NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8109 8.3544 109.7364 46.5693 0.0000 172.9886 2 S 3.5891 8.5430 114.9417 57.5099 60.3992 171.0349 3 S 4.1516 8.5424 115.7439 60.5511 65.0269 173.2109 4 G 3.5028 7.9874 106.2510 45.3535 0.0000 175.0069 5 S 4.5584 7.4946 112.4590 56.5841 61.7549 171.6403 6 S 4.6998 8.0696 119.2475 55.9100 66.1643 173.3369 7 G 4.2020 8.3113 123.0883 46.8661 0.0000 174.6996 8 D 4.3529 8.2717 119.2589 54.4685 41.6850 175.1379 9 D 4.3782 7.3063 115.9328 55.8047 40.1631 173.7180 10 D 4.5650 8.0884 118.6927 56.5808 41.9281 178.3546 11 L 4.2223 7.7208 122.2723 55.0902 39.6566 175.7384 12 E 4.8043 8.0098 120.0825 54.9194 33.0995 175.2207 13 V 4.4366 8.0617 116.8577 62.1290 34.6673 173.1876 14 K 4.8587 8.6234 127.3222 55.5512 35.3553 174.1509 15 E 4.9185 8.1936 117.5142 56.3861 32.6023 175.0444 16 E 4.1856 8.8572 119.5529 55.7796 31.8372 175.2076 17 N 4.1309 9.8697 121.2804 54.3240 36.1619 175.7348 18 G 3.5495 8.2812 105.9079 44.9674 0.0000 174.7753 19 V 4.0083 7.4395 120.7685 60.7377 31.2140 175.0075 20 W 4.6376 8.4589 127.9982 56.6674 30.4358 175.9525 21 V 4.7445 8.7831 123.4275 61.5562 32.1226 174.9407 22 L 5.0079 8.1738 127.9241 53.5995 43.8803 175.8480 23 N 5.0701 9.6235 117.4457 51.1992 40.3805 174.9904 24 D 4.6454 8.9522 118.8476 57.0584 41.3160 177.9986 25 G 3.8585 8.1819 106.8466 47.1269 0.0000 174.0737 26 N 4.9557 7.8957 114.8676 52.2241 37.4397 175.7152 27 F 4.1038 8.3818 121.7783 62.1076 39.2181 176.7749 28 D 4.3803 8.2666 117.1599 57.5737 40.8989 178.0771 29 N 4.4034 8.3792 115.7704 56.7319 38.6766 175.9522 30 F 4.2452 7.6529 120.8484 60.8877 39.9043 177.5681 31 V 3.6632 7.6507 108.7336 61.8670 31.3054 177.5435 32 A 4.0884 7.9015 122.0279 54.5980 19.1034 178.7037 33 D 4.8553 7.6846 113.6100 53.5734 41.3475 176.4337 34 K 4.5061 7.4002 117.1842 54.6320 36.0219 176.8331 35 D 4.5793 8.6689 123.5114 57.3156 42.4877 176.7058 36 T 5.0622 7.6238 114.9258 62.1194 73.0593 173.1808 37 V 4.6074 8.7384 126.4525 60.8175 34.9386 173.9461 38 L 4.5262 8.2525 130.4066 54.5104 43.3891 175.0723 39 L 5.0023 8.7017 126.5457 52.8406 44.5135 174.8817 40 E 4.7182 8.5235 124.8901 54.3722 31.8807 174.6078 41 F 5.3824 9.6659 126.5486 56.2005 40.5923 174.6289 42 Y 5.1164 7.8439 118.7538 56.2897 41.9698 173.0244 43 A 4.1424 8.1286 120.5389 49.3296 21.7846 175.5270 44 P 4.2994 0.0000 0.0000 64.7947 31.6712 177.2309 45 W 4.5375 6.8720 113.7333 56.3556 28.7104 175.3212 46 C 4.6775 7.3260 121.1217 58.0145 31.1150 174.2658 47 G 3.6302 8.7618 115.6043 47.9999 0.0000 173.5459 48 H 4.1856 8.4920 119.9902 59.1606 29.6419 176.4835 49 C 4.4678 7.9365 120.6457 62.0779 30.2239 175.2258 50 K 3.8704 8.3179 120.7261 59.8802 31.4545 179.1805 51 Q 4.1794 7.4771 116.5351 58.3221 28.8851 177.7554 52 F 4.4877 7.7360 118.2137 59.8773 39.4738 177.2237 53 A 3.8007 8.3323 121.2854 55.0178 18.0737 177.8634 54 P 4.7730 0.0000 0.0000 65.2812 31.3434 178.1207 55 E 3.7367 7.7364 117.9867 58.9944 29.6942 177.8744 56 Y 3.9471 7.8861 119.8438 60.5425 38.4283 177.1836 57 E 3.6525 7.6196 119.6173 59.5925 29.1907 179.6576 58 K 3.7890 7.5939 117.7087 59.6283 32.1123 179.3043 59 I 3.5632 7.9061 119.8121 64.7338 36.8198 177.9825 60 A 3.6360 6.7351 118.3667 55.3618 18.3450 178.9273 61 S 4.1163 7.9182 109.9746 62.1143 61.9485 176.2071 62 T 3.8218 7.4107 117.1893 67.2373 68.1952 176.0600 63 L 3.9256 8.0875 119.2510 56.1396 41.4316 179.4525 64 K 4.0268 7.8431 120.3488 59.3493 32.3217 176.8972 65 D 4.6664 7.1283 115.5321 54.0862 40.7239 175.5436 66 N 4.7177 7.6585 116.6504 52.4344 40.0751 173.2534 67 D 5.1310 8.1844 120.1880 51.5073 43.8014 174.4689 68 P 4.5003 0.0000 0.0000 61.3052 32.2210 174.1152 69 P 4.5564 0.0000 0.0000 62.3155 31.7416 175.6765 70 I 4.6024 7.9365 123.0737 59.2838 40.3597 175.1808 71 A 4.6893 8.4449 127.0718 50.4216 20.7671 175.9353 72 V 4.3227 8.4599 122.6420 63.1908 33.0451 174.8933 73 A 5.4921 8.9492 128.3611 50.3848 23.2847 174.3579 74 K 5.1211 9.2874 117.9276 55.3407 36.6912 175.1887 75 I 4.5963 8.6485 120.6533 59.9772 41.9593 174.7660 76 