NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 T 4.3819 8.1749 110.9407 61.6830 69.8995 172.3878 13 N 4.7799 8.5431 115.1920 52.8878 40.7966 173.3296 14 L 4.5267 8.6446 119.0053 54.5472 43.7919 176.1955 15 L 4.6854 7.7866 121.3586 53.6191 43.2818 175.4665 16 Y 4.2114 8.1287 124.4829 57.2991 40.1467 175.6876 17 T 3.8058 7.0669 117.1886 60.8931 70.2151 174.1039 18 R 3.8881 8.1380 126.7329 57.4278 30.1637 176.0983 19 N 4.2773 7.5187 117.7715 53.6779 39.1211 175.4617 20 D 4.6260 8.3779 130.8186 51.9873 38.5873 176.2005 21 V 4.2050 7.0919 116.3083 61.1135 33.6549 175.1977 22 S 4.0525 8.7203 120.6239 59.1656 63.0889 174.7560 23 D 4.4110 9.0951 125.2009 57.6089 39.9519 178.9541 24 S 4.0459 8.0800 112.8083 61.5573 62.3319 175.4964 25 E 3.9187 8.5196 122.1519 59.4618 29.3909 178.3823 26 K 3.7980 8.0597 117.0448 60.0184 32.0650 178.5541 27 K 3.8184 8.3393 117.7863 59.7833 32.1538 179.2680 28 A 3.9695 7.6020 119.7089 55.5035 18.3966 179.8480 29 T 3.7730 8.0038 114.2629 66.8935 68.6589 177.0309 30 V 3.6854 8.3746 120.3842 66.0254 31.4301 177.6422 31 E 3.9781 7.8953 119.1098 58.7838 29.0576 178.3093 32 L 3.9521 7.8858 120.4316 58.0376 42.0610 178.9908 33 L 3.9180 8.4735 119.1073 58.0725 41.7996 179.0389 34 N 4.2108 8.0227 116.1451 56.5320 38.2911 177.4131 35 R 3.9083 7.8570 119.4818 59.5164 30.0993 178.6962 36 Q 4.0851 7.6718 116.7419 58.8343 28.7321 178.4154 37 V 3.5264 7.9569 119.6328 66.2295 31.4363 178.1195 38 I 3.6798 7.6576 118.7974 64.4441 37.0067 177.9762 39 Q 3.9893 7.8426 120.4166 59.3836 28.7815 178.6969 40 F 3.8419 9.2949 119.0496 60.6525 39.0359 177.4692 41 I 3.7376 8.3047 119.8727 64.7869 36.9211 177.9643 42 D 4.2988 8.2950 118.5301 57.1716 40.9776 177.8913 43 L 3.7819 7.9004 121.1953 57.9748 41.9486 179.1759 44 S 4.0503 8.3611 114.5757 61.5228 63.0731 176.3874 45 L 3.9270 7.8344 122.9802 57.4630 41.3536 179.6802 46 I 3.5025 7.8484 119.6789 64.4745 36.9300 178.5073 47 T 3.8229 7.9382 116.8414 66.7387 68.2285 176.8382 48 K 3.3047 7.7088 120.1619 58.8685 31.8862 179.3689 49 Q 4.1267 7.5115 118.0715 58.9683 28.2030 178.7622 50 A 3.9087 7.5613 121.3664 55.4408 18.2319 178.6542 51 H 3.9178 7.8114 115.4060 59.5667 29.8270 176.8993 52 W 4.5871 7.9369 119.0158 59.7917 29.4042 177.5412 53 N 4.9447 8.2277 114.6187 52.6301 38.1008 174.7338 54 M 4.9685 7.0753 117.2222 54.5854 33.1907 175.6084 55 R 4.2717 9.2008 118.1706 55.6680 34.6722 173.9209 56 G 3.9094 8.9058 104.4322 43.8026 0.0000 172.8287 57 A 4.0016 8.4849 120.9913 53.9303 18.7673 176.7949 58 N 4.1399 9.0174 117.5294 54.4959 37.1489 175.6743 59 F 4.1596 7.4067 117.6296 60.5271 39.0671 176.2043 60 I 2.8057 7.6993 116.5279 64.2200 37.9258 177.6036 61 A 3.8139 7.8307 120.4670 55.2885 18.0423 179.6918 62 V 3.2718 7.3819 115.8494 66.1958 31.4141 177.3352 63 H 3.8439 8.0235 117.0418 59.6139 29.6669 176.5817 64 E 3.9095 8.2592 120.3369 59.3901 29.1293 178.7793 65 M 3.5732 7.7461 118.3004 58.5912 32.1209 178.2035 66 L 3.4410 7.6997 119.1327 57.6197 41.7218 179.0653 67 D 4.1604 7.4882 118.6733 57.2271 40.6094 178.8702 68 G 3.6411 7.7224 105.4924 48.0201 0.0000 175.2029 69 F 3.8738 7.0142 120.5268 60.0542 38.8845 177.4665 70 R 3.9205 7.8913 118.1801 59.9807 29.8126 178.3748 71 T 3.8513 7.9009 114.8695 66.8038 68.4682 176.4520 72 A 4.1220 7.9503 122.5092 54.9978 18.4126 179.5194 73 L 4.2438 8.7465 117.9421 58.4055 41.7288 179.8770 74 I 3.8434 8.0484 119.5987 64.3861 36.9890 178.1109 75 C 4.0819 7.9987 119.3474 62.7729 31.3582 175.3337 76 H 4.1052 8.3958 117.7292 59.0430 28.3018 177.0527 77 L 3.6054 8.4000 121.7795 58.7237 41.7620 178.8656 78 A 3.9587 8.5094 120.3265 55.5456 18.4110 179.6030 79 T 3.7840 7.9041 114.0882 67.0296 68.5226 176.7168 80 M 3.8885 8.2522 120.4315 58.3766 32.0292 178.4100 81 A 3.9745 8.0287 120.9591 