NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 S 4.4439 8.1933 115.2907 57.9225 64.0266 174.5480 6 I 3.8142 8.3084 129.8869 63.1276 37.0191 173.4384 7 V 3.6013 8.5688 119.9158 66.2598 31.8265 177.6803 8 Q 4.0276 7.8956 117.6814 58.6093 27.9652 178.3277 9 E 3.9036 8.0947 120.4218 59.1617 29.6902 178.7904 10 A 3.9831 7.9232 120.3785 55.2867 18.5294 179.3456 11 R 3.9583 7.9730 116.6326 59.9970 30.1344 178.7862 12 D 4.3767 8.2312 117.9737 57.4475 40.7375 178.9327 13 I 3.7140 7.3991 119.0375 64.4855 36.7659 178.3452 14 Q 4.2041 7.9740 118.6160 58.9211 28.6317 178.4518 15 L 3.9859 8.3457 121.3129 58.2845 41.9641 178.6956 16 A 3.9271 8.6650 121.2805 55.5749 18.3315 179.3613 17 M 3.9730 8.7512 118.0061 58.6191 31.8799 178.5029 18 E 3.9254 8.9692 118.5819 59.4222 30.1578 178.6422 19 L 4.0720 8.3919 119.1453 57.8068 41.5650 179.4087 20 I 3.6649 8.3213 120.5804 64.6082 36.8930 178.2237 21 T 4.0652 7.8036 107.8938 63.1579 68.8501 175.4961 22 L 4.6253 7.2925 120.7207 54.6968 42.0657 176.0055 23 G 3.8831 8.7058 110.9650 44.1323 0.0000 177.3921 24 A 3.1823 7.3915 124.6207 54.9042 18.3226 177.0406 25 R 5.1468 8.6130 127.6029 56.9990 32.4602 175.3322 26 L 4.2895 7.7132 121.8607 55.5630 39.8692 176.7434 27 Q 3.9949 7.9418 114.8940 59.2440 29.0005 178.1828 28 M 2.6088 7.5613 118.5736 57.8240 32.1530 177.8326 29 L 3.8150 7.5899 118.6429 58.0397 41.6784 179.1917 30 E 4.0615 8.5161 116.4488 58.5186 29.4278 178.8421 31 S 4.4818 7.7106 114.8905 60.0915 63.3658 174.6855 32 E 4.5468 7.9753 118.0483 56.2875 30.9378 175.7651 33 T 4.8167 7.8103 115.3506 61.7097 70.8561 174.6083 34 Q 4.1663 8.8026 123.2214 57.9832 29.2199 177.2387 35 L 3.9670 7.9872 117.5071 54.8341 42.2542 177.2172 36 S 4.2326 8.6453 117.7465 58.0214 63.8734 175.1721 37 R 3.8043 8.8701 123.1880 59.6518 29.4165 177.3688 38 G 3.7781 7.6301 105.1660 45.7212 0.0000 175.7834 39 R 3.8875 7.9316 117.9188 58.4091 30.5040 178.7883 40 L 4.1450 7.8880 118.5530 58.1659 41.7158 179.8152 41 I 3.6322 7.5675 119.0960 64.0320 36.8707 178.3983 42 K 3.9142 8.3655 120.9237 59.4539 31.8931 178.4324 43 L 3.9296 8.5562 120.3451 58.4418 42.0055 177.7992 44 Y 4.0856 8.7566 119.7356 60.7764 38.5533 178.3096 45 K 4.5664 8.5142 120.6996 58.7068 32.8070 179.1988 46 E 4.4473 8.3931 117.6711 55.3390 28.2042 176.0694 47 L 4.3516 7.3435 119.0299 56.7907 47.1998 174.7243 48 R 4.5158 7.8974 112.8723 55.7322 35.1888 176.3028 49 G 3.7621 9.3135 112.0479 45.1972 0.0000 175.8203 50 S 4.1540 9.1459 110.9511 57.7520 64.0641 173.1778 51 P 4.6541 0.0000 0.0000 61.2134 32.0718 174.0012 52 P 3.9981 0.0000 0.0000 61.3596 32.2267 175.7548 53 P 3.9839 0.0000 0.0000 63.9741 31.6533 178.9320 54 K 3.8497 7.7408 120.5836 57.3750 31.6924 176.9212 55 G 3.7497 8.6692 107.1714 45.4015 0.0000 172.7068 56 M 4.4036 8.3529 121.9947 53.6627 33.2530 175.7670 57 L 4.7030 7.9732 123.0389 52.6069 43.1931 174.5943 58 P 3.9805 0.0000 0.0000 62.9714 31.7114 176.4470 59 F 5.1220 8.0963 119.2035 56.0783 38.6983 175.3080 60 S 4.7264 8.6075 119.2491 57.9460 63.5867 173.6112 61 T 5.1211 8.6886 118.9625 64.0158 68.2760 176.5615 62 D 4.6259 8.2932 120.3058 55.5019 40.1268 177.7653 63 W 4.2728 8.1365 130.0542 60.7566 30.7152 177.1479 64 F 4.5605 8.0832 114.2824 58.6110 38.5233 176.6864 65 M 4.4017 8.7621 121.2759 56.7636 32.6589 176.3841 66 T 4.1062 8.2737 115.2811 64.6928 68.3570 176.8376 67 W 4.3153 8.3119 124.1963 58.6265 30.4315 177.8931 68 E 3.3659 8.2484 119.6358 58.5309 29.2474 178.6684 69 Q 4.0430 8.1106 117.2983 58.6219 28.7610 178.1523 70 N 4.7076 8.3993 120.0068 55.9998 39.0140 177.1247 71 V 3.9064 7.6903 119.8358 66.2736 31.6402 177.7945 72 H 4.2266 8.2488 115.7267 58.8705 28.6468 177.3167 73 A 4.0402 8.1427 122.5302 55.6220 18.1873 179.7777 74 S 4.1157 8.3137 113.3045 62.1373 62.8080 176.2326 75 M 3.9472 8.1568 