NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.4959 8.1927 119.0112 58.8140 64.6553 171.8943 1 M 5.3041 8.5706 124.8902 50.8568 34.2383 173.0432 2 K 4.4275 9.3897 129.3414 56.0652 34.8157 174.7832 3 T 5.0372 8.3678 121.2855 61.8126 71.6085 173.3189 4 I 4.3726 9.2275 128.0871 59.5378 39.2698 174.8178 5 K 4.9314 8.6238 127.3539 55.6989 33.1485 176.8510 6 V 4.5159 8.8490 117.6778 59.1448 35.5061 177.0301 7 K 3.9297 8.8036 122.9802 59.3943 32.3976 176.3462 8 N 4.7247 7.4636 114.2252 50.8755 40.8496 174.7610 9 K 2.4800 8.1281 120.0206 59.2334 31.9999 178.6086 10 T 4.1252 7.6737 119.3225 66.7606 68.4594 176.8533 11 E 4.0817 8.8882 120.6556 61.1289 29.6604 181.2476 12 G 3.9967 8.1976 106.9566 47.7924 0.0000 176.0935 13 S 4.2452 8.3371 117.7935 61.2835 62.8023 176.9567 14 K 4.5649 7.9797 122.7359 58.8412 31.7862 179.5118 15 V 3.6374 8.0589 118.3854 66.0007 31.4240 177.7956 16 A 4.0443 8.3526 120.6761 55.1963 18.1280 179.2895 17 F 4.0790 8.5416 119.1077 61.6764 39.5116 177.5426 18 R 3.8847 8.3249 117.5815 59.5614 29.8542 179.0554 19 M 4.0693 8.2632 118.5592 58.0534 31.9651 178.4498 20 L 3.9332 8.2336 120.9497 58.2331 42.2367 178.5614 21 E 3.7983 7.9806 119.3871 59.2965 29.4892 178.4157 22 E 4.3277 8.1070 120.5628 58.8814 29.6270 178.6321 23 E 4.0824 8.3759 118.6547 59.4417 29.5301 179.3896 24 I 3.7801 7.9661 120.0917 64.6605 37.1894 178.5524 25 T 3.8913 8.2602 110.7432 64.4941 68.1904 175.3789 26 F 4.5163 8.0220 117.9876 56.9828 39.1800 176.0984 27 G 4.0606 8.0550 105.7949 45.0021 0.0000 174.6467 28 A 4.1661 8.2390 123.6711 52.6510 18.8853 177.7275 29 K 4.7249 9.6567 120.0404 56.0667 35.7166 176.0900 30 T 5.0632 8.2128 116.4264 61.6390 71.9885 172.7193 31 L 5.0959 9.0615 127.1121 52.8960 44.6765 175.7020 32 G 4.2913 9.0693 111.1762 44.3708 0.0000 172.8889 33 L 5.3375 8.6784 124.1734 52.8923 44.8693 175.4009 34 A 4.8782 8.9917 121.8187 50.6981 22.0658 176.0856 35 T 4.5781 7.8717 109.2715 60.3260 71.3519 173.6692 36 G 3.7883 7.8291 110.2015 45.1243 0.0000 173.0997 37 S 4.4226 8.4074 111.4584 60.9552 63.7565 176.3742 38 T 3.9663 8.2420 117.6526 66.2229 68.1978 172.9229 39 P 4.4895 0.0000 0.0000 62.7045 32.0181 177.4202 40 L 3.9729 7.9903 121.4697 58.4128 41.3155 179.2014 41 E 4.0217 8.0563 117.9501 58.8580 29.4563 178.8202 42 L 4.0315 7.8271 120.1081 58.5565 42.1511 178.5338 43 Y 4.5682 8.1170 116.8586 61.0091 37.8936 178.4572 44 K 3.9232 8.2250 120.6318 59.5921 32.3096 178.4273 45 E 3.7939 8.3185 119.4951 59.2195 29.4876 178.9121 46 I 4.0115 8.0807 119.9432 64.5763 37.0334 178.4559 47 R 3.9969 8.2244 118.1219 59.1182 30.0065 178.0288 48 E 4.3480 7.8273 114.9225 56.1291 30.0109 176.2785 49 S 4.5565 7.6379 115.0182 57.2317 65.1436 173.5151 50 H 4.7255 8.3248 113.6785 55.3095 28.5697 175.3935 51 L 3.9366 7.6572 120.4639 55.1687 41.8304 176.3923 52 D 4.2936 7.9184 119.9988 52.8795 43.1061 174.7085 53 F 4.8270 8.0777 124.9067 57.3120 38.9687 178.1279 54 S 4.1366 8.4109 117.6021 60.4643 62.8034 174.5399 55 D 4.8950 8.0675 118.9561 53.9434 41.4394 174.6842 56 M 5.1300 8.1121 116.7309 53.1544 36.0395 174.5928 57 V 4.9501 8.7377 120.5303 61.1776 34.3041 174.5573 58 S 4.9950 8.1963 121.1069 56.4568 66.2074 172.9376 59 I 4.9429 8.4600 121.6700 59.9598 40.6120 174.6979 60 N 5.0817 9.1474 124.7234 52.1268 40.0784 175.4830 61 L 4.3366 8.3929 120.2832 57.6032 42.9052 176.7637 62 D 5.2752 7.6759 115.3682 52.9404 45.2375 174.5745 63 E 4.9457 8.9720 120.4142 54.7883 33.6636 173.9533 64 Y 4.7339 8.4763 122.6819 57.7375 39.3464 175.5093 65 V 3.8344 8.5773 124.8574 64.1631 32.0144 176.3333 66 G 4.0271 9.2001 116.3605 44.9664 0.0000 173.0142 67 L 4.7218 7.4402 119.3808 52.6449 43.9727 176.5653 68 S 4.4534 8.4068 117.1089 57.4943 64.0254 175.0142 69 A 4.1700 8.4966 123.6124 55.2037 18.2080 178.6685 70 D 4.6437 7.6974 113.8950 55.9021 41.4997 176.5844 71 D 4.3549 7.7941 120.1734 53.8579 41.5615 177.1976 72 K 2.7166 8.2248 125.3322 58.3417 32.1299 177.6255 73 Q 4.1443 8.2720 117.0402 56.0044 29.3080 176.7399 74 S 4.6678 7.9416 114.7023 58.2373 65.3074 174.7493 75 Y 4.4506 9.4389 121.0843 60.8956 37.5696 178.3618 76 A 4.1641 8.6979 122.1945 55.5734 18.4203 179.1070 77 Y 3.9881 8.4467 117.9926 60.6426 38.9117 177.5141 78 F 4.0707 8.5172 121.7418 61.9273 