NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 V 3.9844 8.0544 120.3257 61.2187 32.8404 175.7479 10 D 4.3505 8.3702 120.6831 53.9777 40.9575 175.3281 11 H 4.2589 8.8262 125.9818 58.6005 28.9846 177.1355 12 T 4.1464 8.4927 111.9044 64.2072 68.7835 176.6310 13 K 4.1747 7.9874 121.6040 58.8389 32.9991 177.5144 14 M 4.4965 6.9136 116.5821 54.6132 32.0867 174.2640 15 N 5.2836 8.4825 115.8818 51.3796 40.7814 172.9602 16 A 4.8462 8.1422 118.7253 50.1235 22.4656 174.3205 17 P 4.7778 0.0000 0.0000 62.5651 32.9378 175.5229 18 A 4.9559 8.3544 121.8607 51.7364 22.6580 176.7013 19 V 4.1171 8.6481 122.6378 63.5295 33.6365 175.0097 20 R 4.7415 8.3391 118.0919 56.2436 33.9673 172.7698 21 I 3.7753 8.5329 128.5316 62.0132 36.8323 175.8979 22 A 4.2318 8.7726 129.9690 54.5046 18.9621 177.4520 23 K 4.3330 7.3154 112.8210 56.0150 35.6893 174.1599 24 T 4.9521 8.4024 121.3251 62.1361 71.9349 173.2141 25 M 4.8646 8.5897 124.8321 53.8935 36.8806 174.3345 26 L 4.9201 8.4224 121.7605 53.5414 43.8326 176.5387 27 T 4.3065 8.5347 111.8571 60.2866 70.0571 173.1782 28 P 4.4094 0.0000 0.0000 65.7591 32.2519 177.6577 29 K 3.9736 8.2409 116.0178 57.6111 31.0154 177.7004 30 G 4.0428 8.6724 112.1408 46.5102 0.0000 173.0104 31 D 4.6211 7.9579 118.9840 54.7057 42.4540 175.3436 32 N 5.2478 8.6778 117.0021 51.5960 41.8200 173.7856 33 I 4.9136 8.4125 123.8669 60.1170 39.8206 174.5659 34 T 4.4869 8.6778 124.5476 61.7988 71.0201 174.1962 35 V 4.8452 8.2598 124.7734 61.1623 34.5437 174.0354 36 F 5.2201 9.3195 126.8512 56.0404 41.0843 174.7933 37 D 4.7597 9.1868 123.8705 52.7005 40.5904 175.8512 38 L 4.3379 8.3427 130.4278 53.5237 40.0898 177.2832 39 R 4.5388 8.0984 119.9698 56.0966 30.6094 177.9435 40 F 4.3439 9.7351 125.6788 60.7300 39.2432 175.8203 41 C 5.6467 8.0740 113.2662 57.5100 31.0067 173.1902 42 I 4.0856 8.3733 121.0101 59.9386 37.8557 173.2124 43 P 4.2566 0.0000 0.0000 64.1848 30.8968 176.3360 44 N 4.5896 8.9535 119.8446 53.2520 36.4631 175.5757 45 K 4.2661 8.6054 117.9786 57.3286 33.1851 175.9099 46 E 4.8259 7.5902 114.5677 54.6733 32.8424 173.4952 47 I 4.6518 7.6705 116.2980 59.8909 40.6362 173.8933 48 L 4.4351 8.9356 129.1477 54.5481 42.6975 176.6520 49 S 4.4528 8.4554 116.7354 57.1005 64.1236 173.3042 50 P 4.2990 0.0000 0.0000 65.5338 30.9060 178.9811 51 K 4.0210 7.9364 116.6908 59.1184 32.3266 178.8993 52 G 3.7760 9.0189 106.9785 48.2833 0.0000 175.2194 53 I 3.6563 8.3329 121.9303 63.6611 37.2780 177.5037 54 H 4.2582 7.6308 119.1083 59.6577 29.6199 177.3308 55 T 3.7740 8.1598 117.8248 66.3417 68.1497 176.3287 56 L 3.9304 8.3542 122.5996 58.1735 42.1059 178.3170 57 E 4.3163 8.5762 119.4734 60.0896 29.6986 178.3680 58 H 4.1477 8.0167 114.7752 59.3023 28.8425 177.7047 59 L 3.8706 7.6267 119.8248 58.2469 41.4335 178.4944 60 F 4.3643 8.8559 119.9157 62.5408 38.5841 176.9802 61 A 3.3635 8.5054 120.3010 54.7245 18.1607 179.8391 62 G 3.4044 7.3968 102.7991 47.0842 0.0000 175.2107 63 F 4.9338 7.8201 119.2615 59.7911 39.8754 178.1761 64 M 4.3185 8.8998 119.3346 58.1407 31.4162 178.6107 65 R 4.0479 7.4700 115.7641 57.9586 30.2514 177.9516 66 D 4.5516 8.1783 118.8493 56.9361 41.4819 177.9385 67 H 4.4964 7.9453 114.4907 56.5660 29.7446 175.8471 68 L 3.7763 9.0268 122.3992 56.9748 40.5558 177.9925 69 N 4.0984 8.0387 114.0167 54.3478 39.5352 172.3518 70 G 3.7896 8.6650 113.1967 46.0703 0.0000 172.6587 71 D 4.8799 9.3131 122.6103 53.7192 43.3568 176.0240 72 S 4.7181 8.1210 112.2707 57.6911 64.7107 173.3413 73 I 4.8604 7.6323 120.5118 59.3697 40.1528 174.4738 74 E 4.8016 9.6762 126.4533 54.5439 33.0281 174.2263 