120.6808 58.6983 31.9224 177.6051 76 F 4.1046 8.4854 120.3496 61.6770 39.5026 176.8046 77 C 4.1001 8.7516 118.0761 62.7565 31.3052 175.1071 78 N 4.2246 8.2585 117.6614 56.4222 38.1277 177.2612 79 A 3.9771 7.7533 121.6338 54.7642 18.4065 179.2581 80 W 4.0838 7.9210 126.8614 60.8021 30.6227 177.8025 81 Q 3.2299 8.4721 118.0220 58.8408 28.2069 178.6911 82 F 3.9183 8.2298 121.3197 61.5788 39.1572 176.9095 83 L 3.9358 8.2325 118.4538 57.0982 41.7410 179.4794 84 L 3.9302 7.7924 118.6015 57.8022 41.3668 179.4118 85 K 3.6263 7.6666 117.3444 59.8797 31.7458 178.7342 86 T 3.7190 7.4512 116.2793 66.3762 68.1216 176.0491 87 G 3.9419 8.0226 105.7343 45.4678 0.0000 173.4566 88 L 4.6577 7.6040 115.2620 53.8865 42.9702 176.0074 89 C 4.6727 7.6832 115.9897 57.6994 29.9328 173.0609 90 N 3.7643 8.3010 120.2726 56.3397 38.3132 175.1109 91 G 4.1122 7.5155 112.5248 45.8360 0.0000 175.6900 92 V 3.6837 7.5390 119.6048 65.1150 31.6692 177.8995 93 D 4.3590 8.1727 117.2811 57.2490 41.0735 177.9041 94 A 4.0812 7.9987 120.8980 55.1741 18.4059 179.5412 95 V 3.7292 8.2505 116.8840 66.2248 31.5048 178.4437 96 I 3.8675 7.9240 119.4458 64.5217 37.1401 178.5116 97 K 4.0248 8.4894 119.3412 59.3995 31.7524 179.3484 98 A 4.0420 8.6057 121.3757 55.4829 18.4075 179.0345 99 Y 4.4720 8.7919 118.3177 61.0676 38.8994 178.6229 100 R 3.9633 8.6575 119.4472 59.2974 30.1601 179.0484 101 L 4.0202 8.0064 118.6345 57.7868 41.5598 178.8459 102 Y 4.0876 8.3444 119.9541 60.6638 38.4824 178.2349 103 L 3.3762 7.3700 118.8047 57.4696 41.7421 178.9682 104 E 3.9953 7.6156 117.1794 59.5759 29.5320 178.9803 105 Q 3.9787 7.8015 118.1079 58.0198 29.5855 176.4179 106 C 3.9744 7.5300 121.4268 58.4164 31.9010 172.3271 107 P 4.2506 0.0000 0.0000 64.8378 30.5585 178.8130 108 Q 3.1303 7.1938 114.1487 57.0992 24.8942 176.2647 109 A 4.8106 7.6396 131.2811 51.4408 19.6674 176.5744 110 E 4.1670 8.5704 115.2244 57.8238 30.3548 177.0187 111 E 3.7315 9.5314 117.2148 56.7484 27.1557 175.8673 112 G 3.9385 7.6476 107.4027 43.7190 0.0000 171.7227 113 P 4.4998 0.0000 0.0000 62.1274 32.0786 176.0582 114 L 3.9693 8.9091 123.3671 57.8874 41.9819 176.8639 115 L 4.1748 8.1386 121.6362 53.4397 41.7253 176.4404 116 A 4.3650 8.1742 128.3830 51.2603 20.4590 177.0706 117 L 2.5124 8.1282 123.3277 58.5107 42.0472 179.7452 118 T 3.7698 7.7423 114.7600 66.5970 68.1920 176.4320 119 R 3.6571 7.6255 119.7498 59.3983 30.2766 178.0885 120 A 3.4113 7.4270 120.5233 54.6316 17.9988 179.3446 121 W 3.8980 7.9645 126.9524 60.9728 30.7655 178.2444 122 T 2.9072 7.5681 115.5330 66.2212 67.7347 176.1795 123 L 3.1622 7.5055 122.3351 57.8632 41.9186 179.2923 124 V 2.6813 7.0610 118.0264 65.4627 31.2129 178.1396 125 R 3.6099 7.1602 117.7239 59.2339 29.6557 178.6977 126 F 4.2716 7.9960 116.3512 60.9781 39.0602 177.5062 127 V 4.1683 7.8753 118.1351 65.7068 31.3536 177.6807 128 E 4.2897 8.4042 117.6255 58.3902 29.4731 177.8579 129 S 4.7176 8.3527 114.2123 58.5076 64.2225 176.4837 130 G 4.0522 8.3511 113.0771 46.7273 0.0000 174.8576 131 L 4.2004 7.2625 118.4287 54.5782 42.5364 172.7186 132 L 3.8752 8.5556 127.7886 54.5521 41.9299 173.5233 133 Q 4.4682 8.6312 122.1184 55.6284 33.3417 172.2117 134 L 5.1183 8.4003 120.9426 53.9143 43.2088 176.8932 135 S 4.7574 8.9700 117.8062 56.8274 67.5351 173.4673 136 S 4.9665 8.8377 120.3069 58.2728 63.2453 173.7957 137 C 4.3244 8.8570 125.9524 59.5360 31.4312 173.5219 138 N 4.5011 9.0736 122.9034 56.2185 38.8995 175.3084 139 C 4.0088 7.8467 117.3732 60.9574 30.9165 173.4007 140 C 4.3701 8.5710 111.3533 57.6932 30.8172 175.5383 141 G 3.8193 8.8173 111.9302 46.8294 0.0000 173.7364 142 G 3.7970 7.7765 108.0090 46.5230 0.0000 172.5163 143 N 5.4271 8.3285 118.6977 52.4043 39.7575 174.7612 144 F 5.1021 9.1439 121.0559 55.4219 43.8640 174.3434 145 I 4.4480 8.6970 123.1577 62.0972 