55.5273 18.3870 179.5490 82 E 3.9005 8.5086 117.1797 59.4690 29.5758 179.5785 83 R 3.8137 7.9108 118.5743 59.1701 30.1156 178.3860 84 A 3.9284 8.0268 120.5700 55.3506 18.4446 179.8657 85 V 3.8179 7.6557 117.9711 65.6809 31.2979 178.2444 86 Q 4.0542 8.0683 117.4832 58.4300 28.5233 177.5767 87 L 4.4443 7.4284 117.7510 54.5062 41.9901 177.7089 88 G 3.8644 8.1818 108.1980 45.2594 0.0000 174.5014 89 G 4.1934 7.9162 109.5440 44.1134 0.0000 172.6527 90 V 4.2836 7.9735 118.4671 60.4110 33.0087 175.5081 91 A 4.1629 8.6429 131.0361 52.1905 18.6982 176.2587 92 L 4.6547 9.3122 124.1352 53.2756 42.6327 176.7695 93 G 4.2367 8.3892 112.3238 44.5525 0.0000 172.3638 94 T 4.2397 7.8455 110.3417 60.9698 71.1949 174.7154 95 T 3.8397 8.5401 116.8934 65.5941 67.1260 176.2941 96 Q 3.9647 8.0263 119.3111 59.0191 28.8892 178.7962 97 V 3.6047 7.3826 117.6355 65.9985 31.0495 177.9890 98 I 3.6788 7.8995 119.4890 64.4176 36.7753 177.4630 99 N 4.2687 8.2594 117.0547 56.9892 38.7451 176.5924 100 S 4.3484 7.5943 113.6369 61.2584 63.5308 175.7909 101 K 4.4028 7.7125 120.1377 55.2165 32.6320 176.3123 102 T 4.3912 7.0321 113.4444 60.5755 68.2045 172.6619 103 P 4.6505 0.0000 0.0000 62.5311 31.8308 174.9540 104 L 4.5448 7.3478 120.1613 52.6882 42.6865 176.3699 105 K 3.8237 8.7954 125.0582 56.4867 32.5351 175.8413 106 S 4.0423 8.6761 119.3244 58.8189 62.5136 172.9783 107 Y 4.2517 8.6325 128.1243 55.8467 39.4527 172.8089 108 P 4.3639 0.0000 0.0000 63.3623 31.6504 175.9055 109 L 4.7110 8.5322 120.5822 54.6354 41.9542 176.2390 110 D 4.9245 7.9791 116.4907 52.5631 39.9330 175.0059 111 I 4.4134 7.5654 112.5172 59.8882 39.4817 174.9012 112 H 5.2137 8.3861 117.9206 54.5769 31.5339 173.5117 113 N 4.7872 8.0882 117.7871 53.5032 40.3500 175.3082 114 V 3.7373 8.4215 126.9061 66.5950 31.5645 178.5855 115 Q 4.0397 8.0592 117.1147 58.7761 28.6104 178.1947 116 D 4.3208 8.0337 119.5894 57.5889 40.9110 178.1409 117 H 4.2796 8.1683 117.9608 58.2829 28.7711 177.2179 118 L 3.9842 8.2564 122.3024 58.3968 41.8750 179.2866 119 K 3.9700 8.3369 118.1576 59.5287 31.9426 178.8512 120 E 3.9604 8.6044 119.9219 59.3358 29.5180 178.8893 121 L 4.2151 8.9844 119.1955 57.8787 41.7173 179.0041 122 A 4.0618 8.2048 120.7813 55.5672 18.2043 179.3608 123 D 4.3321 8.1262 116.7352 57.7446 41.0411 179.1313 124 R 3.9702 7.9246 118.1847 59.6970 30.0328 178.8200 125 Y 3.7345 8.8657 116.4996 60.8936 37.8752 178.3545 126 A 3.9088 8.3614 121.8046 55.1738 18.3816 179.6826 127 I 3.5880 7.7386 118.1963 64.5845 37.1691 178.8643 128 V 3.4494 7.5148 118.1299 65.8213 31.4645 177.4992 129 A 3.9183 8.5982 121.5336 55.4994 18.1040 179.3475 130 N 4.2436 8.6679 114.6081 56.4299 38.7229 177.0315 131 D 4.3446 8.2335 119.7281 57.5644 41.1873 178.8901 132 V 3.8345 8.0881 119.6909 64.8062 31.1670 178.2477 133 R 3.8688 7.7170 118.2520 58.9258 30.2268 178.5189 134 K 4.0828 7.9595 118.0131 59.4128 32.3218 178.8900 135 A 4.0062 8.0094 120.9750 55.4012 17.8335 179.5669 136 I 3.7051 7.3104 117.7481 64.7918 37.4096 178.5187 137 G 3.7280 7.7400 103.0568 46.4605 0.0000 174.4891 138 E 4.2946 7.9278 119.6334 56.3411 30.0493 175.5398 139 A 4.3155 7.2834 122.2814 51.4560 19.0454 177.4884 140 K 4.0925 8.5602 123.0995 58.5827 32.9785 177.5740 141 D 4.4811 7.9430 119.0529 53.4996 42.0273 175.6206 142 D 4.3827 8.8297 127.5252 57.8973 40.9573 178.4461 143 D 4.3392 8.2377 118.2440 58.0750 40.8719 179.0658 144 T 3.8240 7.6786 114.1291 66.6495 68.3334 176.3829 145 A 3.9534 8.1050 122.5746 55.0826 18.2766 179.1174 146 D 4.1980 8.0451 116.3823 57.6262 41.3680 178.1986 147 I 3.6516 7.7156 120.2379 64.8187 37.1356 178.3893 148 L 3.9617 8.0487 119.3583 57.8047 41.3598 179.7476 149 T 3.7808 8.0930 115.8219 66.6187 68.3060 176.4910 150 A 3.9904 8.2469 122.6919 55.0832 18.3797 179.6057 151 A 3.2945 