75 I 4.4944 9.3210 128.1981 60.4893 37.8558 175.4882 76 I 4.0387 8.3601 130.1838 62.8399 36.6696 175.2697 77 D 4.7516 7.6577 119.3367 53.3133 45.0713 173.4841 78 I 5.1261 8.3862 123.9852 59.6525 39.9192 174.9585 79 S 5.0501 9.0736 120.7211 55.9084 66.7759 171.9113 80 P 3.4596 0.0000 0.0000 62.4524 32.0554 175.9946 81 M 4.2858 8.2941 121.0577 54.5899 32.8362 178.0974 82 G 3.5724 8.6328 110.8598 48.8967 0.0000 174.5914 83 C 4.2338 8.0174 111.8319 58.3348 30.2727 173.2259 84 R 3.6534 7.6518 120.0294 58.1498 27.5510 176.7462 85 T 4.6309 7.8799 102.5106 61.0595 69.6870 172.9767 86 G 4.0272 7.5511 107.0428 44.6544 0.0000 173.0719 87 F 5.1359 8.7078 117.7296 55.9534 42.2200 174.9067 88 Y 5.3001 8.6344 118.6680 57.3221 40.1207 174.8860 89 M 4.9515 9.5842 123.1999 53.8077 34.8314 173.9646 90 S 5.1327 8.6945 122.0387 57.9370 65.0217 173.3074 91 L 4.7236 9.2643 122.0448 54.5751 44.5627 175.1601 92 I 4.4582 10.1571 122.9686 63.2663 37.3277 174.3028 93 G 3.9387 7.7362 120.2210 45.4199 0.0000 173.2608 94 T 4.9631 7.9990 108.3035 61.0717 68.1876 170.9072 95 P 4.5262 0.0000 0.0000 63.0982 32.6240 175.3377 96 N 5.1094 8.3060 116.0525 51.0535 40.9459 175.1183 97 E 4.1432 8.8046 119.2233 59.6731 29.3334 179.5892 98 Q 3.9229 8.1363 119.0220 59.0623 29.1709 177.8608 99 K 3.8979 8.2768 120.7071 59.4585 32.1397 178.9113 100 V 3.3587 7.6260 117.9749 65.9985 31.0064 177.4567 101 S 4.3061 7.8204 112.4475 61.9940 62.2745 175.8545 102 E 4.0942 8.3672 120.5380 59.8105 29.3350 179.5817 103 A 4.0649 7.8068 120.4232 54.5246 18.3423 179.6369 104 W 4.3025 8.7752 127.4976 60.7794 30.7108 178.0041 105 L 3.7566 8.9066 119.2803 58.1503 41.6224 178.4595 106 A 3.9368 7.9547 120.2399 55.0355 18.3230 179.5196 107 S 4.0059 7.9267 112.4788 62.2874 63.1597 177.2223 108 M 4.2467 8.0179 120.6698 58.7341 31.4436 178.9376 109 Q 3.9777 8.1750 117.6695 58.9208 28.8664 178.1923 110 D 4.0461 7.5638 119.6219 56.7620 40.4163 178.7956 111 V 3.9106 7.9058 118.4252 66.1603 31.9535 177.5118 112 L 3.9632 7.9230 118.7823 57.6929 41.1105 179.2623 113 G 3.6798 7.3872 104.7438 45.7364 0.0000 174.0123 114 V 4.3578 7.5420 120.5686 60.3363 31.7503 175.1223 115 Q 4.2412 8.5892 125.7017 58.1323 29.2306 176.1064 116 D 4.7950 7.6609 115.1625 51.6199 42.6768 175.9062 117 Q 3.9311 8.7747 118.1330 59.1462 28.7099 178.4936 118 A 4.3121 9.6413 118.7232 53.2330 18.4136 177.9676 119 S 4.3880 7.9015 112.1982 59.5590 63.6238 174.5751 120 I 4.0824 7.3641 121.1218 59.6253 36.2894 173.8423 121 P 4.3606 0.0000 0.0000 65.5119 30.9504 177.7211 122 E 3.7742 8.2422 115.5627 58.3895 30.0701 178.3407 123 L 3.9053 6.4776 121.6569 53.8562 38.0778 174.9048 124 N 4.4078 8.2687 115.2507 51.2705 40.7496 176.6343 125 I 3.4168 7.5305 113.2243 64.3383 37.4106 177.1423 126 Y 4.5539 7.2078 116.9982 59.7979 37.9868 176.2155 127 Q 4.5416 8.5557 116.2841 55.0873 31.2165 174.7841 128 C 4.7596 8.7389 119.1016 57.4951 33.1697 173.5498 129 G 4.2753 8.7114 117.0307 48.5070 0.0000 174.4667 130 S 4.6079 7.6938 118.9515 55.0093 63.4970 173.5354 131 Y 4.3652 8.4055 125.0671 60.3953 38.8094 177.3160 132 T 3.9802 7.7379 106.2826 61.1116 69.6516 174.6405 133 E 4.5256 7.8216 123.0039 56.0109 28.8556 175.5824 134 H 4.8696 7.5601 115.1396 53.7756 32.7254 175.0550 135 S 4.4298 9.2893 117.8797 55.2175 63.1814 173.7589 136 L 3.9191 8.6171 130.5105 57.7928 41.9897 178.4387 137 E 3.9605 8.0259 118.0149 59.6134 29.5642 178.8848 138 D 4.3987 7.8380 117.9039 57.1360 40.6746 178.4001 139 A 4.2199 8.1774 120.5368 54.3489 18.3075 179.0343 140 H 4.4181 7.8729 115.0092 58.1414 29.1511 176.9852 141 E 3.9400 