D 3.9596 8.6172 126.2451 52.0273 39.8388 176.2207 77 A 4.2350 8.0949 123.8371 55.0831 18.4719 178.9747 78 T 3.8875 7.5957 106.2849 65.5650 68.5047 175.9385 79 S 4.5383 8.4073 116.5416 59.1454 63.5889 174.5235 80 A 4.5188 7.4978 125.0378 50.4841 19.0079 177.8499 81 S 4.0466 8.3150 118.6774 62.6335 63.6952 175.5659 82 M 3.8775 8.1254 122.1680 58.4073 31.8626 177.9530 83 L 3.9086 7.8873 117.7741 57.6872 41.8994 179.0840 84 A 3.9765 7.9295 120.2285 55.6612 18.3267 180.0042 85 S 4.2782 8.5929 113.7650 61.0737 62.5916 176.6020 86 K 3.7041 7.7680 121.9699 59.3100 31.9224 178.5692 87 F 4.6095 7.8597 114.6524 57.2234 40.3938 175.6737 88 D 4.2651 7.8377 116.0404 55.3037 38.7585 176.6166 89 V 3.5881 7.8486 119.8098 63.1513 29.4309 175.0806 90 S 4.5520 7.6576 123.1761 56.9937 62.8841 173.6137 91 G 3.6279 6.6067 105.7476 45.6260 0.0000 172.4901 92 Y 4.9272 7.8438 114.9390 55.8583 41.6394 173.0601 93 P 4.7747 0.0000 0.0000 63.3335 32.6576 175.7504 94 T 4.6011 8.8968 119.0078 62.0424 71.3078 172.9582 95 I 4.6858 8.4960 127.5270 60.2628 38.9338 175.3203 96 K 4.9050 9.1723 124.4818 55.2762 37.5137 174.9784 97 I 5.1059 8.3994 119.7257 59.6084 41.8276 174.4027 98 L 5.1923 8.9153 127.7855 53.3055 44.5113 174.9128 99 K 4.7100 9.2779 128.9221 54.5851 34.0349 175.4645 100 K 3.9731 9.6827 126.5243 57.4100 30.3847 175.9046 101 G 4.0704 8.7120 104.3349 45.2802 0.0000 173.4253 102 Q 4.4937 8.8831 121.3286 53.5276 30.5014 174.3560 103 A 4.9612 8.7680 128.1127 52.0211 18.9073 176.6130 104 V 4.4796 9.2095 124.6069 60.8735 33.2376 174.4838 105 D 4.8114 8.8394 128.4067 53.7088 39.7641 175.7068 106 Y 4.6275 8.6997 123.2811 56.9699 40.1406 174.3863 107 D 4.0030 6.7139 123.2075 53.6382 43.3361 175.2696 108 G 3.8985 8.0289 113.6307 43.3992 0.0000 171.5605 109 S 4.2598 8.1652 117.1816 58.3982 62.4401 175.9504 110 R 4.4761 8.5564 124.1059 55.9365 27.0303 176.1996 111 T 4.8660 7.7572 116.5906 60.0823 73.4525 174.3651 112 Q 4.1461 8.7189 121.9899 59.3719 28.8001 178.7786 113 E 4.0277 8.0661 118.9370 59.3727 29.9726 178.4134 114 E 4.0410 7.9443 118.2448 59.4130 29.6954 179.1419 115 I 3.3006 8.3368 120.0303 64.6390 37.2946 178.5463 116 V 3.4991 7.4337 117.7525 65.9356 31.3126 177.3677 117 A 3.9828 8.1017 120.5916 55.6038 18.1423 179.2078 118 K 3.8980 8.1138 117.0560 60.2182 32.2682 178.4960 119 V 3.4012 7.7798 117.8832 66.4686 31.1216 177.9599 120 R 3.8558 8.6854 117.5144 59.4968 29.5762 178.1500 121 E 4.1148 8.3154 120.1605 59.0411 29.4383 178.8365 122 V 2.1097 7.8090 118.1144 65.0930 31.4816 177.6729 123 S 4.5132 7.8654 115.0846 59.7755 62.8341 175.2857 124 Q 4.1553 7.2504 120.1814 55.3722 29.0376 176.0380 125 P 4.2080 0.0000 0.0000 65.6197 31.8597 177.5129 126 D 4.5005 8.1814 118.2916 56.3580 41.1780 176.8210 127 W 4.2795 7.5557 127.6964 58.1668 31.0559 175.0677 128 T 4.4208 6.7977 113.5971 58.5247 71.2975 171.6865 129 P 3.9398 0.0000 0.0000 61.7258 31.8495 174.6414 130 P 4.3815 0.0000 0.0000 61.2724 32.2230 174.4503 131 P 4.3798 0.0000 0.0000 63.5830 32.7104 174.5875 132 E 3.7260 8.7452 114.2327 57.4505 27.5656 175.6643 133 V 3.8472 7.5697 116.7017 62.3293 32.6319 176.3803 134 T 4.2370 8.5102 118.6995 65.5809 69.1373 175.4841 135 S 4.6405 7.7288 113.1682 56.7575 65.4113 173.9921 136 G 4.0092 8.2563 115.3217 42.8111 0.0000 169.1003 137 P 4.2629 0.0000 0.0000 63.5327 30.1444 177.2302 138 S 3.5014 8.4735 124.3333 58.6378 60.8745 171.8298 139 S 4.0493 8.2033 115.2954 61.4593 61.7970 173.8871 140 G 3.4570 8.7329 115.2221 45.1324 0.0000 171.3126 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 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 S 8.54 3.59 0.00 4.09 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 3 S 8.54 4.15 0.00 4.02 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 4 G 7.99 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 7.49 4.56 0.00 3.84 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.07 4.70 0.00 3.84 3.71 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 7 G 8.31 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 