37.7480 175.5421 146 T 4.5898 8.9137 115.8868 60.7455 72.6306 172.3518 147 H 4.7871 8.6107 117.9317 55.1719 29.5255 175.8067 148 A 3.7608 8.6717 123.0767 53.7940 18.9452 176.2726 149 H 3.8443 8.6751 119.0583 55.8990 25.2779 172.3663 150 Q 4.2990 7.6750 118.6870 54.9421 29.9702 177.5199 151 P 3.4317 0.0000 0.0000 61.7946 33.5000 176.4632 152 V 4.7260 7.0619 127.6923 63.5904 31.3993 171.4711 153 G 4.1054 7.3538 110.3190 45.0693 0.0000 174.6426 154 S 4.1268 8.2915 117.4939 58.6272 61.2713 170.0655 155 F 4.5491 8.0079 121.9825 55.6346 39.5664 172.0486 156 A 3.3461 7.9233 135.0000 51.3273 15.6920 177.1956 157 C 3.0761 7.3981 115.5426 58.0066 30.4009 175.0657 158 S 4.0514 8.0963 117.3151 61.8653 62.1402 175.8041 159 L 4.1940 7.7566 118.2974 57.8909 41.6992 177.0661 160 C 4.3007 7.5990 119.4720 60.0343 27.9143 173.3681 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 5 S 8.19 4.44 0.00 3.87 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 I 8.31 3.81 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 1.51 1.61 0.91 0.00 0.00 7 V 8.57 3.60 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 1.07 0.00 0.00 0.93 0.00 0.00 8 Q 7.90 4.03 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 9 E 8.09 3.90 0.00 2.25 1.96 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 2.31 2.33 0.00 10 A 7.92 3.98 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 11 R 7.97 3.96 0.00 2.05 2.03 0.00 3.30 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.86 0.00 12 D 8.23 4.38 0.00 2.80 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 13 I 7.40 3.71 1.99 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 1.52 1.04 0.91 0.00 0.00 14 Q 7.97 4.20 0.00 2.33 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 15 L 8.35 3.99 0.00 1.81 1.80 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.66 3.93 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 17 M 8.75 3.97 0.00 1.95 2.26 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.53 0.00 18 E 8.97 3.93 0.00 1.77 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 2.34 2.37 0.00 19 L 8.39 4.07 0.00 1.85 1.59 0.81 0.70 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 20 I 8.32 3.66 1.90 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 1.63 0.92 0.54 0.00 0.00 21 T 7.80 4.07 4.21 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 0.00 0.00 1.15 0.00 0.00 22 L 7.29 4.63 0.00 1.80 1.70 1.06 1.08 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 23 G 8.71 3.88 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 0.00 0.00 0.00 24 A 7.39 3.18 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 25 R 8.61 5.15 0.00 1.78 1.88 0.00 3.35 0.00 0.00 3.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.43 0.00 26 L 7.71 4.29 0.00 1.87 1.83 0.79 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 7.94 3.99 0.00 2.16 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.08 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 28 M 7.56 2.61 0.00 1.49 1.08 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.61 0.00 29 L 7.59 3.81 0.00 1.74 1.66 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.52 4.06 0.00 1.93 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 2.33 2.59 0.00 31 S 7.71 4.48 0.00 4.00 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 0.00 32 E 7.98 4.55 0.00 1.83 1.96 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 2.18 2.07 0.00 33 T 7.81 4.82 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 1.22 0.00 0.00 34 Q 8.80 4.17 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.73 0.00 0.00 0.00 0.00 0.00 2.72 2.48 0.00 35 L 7.99 3.97 0.00 1.63 1.64 0.92 0.87 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 36 S 8.65 4.23 0.00 4.00 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 37 