39.3959 177.1642 79 M 3.6546 8.4865 118.2328 57.7215 31.5775 178.6660 80 K 3.8478 7.9130 119.8611 59.6867 32.1952 178.9448 81 Q 3.7204 7.5342 116.9581 58.6395 28.6764 177.8799 82 N 4.4796 7.5240 115.2197 54.0579 39.0722 175.2052 83 L 4.6092 6.9874 119.9943 56.5049 46.9671 177.7954 84 F 4.8327 8.0272 116.1433 60.3139 39.1979 176.8846 85 A 4.1218 8.2117 123.0631 55.0665 18.3413 178.5204 86 A 4.2832 8.0028 117.0860 54.2416 19.1451 177.7620 87 K 4.5722 8.2486 115.0519 53.6780 32.6393 173.9192 88 P 4.6335 0.0000 0.0000 62.6762 32.5224 176.7355 89 F 4.6834 8.5280 120.1267 56.2603 40.2532 175.7123 90 K 4.0532 8.5401 122.3266 59.4915 32.5011 177.0782 91 K 4.4173 7.7870 119.4739 54.8712 35.8454 174.5722 92 S 4.7776 8.0526 122.1898 55.8556 65.3878 172.7888 93 Y 4.8503 8.9849 123.0451 56.4774 39.9996 174.9647 94 L 5.5910 8.5230 121.4950 51.2588 46.1444 174.6530 95 P 4.2854 0.0000 0.0000 62.7369 31.9789 176.4917 96 N 4.6441 9.5643 121.1479 52.3223 38.0177 176.0932 97 G 3.7955 8.5478 115.5524 47.4474 0.0000 173.1268 98 L 4.4104 8.0306 118.1496 54.2257 41.7247 176.5862 99 A 4.0065 7.7478 122.4549 52.4126 18.7017 178.5602 100 A 4.0135 8.6453 125.2709 54.1742 19.0337 177.3928 101 D 4.7259 7.7404 114.4656 51.9441 43.5227 175.9598 102 L 4.0495 8.4877 128.1624 57.5960 41.7179 179.2969 103 A 4.0499 8.0796 120.5840 55.0376 18.3372 179.6478 104 K 4.0211 8.4375 117.1468 59.4851 32.0708 179.2523 105 E 4.1016 8.1749 119.9614 59.3583 29.5833 178.9283 106 T 3.9978 8.1963 110.0920 64.7000 68.8104 176.2616 107 E 3.9414 8.2999 122.1744 59.0979 29.6599 177.8776 108 Y 4.1224 8.4631 120.0672 61.1473 38.6893 177.7684 109 Y 3.7071 8.3958 120.1649 60.6917 38.9050 177.3914 110 D 4.3533 8.2291 119.8725 57.7183 40.8648 178.9942 111 Q 3.9420 7.9193 118.3008 58.6017 28.6133 178.6473 112 I 3.2859 7.2381 121.1662 64.1500 37.0185 178.4016 113 L 3.8400 7.6532 119.5605 57.6075 41.1516 179.4714 114 A 4.0068 7.6072 120.0306 55.0854 18.3566 179.1897 115 Q 3.8168 7.8327 117.4290 57.8581 30.4457 175.9576 116 Y 4.7033 7.6512 116.2953 54.8131 38.0968 173.0484 117 P 4.4336 0.0000 0.0000 62.1178 32.6494 176.5192 118 I 3.9648 8.2206 123.4641 61.6453 37.6340 176.5539 119 D 4.4515 9.3551 127.5490 56.4426 42.4518 176.4509 120 L 4.9997 7.7298 120.0870 53.4317 45.3455 174.5714 121 Q 5.0340 9.1528 128.3904 54.5797 30.9971 174.1417 122 I 4.5719 8.8029 128.2945 60.5052 38.3430 175.1488 123 L 4.6696 9.0479 127.9507 53.5116 46.0401 175.3802 124 G 4.3458 8.4846 111.2788 45.2003 0.0000 171.9305 125 I 4.7022 7.9154 118.4376 58.7334 40.9469 175.2493 126 G 3.5068 8.3790 115.8083 44.5591 0.0000 174.9122 127 R 3.8450 8.5296 119.0388 58.6425 30.1339 177.6016 128 N 4.6687 8.1225 112.6499 52.3943 37.8360 174.9817 129 A 3.7124 8.3273 120.0570 53.3620 16.9121 178.4320 130 H 4.7456 8.1185 113.9163 56.7065 29.3384 174.6457 131 I 4.6211 8.1156 120.9556 60.2684 40.2599 175.3580 132 G 3.4875 8.3829 115.4214 47.3039 0.0000 173.7205 133 F 4.7579 8.7163 123.9695 57.2420 38.9716 175.3116 134 N 4.6926 8.3075 120.6184 52.3902 38.0402 174.9529 135 E 4.4251 8.4299 123.2340 53.9503 31.1602 174.2563 136 P 4.5178 0.0000 0.0000 64.9259 31.5625 177.0719 137 G 3.9656 9.0551 111.4388 45.4013 0.0000 174.1118 138 T 3.8770 7.4455 116.8868 62.9053 69.1503 174.3102 139 A 3.8947 8.3494 128.9795 52.0866 18.9527 178.5499 140 F 4.6353 8.2757 120.9295 60.0375 39.1482 176.4972 141 S 4.4934 8.0160 113.4734 58.6979 63.7474 174.3948 142 S 4.1766 8.0213 118.3277 59.1362 63.4203 173.7885 143 Q 5.4060 8.2126 123.1951 54.5504 32.0020 174.3361 144 T 4.5428 8.5275 119.2299 65.2910 69.1646 173.7782 145 H 4.9346 9.1469 120.3636 54.1806 32.6813 172.0489 146 L 4.6159 8.4642 121.7950 54.7306 42.8343 175.8226 147 V 4.4182 8.6977 126.4468 61.0675 34.3668 173.9335 148 D 4.9499 8.5956 127.6483 53.3988 41.3631 176.4370 149 L 4.1536 8.3937 124.6107 54.6440 42.5469 177.6708 150 T 4.1119 8.4792 112.1434 60.6811 69.7482 173.6369 151 P 4.2482 0.0000 0.0000 66.3033 30.9935 178.9221 152 S 4.1258 8.0633 114.3611 61.6875 62.7864 176.4918 153 T 3.9564 7.8990 118.2157 66.8192 68.2807 176.6341 154 I 3.6788 7.9433 121.3887 64.3381 36.8963 178.3351 155 A 3.9869 8.0480 120.2614 55.0869 18.3709 179.2651 156 A 4.1387 8.2574 119.3489 55.5881 18.5766 179.7398 157 