D 8.27 4.35 0.00 2.64 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 D 7.31 4.38 0.00 2.84 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 10 D 8.09 4.56 0.00 2.70 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 11 L 7.72 4.22 0.00 1.65 1.69 0.93 0.83 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 12 E 8.01 4.80 0.00 2.05 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 2.39 2.32 0.00 13 V 8.06 4.44 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.97 0.00 0.00 14 K 8.62 4.86 0.00 1.77 1.75 0.00 1.77 0.00 0.00 1.89 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.46 7.81 15 E 8.19 4.92 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.95 0.00 16 E 8.86 4.19 0.00 1.80 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 2.14 2.34 0.00 17 N 9.87 4.13 0.00 2.71 2.75 0.00 0.00 7.70 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 18 G 8.28 3.55 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 0.00 0.00 0.00 19 V 7.44 4.01 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 1.04 0.00 0.00 0.71 0.00 0.00 20 W 8.46 4.64 0.00 3.14 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 21 V 8.78 4.74 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 0.89 0.00 0.00 0.94 0.00 0.00 22 L 8.17 5.01 0.00 1.48 1.59 0.50 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 23 N 9.62 5.07 0.00 2.81 2.89 0.00 0.00 7.03 7.87 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 24 D 8.95 4.65 0.00 2.62 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.18 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 N 7.90 4.96 0.00 2.98 3.05 0.00 0.00 5.96 8.35 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 27 F 8.38 4.10 0.00 3.33 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 28 D 8.27 4.38 0.00 2.85 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.38 4.40 0.00 2.75 2.95 0.00 0.00 6.90 7.04 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 30 F 7.65 4.25 0.00 3.01 3.07 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 0.00 31 V 7.65 3.66 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 0.65 0.00 0.00 0.92 0.00 0.00 32 A 7.90 4.09 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 33 D 7.68 4.86 0.00 2.52 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 34 K 7.40 4.51 0.00 1.57 1.51 0.00 1.56 0.00 0.00 1.21 0.00 0.00 2.64 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.99 0.89 7.81 35 D 8.67 4.58 0.00 2.64 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 36 T 7.62 5.06 4.16 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 1.07 0.00 0.00 37 V 8.74 4.61 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 1.05 0.00 0.00 0.90 0.00 0.00 38 L 8.25 4.53 0.00 1.89 1.55 1.05 0.55 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 39 L 8.70 5.00 0.00 1.36 1.11 0.95 0.17 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 40 E 8.52 4.72 0.00 1.82 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 1.47 2.06 0.00 41 F 9.67 5.38 0.00 3.22 3.13 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 0.00 42 Y 7.84 5.12 0.00 2.91 2.97 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 43 A 8.13 4.14 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.30 0.00 2.20 2.20 0.00 2.98 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.88 0.00 45 W 6.87 4.54 0.00 3.52 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 46 C 7.33 4.68 0.00 2.55 2.77 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 47 G 8.76 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 48 H 8.49 4.19 0.00 3.26 3.39 0.00 5.69 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 49 C 7.94 4.47 0.00 3.00 3.13 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 0.00 50 K 8.32 3.87 0.00 1.96 1.85 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.49 7.81 51 Q 7.48 4.18 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.92 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 52 F 7.74 4.49 0.00 3.00 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 53 