R 8.87 3.80 0.00 2.01 2.01 0.00 3.17 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 38 G 7.63 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.93 3.89 0.00 1.88 2.01 0.00 3.31 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 40 L 7.89 4.15 0.00 1.71 1.74 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 41 I 7.57 3.63 1.96 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 1.32 1.20 0.86 0.00 0.00 42 K 8.37 3.91 0.00 1.80 1.97 0.00 1.65 0.00 0.00 1.58 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.46 7.81 43 L 8.56 3.93 0.00 1.78 1.73 0.92 0.92 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 44 Y 8.76 4.09 0.00 3.22 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 45 K 8.51 4.57 0.00 2.25 1.89 0.00 1.75 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.67 1.51 7.81 46 E 8.39 4.45 0.00 2.10 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 2.57 2.31 0.00 47 L 7.34 4.35 0.00 1.64 1.65 0.87 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 48 R 7.90 4.52 0.00 1.56 1.74 0.00 3.11 0.00 0.00 3.06 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.01 0.00 49 G 9.31 3.76 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 0.00 0.00 0.00 50 S 9.15 4.15 0.00 4.03 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 51 P 0.00 4.65 0.00 2.13 2.08 0.00 3.78 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 1.94 1.93 0.00 52 P 0.00 4.00 0.00 1.63 0.49 0.00 3.51 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.52 0.00 53 P 0.00 3.98 0.00 2.13 2.11 0.00 3.50 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 54 K 7.74 3.85 0.00 1.87 1.91 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.45 7.81 55 G 8.67 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 56 M 8.35 4.40 0.00 1.93 1.97 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.55 0.00 57 L 7.97 4.70 0.00 1.60 1.55 1.02 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 3.98 0.00 2.13 1.99 0.00 3.59 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.88 0.00 59 F 8.10 5.12 0.00 3.30 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 60 S 8.61 4.73 0.00 3.92 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 61 T 8.69 5.12 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 1.43 0.00 0.00 62 D 8.29 4.63 0.00 3.06 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 63 W 8.14 4.27 0.00 3.20 2.56 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 64 F 8.08 4.56 0.00 3.27 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 65 M 8.76 4.40 0.00 2.08 2.46 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.67 0.00 66 T 8.27 4.11 4.58 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 1.55 0.00 0.00 67 W 8.31 4.32 0.00 3.66 3.29 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 68 E 8.25 3.37 0.00 1.53 1.90 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 2.17 1.96 0.00 69 Q 8.11 4.04 0.00 2.36 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.70 0.00 0.00 0.00 0.00 0.00 2.58 2.50 0.00 70 N 8.40 4.71 0.00 3.16 3.14 0.00 0.00 6.92 7.20 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 71 V 7.69 3.91 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 1.07 0.00 0.00 1.07 0.00 0.00 72 H 8.25 4.23 0.00 3.35 3.38 0.00 5.71 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 73 A 8.14 4.04 1.59 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 0.00 0.00 74 S 8.31 4.12 0.00 4.11 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 75 M 8.16 3.95 0.00 2.51 2.12 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.73 0.00 76 F 8.49 4.10 0.00 2.91 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 77 C 8.75 4.10 0.00 3.20 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 78 N 8.26 4.22 0.00 2.88 2.82 0.00 0.00 6.99 6.89 