N 4.8499 8.8138 115.2005 56.3839 38.6978 177.7971 158 S 4.3414 8.3385 116.8401 61.5133 62.6458 176.5082 159 R 3.9847 7.5113 118.1049 57.8535 29.7111 177.1849 160 F 4.6947 7.8851 115.9902 56.9043 39.4530 175.3222 161 F 4.8596 7.6618 121.1372 56.2647 41.7465 175.4788 *162 E 2.9986 7.8783 114.2924 55.6646 31.5102 177.9616 *163 K 4.0567 8.5248 117.2798 54.8297 31.0071 178.4457 164 A 4.0025 8.2450 131.3120 55.7965 19.0907 180.8918 165 E 4.0287 8.1230 110.2729 58.6047 29.7983 179.3941 166 D 4.4888 7.5445 114.9095 55.4561 41.3890 176.7289 167 V 2.4072 7.0850 120.3223 60.8339 31.6914 173.9767 168 P 4.1639 0.0000 0.0000 63.1820 31.7756 176.1654 169 K 4.5055 8.4791 119.5048 56.5153 34.1315 175.4929 170 Q 5.0709 7.8361 117.8270 54.1960 33.7728 173.4641 171 A 5.0529 8.6935 121.2383 50.4014 23.4113 174.9393 172 I 4.6719 8.5901 120.7234 59.8779 39.2202 175.1320 173 S 5.1778 8.8270 121.3083 56.3474 65.9428 173.0015 174 M 4.3566 9.1834 127.2792 56.0925 32.5989 177.5873 175 G 4.2926 8.4929 110.9973 42.6172 0.0000 174.5480 176 L 4.0984 8.6740 119.3521 57.6696 41.2510 179.7785 177 A 4.0704 8.0760 120.1305 54.9971 18.6800 179.4569 178 S 4.2559 8.1209 113.2652 62.1128 62.9187 176.9955 179 I 3.7900 7.9736 122.2828 64.6039 36.6415 178.4104 180 M 4.2479 8.0321 118.2842 57.9686 31.8017 178.4936 181 S 4.2276 7.8504 113.8263 59.5386 63.3689 174.5779 182 A 4.3197 7.1218 124.4542 52.4307 18.6549 177.7957 183 K 4.2620 8.7133 121.3889 59.2731 32.9060 177.5879 184 M 5.0525 8.1424 118.7320 53.9262 36.1878 173.9106 185 I 4.8607 8.7532 126.1125 59.3424 40.7780 174.1524 186 L 4.9470 9.0599 129.5872 53.4256 44.0063 174.4935 187 L 4.9469 8.7146 129.9539 53.8044 43.5228 174.7825 188 M 4.9424 8.8596 126.1914 53.4271 34.9924 174.9580 189 A 4.5267 8.0629 124.4491 50.1914 22.5115 174.8608 190 F 5.2909 8.5900 120.6186 56.9778 42.9495 176.0107 191 G 4.5208 9.2905 107.6030 47.0544 0.0000 174.0377 192 E 4.0840 8.8759 120.9800 59.2362 29.5248 179.1689 193 E 4.0823 8.3160 116.7843 58.5265 29.4781 178.0609 194 K 4.4017 8.0118 117.7659 56.3945 32.7178 178.0580 195 A 4.4739 7.7574 123.9354 54.6210 18.2997 179.3752 196 E 3.8602 8.1196 117.1229 59.2878 29.7681 178.6952 197 A 3.9699 7.8965 120.3940 55.1174 18.5152 179.5587 198 V 3.4611 8.0491 116.7554 66.0984 31.5133 178.0810 199 A 3.9710 8.0751 120.2773 55.1359 18.3214 179.5206 200 A 3.9252 8.0751 119.3391 55.3377 18.2214 179.4813 201 M 3.9451 8.1012 116.1638 58.7616 32.3942 178.2508 202 V 3.8162 7.6055 116.8631 64.8702 32.0215 176.6829 203 K 4.3595 8.2670 115.4703 56.2567 33.6344 176.5639 204 G 3.9628 7.5810 107.7284 43.2284 0.0000 171.4277 205 P 4.3587 0.0000 0.0000 62.1710 31.8482 176.3787 206 V 3.8945 8.1231 119.4594 62.7517 31.4427 175.2188 207 T 4.8527 8.8017 121.2602 60.6648 70.6596 174.4235 208 E 3.5813 8.6316 126.5715 58.5948 29.6765 178.9872 209 E 4.2320 7.9450 117.8106 58.4804 29.6901 177.1711 210 I 4.5353 7.7459 119.4036 57.5085 38.1706 173.6344 211 P 4.4162 0.0000 0.0000 65.7055 31.3200 177.7103 212 A 4.1439 8.0829 118.6794 54.5632 18.2085 179.6210 213 S 4.2012 8.3584 113.4165 61.3768 62.8626 176.4060 214 I 3.2083 7.5347 121.8973 63.5463 37.6006 177.5504 215 L 4.0138 8.0150 119.7059 57.1302 41.1277 178.9569 216 Q 4.0666 7.8794 117.9163 58.1813 28.6667 177.2854 217 T 4.3340 7.5016 107.6536 61.3737 69.6291 174.3010 218 H 4.3124 7.7695 123.7040 55.2927 30.3735 174.1099 219 P 4.3292 0.0000 0.0000 64.8468 31.9245 176.9826 220 K 4.6869 7.7540 120.4564 55.3985 33.8016 173.0654 221 V 4.7611 8.7100 123.2322 60.5759 34.6727 174.0491 222 I 4.8825 8.7816 128.5955 59.4265 40.0717 174.0733 223 L 4.7957 9.0695 130.0623 53.6737 43.7876 175.0159 224 I 4.8897 8.8446 128.8032 59.6903 39.1140 175.2106 225 V 5.2021 8.8380 126.8589 58.6299 34.9815 175.5268 226 D 5.6299 8.7202 123.3822 52.1422 40.6585 176.9777 227 E 4.0239 8.8657 117.1985 59.5239 29.6795 179.9942 228 K 4.2389 8.1716 116.8591 59.2484 32.5134 178.1909 229 A 4.2158 8.9496 121.9653 54.1107 18.7607 178.6955 230 G 4.0601 7.9164 103.6902 45.2492 0.0000 175.5432 231 A 3.9808 7.5053 125.0097 54.5509 18.3962 179.2155 232 G 4.0395 8.0050 102.3579 45.2176 0.0000 173.6907 233 I 4.1478 7.6728 119.2043 60.8104 37.6804 175.1315 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 0 S 