NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7037 8.3829 118.2179 52.3122 38.9229 175.6917 3 N 4.2459 8.5030 118.4984 57.2205 37.3948 174.9875 4 T 4.0605 8.7210 118.0852 67.0014 69.0879 176.3768 5 I 3.8492 8.6141 124.4830 64.8481 37.0191 179.0528 6 E 4.0139 8.1348 119.0025 61.3302 29.3099 182.0354 7 T 4.0848 7.8724 115.8630 66.5118 68.3575 176.5343 8 I 3.8701 7.7317 121.6741 64.5693 36.9961 178.4909 9 L 4.1355 7.9721 117.4876 56.7261 41.5726 178.2887 10 A 4.3255 7.4269 118.5589 51.6042 19.2201 176.9908 11 H 4.2464 7.2634 117.5186 56.3368 30.5647 174.8374 12 R 4.1851 7.5001 117.5801 55.0655 31.5544 174.7097 13 S 4.3748 8.7161 118.5209 58.7441 63.3715 173.4944 14 I 4.3252 8.3470 126.4224 59.9284 38.1312 175.7620 15 R 3.9236 9.1064 123.6341 55.1160 30.6740 175.4227 16 K 4.4218 6.9042 119.7899 54.9148 35.2346 174.9892 17 F 5.6328 8.8518 125.1245 55.9410 42.8556 174.6516 18 T 4.5729 8.5578 111.4328 60.6450 70.5302 174.5543 19 A 4.3002 8.5705 122.4149 52.5075 19.0465 177.7465 20 V 3.6615 7.2779 116.1718 61.9417 31.7171 174.2812 21 P 4.5556 0.0000 0.0000 62.4969 32.1754 175.3273 22 I 4.3101 7.9271 120.0881 60.0640 38.4384 176.9766 23 T 4.1396 8.3467 115.5794 61.6126 70.7038 175.3775 24 D 4.4170 8.7490 124.3599 58.1811 40.8298 179.6832 25 E 4.0143 8.0798 118.3930 61.1597 29.8271 181.6095 26 Q 4.1735 8.0113 119.2912 58.7291 28.7828 178.8987 27 R 3.9220 8.2817 122.2075 60.2009 30.1445 179.1763 28 Q 4.0368 8.1794 120.4475 60.6122 28.0707 180.5867 29 T 4.1361 7.9826 117.4849 66.4736 68.5779 177.0592 30 I 3.7571 7.8876 121.9310 64.3791 37.1147 178.6047 31 I 3.7499 7.9322 120.6771 64.5520 36.9978 178.5445 32 Q 4.0132 8.3114 118.7042 58.7889 28.2366 178.7872 33 A 4.1102 7.9992 121.3468 55.0848 18.7652 179.6023 34 G 3.7648 7.9630 103.8324 48.0303 0.0000 176.0076 35 L 4.1076 7.9836 120.2071 57.1904 41.7209 178.7661 36 A 4.1881 7.7997 118.1947 52.3758 18.6066 177.5665 37 A 4.2063 7.0629 120.1650 51.3818 19.1995 177.9928 38 S 4.3235 8.3985 116.1742 58.7677 63.7984 174.2029 39 S 4.6813 8.2744 116.4185 56.1646 65.1269 173.3295 40 S 4.3499 9.4017 124.3639 60.1792 62.7061 174.4934 41 S 3.9003 9.4584 120.1316 59.1149 60.3049 171.7384 42 M 3.2594 8.0984 116.1397 56.4697 30.9645 178.1577 43 L 4.1045 8.2617 118.9616 55.5879 42.2835 177.3732 44 Q 3.3349 7.8021 115.5277 57.1427 26.1516 173.4845 45 V 4.3187 7.3236 107.9070 60.0399 33.5222 175.6154 46 V 4.7859 7.6650 120.5451 61.2632 33.3579 175.0344 47 S 4.8058 8.9160 122.9286 56.6851 66.5870 172.8790 48 I 4.4062 8.1540 123.4471 59.3418 39.6259 175.0215 49 V 4.0717 8.4033 127.8143 61.0974 33.0922 174.4669 50 R 4.4628 8.4325 129.6118 55.6417 30.7640 175.8117 51 V 4.2840 8.4681 128.2726 62.0353 31.2761 175.2001 52 T 4.3067 8.4386 118.2572 62.2445 70.3145 175.2229 53 D 4.4058 7.9857 122.8373 54.0303 42.2076 176.5825 54 S 4.1614 8.7608 122.9355 61.6404 62.9782 176.3451 55 E 3.9913 8.1811 121.7421 59.1030 29.2650 179.1483 56 K 4.0570 8.4820 118.6245 59.2550 32.0016 179.6290 57 R 3.8882 8.1582 121.0045 59.8847 29.9583 179.3994 58 N 4.2342 7.9077 118.5511 57.6332 37.5048 178.8796 59 E 3.8268 8.0074 121.1781 59.0404 29.4923 179.5461 60 L 4.1199 8.2722 119.2401 57.5675 41.7703 179.3218 61 A 3.8791 8.1578 123.5191 55.6787 18.2577 180.4275 62 Q 4.1346 7.5477 120.1417 59.7703 28.0739 180.5330 63 F 4.9797 7.9923 117.7299 58.9627 39.0626 176.4470 64 A 4.5271 7.6011 119.0266 51.5918 19.2704 177.2984 65 G 3.8911 7.8570 105.8744 45.8192 0.0000 173.4231 66 N 3.9889 7.9211 111.9307 53.9865 36.5844 175.9047 67 Q 4.0868 7.4781 117.7085 54.2054 28.6080 