NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.8270 8.0544 120.2942 61.6046 32.6442 174.2257 2 H 4.3207 8.2768 121.9495 53.6959 30.8699 172.4778 3 W 4.6834 8.6545 128.2366 55.2193 29.8241 175.7848 4 S 4.2945 8.9524 118.9413 58.5979 62.4764 175.2246 5 A 4.1510 8.5220 125.2613 54.7869 18.7153 179.4948 6 E 4.0827 8.1779 116.6826 59.6836 29.6363 179.0400 7 E 3.9695 8.3013 117.8252 59.7650 29.5689 179.2780 8 K 3.5546 7.9975 118.1733 59.7915 32.0670 178.7646 9 Q 4.0329 8.0059 119.0715 58.5087 28.0177 177.9025 10 L 4.1081 7.8619 119.8849 57.4901 41.7262 179.1469 11 I 4.2220 7.6900 119.8059 64.4759 36.9502 178.4352 12 T 4.0862 8.0745 116.0697 66.4221 68.6395 176.8146 13 G 3.7104 8.3901 107.6986 47.6681 0.0000 175.2774 14 L 3.6534 7.3780 124.0115 57.6931 41.9332 178.8318 15 W 4.4889 8.5451 128.0780 60.6488 30.4291 177.9199 16 G 3.6889 7.9743 103.5239 46.3300 0.0000 174.1952 17 K 4.4178 7.3920 119.0883 55.9116 32.4685 176.0305 18 V 3.8677 7.2478 120.4293 62.0245 31.8818 175.9216 19 N 4.3340 8.5658 125.3922 53.6364 38.9023 175.4557 20 V 3.5605 8.1456 129.4445 64.5431 31.7130 177.9857 21 A 3.9984 7.9580 121.0421 54.6653 18.2863 178.8788 22 D 4.1868 7.9730 116.6849 57.9035 41.3830 178.4023 23 C 4.1042 8.1469 117.1890 62.1391 28.1260 176.3516 24 G 3.5576 8.3744 107.7429 47.8541 0.0000 175.6641 25 A 4.0157 7.8672 123.9741 54.4495 18.2910 179.3638 26 E 3.7474 7.9807 117.7053 59.3026 29.7076 178.4798 27 A 3.9341 8.3540 121.2993 55.4373 18.3085 179.4841 28 L 3.8324 7.7840 117.5543 58.1991 42.3580 178.6837 29 A 3.9333 8.3735 121.1323 55.4550 18.1403 179.9049 30 R 3.8209 8.3191 116.7645 58.9456 30.1382 178.6981 31 L 3.9765 8.0671 120.4240 58.5124 42.1820 179.2813 32 L 4.0060 8.0887 118.5708 57.4638 41.2484 179.1922 33 I 3.9330 7.3308 118.4050 62.8172 37.4424 177.4689 34 V 3.9182 7.5956 117.9754 62.8386 33.2109 175.3474 35 Y 4.3608 7.0783 116.9694 55.0385 37.5731 174.2145 36 P 5.1059 0.0000 0.0000 63.8547 31.8410 177.6878 37 W 4.3425 8.3004 116.0551 59.6392 27.6575 177.8687 38 T 4.3496 7.7144 110.3557 64.0266 67.9247 176.0965 39 Q 4.1352 8.3901 122.0937 58.8908 28.4097 178.4581 40 R 3.7599 7.7912 119.1918 59.5590 30.1969 178.4836 41 F 4.1740 7.2459 115.1702 59.1505 39.1079 175.8125 42 F 4.4723 8.2240 117.9848 56.9349 39.5644 177.3849 43 A 4.2910 7.9245 125.5564 54.0094 19.0464 180.4103 44 S 4.2861 8.1560 109.6840 61.0241 62.8112 175.2118 45 F 4.8144 8.0332 118.5996 58.1417 39.6818 176.3123 46 G 3.9309 8.1397 106.7094 44.1638 0.0000 174.0205 47 N 4.5030 8.6709 123.5836 53.8714 38.7953 175.3520 48 L 4.8702 8.3111 128.6021 54.4552 42.7093 178.2574 49 S 4.4019 8.0946 116.1598 60.1876 63.8151 174.7657 50 S 4.7481 7.5338 114.0916 54.8282 67.2919 172.7672 51 P 4.1158 0.0000 0.0000 66.5282 31.0481 178.9707 52 T 3.8963 7.8838 113.5306 66.1985 68.4879 176.3589 53 A 4.0036 8.3952 123.1945 55.5136 18.1674 179.6220 54 I 3.6567 8.1866 116.9169 64.6628 37.3495 178.3245 55 L 4.3228 7.9615 117.4431 56.4835 41.6708 179.1530 56 G 3.7470 8.5616 106.1581 46.3615 0.0000 173.9904 57 N 4.4070 7.8778 120.7375 52.8810 39.5864 173.9214 58 P 4.2696 0.0000 0.0000 65.8414 31.3211 178.6086 59 M 3.8715 7.7769 117.1278 57.6315 31.8837 178.6910 60 V 3.8883 7.6159 118.0802 66.0748 31.6613 178.0983 61 R 3.8660 7.9830 117.3587 59.3881 29.4608 179.0267 62 A 3.9979 8.2963 120.8704 55.3472 18.2842 179.0601 63 H 4.3803 9.3437 118.0924 58.6237 29.9272 177.3949 64 G 3.8613 8.2390 108.1613 47.9127 0.0000 174.9830 65 K 3.8638 7.8592 122.2889 59.3095 32.1903 