7.8701 119.2267 55.0845 18.4082 179.8133 152 S 3.9539 8.6318 112.0570 61.4256 62.1709 175.9752 153 R 3.7939 8.2536 121.8553 59.8524 29.6162 178.1651 154 D 3.9983 7.5817 118.2459 57.1560 40.7918 178.7499 155 L 3.5845 7.4758 119.4083 57.7735 41.6157 179.3765 156 D 4.5359 8.3560 119.1874 56.9189 40.6538 178.7963 157 K 4.1463 7.4169 119.1818 59.3420 32.2260 178.9681 158 F 3.8698 7.9078 118.2109 60.2935 38.7769 177.0569 159 L 3.8642 8.3128 120.3947 58.1686 41.7407 178.7183 160 W 4.4606 8.1961 127.8271 60.7788 30.3690 177.9207 161 F 4.0062 8.0611 116.3626 60.4658 38.6553 177.4935 162 I 3.8549 8.3492 119.6961 64.5400 36.9768 178.1602 163 E 4.0133 8.6631 119.6546 59.8165 29.1739 179.6981 164 S 4.3110 8.2101 113.3666 60.6545 62.9201 175.4266 165 N 4.6358 7.7351 117.6442 52.6755 38.8514 175.0736 166 I 4.1502 7.0807 122.7835 60.5157 37.8340 175.8628 167 E 4.1467 9.8312 125.0476 56.7366 29.1637 176.7669 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 12 T 8.17 4.38 4.33 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 1.22 0.00 0.00 13 N 8.54 4.78 0.00 2.77 2.85 0.00 0.00 6.80 6.97 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 14 L 8.64 4.53 0.00 1.56 1.61 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.79 4.69 0.00 1.50 1.62 0.94 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 8.13 4.21 0.00 2.97 2.92 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 17 T 7.07 3.81 4.05 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 1.06 0.00 0.00 18 R 8.14 3.89 0.00 1.75 1.93 0.00 3.25 0.00 0.00 3.17 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.50 0.00 19 N 7.52 4.28 0.00 2.57 2.67 0.00 0.00 7.12 9.28 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 20 D 8.38 4.63 0.00 2.82 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 21 V 7.09 4.21 2.06 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 0.83 0.00 0.00 0.96 0.00 0.00 22 S 8.72 4.05 0.00 4.03 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 23 D 9.10 4.41 0.00 2.79 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 24 S 8.08 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 25 E 8.52 3.92 0.00 2.06 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 2.29 2.39 0.00 26 K 8.06 3.80 0.00 1.98 1.94 0.00 1.74 0.00 0.00 2.07 0.00 0.00 2.91 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.52 1.85 7.81 27 K 8.34 3.82 0.00 1.81 1.89 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.60 7.81 28 A 7.60 3.97 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 29 T 8.00 3.77 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 1.18 0.00 0.00 30 V 8.37 3.69 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 0.98 0.00 0.00 1.02 0.00 0.00 31 E 7.90 3.98 0.00 2.19 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 2.30 2.45 0.00 32 L 7.89 3.95 0.00 1.80 1.81 0.96 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.47 3.92 0.00 1.64 1.63 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.02 4.21 0.00 2.86 2.89 0.00 0.00 6.76 7.54 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 35 R 7.86 3.91 0.00 2.10 2.09 0.00 3.10 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 36 Q 7.67 4.09 0.00 2.14 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.50 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 37 V 7.96 3.53 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.92 0.00 0.00 38 I 7.66 3.68 2.04 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.70 0.99 0.00 0.00 39 Q 7.84 3.99 0.00 2.29 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 40 F 9.29 3.84 0.00 3.26 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 41 I 8.30 3.74 1.91 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 1.45 0.84 0.94 0.00 0.00 42 D 8.30 4.30 0.00 2.91 