8.19 4.50 0.00 3.44 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 1 M 8.57 5.30 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 2 K 9.39 4.43 0.00 1.87 1.63 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.84 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.47 1.46 7.81 3 T 8.37 5.04 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 4 I 9.23 4.37 1.89 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 1.23 0.98 0.94 0.00 0.00 5 K 8.62 4.93 0.00 1.65 1.76 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.47 7.81 6 V 8.85 4.52 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 0.86 0.00 0.00 1.18 0.00 0.00 7 K 8.80 3.93 0.00 1.72 1.83 0.00 1.81 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.43 7.81 8 N 7.46 4.72 0.00 2.90 2.85 0.00 0.00 5.87 7.18 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 9 K 8.13 2.48 0.00 1.12 1.46 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.25 0.49 7.81 10 T 7.67 4.13 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 1.15 0.00 0.00 11 E 8.89 4.08 0.00 1.93 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 2.24 2.20 0.00 12 G 8.20 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 13 S 8.34 4.25 0.00 3.94 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 14 K 7.98 4.56 0.00 2.01 1.89 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.46 7.81 15 V 8.06 3.64 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 1.06 0.00 0.00 1.04 0.00 0.00 16 A 8.35 4.04 1.50 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 17 F 8.54 4.08 0.00 3.29 3.35 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 18 R 8.32 3.88 0.00 2.11 2.02 0.00 3.25 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.08 0.00 19 M 8.26 4.07 0.00 2.07 2.25 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.55 0.00 20 L 8.23 3.93 0.00 1.75 1.78 1.03 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 21 E 7.98 3.80 0.00 1.53 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 2.29 2.28 0.00 22 E 8.11 4.33 0.00 2.18 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 0.00 2.25 2.35 0.00 23 E 8.38 4.08 0.00 2.20 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 2.57 2.52 0.00 24 I 7.97 3.78 2.05 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.12 0.97 0.00 0.00 25 T 8.26 3.89 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 1.29 0.00 0.00 26 F 8.02 4.52 0.00 3.17 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.06 4.06 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 0.00 0.00 0.00 28 A 8.24 4.17 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 29 K 9.66 4.72 0.00 1.69 1.87 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.64 1.57 7.81 30 T 8.21 5.06 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 31 L 9.06 5.10 0.00 1.48 1.56 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 32 G 9.07 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 0.00 0.00 0.00 0.00 33 L 8.68 5.34 0.00 1.55 1.71 0.85 0.70 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 34 A 8.99 4.88 1.21 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 0.00 0.00 35 T 7.87 4.58 3.36 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 0.80 0.00 0.00 36 G 7.83 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 37 S 8.41 4.42 0.00 4.09 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 0.00 38 T 8.24 3.97 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 1.25 0.00 0.00 39 P 0.00 4.49 0.00 0.90 1.96 0.00 3.72 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 1.92 2.05 0.00 40 L 7.99 3.97 0.00 1.82 1.79 1.03 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 41 E 8.06 4.02 0.00 1.93 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 2.35 2.31 0.00 42 L 7.83 4.03 0.00 1.79 1.75 1.19 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 43 Y 8.12 4.57 0.00 3.14 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 44 K 8.23 3.92 0.00 1.85 1.97 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.44 7.81 45 E 8.32 3.79 0.00 2.07 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 1.47 1.96 0.00 46 I 8.08 4.01 2.30 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.37 1.22 0.00 0.00 47 R 8.22 4.00 0.00 1.93 2.01 0.00 3.13 