8.0645 120.8742 59.5114 29.3844 178.7948 142 I 3.7831 7.6800 118.8212 64.5075 37.1677 177.7632 143 A 4.0235 7.5743 120.9322 55.5381 18.0861 179.6117 144 K 3.8103 8.3374 116.7188 59.9203 32.0347 178.6561 145 N 4.2326 8.8124 117.4596 56.6775 38.7690 176.6076 146 V 3.6974 8.3001 119.5636 66.3181 31.4250 178.0698 147 I 3.5015 8.2156 118.4384 64.3595 37.0204 178.1007 148 A 4.0655 7.9049 120.4539 55.3856 18.4005 179.7596 149 R 3.9335 8.6524 116.2646 56.3427 30.5650 177.5867 150 G 3.8359 7.7938 106.1244 45.9384 0.0000 173.6185 151 I 4.0294 7.5949 123.3656 59.2857 36.8964 176.9918 152 G 4.0985 8.2533 123.8169 46.1148 0.0000 170.5716 153 V 4.8177 8.3320 122.9761 61.3175 35.1460 175.6095 154 N 4.9677 9.2606 121.8072 51.7042 41.8210 174.0355 155 K 4.4639 8.6318 123.2610 54.5451 34.0785 176.7774 156 N 4.5245 8.6714 117.6361 53.8662 38.4040 175.1287 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 9 V 8.05 3.98 2.12 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 0.91 0.00 0.00 0.95 0.00 0.00 10 D 8.37 4.35 0.00 2.88 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 11 H 8.83 4.26 0.00 3.27 3.40 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 8.49 4.15 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 13 K 7.99 4.17 0.00 1.97 2.00 0.00 1.62 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.65 1.41 7.81 14 M 6.91 4.50 0.00 2.19 2.13 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 2.61 2.69 0.00 15 N 8.48 5.28 0.00 2.71 2.82 0.00 0.00 5.78 7.26 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 16 A 8.14 4.85 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 17 P 0.00 4.78 0.00 1.60 1.66 0.00 3.65 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 18 A 8.35 4.96 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 V 8.65 4.12 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 1.30 0.00 0.00 20 R 8.34 4.74 0.00 2.24 1.85 0.00 3.27 0.00 0.00 3.33 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.47 0.00 21 I 8.53 3.78 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.09 0.79 0.00 0.00 22 A 8.77 4.23 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 23 K 7.32 4.33 0.00 1.71 1.48 0.00 1.57 0.00 0.00 1.75 0.00 0.00 2.77 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.28 1.35 7.81 24 T 8.40 4.95 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 1.18 0.00 0.00 25 M 8.59 4.86 0.00 1.85 1.86 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 2.46 2.47 0.00 26 L 8.42 4.92 0.00 1.51 1.57 1.00 1.01 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 27 T 8.53 4.31 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 1.25 0.00 0.00 28 P 0.00 4.41 0.00 2.05 2.17 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 29 K 8.24 3.97 0.00 1.74 1.61 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.43 7.81 30 G 8.67 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 0.00 0.00 0.00 31 D 7.96 4.62 0.00 2.69 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.68 5.25 0.00 2.74 2.68 0.00 0.00 6.64 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 33 I 8.41 4.91 1.86 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 1.22 0.68 0.89 0.00 0.00 34 T 8.68 4.49 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 0.76 0.00 0.00 35 V 8.26 4.85 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 0.86 0.00 0.00 0.89 0.00 0.00 36 F 9.32 5.22 0.00 3.01 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 37 D 9.19 4.76 0.00 3.11 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.34 4.34 0.00 1.78 0.74 0.84 0.68 