NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2175 8.3149 121.7837 56.2108 33.3460 174.8351 3 L 4.6707 8.1269 123.3391 51.5056 43.9512 175.4136 4 S 4.6119 9.1940 117.0453 57.3629 66.6761 174.5462 5 Q 3.9621 8.5405 121.8002 59.8062 28.6036 177.9288 6 D 4.4098 8.1597 119.0439 57.4049 40.9461 178.4616 7 E 4.4113 8.0708 120.7605 58.9963 29.6596 179.1262 8 I 3.9844 8.0175 119.2480 63.9944 36.9754 178.0787 9 D 4.4012 8.2518 120.3120 57.1061 40.6123 178.3593 10 D 3.9513 9.0192 120.5357 56.8214 40.6702 178.4019 11 L 4.0345 7.9035 121.0459 57.5502 41.9307 178.9182 12 K 3.9288 8.2250 120.3283 60.4711 32.2181 179.1523 13 D 4.4592 8.9181 122.3280 58.4206 39.4611 180.0529 14 V 3.8284 8.0605 118.5562 66.2195 31.4986 177.9991 15 F 3.9036 8.6705 120.0528 61.5149 38.9782 177.4847 16 E 4.8096 8.0978 114.6578 56.6524 29.6665 177.1560 17 L 4.5676 8.3443 121.5293 56.4738 44.1377 178.4953 18 F 4.3863 8.1400 113.6708 59.3925 39.1024 177.0250 19 D 4.5353 7.9845 119.5050 56.4961 41.2650 177.1928 20 F 3.8425 8.3226 120.7641 61.4871 39.0177 177.0653 21 W 4.7301 8.2413 116.3514 58.6525 28.9627 176.8344 22 D 5.0812 8.7075 116.3395 51.4563 40.1520 174.0687 23 G 3.1858 7.1328 106.2751 43.5706 0.0000 173.5721 24 R 3.9642 8.0572 126.6754 56.7049 29.4479 175.5156 25 D 4.6203 8.8760 121.9959 52.7832 41.3715 176.3163 26 G 3.9886 9.9269 107.8455 45.7437 0.0000 172.8061 27 A 5.2072 8.4414 119.9762 50.2912 23.5915 175.7674 28 V 4.3485 8.6903 118.6003 60.6008 34.9350 174.4668 29 D 4.8489 8.9557 126.9563 54.6250 41.7186 176.6748 30 A 4.1096 9.8548 128.9114 55.6018 18.0894 179.4304 31 F 4.6323 8.3125 119.0484 60.8673 39.9430 176.7581 32 K 4.1359 8.5093 116.4649 57.0016 31.9041 178.4972 33 L 4.2550 7.6692 121.5743 58.3985 41.5637 179.0418 34 G 3.4972 7.8510 104.5278 47.8967 0.0000 174.9782 35 D 4.6109 7.9279 119.2242 56.4952 41.2238 177.9771 36 V 3.1643 7.3227 117.4201 65.1256 31.7548 177.3359 37 C 4.2677 9.4150 119.1094 62.6781 27.8929 176.5271 38 R 4.2398 7.8743 118.4832 58.8775 29.3264 182.4232 39 C 4.7633 7.5730 111.9256 60.9097 27.7662 173.6660 40 L 4.8066 7.4269 119.0678 54.2819 42.4365 176.4686 41 G 3.9001 7.9445 104.8451 47.2536 0.0000 173.8197 42 I 4.6661 7.5862 118.6689 59.7372 40.8195 175.9158 43 N 4.8957 8.1172 116.8232 50.9889 39.3311 174.0885 44 P 4.1585 0.0000 0.0000 63.2879 32.1031 177.2944 45 R 4.0900 8.5848 121.4092 56.0244 30.3419 173.6334 46 N 3.8394 9.0213 115.1205 57.2803 38.3075 177.1849 47 E 4.0974 8.6343 119.4498 59.5901 29.7379 178.6132 48 D 4.3822 7.9135 118.8224 57.2321 40.9941 178.6443 49 V 3.4017 7.3985 112.1950 64.8360 31.0651 178.7418 50 F 4.7386 7.3454 116.3727 60.1949 38.4572 177.6470 51 A 3.8475 7.9760 121.2617 54.5606 18.3609 178.7148 52 V 4.0182 8.2652 107.5376 61.0248 32.4572 177.3042 53 G 4.8474 7.1502 121.4879 45.9584 0.0000 172.4198 54 G 4.0867 7.8509 110.6581 46.0532 0.0000 172.7415 55 T 4.8288 8.3866 111.5242 60.9838 70.3934 173.7528 56 H 4.5923 8.9684 124.8268 57.0143 29.6314 176.4331 57 K 4.1068 7.6004 120.4544 51.9699 34.4025 179.9392 58 M 4.1915 7.7599 123.7439 57.2761 32.4760 176.6447 59 G 4.3389 9.0869 118.9726 46.9824 0.0000 173.4852 60 E 4.5515 8.1147 119.9234 57.4538 32.6347 178.0276 61 K 4.8171 7.7624 119.7582 53.8876 36.2856 177.7107 62 S 5.3547 8.8076 119.1943 56.2746 65.7786 173.4837 63 L 5.0954 9.2589 123.6128 52.4148 44.4538 174.9876 64 P 5.2463 0.0000 0.0000 61.7640 32.3871 175.7242 65 F 3.4588 8.2583 119.4914 61.1675 38.6152 176.9214 66 E 3.9012 8.1267 117.8885 59.7226 29.6683 179.1487 67 E 4.1029 7.7822 117.5656 59.6664 29.9340 178.1864 68 F 3.6288 8.7161 119.7257 61.7799 39.2438 177.3605 69 L 3.6402 7.0483 118.0230 57.5132 42.6423 177.2902 70 P 4.2117 0.0000 0.0000 65.8106 31.4032 