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.95 0.00 48 E 7.83 4.35 0.00 1.88 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 2.27 2.36 0.00 49 S 7.64 4.56 0.00 4.16 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 50 H 8.32 4.73 0.00 3.19 3.44 0.00 5.73 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.66 3.94 0.00 1.25 1.09 0.90 0.87 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 52 D 7.92 4.29 0.00 2.41 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 F 8.08 4.83 0.00 2.61 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 54 S 8.41 4.14 0.00 3.95 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 55 D 8.07 4.90 0.00 2.62 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 56 M 8.11 5.13 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.62 0.00 57 V 8.74 4.95 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 0.80 0.00 0.00 0.64 0.00 0.00 58 S 8.20 5.00 0.00 3.27 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 59 I 8.46 4.94 1.83 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.65 0.86 0.00 0.00 60 N 9.15 5.08 0.00 2.85 2.76 0.00 0.00 7.12 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 61 L 8.39 4.34 0.00 1.44 1.64 0.82 0.93 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 62 D 7.68 5.28 0.00 2.25 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 63 E 8.97 4.95 0.00 2.11 1.76 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 2.40 2.43 0.00 64 Y 8.48 4.73 0.00 2.97 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 65 V 8.58 3.83 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.92 0.00 0.00 66 G 9.20 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 67 L 7.44 4.72 0.00 1.74 1.67 1.03 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.41 4.45 0.00 4.04 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 69 A 8.50 4.17 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 70 D 7.70 4.64 0.00 2.73 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 71 D 7.79 4.35 0.00 2.73 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 72 K 8.22 2.72 0.00 1.42 1.31 0.00 1.58 0.00 0.00 1.34 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.57 1.11 7.81 73 Q 8.27 4.14 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.95 0.00 0.00 0.00 0.00 0.00 1.77 1.22 0.00 74 S 7.94 4.67 0.00 4.49 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 0.00 75 Y 9.44 4.45 0.00 3.12 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 76 A 8.70 4.16 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 77 Y 8.45 3.99 0.00 3.37 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 78 F 8.52 4.07 0.00 3.36 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 M 8.49 3.65 0.00 0.73 2.01 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.98 0.00 80 K 7.91 3.85 0.00 1.84 1.72 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.30 1.50 7.81 81 Q 7.53 3.72 0.00 1.79 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.66 0.00 0.00 0.00 0.00 0.00 1.45 2.02 0.00 82 N 7.52 4.48 0.00 2.19 2.69 0.00 0.00 6.76 7.32 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 83 L 6.99 4.61 0.00 0.96 1.04 1.08 0.88 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 84 F 8.03 4.83 0.00 3.05 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 85 A 8.21 4.12 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 86 A 8.00 4.28 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 87 K 8.25 4.57 0.00 1.90 1.71 0.00 1.55 0.00 0.00 1.66 0.00 0.00 3.14 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.57 7.81 88 P 0.00 4.63 0.00 2.08 2.17 0.00 3.76 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 89 F 8.53 4.68 0.00 2.55 3.13 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 0.00 0.00 0.00 90 K 8.54 4.05 0.00 1.99 2.01 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.41 7.81 91 K 7.79 4.42 0.00 1.65 1.25 0.00 1.26 0.00 0.00 1.58 0.00 0.00 2.74 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.66 0.40 7.81 92 S 8.05 4.78 0.00 3.14 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 8.98 4.85 0.00 2.79 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 94 L 8.52 5.59 0.00 1.59 1.62 1.15 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.29 