178.5949 66 K 3.9757 7.6945 117.5775 59.6723 31.9423 179.1053 67 V 3.6792 8.0199 118.1231 66.0879 31.5841 177.7996 68 L 4.3088 8.2813 120.1263 58.5442 42.0294 178.5422 69 T 4.1017 8.3163 115.8297 67.3444 68.1102 176.0701 70 S 4.1750 8.2945 114.3716 61.4766 62.2706 176.3136 71 F 3.9071 8.9752 121.0331 60.6878 38.7130 177.7273 72 G 3.4006 7.9210 105.2833 47.8810 0.0000 175.2840 73 D 4.2666 7.5561 119.7305 56.9280 41.1101 178.5977 74 A 4.1162 7.7568 119.9054 55.1395 18.1361 179.8195 75 V 3.3127 7.1552 115.7906 65.3701 31.5997 177.8270 76 K 4.1547 7.9597 116.9144 57.7051 32.7589 177.3436 77 N 4.8406 7.8729 117.9023 51.4726 40.0709 175.9513 78 L 4.0458 7.8429 117.6866 56.7647 42.0143 178.0722 79 D 5.1232 7.4601 117.7628 53.6448 41.5263 176.0427 80 N 4.6491 7.8362 114.5475 51.3786 40.5225 176.8430 81 I 3.9150 8.3149 120.6678 65.1121 37.4195 177.7288 82 K 4.2647 7.6171 116.8233 59.3753 33.3247 177.0103 83 N 4.5094 8.0471 116.7403 55.8717 38.6811 177.4660 84 T 3.6252 7.2897 117.0155 66.1752 68.7715 175.3669 85 F 4.4475 7.5418 117.4600 57.3521 39.1416 177.9429 86 S 4.1670 7.7905 116.9986 61.5262 62.5111 176.2325 87 Q 3.9904 7.9210 122.6421 58.6234 28.9688 177.6765 88 L 4.1868 7.8156 119.3513 57.1782 41.6484 178.8536 89 S 4.2960 7.9624 113.3527 60.7254 62.2962 175.8799 90 E 4.1025 7.6773 122.2370 58.8132 29.2221 179.0797 91 L 3.9109 7.6215 119.1453 58.2580 41.9818 178.5293 92 H 4.3853 8.0943 115.6229 58.1118 28.4364 177.2585 93 C 4.7469 8.3945 120.0290 61.3924 28.5469 175.8141 94 D 4.2487 8.1502 120.5254 57.2958 40.9298 178.8154 95 K 3.9508 7.9912 118.2067 59.1248 32.4189 177.6957 96 L 4.3399 7.6349 116.2476 54.7324 42.2668 176.6325 97 H 4.4107 8.2050 112.9774 55.9981 25.8751 174.9152 98 V 3.2223 7.2937 119.4208 62.9494 31.5756 175.0428 99 D 4.3111 8.5484 127.3199 52.9985 41.8443 174.7214 100 P 3.3297 0.0000 0.0000 66.2369 30.8572 178.0135 101 E 3.8971 8.3697 117.8310 59.2403 29.2662 178.4648 102 N 4.5836 8.7784 116.2720 54.7010 38.6625 176.8979 103 F 4.6708 8.0893 120.2113 59.9537 39.1833 177.4971 104 R 3.9892 8.1973 118.1280 59.3066 29.9456 178.1316 105 L 3.9207 7.9155 118.4811 58.1228 41.6973 179.7646 106 L 4.2514 8.5874 120.2576 57.8789 42.1084 179.2207 107 G 3.7039 8.5335 106.4620 47.8236 0.0000 175.5447 108 D 4.6042 8.5019 121.4014 57.2349 40.7379 178.9815 109 I 3.8099 7.8573 120.5492 64.1179 37.1707 177.9809 110 L 3.8076 8.3246 121.5886 57.8670 41.6910 178.9223 111 I 3.8032 7.1895 117.9485 63.5447 37.4094 177.8363 112 I 3.6284 7.4660 119.6234 64.6479 37.3435 178.3117 113 V 3.6185 7.8219 118.9341 65.7549 31.4367 178.0771 114 L 3.7591 7.4715 118.4584 56.9840 41.3254 178.9060 115 A 3.5018 7.3577 120.8164 54.8201 18.0403 178.9746 116 A 4.1826 7.3654 116.3970 53.4340 19.3250 178.1662 117 H 4.3910 7.2977 112.3221 55.4376 29.5669 175.2212 118 F 4.8563 7.0739 117.3323 55.6941 41.9940 175.6215 119 S 3.5747 8.3346 116.1408 58.8622 62.3559 173.0914 120 K 3.6280 8.8811 114.6455 59.3637 31.9622 177.4030 121 D 4.4356 7.9539 117.0160 56.3514 41.5921 176.5790 122 F 4.7276 8.5095 123.9540 56.7383 37.8498 175.7098 123 T 3.9367 7.4372 120.4859 62.9363 70.7531 172.6248 124 P 3.8708 0.0000 0.0000 66.2130 31.1071 178.8920 125 E 3.9957 7.9632 115.8604 59.3429 29.8068 178.3914 126 C 4.3016 7.7411 118.3916 62.5320 31.6509 175.2857 127 Q 3.6733 8.4383 121.9789 58.7778 28.4087 177.8604 128 A 4.0699 8.0409 121.4891 54.3907 18.3220 179.5383 129 A 4.0886 7.9445 119.9025 55.2294 18.5766 179.9188 130 W 3.6711 8.3813 117.0510 59.8657 29.3755 