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 39 R 8.10 4.54 0.00 2.14 2.14 0.00 3.24 0.00 0.00 3.59 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 40 F 9.74 4.34 0.00 2.99 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 41 C 8.07 5.65 0.00 2.91 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 42 I 8.37 4.09 1.90 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 1.60 1.16 0.94 0.00 0.00 43 P 0.00 4.26 0.00 2.27 2.21 0.00 3.77 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.19 0.00 44 N 8.95 4.59 0.00 2.93 3.05 0.00 0.00 7.13 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.61 4.27 0.00 1.86 1.87 0.00 1.54 0.00 0.00 1.77 0.00 0.00 3.14 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.42 7.81 46 E 7.59 4.83 0.00 2.12 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 0.00 2.27 2.35 0.00 47 I 7.67 4.65 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.55 0.90 0.00 0.00 48 L 8.94 4.44 0.00 1.72 1.49 0.95 0.65 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 49 S 8.46 4.45 0.00 3.88 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 50 P 0.00 4.30 0.00 2.13 2.11 0.00 3.55 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 2.08 2.15 0.00 51 K 7.94 4.02 0.00 1.77 1.82 0.00 1.65 0.00 0.00 1.90 0.00 0.00 2.91 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.60 1.76 7.81 52 G 9.02 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 53 I 8.33 3.66 1.87 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.35 0.84 0.00 0.00 54 H 7.63 4.26 0.00 3.31 3.42 0.00 5.67 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 55 T 8.16 3.77 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 1.16 0.00 0.00 56 L 8.35 3.93 0.00 1.85 1.92 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.58 4.32 0.00 2.57 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 0.00 2.58 2.76 0.00 58 H 8.02 4.15 0.00 3.50 3.49 0.00 5.69 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 59 L 7.63 3.87 0.00 2.06 1.95 1.06 0.97 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 60 F 8.86 4.36 0.00 2.96 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 61 A 8.51 3.36 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 62 G 7.40 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 63 F 7.82 4.93 0.00 3.37 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 64 M 8.90 4.32 0.00 1.59 1.71 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 2.24 0.00 65 R 7.47 4.05 0.00 1.82 1.96 0.00 3.19 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 66 D 8.18 4.55 0.00 2.76 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 H 7.95 4.50 0.00 3.15 3.35 0.00 5.69 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 9.03 3.78 0.00 1.65 1.48 0.87 0.29 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 69 N 8.04 4.10 0.00 2.69 2.83 0.00 0.00 6.80 7.98 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 70 G 8.67 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 D 9.31 4.88 0.00 2.63 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 72 S 8.12 4.72 0.00 3.81 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 73 I 7.63 4.86 1.88 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 1.25 0.63 1.00 0.00 0.00 74 E 9.68 4.80 0.00 1.93 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 0.00 2.19 2.26 0.00 75 I 9.32 4.49 1.95 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.68 0.92 0.00 0.00 76 I 8.36 4.04 1.89 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 1.12 0.48 0.92 0.00 0.00 77 D 7.66 4.75 0.00 2.79 2.48 