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 43 L 7.90 3.78 0.00 1.64 1.35 -0.33 0.21 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 44 S 8.36 4.05 0.00 4.05 4.12 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 45 L 7.83 3.93 0.00 1.87 1.77 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.85 3.50 1.96 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.00 0.61 0.00 0.00 47 T 7.94 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 1.26 0.00 0.00 48 K 7.71 3.30 0.00 1.36 0.74 0.00 0.61 0.00 0.00 0.80 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.03 1.19 7.81 49 Q 7.51 4.13 0.00 1.91 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 50 A 7.56 3.91 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 51 H 7.81 3.92 0.00 2.87 3.10 0.00 5.96 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 W 7.94 4.59 0.00 3.50 3.08 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 0.00 0.00 0.00 0.00 53 N 8.23 4.94 0.00 3.05 3.03 0.00 0.00 6.79 7.43 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 54 M 7.08 4.97 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.97 0.00 55 R 9.20 4.27 0.00 1.80 1.69 0.00 3.02 0.00 0.00 3.07 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.45 0.00 56 G 8.91 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.48 4.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 N 9.02 4.14 0.00 2.91 2.82 0.00 0.00 6.78 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 59 F 7.41 4.16 0.00 3.18 2.96 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 60 I 7.70 2.81 1.84 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.02 0.85 0.00 0.00 61 A 7.83 3.81 1.19 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 0.00 0.00 62 V 7.38 3.27 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 0.99 0.00 0.00 0.87 0.00 0.00 63 H 8.02 3.84 0.00 2.19 2.87 0.00 5.81 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.26 3.91 0.00 1.84 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 0.00 2.26 2.33 0.00 65 M 7.75 3.57 0.00 1.86 1.79 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.43 0.00 66 L 7.70 3.44 0.00 1.61 1.47 0.88 1.04 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 67 D 7.49 4.16 0.00 2.57 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 68 G 7.72 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 0.00 0.00 0.00 69 F 7.01 3.87 0.00 2.98 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 70 R 7.89 3.92 0.00 1.79 2.01 0.00 3.03 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 71 T 7.90 3.85 4.42 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 1.23 0.00 0.00 72 A 7.95 4.12 1.70 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 73 L 8.75 4.24 0.00 2.14 1.87 1.13 0.89 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 74 I 8.05 3.84 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.98 0.94 0.00 0.00 75 C 8.00 4.08 0.00 3.02 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 76 H 8.40 4.11 0.00 3.46 3.18 0.00 5.71 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 77 L 8.40 3.61 0.00 1.96 1.91 1.03 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.51 3.96 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 79 T 7.90 3.78 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 1.18 0.00 0.00 80 M 8.25 3.89 0.00 1.89 2.09 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.38 0.00 81 A 8.03 3.97 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 82 E 8.51 3.90 0.00 2.16 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.50 0.00 83 R 7.91 3.81 0.00 1.90 2.06 0.00 3.12 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 84 A 8.03 3.93 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 85 V 7.66 3.82 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 