0.00 1.88 1.66 0.00 3.57 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.64 0.00 96 N 9.56 4.64 0.00 2.76 2.96 0.00 0.00 7.20 7.84 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 97 G 8.55 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 98 L 8.03 4.41 0.00 1.81 1.70 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 99 A 7.75 4.01 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 0.00 100 A 8.65 4.01 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 0.00 101 D 7.74 4.73 0.00 2.67 2.53 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 0.00 102 L 8.49 4.05 0.00 1.73 1.71 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 103 A 8.08 4.05 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 0.00 104 K 8.44 4.02 0.00 2.01 1.91 0.00 1.68 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.63 7.81 105 E 8.17 4.10 0.00 2.14 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 0.00 2.33 2.43 0.00 106 T 8.20 4.00 4.50 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 1.31 0.00 0.00 107 E 8.30 3.94 0.00 2.18 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 2.41 0.00 108 Y 8.46 4.12 0.00 3.19 3.31 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 0.00 109 Y 8.40 3.71 0.00 3.35 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 0.00 110 D 8.23 4.35 0.00 2.93 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 0.00 111 Q 7.92 3.94 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.66 2.50 0.00 112 I 7.24 3.29 1.11 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 -0.16 -0.23 0.00 0.00 113 L 7.65 3.84 0.00 1.73 1.62 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 114 A 7.61 4.01 1.25 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 0.00 0.00 115 Q 7.83 3.82 0.00 1.82 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.16 0.00 0.00 0.00 0.00 0.00 1.16 1.87 0.00 116 Y 7.65 4.70 0.00 2.89 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 0.00 117 P 0.00 4.43 0.00 2.03 1.98 0.00 3.67 0.00 0.00 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.03 0.00 118 I 8.22 3.96 1.87 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 1.33 0.56 0.98 0.00 0.00 119 D 9.36 4.45 0.00 2.77 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 0.00 120 L 7.73 5.00 0.00 1.73 1.49 0.97 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 121 Q 9.15 5.03 0.00 2.18 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.69 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 122 I 8.80 4.57 1.94 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.09 0.91 0.00 0.00 123 L 9.05 4.67 0.00 1.65 1.37 0.87 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 124 G 8.48 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 0.00 0.00 0.00 0.00 125 I 7.92 4.70 1.78 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.93 0.81 0.00 0.00 126 G 8.38 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 R 8.53 3.84 0.00 1.83 2.03 0.00 3.23 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.64 0.00 128 N 8.12 4.67 0.00 2.85 2.93 0.00 0.00 6.03 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 0.00 129 A 8.33 3.71 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 0.00 130 H 8.12 4.75 0.00 3.57 3.64 0.00 5.21 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.12 4.62 1.91 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 1.25 1.12 0.91 0.00 0.00 132 G 8.38 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 F 8.72 4.76 0.00 3.00 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 0.00 134 N 8.31 4.69 0.00 2.99 2.85 0.00 0.00 7.00 7.28 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 0.00 135 E 8.43 4.43 0.00 2.02 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 2.41 2.30 0.00 136 P 0.00 4.52 0.00 2.04 2.21 0.00 3.67 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 2.07 2.15 0.00 137 G 9.06 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 0.00 0.00 0.00 138 T 7.45 3.88 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 1.23 0.00 0.00 139 A 8.35 3.89 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 0.00 140 F 8.28 4.64 0.00 3.06 2.99 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 0.00 141 S 8.02 4.49 0.00 4.