NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5043 8.1776 115.4155 57.7915 64.6283 174.4034 3 V 3.2552 8.2126 121.9461 64.8845 30.9383 176.9068 4 Y 3.9762 8.4871 118.2347 60.8250 37.9550 179.3087 5 D 4.3904 7.7359 117.5311 57.1565 41.1910 178.3844 6 A 4.0616 8.1991 121.2260 55.0827 18.4106 179.5263 7 A 3.8298 8.2193 119.3524 55.1496 18.1936 179.5680 8 A 4.0656 7.5410 117.6428 54.6217 18.5081 179.0122 9 Q 4.2840 7.6683 115.0329 56.3616 29.9086 177.0116 10 L 4.2213 7.4209 121.6130 53.5947 40.2676 177.0490 11 T 4.1759 7.6981 114.6455 60.3168 71.4215 175.0252 12 A 3.9434 8.4658 122.3265 55.8862 18.1506 179.6779 13 D 4.3544 7.9880 116.2714 56.9991 40.9551 179.1146 14 V 3.4676 7.3830 118.0779 65.7476 31.4787 178.1055 15 K 3.7993 8.2134 118.5879 59.2918 31.8343 179.1648 16 K 3.9234 8.0032 119.6975 59.7929 32.2322 178.6424 17 D 4.5945 8.3464 119.2794 57.1588 40.5218 178.9033 18 L 3.7092 7.9445 119.6693 57.6881 41.6206 179.6245 19 R 4.0212 8.0758 117.9586 59.5202 28.6054 178.8419 20 D 4.4999 8.5884 119.2389 57.4962 40.7741 179.1512 21 S 3.2196 8.1644 114.6449 60.7655 63.1238 176.3431 22 W 4.2786 8.7588 132.2391 59.9149 30.1937 177.7047 23 K 3.8912 8.0285 119.2078 59.1698 31.8140 178.5147 24 V 3.7603 7.0195 117.9458 65.4960 31.3266 177.9407 25 I 3.5188 7.6983 119.8246 64.3799 36.9814 178.2659 26 G 2.2047 6.8364 105.8952 45.8624 0.0000 174.7289 27 S 4.0586 7.2292 116.5162 60.7123 63.2227 174.0193 28 D 4.6262 7.3531 118.9642 51.0199 41.2611 175.5432 29 K 3.9530 8.1389 123.7890 58.5663 32.3323 178.3753 30 K 4.0234 7.9737 119.5589 59.4810 32.2709 179.0684 31 G 3.5979 8.4141 107.5123 47.4564 0.0000 175.5366 32 N 4.4361 8.2628 119.3042 55.4789 38.5312 177.9857 33 G 3.5144 8.1352 107.4719 47.8234 0.0000 176.0607 34 V 3.5884 7.9648 120.9735 65.3617 31.5134 177.8711 35 A 3.9058 8.0993 120.7075 54.9582 18.1271 179.1254 36 L 3.7361 7.8679 118.6944 58.6980 42.0880 179.1221 37 M 3.4823 7.6350 118.0670 58.4393 31.8848 178.9485 38 T 3.9126 7.9470 109.9611 65.0765 68.8007 176.7201 39 T 3.8114 7.8308 118.5472 66.1208 68.4065 176.3050 40 L 3.8346 7.8041 122.3622 58.3741 41.5725 179.1572 41 F 4.6255 7.9565 117.4608 60.3898 38.5200 177.7137 42 A 4.0445 8.0033 119.8203 55.4632 18.4254 179.2014 43 D 4.6042 8.3600 116.0544 56.0238 42.4887 177.0281 44 N 5.2670 8.4397 116.0759 49.4308 39.6733 174.7691 45 Q 4.2938 8.5056 121.9995 58.1343 29.1240 178.2419 46 E 4.1079 8.3278 118.2147 59.1282 29.4191 178.4964 47 T 4.6014 8.3822 110.3032 63.4551 69.1620 176.6117 48 I 3.7159 7.9859 123.9269 64.4159 36.8279 178.0061 49 G 3.6938 8.1355 107.5008 48.9082 0.0000 174.2164 50 Y 4.1785 7.6111 116.5245 60.0382 38.0744 176.5958 51 F 4.9476 8.4692 119.0960 56.8690 39.9534 178.0146 52 K 3.8524 8.3481 123.1135 59.7105 32.0465 179.2943 53 R 3.9595 8.0529 117.5037 59.2681 30.0220 177.3173 54 L 4.1768 8.0914 116.5526 55.4900 42.5280 179.2401 55 G 3.7746 7.6861 105.9427 46.2742 0.0000 175.8698 56 N 4.5192 8.4062 118.5280 52.5338 38.5660 175.7729 57 V 3.7192 7.9925 127.2804 64.9508 31.5628 176.9520 58 S 4.3364 7.8812 112.2351 60.7394 63.2839 175.6635 59 Q 4.1181 8.2529 122.0574 56.2441 28.7349 177.2666 60 G 3.8642 8.5771 108.5599 46.2860 0.0000 176.6917 61 M 3.8799 9.0128 122.6604 58.2555 31.8907 176.8246 62 A 4.0634 7.6312 119.9092 53.3814 18.9281 177.0688 63 N 4.6882 8.1952 115.8054 52.2701 39.6437 175.0137 64 D 4.3746 8.6578 128.9637 57.4907 41.0176 178.9422 65 K 4.0128 8.1181 118.4615 59.2840 32.0916 179.0022 66 L 4.0201 8.4744 120.7406 58.0701 42.0471 178.8463 67 R 3.9982 8.3327 118.9871 59.5315 30.0541 178.6540 68 G 3.6690 8.3791 105.6315 48.0358 0.0000 175.0769 69 H 4.1974 8.4890 120.8044 59.1407 29.7264 177.4667 70 S 4.0968 8.2450 115.9461 61.6469 62.8328 176.5317 71 I 3.9269 7.9067 122.2913 64.8358 36.9093 178.5860 72 T 4.0390 7.9244 116.4710 66.6038 68.3329 176.1409 73 L 4.0146 8.3115 122.6154 58.8022 42.0552 179.1281 74 M 4.2488 7.9641 118.1537 58.3153 31.8300 178.0470 75 Y 4.0988 8.1299 116.4398 60.0090 38.0884 177.7970 76 A 3.7714 7.8389 122.3009 54.8323 18.4722 179.5137 77 L 3.4297 7.4866 116.9754 57.6917 41.6154 179.1266 78 Q 3.4750 7.6810 119.3380 59.1785 29.0414 177.8439 79 N 4.1893 7.8335 117.6581 56.9510 38.7024 