178.7360 131 Q 4.2116 8.8450 118.5528 58.7601 27.9948 178.5690 132 K 4.0747 7.9697 120.8555 58.9543 32.1182 178.7433 133 L 4.2400 7.9453 121.0541 58.2904 42.0074 179.2914 134 V 3.9438 8.2630 112.2540 64.1045 31.4452 178.7292 135 R 3.9874 8.0409 118.2255 58.8863 29.8014 179.1608 136 V 3.5623 7.4421 118.0811 65.7457 31.6985 177.9063 137 V 3.2000 7.9038 118.0790 66.2501 31.2728 177.8614 138 A 3.7993 8.0109 119.9838 55.3493 18.2068 179.1215 139 H 4.4222 8.0622 114.3616 58.2433 28.6426 177.7812 140 A 4.0470 8.1117 122.8373 55.0734 18.2749 179.2346 141 L 4.0842 7.7544 116.3756 57.1634 41.8677 178.7370 142 A 4.6737 7.9118 118.5630 53.7961 18.3092 179.3950 143 R 3.9561 7.9956 117.1788 58.7336 31.2723 175.4631 144 K 4.2172 7.0070 120.4955 55.6918 30.5865 173.8948 145 Y 4.5828 6.5660 121.6315 57.5169 48.0684 174.8440 146 H 4.6726 8.4494 123.3332 56.2835 29.4675 173.8127 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 V 8.05 3.83 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 0.36 0.00 0.00 0.62 0.00 0.00 2 H 8.28 4.32 0.00 3.10 3.07 0.00 5.74 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 W 8.65 4.68 0.00 3.35 3.14 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 4 S 8.95 4.29 0.00 3.95 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 5 A 8.52 4.15 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 6 E 8.18 4.08 0.00 2.10 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 2.42 2.49 0.00 7 E 8.30 3.97 0.00 2.27 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 2.51 2.70 0.00 8 K 8.00 3.55 0.00 1.76 1.75 0.00 1.60 0.00 0.00 1.42 0.00 0.00 3.09 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.51 1.56 7.81 9 Q 8.01 4.03 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 10 L 7.86 4.11 0.00 1.93 1.81 0.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.69 4.22 1.47 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.19 0.40 0.00 0.00 12 T 8.07 4.09 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 1.25 0.00 0.00 13 G 8.39 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 0.00 0.00 0.00 14 L 7.38 3.65 0.00 2.03 1.84 0.53 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.55 4.49 0.00 3.85 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 16 G 7.97 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 17 K 7.39 4.42 0.00 1.84 1.82 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.33 1.16 7.81 18 V 7.25 3.87 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 0.36 0.00 0.00 0.79 0.00 0.00 19 N 8.57 4.33 0.00 2.71 2.63 0.00 0.00 6.96 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 20 V 8.15 3.56 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 0.97 0.00 0.00 1.08 0.00 0.00 21 A 7.96 4.00 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 22 D 7.97 4.19 0.00 2.62 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 C 8.15 4.10 0.00 2.90 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 24 G 8.37 3.56 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 0.00 25 A 7.87 4.02 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 26 E 7.98 3.75 0.00 2.07 1.88 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 0.00 2.26 2.28 0.00 27 A 8.35 3.93 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 28 L 7.78 3.83 0.00 1.80 1.64 0.75 1.05 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 29 A 8.37 3.93 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 30 R 8.32 3.82 0.00 2.02 1.91 0.00 3.09 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 