178.3427 71 A 3.9583 8.0918 119.2705 55.3040 17.8386 179.0586 72 Y 4.0715 7.7445 117.6745 60.8388 38.9127 177.1432 73 E 3.8999 8.4617 118.3010 60.2712 29.1884 178.4605 74 G 3.6228 8.2241 109.1097 47.7509 0.0000 175.4311 75 L 3.9751 7.8036 123.6381 57.1896 41.4534 180.1359 76 M 4.2336 8.3135 122.3113 59.3232 32.5383 179.0055 77 D 4.4720 7.2425 115.7774 55.4417 40.1599 179.0656 78 C 4.3659 7.4146 114.8694 59.7777 28.7031 173.2957 79 E 3.9526 8.7686 126.4561 57.1394 29.8067 176.7375 80 Q 4.7652 8.3534 123.3914 52.8218 31.3467 173.5939 81 G 3.5719 8.7270 108.5003 44.4291 0.0000 173.2163 82 T 4.4662 7.5397 111.9197 59.4959 71.2002 175.4502 83 F 3.9148 8.5022 126.2320 61.4141 39.4141 177.2409 84 A 3.9209 7.8770 119.9719 56.1400 18.1314 178.8326 85 D 4.1853 7.9216 114.5795 58.0161 40.4157 178.9682 86 Y 4.5816 7.5427 115.9107 61.9965 38.1286 179.0529 87 M 4.1812 8.4505 119.3416 58.5816 31.8935 178.5460 88 E 4.2887 9.2700 116.5721 57.9808 29.7905 178.6645 89 A 4.3239 8.0406 121.6376 54.7841 19.2834 179.3551 90 F 3.3747 8.5936 116.5753 60.4549 39.0043 177.6869 91 K 4.0848 8.8841 119.7431 59.7103 31.5350 178.0774 92 T 4.3220 7.9053 107.4081 62.1155 68.7645 174.9085 93 F 4.5157 8.3644 117.3265 57.1742 41.3792 174.7165 94 D 4.7360 8.0434 121.7446 52.7821 39.9608 177.1106 95 R 4.0084 8.4559 124.1981 59.0057 30.6496 178.1861 96 E 3.9594 8.2595 116.1580 57.9959 29.9332 178.2321 97 G 4.3323 8.5559 106.5193 45.5152 0.0000 175.4234 98 Q 4.0771 7.9353 117.1969 57.6787 28.1154 176.9138 99 G 4.3071 8.5544 105.6672 46.7801 0.0000 172.4282 100 F 5.1026 8.7052 119.7046 55.9079 41.8954 175.9270 101 I 4.4889 8.6119 124.0379 59.1831 37.5757 171.4600 102 S 4.1678 8.6532 123.5045 55.7635 64.6132 174.9282 103 G 3.6445 9.2415 111.4283 47.0898 0.0000 175.6240 104 A 4.0151 8.0113 122.7247 54.5494 18.3985 179.0888 105 E 3.8529 8.1707 116.8870 59.4501 29.8366 178.3241 106 L 3.9267 7.7061 119.7827 58.4636 41.9566 178.9399 107 R 3.8660 7.9941 118.2635 60.0442 29.9910 177.3207 108 H 4.0817 8.7754 118.2797 58.9316 29.8280 176.9172 109 V 3.4416 8.6463 119.8338 66.4381 31.0875 178.5210 110 L 4.0287 8.0949 118.4905 57.1675 41.2615 178.6004 111 T 4.5725 7.8717 106.5500 61.4323 69.1985 174.6117 112 A 4.4180 8.3154 123.8263 53.4401 21.0509 176.9670 113 L 4.4878 7.6295 113.7122 53.9135 43.8674 178.6514 114 G 3.6470 8.3193 108.1082 46.5600 0.0000 173.3600 115 E 4.1759 8.6848 122.6991 55.8215 29.6775 176.7920 116 R 4.5515 8.4132 123.2415 55.9990 31.4700 175.6704 117 L 4.9330 7.8775 119.0079 52.8102 44.4850 177.4933 118 S 4.2701 8.6897 118.2426 58.6204 63.5874 175.2402 119 D 4.4207 9.0505 122.8543 58.4791 40.4335 178.1084 120 E 3.8745 8.7648 116.7194 59.1173 28.5523 179.1210 121 D 4.4813 7.8601 118.6740 57.7163 41.6155 179.2451 122 V 3.6616 7.5044 117.7661 66.5497 31.3295 177.7762 123 D 4.3870 8.5700 117.8856 57.2018 40.7766 178.3735 124 E 4.0857 8.7612 120.6897 59.0250 29.3947 178.3087 125 I 3.3883 9.2112 119.0512 63.9784 37.9884 177.4915 126 I 4.1802 8.1962 122.4267 63.6295 37.0525 178.7555 127 K 4.0696 8.6494 125.6602 59.1371 31.7037 183.7079 128 L 4.1418 7.9466 118.9984 57.8757 41.5309 178.7692 129 T 4.0922 7.4944 104.2421 61.5961 69.3386 173.7815 130 D 4.4067 7.8609 120.8500 54.8118 39.9508 173.4976 131 L 4.1011 7.7609 118.7861 55.1543 42.6960 175.8052 132 Q 4.6008 8.4660 123.8706 54.0422 31.2815 175.2168 133 E 4.4066 8.6170 122.5898 55.8769 30.2368 176.2470 134 D 4.7213 8.2976 121.5770 51.6022 41.5328 177.0946 135 L 3.9904 8.5582 118.3564 58.2944 41.5540 179.1260 136 E 4.0049 8.1573 116.5632 58.1620 30.0607 177.3138 137 G 4.2979 8.8242 108.7132 45.8396 0.0000 172.5590 138 N 5.4240 8.3067 114.5728 51.1253 43.2886 174.6298 139 V 4.8857 8.0989 113.8430 