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 78 I 8.39 5.13 1.94 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.74 1.05 0.00 0.00 79 S 9.07 5.05 0.00 3.90 4.08 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 80 P 0.00 3.46 0.00 1.55 0.89 0.00 3.68 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 1.74 1.73 0.00 81 M 8.29 4.29 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.01 0.00 82 G 8.63 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 83 C 8.02 4.23 0.00 3.08 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 R 7.65 3.65 0.00 1.99 1.86 0.00 2.97 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.54 0.00 85 T 7.88 4.63 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 1.27 0.00 0.00 86 G 7.55 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 87 F 8.71 5.14 0.00 2.97 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 88 Y 8.63 5.30 0.00 3.05 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 89 M 9.58 4.95 0.00 2.15 2.00 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 2.39 2.63 0.00 90 S 8.69 5.13 0.00 3.94 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 91 L 9.26 4.72 0.00 1.96 1.78 1.18 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 92 I 10.16 4.46 1.97 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 1.17 0.94 0.96 0.00 0.00 93 G 7.74 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 94 T 8.00 4.96 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 95 P 0.00 4.53 0.00 2.29 2.13 0.00 4.07 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 2.17 2.01 0.00 96 N 8.31 5.11 0.00 3.07 3.05 0.00 0.00 5.92 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 97 E 8.80 4.14 0.00 2.16 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 2.51 2.63 0.00 98 Q 8.14 3.92 0.00 2.13 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 99 K 8.28 3.90 0.00 2.08 1.91 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.46 7.81 100 V 7.63 3.36 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 0.72 0.00 0.00 -0.30 0.00 0.00 101 S 7.82 4.31 0.00 3.93 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 0.00 102 E 8.37 4.09 0.00 2.05 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 0.00 2.31 2.58 0.00 103 A 7.81 4.06 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 0.00 104 W 8.78 4.30 0.00 3.38 3.27 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 0.00 105 L 8.91 3.76 0.00 1.46 1.59 0.75 0.97 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 0.00 106 A 7.95 3.94 1.02 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 0.00 0.00 107 S 7.93 4.01 0.00 4.39 4.32 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 0.00 108 M 8.02 4.25 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 3.12 0.00 109 Q 8.18 3.98 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.98 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 110 D 7.56 4.05 0.00 1.86 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 0.00 111 V 7.91 3.91 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 1.03 0.00 0.00 1.30 0.00 0.00 112 L 7.92 3.96 0.00 2.00 1.66 0.87 0.84 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 0.00 113 G 7.39 3.68 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 0.00 0.00 0.00 114 V 7.54 4.36 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.22 0.00 0.00 115 Q 8.59 4.24 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 116 D 7.66 4.79 0.00 2.86 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 0.00 117 Q 8.77 3.93 0.00 2.18 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.05 