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 79 A 7.75 3.98 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 80 W 7.92 4.08 0.00 2.63 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 81 Q 8.47 3.23 0.00 2.08 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.51 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 82 F 8.23 3.92 0.00 3.13 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.23 3.94 0.00 1.87 1.75 1.08 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.79 3.93 0.00 1.42 1.43 0.13 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 85 K 7.67 3.63 0.00 1.46 1.68 0.00 1.62 0.00 0.00 1.52 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.50 1.50 7.81 86 T 7.45 3.72 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 1.11 0.00 0.00 87 G 8.02 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 0.00 0.00 0.00 88 L 7.60 4.66 0.00 1.54 1.62 0.86 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 89 C 7.68 4.67 0.00 3.05 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 90 N 8.30 3.76 0.00 2.74 2.77 0.00 0.00 6.97 7.65 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 91 G 7.52 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 0.00 0.00 0.00 92 V 7.54 3.68 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 1.05 0.00 0.00 1.08 0.00 0.00 93 D 8.17 4.36 0.00 2.79 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 94 A 8.00 4.08 1.54 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 0.00 0.00 95 V 8.25 3.73 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 1.23 0.00 0.00 1.06 0.00 0.00 96 I 7.92 3.87 2.09 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 1.56 0.93 1.06 0.00 0.00 97 K 8.49 4.02 0.00 1.97 1.96 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.53 1.54 7.81 98 A 8.61 4.04 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 99 Y 8.79 4.47 0.00 3.41 3.33 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 0.00 100 R 8.66 3.96 0.00 2.14 2.01 0.00 3.39 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.93 0.00 101 L 8.01 4.02 0.00 1.96 1.73 0.96 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 8.34 4.09 0.00 3.25 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 0.00 103 L 7.37 3.38 0.00 1.68 1.52 0.95 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 104 E 7.62 4.00 0.00 2.00 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 2.50 0.00 105 Q 7.80 3.98 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 106 C 7.53 3.97 0.00 1.92 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 0.00 0.00 0.00 0.00 107 P 0.00 4.25 0.00 2.07 2.04 0.00 3.67 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 2.00 2.05 0.00 108 Q 7.19 3.13 0.00 2.14 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.62 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 109 A 7.64 4.81 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 0.00 110 E 8.57 4.17 0.00 2.03 1.91 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 2.41 2.29 0.00 111 E 9.53 3.73 0.00 2.16 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 2.23 2.32 0.00 112 G 7.65 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 0.00 0.00 0.00 113 P 0.00 4.50 0.00 2.46 2.11 0.00 3.89 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.14 0.00 114 L 8.91 3.97 0.00 1.59 1.69 0.75 1.01 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 0.00 115 L 8.14 4.17 0.00 1.49 1.16 0.14 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.17 4.36 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 0.00 117 L 8.13 2.51 0.00 1.15 1.30 0.75 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 118 T 7.74 3.77 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 1.32 0.00 0.00 119 R 7.63 3.66 0.00 1.52 1.45 0.00 2.54 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.50 