59.3882 35.0067 175.1792 140 K 4.2718 8.6422 124.1232 56.0733 32.6533 177.7762 141 Y 3.9935 8.3553 122.0825 59.7108 37.7587 177.8677 142 E 3.7602 7.4350 120.7987 59.4718 29.4678 178.4330 143 D 4.3461 7.9401 118.0130 57.3704 40.9328 178.5433 144 F 4.1789 7.8758 120.0902 61.3742 39.3088 177.4131 145 V 3.3887 8.2838 118.1600 65.7356 31.1724 178.1931 146 K 4.0996 8.1152 118.5585 59.1424 31.7230 179.5306 147 K 3.8736 7.7003 118.8859 59.4454 31.7817 179.4800 148 V 3.3469 7.0112 117.1154 66.2498 31.3761 177.5639 149 M 4.2393 7.6124 117.0720 57.6875 32.0164 178.0318 150 A 4.0890 7.9519 121.1206 52.5742 18.7143 178.8796 151 G 3.9971 7.1569 101.4935 44.7521 0.0000 171.9376 152 P 4.0817 0.0000 0.0000 64.6216 31.4449 176.0003 153 Y 4.7517 7.3068 116.6297 55.1269 37.7888 173.6538 154 P 4.4499 0.0000 0.0000 62.7695 31.5461 176.9336 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 K 8.31 4.22 0.00 1.73 1.77 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.48 7.81 3 L 8.13 4.67 0.00 1.81 1.64 1.16 0.56 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 4 S 9.19 4.61 0.00 4.03 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 8.54 3.96 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.88 0.00 0.00 0.00 0.00 0.00 2.44 2.70 0.00 6 D 8.16 4.41 0.00 2.75 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 7 E 8.07 4.41 0.00 2.25 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 0.00 2.46 2.30 0.00 8 I 8.02 3.98 2.20 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 1.64 0.81 1.15 0.00 0.00 9 D 8.25 4.40 0.00 2.81 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 9.02 3.95 0.00 2.83 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 7.90 4.03 0.00 1.70 1.99 0.66 0.58 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 12 K 8.22 3.93 0.00 1.89 1.72 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.70 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.73 0.24 7.81 13 D 8.92 4.46 0.00 2.62 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 14 V 8.06 3.83 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 0.88 0.00 0.00 1.04 0.00 0.00 15 F 8.67 3.90 0.00 3.04 3.20 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 16 E 8.10 4.81 0.00 2.35 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 2.44 2.49 0.00 17 L 8.34 4.57 0.00 1.74 2.07 0.92 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 18 F 8.14 4.39 0.00 2.84 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 19 D 7.98 4.54 0.00 2.51 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 20 F 8.32 3.84 0.00 2.97 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 W 8.24 4.73 0.00 3.35 3.25 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 0.00 22 D 8.71 5.08 0.00 2.85 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 23 G 7.13 3.19 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 24 R 8.06 3.96 0.00 1.68 1.76 0.00 3.17 0.00 0.00 3.28 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 25 D 8.88 4.62 0.00 2.76 2.66 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 0.00 0.00 0.00 0.00 26 G 9.93 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.44 5.21 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 28 V 8.69 4.35 1.77 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 0.93 0.00 0.00 -0.38 0.00 0.00 29 D 8.96 4.85 0.00 2.93 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 30 A 9.85 4.11 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 31 F 8.31 4.63 0.00 3.03 3.25 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 0.00 32 K 8.51 4.14 0.00 2.16 2.13 0.00 2.20 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.67 1.83 7.81 33 L 7.67 4.25 0.00 1.65 1.80 0.59 