31 L 8.07 3.98 0.00 1.80 1.84 1.05 0.85 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 32 L 8.09 4.01 0.00 1.85 1.67 0.88 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.33 3.93 1.83 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 1.36 0.63 0.84 0.00 0.00 34 V 7.60 3.92 1.58 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 -0.18 0.00 0.00 0.73 0.00 0.00 35 Y 7.08 4.36 0.00 2.85 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 36 P 0.00 5.11 0.00 2.25 2.11 0.00 4.07 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 2.17 2.12 0.00 37 W 8.30 4.34 0.00 3.60 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 38 T 7.71 4.35 4.48 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 0.92 0.00 0.00 39 Q 8.39 4.14 0.00 2.30 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.40 0.00 40 R 7.79 3.76 0.00 1.64 1.36 0.00 3.12 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.51 0.00 41 F 7.25 4.17 0.00 2.54 2.63 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 42 F 8.22 4.47 0.00 2.81 2.24 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 43 A 7.92 4.29 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 44 S 8.16 4.29 0.00 4.24 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 45 F 8.03 4.81 0.00 3.17 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.14 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 47 N 8.67 4.50 0.00 2.70 2.79 0.00 0.00 6.62 7.78 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 48 L 8.31 4.87 0.00 1.67 1.65 1.05 1.04 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 49 S 8.09 4.40 0.00 3.94 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 50 S 7.53 4.75 0.00 4.00 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 51 P 0.00 4.12 0.00 2.16 2.16 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 52 T 7.88 3.90 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 53 A 8.40 4.00 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 54 I 8.19 3.66 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.81 0.89 0.00 0.00 55 L 7.96 4.32 0.00 1.58 1.69 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.56 3.75 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 0.00 0.00 0.00 57 N 7.88 4.41 0.00 3.01 2.83 0.00 0.00 7.17 7.58 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 58 P 0.00 4.27 0.00 2.13 2.04 0.00 3.62 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 59 M 7.78 3.87 0.00 0.65 1.58 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 60 V 7.62 3.89 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.04 0.00 0.00 61 R 7.98 3.87 0.00 2.02 1.94 0.00 3.29 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 62 A 8.30 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 63 H 9.34 4.38 0.00 3.28 3.58 0.00 5.81 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 64 G 8.24 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 65 K 7.86 3.86 0.00 1.80 1.98 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.54 7.81 66 K 7.69 3.98 0.00 2.00 1.89 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.52 7.81 67 V 8.02 3.68 2.39 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 1.38 0.00 0.00 1.10 0.00 0.00 68 L 8.28 4.31 0.00 2.00 1.86 0.92 1.08 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 69 T 8.32 4.10 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 70 S 8.29 4.17 0.00 4.01 4.11 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 0.00 0.00 0.00 71 F 8.98 3.91 