176.3973 80 F 4.3651 7.3788 117.6161 60.9771 39.4733 177.5575 81 I 3.6551 7.5861 119.0824 64.4839 36.6122 178.3173 82 D 4.4426 8.0881 118.6322 56.8013 41.0264 177.8042 83 Q 4.3716 7.7159 116.4518 56.0432 28.7459 177.4819 84 L 3.9594 7.5834 121.2318 57.8815 41.6479 178.2301 85 D 4.3227 8.0667 117.6729 56.1295 41.1327 175.8516 86 N 4.7990 7.9353 116.9204 50.7188 40.5501 172.5922 87 P 4.1811 0.0000 0.0000 65.7591 31.4597 178.2695 88 D 4.3720 8.2110 117.3871 57.4819 40.7537 178.6295 89 D 4.3279 8.1443 118.9118 57.1440 40.9762 178.2797 90 L 3.8808 8.1563 121.2447 58.1497 41.9652 179.2855 91 V 3.3831 7.9827 118.6451 66.0333 31.5171 177.8305 92 C 4.1152 8.0344 114.2661 61.2365 29.3655 176.0384 93 V 3.7227 7.9545 120.8815 65.5451 31.0690 178.3103 94 V 3.4248 7.7861 118.2562 65.9246 31.1284 177.9336 95 E 3.9416 8.1608 117.5285 59.0711 29.1803 178.8939 96 K 4.0907 8.0541 119.6417 59.6453 31.3106 178.5714 97 F 4.2019 8.6514 120.7460 61.3834 39.2623 176.9348 98 A 4.1355 8.3969 120.4970 54.7287 18.1025 179.2910 99 V 3.4736 7.4411 116.6262 66.8596 31.6168 178.0697 100 N 4.2869 7.9868 115.0983 56.6310 38.4359 177.1037 101 H 4.0636 7.5242 114.5703 58.7049 28.7414 177.9372 102 I 3.7209 8.1760 122.1983 64.6936 36.7013 178.6174 103 T 3.8993 7.6690 115.5873 66.2957 68.3411 176.0553 104 R 4.1902 7.5250 116.9241 55.6020 30.4974 176.4213 105 K 3.8492 7.8824 117.2452 57.4761 29.6666 176.0258 106 I 3.9027 7.6606 120.5751 60.4504 37.5245 177.1835 107 S 4.5684 8.4143 120.7963 56.9626 65.7955 174.7366 108 A 3.9936 8.5276 122.9782 55.5532 17.7471 179.7193 109 A 4.0228 7.9593 117.3725 55.1251 18.8791 179.0651 110 E 4.0921 8.2349 117.6565 59.5129 29.8287 178.7451 111 F 4.1341 8.6364 121.0535 61.2668 39.5217 177.0609 112 G 3.8865 8.4239 104.6556 46.8993 0.0000 175.4410 113 K 4.1505 7.9475 120.5764 58.9068 31.9226 178.7308 114 I 3.5106 7.7323 118.9557 63.2675 37.6672 177.3238 115 N 4.4231 8.1265 117.9637 56.4659 38.2771 177.0410 116 G 3.6462 7.6333 106.4434 47.5513 0.0000 173.6664 117 P 4.1912 0.0000 0.0000 65.1099 31.2741 178.8337 118 I 3.5236 7.9352 118.6993 64.1087 37.0060 178.2768 119 K 3.9131 8.2696 120.7454 59.5746 31.9890 178.9505 120 K 3.9688 8.2967 118.9245 59.3702 31.7306 179.5227 121 V 3.5149 7.6484 117.5260 65.8253 31.6937 177.6686 122 L 4.1248 8.1555 118.8142 58.0234 41.6185 179.3473 123 A 4.3322 8.4234 122.0461 54.6266 18.0393 179.7440 124 S 4.2241 7.9673 111.5755 60.4314 63.0305 175.8462 125 K 4.4197 7.9436 120.8571 55.5704 32.3317 175.6593 126 N 4.1474 7.8319 114.7341 54.3091 35.8386 173.9956 127 F 4.4787 8.0257 117.2480 55.6790 40.9373 175.8247 128 G 4.4739 8.6044 116.7920 44.6228 0.0000 172.4934 129 D 4.4827 9.0623 117.8625 57.8462 40.6058 178.9012 130 K 3.8456 8.1749 119.1702 59.7490 32.0251 178.2800 131 Y 4.1343 8.3658 116.7867 60.8268 37.8595 177.7618 132 A 4.1852 8.2682 121.3248 55.4341 18.4288 179.3142 133 N 4.3375 8.7208 115.1215 56.2226 38.4344 177.6003 134 A 3.9172 7.8385 122.0212 55.0310 18.4149 179.7970 135 W 3.7603 8.6679 117.5150 59.6545 29.0983 178.6091 136 A 4.0913 8.4190 120.9985 55.0687 17.5129 179.8811 137 K 3.9219 7.5706 116.3483 59.3535 32.3783 179.0759 138 L 3.8967 7.4881 120.7652 58.1518 41.9652 179.1636 139 V 3.7526 8.1828 118.2214 66.0209 31.5472 177.8205 140 A 4.5250 8.0667 121.7845 54.2767 17.8841 179.8298 141 V 3.3806 7.2996 116.6027 66.0617 31.8783 178.1438 142 V 3.4344 7.3883 117.4951 65.9950 31.4918 177.8643 143 Q 3.8844 8.3317 117.8861 58.7873 28.2652 178.6675 144 A 4.0022 7.7112 120.4249 54.3176 18.4448 178.5677 145 A 4.2599 7.5704 117.2485 52.7075 19.3828 177.2267 146 L 4.1063 7.3828 121.8491 54.8057 41.8151 176.6159 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 2 S 8.18 4.50 0.00 4.14 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 0.00 3 V 8.21 3.26 1.85 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 0.71 0.00 0.00 4 Y 8.49 3.98 0.00 3.06 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 5 D 7.74 4.39 0.00 2.88 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 8.20 4.06 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 A 8.22 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 8 A 7.54 4.07 1.37 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 