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 34 G 7.85 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 35 D 7.93 4.61 0.00 2.59 2.85 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 0.00 36 V 7.32 3.16 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 0.62 0.00 0.00 0.04 0.00 0.00 37 C 9.42 4.27 0.00 3.12 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 38 R 7.87 4.24 0.00 1.74 1.94 0.00 3.24 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.22 0.00 39 C 7.57 4.76 0.00 3.07 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 40 L 7.43 4.81 0.00 1.93 1.77 0.57 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 41 G 7.94 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 42 I 7.59 4.67 2.04 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 1.44 1.06 0.93 0.00 0.00 43 N 8.12 4.90 0.00 2.69 2.76 0.00 0.00 6.85 8.02 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 44 P 0.00 4.16 0.00 2.07 2.02 0.00 3.75 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.92 0.00 45 R 8.58 4.09 0.00 1.76 1.87 0.00 3.26 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.24 0.00 46 N 9.02 3.84 0.00 3.13 3.23 0.00 0.00 6.44 7.66 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 47 E 8.63 4.10 0.00 2.08 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 2.37 2.45 0.00 48 D 7.91 4.38 0.00 2.87 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 49 V 7.40 3.40 1.69 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 0.59 0.00 0.00 -0.36 0.00 0.00 50 F 7.35 4.74 0.00 3.17 3.11 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 51 A 7.98 3.85 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 52 V 8.27 4.02 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 0.68 0.00 0.00 0.93 0.00 0.00 53 G 7.15 4.85 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 0.00 0.00 0.00 0.00 54 G 7.85 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 0.00 0.00 0.00 55 T 8.39 4.83 4.43 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 0.00 0.00 1.51 0.00 0.00 56 H 8.97 4.59 0.00 3.01 3.25 0.00 5.89 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 7.60 4.11 0.00 1.67 1.54 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.27 1.20 7.81 58 M 7.76 4.19 0.00 1.83 1.84 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.11 2.59 0.00 59 G 9.09 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 0.00 0.00 0.00 0.00 60 E 8.11 4.55 0.00 1.80 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 2.22 2.46 0.00 61 K 7.76 4.82 0.00 1.39 1.59 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.79 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.34 1.04 7.81 62 S 8.81 5.35 0.00 3.79 3.85 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 0.00 63 L 9.26 5.10 0.00 1.99 1.84 0.99 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 5.25 0.00 2.67 2.30 0.00 3.87 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 2.23 2.04 0.00 65 F 8.26 3.46 0.00 2.18 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 66 E 8.13 3.90 0.00 2.22 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 0.00 2.33 2.45 0.00 67 E 7.78 4.10 0.00 2.34 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 0.00 2.40 2.53 0.00 68 F 8.72 3.63 0.00 3.22 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 69 L 7.05 3.64 0.00 1.29 1.49 0.97 0.95 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 70 P 0.00 4.21 0.00 2.17 2.08 0.00 3.86 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 71 A 8.09 3.96 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 72 Y 7.74 4.07 0.00 2.73 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 73 E 8.46 3.90 0.00 2.20 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 0.00 