66 1.30 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 18 H 8.55 4.96 0.00 3.49 3.44 0.00 5.65 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 7.45 3.08 0.00 2.97 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 20 D 8.16 4.15 0.00 2.66 2.68 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 21 K 8.18 4.18 0.00 2.01 1.97 0.00 1.72 0.00 0.00 1.80 0.00 0.00 3.13 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.47 7.81 22 W 7.57 5.05 0.00 3.46 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 23 I 6.72 2.93 1.30 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.21 -0.83 0.00 0.00 24 K 7.67 3.81 0.00 1.70 1.83 0.00 1.42 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.19 1.14 7.81 25 H 8.81 4.85 0.00 3.34 3.36 0.00 5.65 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 26 R 8.04 3.87 0.00 2.04 2.27 0.00 2.75 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 27 E 8.21 4.08 0.00 2.05 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 2.40 2.28 0.00 28 K 8.44 4.81 0.00 1.93 2.05 0.00 1.82 0.00 0.00 2.05 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.47 7.81 29 L 7.81 5.41 0.00 1.67 1.88 0.95 1.10 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 30 A 8.97 5.51 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 8.92 4.75 1.85 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 1.45 1.12 0.51 0.00 0.00 32 L 8.38 4.96 0.00 1.54 1.53 0.11 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 33 H 8.82 4.18 0.00 3.42 3.55 0.00 5.64 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.33 4.21 0.00 1.76 1.75 1.15 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 35 T 7.84 4.02 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 36 I 7.44 3.61 1.72 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 1.47 0.68 0.58 0.00 0.00 37 Y 7.80 4.01 0.00 3.23 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 38 E 8.44 3.98 0.00 2.19 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 2.13 2.51 0.00 39 A 8.71 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 40 G 8.19 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.92 4.59 0.00 2.87 2.88 0.00 0.00 7.18 7.84 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 42 A 8.09 3.96 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.31 4.34 0.00 2.11 1.95 1.08 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 44 W 8.77 4.16 0.00 3.44 3.37 0.00 0.00 0.00 0.00 0.00 0.00 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 8.17 3.26 0.00 1.88 1.64 0.00 1.70 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.16 1.67 7.81 46 E 7.91 3.88 0.00 2.25 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 2.56 0.00 47 A 7.89 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 R 7.29 3.71 0.00 1.32 1.58 0.00 3.08 0.00 0.00 3.03 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.78 0.00 49 L 6.80 4.50 0.00 1.47 1.60 0.82 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 50 G 7.67 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 0.00 0.00 0.00 51 R 7.95 3.93 0.00 1.89 2.00 0.00 3.52 0.00 0.00 3.35 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.74 0.00 52 V 8.67 3.94 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 0.83 0.00 0.00 0.96 0.00 0.00 53 D 7.94 4.67 0.00 2.85 2.84 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 54 W 8.42 4.34 0.00 3.64 3.40 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 55 A 6.71 3.63 0.51 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 0.00 0.00 0.00 0.00 0.00 0.00 56 A 7.68 3.83 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.38 4.00 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 58 S 8.52 4.20 0.00 4.18 4.59 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 59 R 7.87 3.94 0.00 2.10 2.00 0.00 3.09 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 60 H 8.23 4.16 0.00 3.20 3.44 0.00 5.78 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 61 L 8.17 3.87 0.00 1.95 1.68 1.08 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.88 3.93 0.00 1.98 2.06 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.47 7.81 63 K 7.76 3.99 0.00 1.78 1.93 0.00 1.78 0.00 0.00 1.47 0.00 0.00 2.82 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.27 1.42 7.81 64 V 8.01 4.12 2.33 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 1.46 0.00 0.00 1.02 0.00 0.00 65 L 8.53 4.35 0.00 1.94 1.79 0.93 0.70 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 66 S 7.91 4.36 0.00 4.14 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 8.10 4.31 0.00 4.17 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 68 F 7.43 4.86 0.00 2.92 3.04 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 69 K 8.68 4.32 0.00 1.94 1.99 0.00 1.52 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.50 7.81 70 V 8.26 4.77 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 0.65 0.00 0.00 1.03 0.00 0.00 71 L 8.73 4.49 0.00 1.57 1.60 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 72 E 8.60 4.25 0.00 1.99 1.93 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 2.36 2.37 0.00 73 D 8.39 4.57 0.00 2.71 2.64 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 0.00 0.00 0.00 0.00 74 P 0.00 4.63 0.00 1.95 2.20 0.00 3.67 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 1.94 