0.00 3.53 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 72 G 7.92 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 0.00 0.00 0.00 73 D 7.56 4.27 0.00 2.39 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 7.76 4.12 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 75 V 7.16 3.31 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 0.56 0.00 0.00 0.51 0.00 0.00 76 K 7.96 4.15 0.00 1.80 1.76 0.00 1.91 0.00 0.00 1.64 0.00 0.00 3.06 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.40 7.81 77 N 7.87 4.84 0.00 2.90 2.66 0.00 0.00 6.89 6.33 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 78 L 7.84 4.05 0.00 1.29 1.22 0.56 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.46 5.12 0.00 2.64 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 80 N 7.84 4.65 0.00 2.74 2.64 0.00 0.00 7.27 7.95 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 81 I 8.31 3.91 1.99 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 1.61 1.03 1.08 0.00 0.00 82 K 7.62 4.26 0.00 1.79 1.74 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.61 7.81 83 N 8.05 4.51 0.00 2.73 2.80 0.00 0.00 6.90 7.05 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 84 T 7.29 3.63 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 0.25 0.00 0.00 85 F 7.54 4.45 0.00 2.93 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 7.79 4.17 0.00 4.06 4.09 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 87 Q 7.92 3.99 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 88 L 7.82 4.19 0.00 1.96 1.83 1.00 0.80 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 89 S 7.96 4.30 0.00 4.02 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 90 E 7.68 4.10 0.00 2.29 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 2.29 2.31 0.00 91 L 7.62 3.91 0.00 1.77 1.76 0.89 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.09 4.39 0.00 3.49 3.69 0.00 5.85 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.39 4.75 0.00 2.67 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 0.00 0.00 0.00 0.00 94 D 8.15 4.25 0.00 2.81 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 95 K 7.99 3.95 0.00 1.67 1.94 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.38 7.81 96 L 7.63 4.34 0.00 1.87 1.67 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.20 4.41 0.00 3.42 3.50 0.00 5.96 0.00 0.00 0.00 0.00 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.29 3.22 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 0.08 0.00 0.00 0.12 0.00 0.00 99 D 8.55 4.31 0.00 2.74 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 0.00 0.00 0.00 0.00 100 P 0.00 3.33 0.00 2.20 2.28 0.00 3.43 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.47 0.00 101 E 8.37 3.90 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 102 N 8.78 4.58 0.00 2.31 2.78 0.00 0.00 6.83 8.01 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 0.00 103 F 8.09 4.67 0.00 3.17 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 0.00 104 R 8.20 3.99 0.00 1.92 2.14 0.00 3.54 0.00 0.00 3.37 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.73 0.00 105 L 7.92 3.92 0.00 1.94 1.68 0.77 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.59 4.25 0.00 1.88 1.85 1.01 1.22 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 0.00 107 G 8.53 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 0.00 108 D 8.50 4.60 0.00 2.97 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 0.00 109 I 7.86 3.81 2.07 0.00 0.00 1.00 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 