1.15 0.00 0.00 0.94 0.00 0.00 86 Q 8.07 4.05 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.04 0.00 0.00 0.00 0.00 0.00 2.37 2.65 0.00 87 L 7.43 4.44 0.00 1.77 1.66 0.89 0.91 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 88 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 89 G 7.92 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 0.00 0.00 0.00 90 V 7.97 4.28 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 0.86 0.00 0.00 0.93 0.00 0.00 91 A 8.64 4.16 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 92 L 9.31 4.65 0.00 1.57 1.62 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.39 4.24 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 0.00 94 T 7.85 4.24 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 95 T 8.54 3.84 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 1.23 0.00 0.00 96 Q 8.03 3.96 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 97 V 7.38 3.60 2.23 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 1.04 0.00 0.00 0.94 0.00 0.00 98 I 7.90 3.68 2.02 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.24 0.93 0.00 0.00 99 N 8.26 4.27 0.00 2.82 3.08 0.00 0.00 7.36 7.40 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 0.00 100 S 7.59 4.35 0.00 4.02 3.98 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 0.00 0.00 0.00 101 K 7.71 4.40 0.00 1.87 1.87 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.44 7.81 102 T 7.03 4.39 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 1.33 0.00 0.00 103 P 0.00 4.65 0.00 2.21 2.13 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.98 0.00 104 L 7.35 4.54 0.00 1.78 1.66 0.85 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.80 3.82 0.00 1.72 1.76 0.00 1.81 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.46 7.81 106 S 8.68 4.04 0.00 3.90 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 8.63 4.25 0.00 3.05 2.88 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 0.00 0.00 0.00 108 P 0.00 4.36 0.00 2.02 1.87 0.00 2.69 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.55 0.00 109 L 8.53 4.71 0.00 1.69 1.79 0.99 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 110 D 7.98 4.92 0.00 2.73 2.70 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 0.00 111 I 7.57 4.41 1.70 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.42 0.79 0.00 0.00 112 H 8.39 5.21 0.00 3.20 3.36 0.00 5.90 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.09 4.79 0.00 2.85 2.86 0.00 0.00 6.85 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 0.00 114 V 8.42 3.74 2.15 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 1.17 0.00 0.00 1.12 0.00 0.00 115 Q 8.06 4.04 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.69 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 116 D 8.03 4.32 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 0.00 117 H 8.17 4.28 0.00 3.48 3.48 0.00 5.65 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 0.00 118 L 8.26 3.98 0.00 2.08 1.78 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.34 3.97 0.00 2.04 1.86 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.67 7.81 120 E 8.60 3.96 0.00 2.11 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 0.00 1.64 2.33 0.00 121 L 8.98 4.22 0.00 1.95 1.78 0.96 0.92 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 0.00 122 A 8.20 4.06 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 0.00 123 D 8.13 4.33 0.00 3.03 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 0.00 124 R 7.92 3.97 0.00 2.00 2.02 0.00 3.40 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.07 0.00 125 Y 8.87 3.73 0.00 3.11 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 0.00 126 A 8.36 3.91 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 0.00 127 I 