176.5025 68 A 3.8902 8.3126 126.5392 55.4007 18.4081 178.3311 69 Y 4.9046 7.0592 116.0673 59.1232 37.7365 178.5876 70 V 3.4748 7.4335 122.6833 66.2904 31.5827 177.7780 71 E 4.1545 7.8411 117.4638 60.3558 30.2477 180.9855 72 S 4.5379 8.0288 113.2311 59.1601 63.6574 174.2267 73 A 3.7400 7.2893 125.4577 51.8159 18.6806 177.3694 74 A 4.2096 8.1179 123.0817 54.5832 19.2783 177.9233 75 E 4.7402 8.4358 113.4744 54.7019 34.6988 175.0549 76 F 5.3064 8.7044 124.1171 56.7925 42.7275 172.9451 77 L 4.8808 8.2738 126.5590 52.8079 44.4195 175.7910 78 V 4.4795 8.0375 122.8989 61.0558 34.0999 174.2272 79 F 4.6566 8.9461 127.9618 56.7781 40.2463 174.8780 80 C 5.2649 8.9339 120.7926 57.7662 32.8433 173.3834 81 I 4.2873 8.6163 122.9219 61.2732 38.4577 174.9049 82 D 4.4771 9.3572 125.8802 52.4181 43.8615 174.7857 83 Y 4.8081 9.0025 123.2643 57.8394 38.6362 177.4482 84 Q 4.0680 8.5177 123.0878 58.9657 29.2456 178.1460 85 R 3.8845 8.1696 118.8581 59.6590 30.0892 178.5643 86 H 4.2212 8.2128 115.1749 58.8445 28.5877 177.6394 87 A 4.2083 8.0303 121.6303 55.3817 18.2213 179.5479 88 T 4.0349 8.0162 114.0582 66.6223 68.5798 176.9629 89 I 4.1121 7.4913 120.5882 62.6961 37.3956 176.0322 90 N 4.8388 8.3764 119.9441 51.1330 40.6823 173.0271 91 P 4.5016 0.0000 0.0000 64.9707 31.5729 177.1487 92 D 4.5841 8.1851 116.8180 54.5741 41.0365 176.8657 93 V 3.5737 7.4177 120.5432 63.1256 31.7889 175.5618 94 Q 4.3393 8.6231 126.2779 54.7517 28.3249 174.5490 95 A 4.2698 8.2690 124.2981 51.7142 19.3897 177.0034 96 D 4.7102 7.4651 115.7059 53.3043 40.4206 176.2716 97 F 4.5861 7.6800 120.6015 57.5240 39.7732 176.3606 98 T 3.9024 9.1625 122.9753 66.7219 68.1673 176.1981 99 E 3.9721 8.3425 120.8819 59.4847 29.6008 178.7906 100 L 4.1530 8.1716 118.7906 57.8628 41.5405 179.5851 101 T 4.0952 7.8032 115.5700 66.3771 68.4243 176.7216 102 L 4.0423 8.1216 121.0565 57.8235 41.5794 179.5790 103 I 3.8645 8.0122 119.9012 64.3711 37.2016 178.6773 104 G 3.6816 8.4534 106.3541 47.7293 0.0000 175.6473 105 A 4.0957 8.3013 123.2378 54.8724 18.4820 179.8944 106 V 3.5348 8.1653 117.1071 66.4819 31.7356 178.0359 107 D 4.4617 8.4955 118.8499 57.3499 40.5161 179.1790 108 S 4.3452 8.2161 115.7326 61.5274 62.8849 176.7933 109 G 3.6480 8.1295 108.1694 47.8140 0.0000 175.7227 110 I 3.6933 7.7924 122.2954 64.2915 37.2321 178.2159 111 M 4.0846 8.1688 118.6321 58.7362 32.0804 178.0126 112 A 3.7379 8.2903 121.3274 55.2033 18.4034 179.4186 113 Q 4.1184 8.1253 119.3484 58.7334 29.0995 178.2010 114 N 4.3790 7.8992 117.8303 56.3180 38.5881 177.1774 115 C 4.3162 8.0872 118.0617 62.7323 28.2210 175.9152 116 L 3.9211 8.1049 122.0240 58.2148 41.6840 179.0002 117 L 4.0105 8.1556 118.7735 57.6485 41.2927 179.3577 118 A 3.9805 7.9418 119.6205 55.0404 18.6242 179.2642 119 A 4.0884 8.0535 119.1842 55.5236 18.5332 179.7600 120 E 4.5067 8.8570 119.0885 59.0126 29.2925 179.6531 121 S 4.3055 8.1843 113.1622 60.7050 63.1956 175.3295 122 M 4.4205 7.7630 120.7658 54.9695 32.1389 176.7933 123 G 3.9694 8.0260 108.1240 44.9528 0.0000 173.8064 124 L 4.4252 7.6160 119.6270 54.1281 43.7142 175.6690 125 G 4.5676 9.1708 107.6066 44.9622 0.0000 171.8702 126 G 5.0788 8.4061 105.8934 45.4016 0.0000 172.4496 127 V 4.9124 7.8019 116.8016 60.7203 34.2980 172.8502 128 Y 4.6277 8.9159 121.3753 58.3082 39.6409 174.8014 129 I 4.8941 9.3812 123.9382 59.5146 39.0999 176.2659 130 G 4.1715 8.9085 113.0716 45.4629 0.0000 172.9611 131 G 3.8459 8.2361 107.8441 47.5379 0.0000 175.4825 132 L 4.3196 8.1992 120.8293 57.9646 41.3970 179.3858 133 R 3.9993 7.8756 116.8797 58.6782 30.0037 