0.00 120 A 7.43 3.41 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 W 7.96 3.90 0.00 3.19 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 0.00 122 T 7.57 2.91 4.22 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 0.37 0.00 0.00 123 L 7.51 3.16 0.00 1.14 1.52 0.80 -0.22 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 0.00 124 V 7.06 2.68 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 0.57 0.00 0.00 0.03 0.00 0.00 125 R 7.16 3.61 0.00 1.56 1.66 0.00 2.21 0.00 0.00 2.63 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.50 0.00 126 F 8.00 4.27 0.00 2.75 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 0.00 127 V 7.88 4.17 2.41 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 1.32 0.00 0.00 1.03 0.00 0.00 128 E 8.40 4.29 0.00 2.26 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 2.49 2.70 0.00 129 S 8.35 4.72 0.00 4.02 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 0.00 130 G 8.35 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 0.00 0.00 0.00 0.00 131 L 7.26 4.20 0.00 1.30 1.41 0.56 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 132 L 8.56 3.88 0.00 1.94 1.65 0.98 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 133 Q 8.63 4.47 0.00 1.99 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.87 0.00 0.00 0.00 0.00 0.00 2.20 2.41 0.00 134 L 8.40 5.12 0.00 1.57 1.59 0.90 0.80 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 0.00 135 S 8.97 4.76 0.00 3.45 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 S 8.84 4.97 0.00 3.85 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 0.00 137 C 8.86 4.32 0.00 2.95 3.21 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 0.00 0.00 0.00 138 N 9.07 4.50 0.00 2.76 2.90 0.00 0.00 6.92 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 0.00 139 C 7.85 4.01 0.00 2.89 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 0.00 140 C 8.57 4.37 0.00 3.21 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 0.00 141 G 8.82 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 0.00 0.00 0.00 142 G 7.78 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 0.00 0.00 0.00 143 N 8.33 5.43 0.00 2.68 2.74 0.00 0.00 6.72 7.45 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 0.00 144 F 9.14 5.10 0.00 3.71 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 0.00 145 I 8.70 4.45 2.01 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 1.17 0.30 1.02 0.00 0.00 146 T 8.91 4.59 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 0.48 0.00 0.00 147 H 8.61 4.79 0.00 3.07 3.25 0.00 5.72 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 0.00 148 A 8.67 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 H 8.68 3.84 0.00 3.33 3.35 0.00 5.65 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 0.00 150 Q 7.68 4.30 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.41 0.00 0.00 0.00 0.00 0.00 2.37 2.09 0.00 151 P 0.00 3.43 0.00 2.25 2.27 0.00 3.77 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 152 V 7.06 4.73 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 0.69 0.00 0.00 0.95 0.00 0.00 153 G 7.35 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 0.00 0.00 0.00 154 S 8.29 4.13 0.00 4.24 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 0.00 155 F 8.01 4.55 0.00 2.99 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 0.00 156 A 7.92 3.35 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 0.00 157 C 7.40 3.08 0.00 1.23 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 0.00 0.00 0.00 0.00 158 S 8.10 4.05 0.00 3.92 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 0.00 159 L 7.76 4.19 0.00 1.69 1.75 1.05 0.83 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 0.00 160 C 7.60 4.30 0.00 2.98 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