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 118 A 9.64 4.31 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 0.00 119 S 7.90 4.39 0.00 4.10 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 0.00 120 I 7.36 4.08 1.84 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 1.30 0.56 0.97 0.00 0.00 121 P 0.00 4.36 0.00 2.01 2.11 0.00 3.66 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 122 E 8.24 3.77 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.22 0.00 123 L 6.48 3.91 0.00 1.84 1.90 0.69 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 124 N 8.27 4.41 0.00 2.57 2.80 0.00 0.00 6.75 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 0.00 125 I 7.53 3.42 1.62 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 0.04 0.52 0.00 0.00 126 Y 7.21 4.55 0.00 2.99 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 Q 8.56 4.54 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 128 C 8.74 4.76 0.00 3.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.71 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 0.00 0.00 0.00 0.00 130 S 7.69 4.61 0.00 3.82 3.74 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 0.00 131 Y 8.41 4.37 0.00 2.81 3.04 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 0.00 132 T 7.74 3.98 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 0.89 0.00 0.00 133 E 7.82 4.53 0.00 1.85 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 2.17 2.26 0.00 134 H 7.56 4.87 0.00 3.04 3.05 0.00 5.70 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 0.00 135 S 9.29 4.43 0.00 3.75 3.66 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 0.00 136 L 8.62 3.92 0.00 1.82 1.61 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 137 E 8.03 3.96 0.00 2.09 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 2.40 2.46 0.00 138 D 7.84 4.40 0.00 2.91 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 0.00 139 A 8.18 4.22 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 0.00 140 H 7.87 4.42 0.00 3.40 3.34 0.00 5.66 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 E 8.06 3.94 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 142 I 7.68 3.78 2.00 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 1.48 0.63 1.19 0.00 0.00 143 A 7.57 4.02 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.34 3.81 0.00 1.92 1.88 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.58 7.81 145 N 8.81 4.23 0.00 2.90 2.96 0.00 0.00 6.88 8.23 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 0.00 146 V 8.30 3.70 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 0.36 0.00 0.00 0.88 0.00 0.00 147 I 8.22 3.50 1.82 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 1.37 0.73 0.84 0.00 0.00 148 A 7.90 4.07 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 0.00 149 R 8.65 3.93 0.00 1.68 1.92 0.00 3.24 0.00 0.00 3.18 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 150 G 7.79 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 0.00 0.00 0.00 151 I 7.59 4.03 1.50 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 -0.07 0.56 0.00 0.00 152 G 8.25 4.10 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 0.00 0.00 0.00 153 V 8.33 4.82 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 0.91 0.00 0.00 0.96 0.00 0.00 154 N 9.26 4.97 0.00 2.69 2.73 0.00 0.00 7.18 8.25 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 0.00 155 K 8.63 4.46 0.00 1.76 1.75 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.48 7.81 156 N 8.67 4.52 0.00 2.72 2.75 0.00 0.00 6.81 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