0.00 0.00 9 Q 7.67 4.28 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.18 0.00 0.00 0.00 0.00 0.00 2.65 2.50 0.00 10 L 7.42 4.22 0.00 1.65 1.52 0.75 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.70 4.18 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 1.20 0.00 0.00 12 A 8.47 3.94 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 13 D 7.99 4.35 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 14 V 7.38 3.47 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 0.89 0.00 0.00 0.86 0.00 0.00 15 K 8.21 3.80 0.00 1.91 1.78 0.00 1.65 0.00 0.00 1.50 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.61 7.81 16 K 8.00 3.92 0.00 1.88 1.94 0.00 1.57 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.73 7.81 17 D 8.35 4.59 0.00 2.59 2.49 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 0.00 18 L 7.94 3.71 0.00 1.67 1.26 0.51 -0.66 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 19 R 8.08 4.02 0.00 2.04 2.05 0.00 3.15 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 20 D 8.59 4.50 0.00 2.97 2.93 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 21 S 8.16 3.22 0.00 3.29 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 22 W 8.76 4.28 0.00 3.80 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 23 K 8.03 3.89 0.00 1.97 2.05 0.00 1.89 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.46 7.81 24 V 7.02 3.76 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 1.08 0.00 0.00 25 I 7.70 3.52 1.59 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.73 0.63 0.00 0.00 26 G 6.84 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 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.23 4.06 0.00 4.06 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 28 D 7.35 4.63 0.00 2.61 2.36 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.14 3.95 0.00 1.76 1.74 0.00 1.32 0.00 0.00 0.81 0.00 0.00 2.14 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.42 7.81 30 K 7.97 4.02 0.00 1.83 1.79 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.51 7.81 31 G 8.41 3.60 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 0.00 0.00 0.00 32 N 8.26 4.44 0.00 2.78 2.73 0.00 0.00 6.95 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.14 3.51 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 0.00 34 V 7.96 3.59 2.13 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 1.07 0.00 0.00 0.96 0.00 0.00 35 A 8.10 3.91 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 36 L 7.87 3.74 0.00 1.96 1.64 0.78 0.77 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 37 M 7.63 3.48 0.00 1.60 1.92 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.70 0.00 38 T 7.95 3.91 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 1.30 0.00 0.00 39 T 7.83 3.81 4.29 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 1.19 0.00 0.00 40 L 7.80 3.83 0.00 1.48 1.26 0.87 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 41 F 7.96 4.63 0.00 3.21 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 8.00 4.04 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 43 D 8.36 4.60 0.00 2.73 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.44 5.27 0.00 2.93 2.89 0.00 0.00 7.03 7.32 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 45 Q 8.51 4.29 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.89 0.00 0.00 0.00 0.00 0.00 2.60 2.26 0.00 46 E 8.33 4.11 0.00 2.19 2.26 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 2.47 2.39 0.00 47 T 8.38 4.60 4.73 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 1.44 0.00 0.00 48 I 7.99 3.72 1.89 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.78 0.66 0.00 0.00 49 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 50 Y 7.61 4.18 0.00 2.84 2.58 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 51 F 8.47 4.95 0.00 3.13 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 52 K 8.35 3.85 0.00 1.81 1.87 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.79 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.51 1.72 7.81 53 R 8.05 3.96 0.00 1.79 2.01 0.00 3.26 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 54 L 8.09 4.18 0.00 2.01 1.77 1.07 1.03 