2.41 2.42 0.00 74 G 8.22 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.80 3.98 0.00 1.78 1.60 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 76 M 8.31 4.23 0.00 1.81 2.05 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.80 0.00 77 D 7.24 4.47 0.00 2.52 2.60 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 78 C 7.41 4.37 0.00 2.88 2.85 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 0.00 79 E 8.77 3.95 0.00 1.90 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 2.26 2.28 0.00 80 Q 8.35 4.77 0.00 2.08 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.76 0.00 0.00 0.00 0.00 0.00 2.17 1.88 0.00 81 G 8.73 3.57 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 0.00 0.00 0.00 0.00 82 T 7.54 4.47 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 1.23 0.00 0.00 83 F 8.50 3.91 0.00 3.15 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 84 A 7.88 3.92 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 85 D 7.92 4.19 0.00 2.49 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 86 Y 7.54 4.58 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 M 8.45 4.18 0.00 1.85 2.03 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 1.48 1.62 0.00 88 E 9.27 4.29 0.00 2.21 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 2.37 2.48 0.00 89 A 8.04 4.32 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 90 F 8.59 3.37 0.00 3.26 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 91 K 8.88 4.08 0.00 2.16 1.92 0.00 1.72 0.00 0.00 1.84 0.00 0.00 3.15 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.54 1.61 7.81 92 T 7.91 4.32 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 1.33 0.00 0.00 93 F 8.36 4.52 0.00 2.92 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 94 D 8.04 4.74 0.00 2.79 2.85 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 0.00 95 R 8.46 4.01 0.00 1.87 1.98 0.00 3.29 0.00 0.00 3.20 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 96 E 8.26 3.96 0.00 2.06 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 0.00 2.39 2.37 0.00 97 G 8.56 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 0.00 0.00 0.00 0.00 98 Q 7.94 4.08 0.00 2.27 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.19 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 99 G 8.55 4.31 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 0.00 100 F 8.71 5.10 0.00 3.02 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 0.00 101 I 8.61 4.49 1.87 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 1.11 0.84 0.91 0.00 0.00 102 S 8.65 4.17 0.00 3.94 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 0.00 103 G 9.24 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 0.00 104 A 8.01 4.02 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 0.00 105 E 8.17 3.85 0.00 2.10 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 0.00 2.53 2.55 0.00 106 L 7.71 3.93 0.00 1.93 1.88 0.99 0.58 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 0.00 107 R 7.99 3.87 0.00 1.97 2.07 0.00 3.20 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 108 H 8.78 4.08 0.00 3.34 3.48 0.00 5.88 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 0.00 109 V 8.65 3.44 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 0.37 0.00 0.00 0.65 0.00 0.00 110 L 8.09 4.03 0.00 1.74 1.72 0.99 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 111 T 7.87 4.57 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 1.27 0.00 0.00 112 A 8.32 4.42 0.98 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 0.00 0.00 113 L 7.63 4.49 0.00 1.80 1.58 0.94 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.32 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 0.00 115 E 8.68 4.18 