7.74 3.59 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.78 0.90 0.00 0.00 128 V 7.51 3.45 1.74 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 0.55 0.00 0.00 0.72 0.00 0.00 129 A 8.60 3.92 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 0.00 130 N 8.67 4.24 0.00 2.78 2.88 0.00 0.00 6.75 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 D 8.23 4.34 0.00 2.81 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 0.00 132 V 8.09 3.83 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 0.99 0.00 0.00 1.00 0.00 0.00 133 R 7.72 3.87 0.00 1.95 2.14 0.00 3.23 0.00 0.00 3.33 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 134 K 7.96 4.08 0.00 1.89 1.83 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.75 1.59 7.81 135 A 8.01 4.01 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 0.00 136 I 7.31 3.71 1.96 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 1.43 0.86 0.89 0.00 0.00 137 G 7.74 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 0.00 0.00 0.00 138 E 7.93 4.29 0.00 1.96 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 0.00 2.25 2.36 0.00 139 A 7.28 4.32 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 0.00 140 K 8.56 4.09 0.00 1.85 1.87 0.00 1.84 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.41 7.81 141 D 7.94 4.48 0.00 2.72 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 0.00 142 D 8.83 4.38 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 0.00 143 D 8.24 4.34 0.00 2.85 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 0.00 144 T 7.68 3.82 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 1.17 0.00 0.00 145 A 8.11 3.95 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 0.00 146 D 8.05 4.20 0.00 2.80 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 0.00 147 I 7.72 3.65 2.01 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 1.49 0.67 0.84 0.00 0.00 148 L 8.05 3.96 0.00 1.82 1.67 0.88 0.51 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 0.00 149 T 8.09 3.78 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 1.18 0.00 0.00 150 A 8.25 3.99 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 0.00 151 A 7.87 3.29 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 S 8.63 3.95 0.00 3.83 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 0.00 153 R 8.25 3.79 0.00 2.02 1.98 0.00 3.10 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 154 D 7.58 4.00 0.00 2.60 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 0.00 0.00 0.00 155 L 7.48 3.58 0.00 1.59 1.59 0.79 0.58 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 0.00 156 D 8.36 4.54 0.00 2.61 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 0.00 157 K 7.42 4.15 0.00 1.82 1.82 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.67 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.14 1.46 7.81 158 F 7.91 3.87 0.00 2.91 1.84 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 0.00 159 L 8.31 3.86 0.00 1.85 1.98 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 160 W 8.20 4.46 0.00 3.44 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 F 8.06 4.01 0.00 3.16 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 0.00 162 I 8.35 3.85 1.94 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.76 0.87 0.00 0.00 163 E 8.66 4.01 0.00 2.28 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 0.00 2.39 2.55 0.00 164 S 8.21 4.31 0.00 3.61 3.84 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 0.00 165 N 7.74 4.64 0.00 2.77 2.79 0.00 0.00 7.01 7.31 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 0.00 166 I 7.08 4.15 2.03 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 1.32 0.66 0.93 0.00 0.00 167 E 9.83 4.15 0.00 1.99 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 2.34 2.26 0.00