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 55 G 7.69 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 56 N 8.41 4.52 0.00 2.78 2.72 0.00 0.00 6.57 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 57 V 7.99 3.72 1.73 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 0.48 0.00 0.00 0.67 0.00 0.00 58 S 7.88 4.34 0.00 4.06 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 59 Q 8.25 4.12 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.88 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 60 G 8.58 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 61 M 9.01 3.88 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.62 0.00 62 A 7.63 4.06 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 63 N 8.20 4.69 0.00 2.77 2.90 0.00 0.00 7.05 8.94 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 64 D 8.66 4.37 0.00 2.74 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 65 K 8.12 4.01 0.00 1.98 1.91 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.52 7.81 66 L 8.47 4.02 0.00 1.82 1.85 1.05 0.81 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 67 R 8.33 4.00 0.00 2.07 2.06 0.00 3.16 0.00 0.00 3.41 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 68 G 8.38 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 H 8.49 4.20 0.00 3.40 3.57 0.00 5.79 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 70 S 8.25 4.10 0.00 4.01 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 71 I 7.91 3.93 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.21 1.14 0.00 0.00 72 T 7.92 4.04 4.44 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 1.27 0.00 0.00 73 L 8.31 4.01 0.00 1.68 1.87 0.96 0.85 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 74 M 7.96 4.25 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.93 0.00 75 Y 8.13 4.10 0.00 3.18 3.05 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 76 A 7.84 3.77 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 77 L 7.49 3.43 0.00 1.64 0.95 0.88 0.95 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 78 Q 7.68 3.48 0.00 2.36 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.75 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 79 N 7.83 4.19 0.00 2.87 2.76 0.00 0.00 7.26 7.62 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 80 F 7.38 4.37 0.00 2.92 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 81 I 7.59 3.66 1.53 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.42 0.84 0.00 0.00 82 D 8.09 4.44 0.00 2.78 2.74 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 83 Q 7.72 4.37 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.78 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 84 L 7.58 3.96 0.00 1.64 1.66 0.76 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.07 4.32 0.00 2.65 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 86 N 7.94 4.80 0.00 2.74 2.66 0.00 0.00 7.10 7.07 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 87 P 0.00 4.18 0.00 2.19 2.06 0.00 3.64 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 88 D 8.21 4.37 0.00 2.89 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 89 D 8.14 4.33 0.00 2.82 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 90 L 8.16 3.88 0.00 1.82 1.69 0.70 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.98 3.38 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 0.65 0.00 0.00 0.71 0.00 0.00 92 C 8.03 4.12 0.00 3.22 3.18 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 0.00 93 V 7.95 3.72 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 1.39 0.00 0.00 1.04 0.00 0.00 94 V 7.79 3.42 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 0.68 0.00 0.00 0.22 0.00 0.00 95 E 8.16 3.94 0.00 1.93 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 2.24 2.28 0.00 96 K 8.05 4.09 0.00 1.99 2.14 0.00 1.57 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.60 7.81 97 F 8.65 4.20 0.00 3.39 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 98 A 8.40 4.14 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 99 V 7.44 3.47 2.16 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 1.01 0.00 0.00 1.02 0.00 0.00 100 N 7.99 4.29 0.00 2.58 2.69 0.00 0.00 6.99 8.16 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 