0.84 0.94 0.00 0.00 110 L 8.32 3.81 0.00 1.85 1.68 0.65 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 111 I 7.19 3.80 2.13 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.88 1.14 0.00 0.00 112 I 7.47 3.63 1.97 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 1.43 0.64 0.87 0.00 0.00 113 V 7.82 3.62 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 0.85 0.00 0.00 0.90 0.00 0.00 114 L 7.47 3.76 0.00 0.89 1.38 -0.06 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.36 3.50 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 0.00 116 A 7.37 4.18 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 0.00 117 H 7.30 4.39 0.00 2.08 2.50 0.00 5.62 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 7.07 4.86 0.00 3.15 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 0.00 119 S 8.33 3.57 0.00 3.97 3.73 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 0.00 120 K 8.88 3.63 0.00 1.82 1.92 0.00 1.85 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.42 7.81 121 D 7.95 4.44 0.00 2.84 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 0.00 122 F 8.51 4.73 0.00 3.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.44 3.94 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 1.25 0.00 0.00 124 P 0.00 3.87 0.00 2.12 2.11 0.00 3.56 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 E 7.96 4.00 0.00 1.91 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 2.31 2.42 0.00 126 C 7.74 4.30 0.00 2.93 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 Q 8.44 3.67 0.00 1.23 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.45 2.65 0.00 128 A 8.04 4.07 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 0.00 129 A 7.94 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 0.00 130 W 8.38 3.67 0.00 3.94 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 0.00 131 Q 8.84 4.21 0.00 2.37 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.82 0.00 0.00 0.00 0.00 0.00 2.55 2.62 0.00 132 K 7.97 4.07 0.00 1.80 2.19 0.00 1.59 0.00 0.00 1.37 0.00 0.00 2.36 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.23 1.18 7.81 133 L 7.95 4.24 0.00 1.64 1.56 0.39 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.26 3.94 2.28 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 1.05 0.00 0.00 1.18 0.00 0.00 135 R 8.04 3.99 0.00 2.08 1.88 0.00 3.32 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.78 0.00 136 V 7.44 3.56 2.35 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 1.03 0.00 0.00 0.89 0.00 0.00 137 V 7.90 3.20 1.88 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 -0.17 0.00 0.00 0.75 0.00 0.00 138 A 8.01 3.80 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 0.00 139 H 8.06 4.42 0.00 3.28 3.38 0.00 5.82 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 0.00 140 A 8.11 4.05 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 0.00 141 L 7.75 4.08 0.00 1.00 1.30 0.01 0.92 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 0.00 142 A 7.91 4.67 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 0.00 143 R 8.00 3.96 0.00 1.90 2.01 0.00 3.17 0.00 0.00 3.11 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.92 0.00 144 K 7.01 4.22 0.00 1.48 1.47 0.00 1.63 0.00 0.00 1.62 0.00 0.00 3.26 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.22 7.81 145 Y 6.57 4.58 0.00 2.92 2.45 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 0.00 146 H 8.45 4.67 0.00 3.19 3.13 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00