A 8.33 3.80 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 54 P 0.00 4.77 0.00 2.20 2.25 0.00 3.78 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 2.11 1.83 0.00 55 E 7.74 3.74 0.00 1.81 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 2.33 2.09 0.00 56 Y 7.89 3.95 0.00 2.49 2.83 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 57 E 7.62 3.65 0.00 1.98 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 2.21 2.46 0.00 58 K 7.59 3.79 0.00 1.79 1.78 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.51 7.81 59 I 7.91 3.56 1.71 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.90 0.80 0.00 0.00 60 A 6.74 3.64 1.13 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 0.00 0.00 0.00 61 S 7.92 4.12 0.00 3.80 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 62 T 7.41 3.82 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 1.18 0.00 0.00 63 L 8.09 3.93 0.00 1.64 1.67 0.87 0.47 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 64 K 7.84 4.03 0.00 1.80 1.92 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.51 7.81 65 D 7.13 4.67 0.00 2.48 2.61 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 0.00 66 N 7.66 4.72 0.00 2.97 2.83 0.00 0.00 7.07 8.48 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 67 D 8.18 5.13 0.00 2.62 2.52 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 68 P 0.00 4.50 0.00 2.15 2.05 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.04 0.00 69 P 0.00 4.56 0.00 2.18 2.09 0.00 3.29 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 70 I 7.94 4.60 1.85 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 1.11 0.85 0.93 0.00 0.00 71 A 8.44 4.69 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 72 V 8.46 4.32 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 0.50 0.00 0.00 0.84 0.00 0.00 73 A 8.95 5.49 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 K 9.29 5.12 0.00 1.98 2.02 0.00 1.19 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.53 1.54 7.81 75 I 8.65 4.60 1.34 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 1.26 1.04 0.89 0.00 0.00 76 D 8.62 3.96 0.00 2.39 2.34 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 77 A 8.09 4.24 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.60 3.89 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 1.10 0.00 0.00 79 S 8.41 4.54 0.00 3.88 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 80 A 7.50 4.52 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 81 S 8.31 4.05 0.00 4.08 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 M 8.13 3.88 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.58 0.00 83 L 7.89 3.91 0.00 1.84 1.82 0.96 -0.21 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 84 A 7.93 3.98 1.52 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 85 S 8.59 4.28 0.00 4.04 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 86 K 7.77 3.70 0.00 1.79 1.82 0.00 1.61 0.00 0.00 1.44 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.75 1.23 7.81 87 F 7.86 4.61 0.00 2.84 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 88 D 7.84 4.27 0.00 2.73 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 89 V 7.85 3.59 1.83 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 0.48 0.00 0.00 -0.25 0.00 0.00 90 S 7.66 4.55 0.00 3.78 3.71 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 G 6.61 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 92 Y 7.84 4.93 0.00 2.86 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 P 0.00 4.77 0.00 1.92 2.02 0.00 3.74 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.82 0.00 94 T 8.90 4.60 4.32 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 1.18 0.00 0.00 95 I 8.50 4.69 1.91 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 1.56 0.50 0.91 0.00 0.00 96 K 9.17 4.90 0.00 1.57 1.68 0.00 1.88 0.00 0.00 1.80 0.00 0.00 2.87 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.49 1.65 7.81 97 I 8.40 5.11 1.88 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 1.06 0.66 0.80 0.00 0.00 98 L 8.92 5.19 0.00 