178.0807 134 N 4.6480 8.1095 116.2450 55.2512 39.6272 174.8423 135 S 4.5886 7.9492 116.4369 56.9579 64.1368 175.8868 136 A 3.5725 8.1233 123.6124 55.4131 18.1500 179.1987 137 A 3.9356 7.5339 118.2336 55.4614 18.4644 179.7748 138 Q 3.6772 7.5500 115.9444 58.9111 28.8285 178.8752 139 V 3.5190 7.3898 119.2916 65.7472 31.5426 177.5268 140 D 4.4146 8.4536 120.7253 58.1313 41.1220 178.8617 141 E 4.0337 8.1000 118.6958 60.9482 29.5085 180.4525 142 L 4.2306 7.8049 120.4571 57.7790 42.2832 178.3031 143 L 4.4364 7.8405 115.6888 53.6803 42.1759 176.6090 144 G 3.9392 7.9682 107.0346 46.3064 0.0000 174.3620 145 L 4.0802 7.9079 120.0453 53.5719 42.1328 176.4011 146 P 4.5737 0.0000 0.0000 62.2433 31.7611 176.2020 147 E 4.0605 8.4182 113.2371 57.4207 30.1960 172.6009 148 N 4.4975 9.4436 116.1748 54.2248 36.6671 174.0150 149 S 5.3329 7.7598 108.8062 55.7185 65.7520 172.8577 150 A 4.9736 8.1249 126.2142 50.5603 22.6121 175.4563 151 V 4.1800 8.7732 120.3105 61.6837 32.2616 175.1936 152 L 4.8722 8.1213 122.1077 55.6727 43.8205 176.4559 153 F 4.9232 7.3270 110.6851 56.4951 41.0026 172.6995 154 G 4.2856 9.0913 107.8044 45.1498 0.0000 171.7741 155 M 5.3291 7.9499 118.4293 54.7770 36.1369 173.4469 156 C 5.3248 9.3343 124.5853 58.9983 30.4199 172.7956 157 L 5.0927 9.0750 122.2578 52.3171 45.9729 176.2360 158 G 3.9487 7.8664 109.1942 46.3793 0.0000 170.9735 159 H 4.9166 8.1075 117.0732 54.6955 29.7759 173.9337 160 P 4.7107 0.0000 0.0000 62.5799 32.0120 175.5254 161 D 5.0811 8.4508 122.9705 53.4670 42.1290 174.9442 162 Q 4.5750 7.7317 111.4099 55.2156 30.8553 173.4256 163 N 4.8681 8.1833 116.8045 51.0779 38.8935 172.1097 164 P 4.4256 0.0000 0.0000 62.2952 32.5934 176.8964 165 E 4.3570 8.3320 116.2420 54.9387 30.6739 177.8347 166 V 3.7492 8.1616 120.2578 62.9650 32.0473 175.9454 167 K 3.4113 8.3583 127.4942 54.8495 32.6214 175.1656 168 P 4.3207 0.0000 0.0000 62.6270 32.0296 175.7178 169 R 4.4777 7.9265 118.7362 53.7442 32.8173 175.8092 170 L 3.0540 7.3989 118.9613 53.6696 42.1861 175.9849 171 P 4.2240 0.0000 0.0000 62.3508 32.0303 177.0527 172 A 3.9254 8.5633 121.8420 55.7165 17.9403 179.6590 173 H 4.1955 7.9343 111.6194 57.8209 28.7709 177.2411 174 V 3.7227 7.1538 120.7084 65.3760 31.7277 177.6216 175 V 3.6885 7.4399 116.4083 63.9678 31.7856 176.0259 176 V 4.1421 7.4603 118.6107 61.4967 32.4508 174.4419 177 H 4.7515 8.6053 123.7239 53.9269 31.2205 173.6010 178 E 4.3263 8.5771 122.9740 55.7541 29.6979 177.2820 179 N 4.4167 9.2677 127.8559 54.9672 38.0077 175.5427 180 Q 4.6410 8.4624 113.4617 52.8124 32.2980 176.5125 181 Y 3.9172 8.7954 123.6131 58.4728 39.2951 176.0557 182 Q 4.6605 8.1475 125.3778 52.8873 30.2224 171.8122 183 E 4.2565 8.5130 121.5559 55.5864 30.3985 176.4301 184 L 3.9917 8.4549 127.3069 54.9401 43.0191 175.6876 185 N 4.7667 8.5240 124.3010 51.9571 39.2423 175.2931 186 L 4.1482 8.5054 127.0706 57.7021 41.7366 179.1132 187 D 4.4644 8.5480 119.1580 57.2351 40.7088 178.3318 188 D 4.4474 8.3126 119.7359 57.2174 40.7146 178.8272 189 I 3.9598 7.8157 122.5238 65.0489 37.2341 178.8897 190 Q 4.1246 8.2074 121.6212 60.4607 27.9493 180.7801 191 S 4.3900 8.1279 117.0947 61.4776 62.7488 176.2631 192 Y 4.1019 7.9838 122.2725 60.7583 38.5678 177.4911 193 D 4.4281 8.7391 122.7498 58.2192 41.0339 179.5746 194 Q 4.0683 8.1325 121.1098 60.4630 27.9011 180.6922 195 T 4.0608 7.7290 117.5609 66.8416 68.4872 176.8373 196 M 3.9127 8.2295 123.4187 58.6204 31.6563 179.5132 197 Q 4.1587 8.0304 120.2645 60.2256 28.3959 181.5273 198 A 4.3288 7.6828 121.4413 54.9052 18.4051 178.9470 199 Y 3.9975 7.3346 