2.11 0.00 75 P 0.00 4.40 0.00 2.04 1.94 0.00 3.43 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 76 L 8.76 4.15 0.00 1.76 1.70 0.77 1.10 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 77 D 8.27 4.24 0.00 2.74 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 78 E 7.69 3.82 0.00 1.16 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 2.22 2.11 0.00 79 V 6.97 3.24 1.61 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 0.03 0.00 0.00 0.53 0.00 0.00 80 L 7.89 4.06 0.00 2.11 1.69 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 81 R 7.49 3.85 0.00 2.00 2.02 0.00 3.16 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.64 0.00 82 V 7.84 3.57 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 0.99 0.00 0.00 1.10 0.00 0.00 83 A 8.19 3.96 1.44 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 0.00 0.00 0.00 84 V 7.95 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 0.87 0.00 0.00 1.01 0.00 0.00 85 E 8.44 4.21 0.00 2.06 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 2.35 2.43 0.00 86 R 7.75 4.43 0.00 1.86 1.93 0.00 3.30 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 87 G 8.14 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 7.38 4.63 0.00 1.61 1.64 0.95 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 89 T 8.03 4.33 4.35 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 1.30 0.00 0.00 90 F 8.56 3.96 0.00 2.99 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 91 Y 7.70 4.36 0.00 3.16 3.26 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 92 D 8.55 4.77 0.00 2.82 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 93 A 8.29 4.05 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 94 S 7.70 3.84 0.00 3.65 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 95 Y 7.86 3.97 0.00 3.32 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.12 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 97 Y 8.25 3.89 0.00 3.04 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 98 V 7.87 3.41 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 0.95 0.00 0.00 1.05 0.00 0.00 99 A 8.16 3.91 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 0.00 100 E 8.18 3.81 0.00 1.91 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 2.29 2.38 0.00 101 S 7.62 4.02 0.00 3.67 3.30 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 0.00 102 S 7.78 4.44 0.00 4.00 3.87 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 0.00 103 G 7.63 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 0.00 0.00 0.00 104 L 8.14 4.74 0.00 1.42 1.52 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.15 3.96 1.81 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 1.09 0.00 0.00 0.76 0.00 0.00 106 L 8.55 4.74 0.00 1.80 1.58 0.94 0.89 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 0.00 107 V 8.75 4.43 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 0.76 0.00 0.00 0.97 0.00 0.00 108 T 8.73 5.12 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 109 Q 8.41 4.52 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.64 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 110 D 8.18 4.56 0.00 2.65 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 R 8.45 4.07 0.00 1.93 1.95 0.00 3.22 0.00 0.00 3.26 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 112 E 9.27 3.93 0.00 2.10 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 2.32 2.41 0.00 113 L 7.96 3.95 0.00 1.71 1.69 0.88 0.74 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 0.00 114 L 7.39 3.96 0.00 1.57 1.75 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.74 4.23 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 0.00 116 K 7.70 4.59 0.00 1.81 1.84 0.00 1.66 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.39 1.60 7.81 117 T 7.50 4.62 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 118 K 8.98 3.95 0.00 1.72 1.77 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.47 1.39 7.81 119 G 8.94 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 0.00 0.00 0.00 120 A 7.64 4.49 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 0.00 121 I 8.54 4.77 1.89 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 1.37 0.83 1.01 0.00 0.00 122 D 8.24 5.65 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 0.00 123 V 8.28 3.45 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 1.00 0.00 0.00 1.02 0.00 0.00 124 E 8.16 3.85 0.00 2.05 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 2.37 2.40 0.00 125 T 8.76 3.84 4.39 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 1.23 0.00 0.00 126 L 8.12 3.82 0.00 1.52 1.73 -0.04 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 127 L 7.95 3.95 0.00 1.88 1.69 0.80 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 128 V 7.71 3.62 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 1.02 0.00 0.00 1.00 0.00 0.00 129 R 7.72 3.98 0.00 1.99 2.09 0.00 3.35 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.94 0.00 130 L 7.83 3.99 0.00 1.71 1.49 0.90 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 131 A 8.49 4.20 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 0.00 132 A 7.60 4.73 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 0.00 133 Q 7.88 4.06 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.49 0.00 0.00 0.00 0.00 0.00 2.31 2.48 0.00