0.00 2.00 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 0.00 2.36 2.35 0.00 116 R 8.41 4.55 0.00 1.71 1.89 0.00 3.34 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 117 L 7.88 4.93 0.00 1.49 1.54 0.95 0.81 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 0.00 118 S 8.69 4.27 0.00 4.10 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 0.00 119 D 9.05 4.42 0.00 2.69 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 0.00 120 E 8.76 3.87 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 2.42 2.39 0.00 121 D 7.86 4.48 0.00 2.71 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 0.00 122 V 7.50 3.66 2.27 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 1.01 0.00 0.00 0.99 0.00 0.00 123 D 8.57 4.39 0.00 2.85 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 0.00 124 E 8.76 4.09 0.00 2.20 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 0.00 2.31 2.45 0.00 125 I 9.21 3.39 1.93 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 1.65 1.22 1.15 0.00 0.00 126 I 8.20 4.18 1.89 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.16 0.87 0.00 0.00 127 K 8.65 4.07 0.00 1.72 1.80 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.34 7.81 128 L 7.95 4.14 0.00 1.63 1.75 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.49 4.09 4.28 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 1.12 0.00 0.00 130 D 7.86 4.41 0.00 2.85 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 0.00 131 L 7.76 4.10 0.00 1.73 1.53 1.07 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 132 Q 8.47 4.60 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.78 0.00 0.00 0.00 0.00 0.00 2.47 2.30 0.00 133 E 8.62 4.41 0.00 2.03 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.28 0.00 134 D 8.30 4.72 0.00 2.88 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 0.00 135 L 8.56 3.99 0.00 1.62 1.78 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.16 4.00 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 137 G 8.82 4.30 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 0.00 138 N 8.31 5.42 0.00 2.76 2.83 0.00 0.00 6.86 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 0.00 139 V 8.10 4.89 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 0.79 0.00 0.00 0.96 0.00 0.00 140 K 8.64 4.27 0.00 1.67 1.30 0.00 1.12 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.38 1.34 7.81 141 Y 8.36 3.99 0.00 2.45 2.65 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 0.00 142 E 7.43 3.76 0.00 1.71 1.82 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 2.50 2.63 0.00 143 D 7.94 4.35 0.00 2.85 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 0.00 144 F 7.88 4.18 0.00 3.07 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 0.00 145 V 8.28 3.39 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 1.11 0.00 0.00 0.75 0.00 0.00 146 K 8.12 4.10 0.00 2.00 1.82 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.63 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.88 7.81 147 K 7.70 3.87 0.00 1.68 1.74 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.60 7.81 148 V 7.01 3.35 1.71 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 0.63 0.00 0.00 0.07 0.00 0.00 149 M 7.61 4.24 0.00 2.06 2.29 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.79 0.00 150 A 7.95 4.09 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 0.00 151 G 7.16 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.08 0.00 1.35 1.89 0.00 3.63 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 1.58 1.74 0.00 153 Y 7.31 4.75 0.00 3.01 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 P 0.00 4.45 0.00 2.19 2.04 0.00 3.92 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 1.98 0.00