117.3643 59.1199 39.2671 176.5187 200 Y 4.4770 8.0939 117.8020 57.3753 37.3355 178.6650 *210 S 4.1552 8.6596 119.9325 58.9523 63.6546 173.0914 211 T 4.4169 8.1120 117.6206 60.4796 71.1049 175.5596 212 W 4.1998 8.7749 130.5801 60.8453 30.8572 177.8377 213 S 3.6750 8.9988 116.5128 62.2890 62.3591 177.1781 214 Q 4.0484 7.9345 125.6245 60.3002 27.9331 180.9384 215 E 4.0796 8.1716 120.1375 61.1900 29.7660 181.8021 216 V 3.6484 7.4460 114.1690 64.2887 31.5411 178.9309 217 T 4.0004 7.6385 109.2090 64.3835 68.4677 177.1201 218 G 3.5464 7.6736 107.9306 47.3986 0.0000 175.3687 219 K 4.0863 7.9036 121.7589 59.2179 32.0619 178.5845 220 L 4.2614 7.5440 116.7189 56.3699 41.7897 178.5774 221 A 4.2182 7.7051 120.0399 55.2845 18.7137 177.0947 222 G 4.1683 7.4390 105.0078 44.1126 0.0000 172.8917 223 E 4.2251 8.5434 118.6876 56.1155 30.2163 177.0963 224 S 4.4810 8.3282 119.0217 57.4718 63.5336 173.6650 225 R 3.6973 8.3220 123.3494 56.2723 26.9874 175.5415 226 P 4.4185 0.0000 0.0000 64.9284 32.0923 177.9203 227 H 4.5705 8.0552 114.0489 56.9146 29.5202 177.2525 228 I 3.7368 7.6335 122.2560 64.5087 36.8277 177.7287 229 L 3.9461 7.8843 120.3903 57.8988 42.0504 177.0016 230 P 4.2411 0.0000 0.0000 65.6081 30.9807 177.9926 231 Y 4.1392 8.1821 118.2953 60.7432 38.7210 177.9183 232 L 3.5916 8.0755 120.0287 57.9148 41.6669 179.3607 233 N 4.4710 8.6555 118.1521 55.7287 38.2335 177.6136 234 S 4.1064 7.8753 114.6003 60.5532 63.3252 175.6502 235 K 4.3429 7.4249 120.5816 55.5385 31.9552 177.3818 236 G 3.9073 8.1582 108.2374 45.9333 0.0000 173.2330 237 L 4.6781 7.8835 118.4951 53.1374 44.6191 176.0527 238 A 3.5483 8.3070 120.8380 53.3420 15.9693 178.2562 239 K 4.2436 8.0739 119.7544 58.4122 33.3865 178.0491 240 R 4.1277 7.4807 120.4742 56.5735 28.8545 174.5792 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 N 8.38 4.70 0.00 2.97 3.04 0.00 0.00 6.25 6.07 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 3 N 8.50 4.25 0.00 2.83 2.87 0.00 0.00 6.57 6.34 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 4 T 8.72 4.06 4.41 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 1.22 0.00 0.00 5 I 8.61 3.85 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 1.38 0.78 0.91 0.00 0.00 6 E 8.13 4.01 0.00 2.01 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 2.22 0.00 7 T 7.87 4.08 4.40 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 1.26 0.00 0.00 8 I 7.73 3.87 2.01 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 1.53 1.23 0.91 0.00 0.00 9 L 7.97 4.14 0.00 1.62 1.73 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.43 4.33 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 11 H 7.26 4.25 0.00 3.14 3.36 0.00 5.99 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 7.50 4.19 0.00 1.84 1.77 0.00 3.44 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.48 0.00 13 S 8.72 4.37 0.00 3.89 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 8.35 4.33 1.91 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.83 0.45 0.00 0.00 15 R 9.11 3.92 0.00 1.31 0.82 0.00 2.92 0.00 0.00 2.71 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.17 0.00 16 K 6.90 4.42 0.00 1.63 1.42 0.00 1.62 0.00 0.00 1.98 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.44 7.81 17 F 8.85 5.63 0.00 2.99 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 18 T 8.56 4.57 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 1.27 0.00 0.00 19 A 8.57 4.30 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 20 V 7.28 3.66 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 0.75 0.00 0.00 0.92 