0.00 101 H 7.52 4.06 0.00 3.21 3.33 0.00 5.81 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 0.00 102 I 8.18 3.72 1.99 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 1.49 0.82 0.90 0.00 0.00 103 T 7.67 3.90 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 104 R 7.53 4.19 0.00 1.84 1.88 0.00 3.01 0.00 0.00 3.01 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 105 K 7.88 3.85 0.00 2.02 2.03 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.42 7.81 106 I 7.66 3.90 1.88 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.63 0.98 0.00 0.00 107 S 8.41 4.57 0.00 4.08 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 0.00 108 A 8.53 3.99 1.39 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 0.00 0.00 0.00 109 A 7.96 4.02 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.23 4.09 0.00 2.21 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 2.18 2.46 0.00 111 F 8.64 4.13 0.00 3.33 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 0.00 112 G 8.42 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 0.00 113 K 7.95 4.15 0.00 1.99 1.90 0.00 1.88 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.66 7.81 114 I 7.73 3.51 1.62 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.38 0.74 0.00 0.00 115 N 8.13 4.42 0.00 2.99 2.91 0.00 0.00 6.70 7.56 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 0.00 116 G 7.63 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 0.00 0.00 0.00 117 P 0.00 4.19 0.00 2.17 2.17 0.00 3.69 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 2.03 2.13 0.00 118 I 7.94 3.52 1.95 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.75 0.60 0.00 0.00 119 K 8.27 3.91 0.00 1.91 2.00 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.54 7.81 120 K 8.30 3.97 0.00 1.79 1.82 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.61 7.81 121 V 7.65 3.51 1.94 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 0.71 0.00 0.00 0.87 0.00 0.00 122 L 8.16 4.12 0.00 1.99 2.04 0.63 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.42 4.33 1.39 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 0.00 0.00 0.00 124 S 7.97 4.22 0.00 4.03 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 0.00 125 K 7.94 4.42 0.00 2.05 1.96 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.56 1.60 7.81 126 N 7.83 4.15 0.00 2.64 2.61 0.00 0.00 6.72 7.42 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 0.00 127 F 8.03 4.48 0.00 3.15 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.60 4.47 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 0.00 0.00 0.00 129 D 9.06 4.48 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 0.00 130 K 8.17 3.85 0.00 1.74 1.77 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.64 1.28 7.81 131 Y 8.37 4.13 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 0.00 132 A 8.27 4.19 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 0.00 133 N 8.72 4.34 0.00 2.96 2.89 0.00 0.00 6.91 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.84 3.92 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 0.00 135 W 8.67 3.76 0.00 3.61 3.39 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 0.00 136 A 8.42 4.09 1.46 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 0.00 137 K 7.57 3.92 0.00 1.82 1.80 0.00 1.83 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.54 7.81 138 L 7.49 3.90 0.00 1.36 1.62 0.62 0.54 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 0.00 139 V 8.18 3.75 2.22 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 1.30 0.00 0.00 1.19 0.00 0.00 140 A 8.07 4.52 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 0.00 141 V 7.30 3.38 1.89 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 0.57 0.00 0.00 0.79 0.00 0.00 142 V 7.39 3.43 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 0.36 0.00 0.00 0.49 0.00 0.00 143 Q 8.33 3.88 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.65 2.68 0.00 144 A 7.71 4.00 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 0.00 145 A 7.57 4.26 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 0.00 146 L 7.38 4.11 0.00 1.77 1.54 0.78 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00