1.87 1.63 1.30 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 99 K 9.28 4.71 0.00 1.78 1.76 0.00 1.92 0.00 0.00 1.41 0.00 0.00 3.12 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.52 7.81 100 K 9.68 3.97 0.00 1.97 1.85 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.41 7.81 101 G 8.71 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 0.00 0.00 0.00 0.00 102 Q 8.88 4.49 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 7.01 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 103 A 8.77 4.96 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 0.00 104 V 9.21 4.48 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 1.33 0.00 0.00 1.16 0.00 0.00 105 D 8.84 4.81 0.00 2.78 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 8.70 4.63 0.00 2.93 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 0.00 107 D 6.71 4.00 0.00 2.50 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 0.00 0.00 0.00 0.00 108 G 8.03 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 0.00 0.00 0.00 109 S 8.17 4.26 0.00 3.95 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 0.00 110 R 8.56 4.48 0.00 1.87 2.05 0.00 2.65 0.00 0.00 2.96 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.39 0.00 111 T 7.76 4.87 4.32 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 1.30 0.00 0.00 112 Q 8.72 4.15 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 113 E 8.07 4.03 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 2.41 2.36 0.00 114 E 7.94 4.04 0.00 2.25 2.19 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 2.42 2.71 0.00 115 I 8.34 3.30 1.98 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.20 0.88 0.00 0.00 116 V 7.43 3.50 2.32 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 0.95 0.00 0.00 0.92 0.00 0.00 117 A 8.10 3.98 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.11 3.90 0.00 2.20 1.99 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.27 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.71 1.53 7.81 119 V 7.78 3.40 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 0.88 0.00 0.00 120 R 8.69 3.86 0.00 1.91 2.06 0.00 3.19 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.96 0.00 121 E 8.32 4.11 0.00 2.19 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 0.00 2.62 2.55 0.00 122 V 7.81 2.11 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.20 0.00 0.00 123 S 7.87 4.51 0.00 3.98 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 Q 7.25 4.16 0.00 2.42 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.36 7.00 0.00 0.00 0.00 0.00 0.00 2.71 2.54 0.00 125 P 0.00 4.21 0.00 2.22 2.21 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 126 D 8.18 4.50 0.00 2.77 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 0.00 127 W 7.56 4.28 0.00 3.44 3.42 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 0.00 128 T 6.80 4.42 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 1.24 0.00 0.00 129 P 0.00 3.94 0.00 2.24 2.35 0.00 3.64 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.07 0.00 130 P 0.00 4.38 0.00 2.17 2.03 0.00 3.80 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 131 P 0.00 4.38 0.00 2.19 2.12 0.00 3.87 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.92 0.00 132 E 8.75 3.73 0.00 2.07 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 2.20 2.34 0.00 133 V 7.57 3.85 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 0.79 0.00 0.00 1.01 0.00 0.00 134 T 8.51 4.24 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 1.22 0.00 0.00 135 S 7.73 4.64 0.00 3.74 3.64 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 0.00 136 G 8.26 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 0.00 0.00 0.00 137 P 0.00 4.26 0.00 2.16 2.07 0.00 3.87 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.86 0.00 138 S 8.47 3.50 0.00 3.92 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 0.00 139 S 8.20 4.05 0.00 3.88 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 8.73 3.46 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 0.00 0.00 0.00