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.02 4.18 0.00 3.82 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 0.00 143 Q 8.21 5.41 0.00 2.06 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.13 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 144 T 8.53 4.54 4.55 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 1.28 0.00 0.00 145 H 9.15 4.93 0.00 3.15 3.34 0.00 5.26 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.46 4.62 0.00 1.66 1.62 1.02 0.84 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 0.00 147 V 8.70 4.42 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 0.90 0.00 0.00 0.83 0.00 0.00 148 D 8.60 4.95 0.00 2.57 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 0.00 149 L 8.39 4.15 0.00 1.48 1.58 1.02 0.25 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 0.00 150 T 8.48 4.11 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 1.24 0.00 0.00 151 P 0.00 4.25 0.00 2.29 2.36 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 152 S 8.06 4.13 0.00 3.93 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 0.00 153 T 7.90 3.96 4.49 0.00 0.00 0.00 0.00 0.00 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 0.00 154 I 7.94 3.68 1.99 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 1.54 0.85 0.87 0.00 0.00 155 A 8.05 3.99 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 0.00 156 A 8.26 4.14 1.50 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 0.00 157 N 8.81 4.85 0.00 2.81 3.03 0.00 0.00 7.08 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 0.00 158 S 8.34 4.34 0.00 4.09 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 0.00 159 R 7.51 3.98 0.00 1.45 1.57 0.00 3.25 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.54 0.00 160 F 7.89 4.69 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 0.00 161 F 7.66 4.86 0.00 2.98 3.02 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 *162 E 7.88 3.00 0.00 2.00 1.64 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 2.23 1.94 0.00 *163 K 8.52 4.06 0.00 1.75 2.04 0.00 1.76 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.25 0.80 7.81 164 A 8.24 4.00 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 0.00 165 E 8.12 4.03 0.00 2.00 1.89 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 2.23 1.91 0.00 166 D 7.54 4.49 0.00 2.90 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 0.00 167 V 7.09 2.41 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 0.48 0.00 0.00 0.81 0.00 0.00 168 P 0.00 4.16 0.00 1.76 2.07 0.00 2.93 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.89 0.00 169 K 8.48 4.51 0.00 1.59 1.74 0.00 1.55 0.00 0.00 1.70 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.31 7.81 170 Q 7.84 5.07 0.00 1.90 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 171 A 8.69 5.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 I 8.59 4.67 1.78 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 1.08 0.78 0.81 0.00 0.00 173 S 8.83 5.18 0.00 3.95 3.54 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 0.00 174 M 9.18 4.36 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.74 0.00 175 G 8.49 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 0.00 0.00 0.00 0.00 176 L 8.67 4.10 0.00 1.85 1.90 1.11 0.84 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 0.00 177 A 8.08 4.07 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 S 8.12 4.26 0.00 4.16 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 0.00 179 I 7.97 3.79 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 1.54 1.55 0.90 0.00 0.00 180 M 8.03 4.25 0.00 2.02 2.33 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.84 0.00 181 S 7.85 4.23 0.00 4.04 3.92 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 0.00 182 A 7.12 4.32 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 0.00 183 K 8.71 4.26 0.00 1.86 1.90 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.64 1.55 7.81 184 M 8.14 5.05 0.00 2.16 1.84 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 185 I 8.75 4.86 1.69 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.44 0.83 0.00 0.00 186 L 9.06 4.95 0.00 1.70 1.53 0.95 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 187 L 8.71 4.95 0.00 1.68 1.43 0.85 0.83 