0.00 0.00 21 P 0.00 4.56 0.00 2.23 2.06 0.00 3.82 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 2.00 2.00 0.00 22 I 7.93 4.31 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.54 0.96 0.00 0.00 23 T 8.35 4.14 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 24 D 8.75 4.42 0.00 2.71 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 25 E 8.08 4.01 0.00 1.97 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 2.31 1.97 0.00 26 Q 8.01 4.17 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 27 R 8.28 3.92 0.00 1.87 1.91 0.00 3.07 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 28 Q 8.18 4.04 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 29 T 7.98 4.14 4.40 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 1.22 0.00 0.00 30 I 7.89 3.76 2.03 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 1.53 1.22 0.97 0.00 0.00 31 I 7.93 3.75 2.00 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 1.74 0.96 0.89 0.00 0.00 32 Q 8.31 4.01 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 33 A 8.00 4.11 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 34 G 7.96 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 35 L 7.98 4.11 0.00 1.81 1.76 0.92 0.70 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 36 A 7.80 4.19 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 37 A 7.06 4.21 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 38 S 8.40 4.32 0.00 3.89 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 39 S 8.27 4.68 0.00 3.80 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 40 S 9.40 4.35 0.00 3.95 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 41 S 9.46 3.90 0.00 4.02 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 42 M 8.10 3.26 0.00 2.12 2.10 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 2.53 2.54 0.00 43 L 8.26 4.10 0.00 1.77 1.77 1.02 1.18 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 44 Q 7.80 3.33 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.21 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 45 V 7.32 4.32 1.24 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 0.56 0.00 0.00 0.84 0.00 0.00 46 V 7.66 4.79 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 0.93 0.00 0.00 0.97 0.00 0.00 47 S 8.92 4.81 0.00 3.70 3.61 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 48 I 8.15 4.41 1.61 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.34 0.36 0.00 0.00 49 V 8.40 4.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.86 0.00 0.00 50 R 8.43 4.46 0.00 1.77 1.77 0.00 3.23 0.00 0.00 3.12 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 51 V 8.47 4.28 2.31 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 0.91 0.00 0.00 1.05 0.00 0.00 52 T 8.44 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 1.21 0.00 0.00 53 D 7.99 4.41 0.00 2.82 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 54 S 8.76 4.16 0.00 4.07 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 55 E 8.18 3.99 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 56 K 8.48 4.06 0.00 1.98 1.90 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.67 7.81 57 R 8.16 3.89 0.00 2.00 1.88 0.00 3.35 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 58 N 7.91 4.23 0.00 2.76 2.83 0.00 0.00 7.11 7.06 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 59 E 8.01 3.83 0.00 2.12 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 2.16 2.46 0.00 60 L 8.27 4.12 0.00 1.71 1.69 1.13 1.22 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 61 A 8.16 3.88 