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 0.00 188 M 8.86 4.94 0.00 1.66 1.77 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.48 0.00 189 A 8.06 4.53 0.99 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 0.00 190 F 8.59 5.29 0.00 2.92 2.99 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 0.00 191 G 9.29 4.52 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 0.00 192 E 8.88 4.08 0.00 2.03 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 2.39 2.34 0.00 193 E 8.32 4.08 0.00 2.22 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 0.00 2.39 2.38 0.00 194 K 8.01 4.40 0.00 1.86 1.81 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.53 7.81 195 A 7.76 4.47 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 E 8.12 3.86 0.00 2.05 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 2.38 2.38 0.00 197 A 7.90 3.97 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 V 8.05 3.46 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 1.00 0.00 0.00 0.94 0.00 0.00 199 A 8.08 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 0.00 200 A 8.08 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 0.00 201 M 8.10 3.95 0.00 2.14 2.09 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 2.73 2.52 0.00 202 V 7.61 3.82 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 0.88 0.00 0.00 0.98 0.00 0.00 203 K 8.27 4.36 0.00 1.87 1.81 0.00 1.85 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.34 7.81 204 G 7.58 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 0.00 0.00 0.00 205 P 0.00 4.36 0.00 2.22 2.09 0.00 3.78 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 2.02 1.97 0.00 206 V 8.12 3.89 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 0.56 0.00 0.00 0.89 0.00 0.00 207 T 8.80 4.85 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 1.35 0.00 0.00 208 E 8.63 3.58 0.00 1.88 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 1.95 1.47 0.00 209 E 7.95 4.23 0.00 2.01 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 2.33 2.43 0.00 210 I 7.75 4.54 1.94 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 1.33 1.13 0.94 0.00 0.00 211 P 0.00 4.42 0.00 2.39 2.21 0.00 3.70 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 212 A 8.08 4.14 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 0.00 213 S 8.36 4.20 0.00 4.13 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 0.00 214 I 7.53 3.21 1.10 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.17 0.96 0.00 0.00 215 L 8.01 4.01 0.00 1.80 1.65 0.87 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 216 Q 7.88 4.07 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 217 T 7.50 4.33 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 218 H 7.77 4.31 0.00 3.17 3.17 0.00 5.58 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 P 0.00 4.33 0.00 2.16 2.09 0.00 3.17 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.82 0.00 220 K 7.75 4.69 0.00 1.91 1.90 0.00 1.57 0.00 0.00 1.58 0.00 0.00 2.74 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.38 7.81 221 V 8.71 4.76 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 0.86 0.00 0.00 0.82 0.00 0.00 222 I 8.78 4.88 1.86 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 1.10 0.45 0.90 0.00 0.00 223 L 9.07 4.80 0.00 1.67 1.64 0.83 0.83 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 0.00 224 I 8.84 4.89 1.86 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 1.32 0.56 1.10 0.00 0.00 225 V 8.84 5.20 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 1.18 0.00 0.00 0.97 0.00 0.00 226 D 8.72 5.63 0.00 3.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 E 8.87 4.02 0.00 2.04 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 2.60 2.29 0.00 228 K 8.17 4.24 0.00 1.79 1.97 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.40 7.81 229 A 8.95 4.22 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 G 7.92 4.06 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 0.00 0.00 0.00 231 A 7.51 3.98 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 0.00 232 G 8.00 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 0.00 233 I 7.67 4.15 1.86 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 1.21 0.83 0.90 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.