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Q 7.55 4.13 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.13 0.00 63 F 7.99 4.98 0.00 3.02 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.60 4.53 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 65 G 7.86 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 0.00 0.00 0.00 66 N 7.92 3.99 0.00 2.92 2.82 0.00 0.00 7.03 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 67 Q 7.48 4.09 0.00 1.77 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 68 A 8.31 3.89 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 69 Y 7.06 4.90 0.00 3.56 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 V 7.43 3.47 1.85 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 -0.18 0.00 0.00 0.74 0.00 0.00 71 E 7.84 4.15 0.00 2.13 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 2.23 2.18 0.00 72 S 8.03 4.54 0.00 4.17 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 0.00 73 A 7.29 3.74 1.18 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 0.00 0.00 74 A 8.12 4.21 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 75 E 8.44 4.74 0.00 1.80 1.75 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 2.18 2.35 0.00 76 F 8.70 5.31 0.00 3.04 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.27 4.88 0.00 1.49 1.08 0.89 0.25 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 78 V 8.04 4.48 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.81 0.00 0.00 79 F 8.95 4.66 0.00 1.96 2.51 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 80 C 8.93 5.26 0.00 2.75 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.62 4.29 1.93 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.19 1.02 0.00 0.00 82 D 9.36 4.48 0.00 2.54 2.38 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 83 Y 9.00 4.81 0.00 3.19 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 84 Q 8.52 4.07 0.00 2.37 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 85 R 8.17 3.88 0.00 1.77 1.83 0.00 3.11 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 86 H 8.21 4.22 0.00 3.50 3.46 0.00 5.82 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 87 A 8.03 4.21 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 88 T 8.02 4.03 4.39 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 1.21 0.00 0.00 89 I 7.49 4.11 2.02 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 1.40 0.65 0.92 0.00 0.00 90 N 8.38 4.84 0.00 2.65 2.66 0.00 0.00 7.29 7.78 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 91 P 0.00 4.50 0.00 2.09 2.10 0.00 3.73 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 2.03 2.11 0.00 92 D 8.19 4.58 0.00 2.83 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 93 V 7.42 3.57 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.07 0.00 0.00 94 Q 8.62 4.34 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.30 2.50 0.00 95 A 8.27 4.27 1.07 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 0.00 0.00 96 D 7.47 4.71 0.00 2.64 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 F 7.68 4.59 0.00 3.04 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 98 T 9.16 3.90 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 1.24 0.00 0.00 99 E 8.34 3.97 0.00 2.07 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 2.33 2.47 0.00 100 L 8.17 4.15 0.00 1.57 1.00 0.66 0.56 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 0.00 101 T 7.80 4.10 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 102 L 8.12 4.04 0.00 1.96 1.75 0.94 0.59 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 0.00 103 I 8.01 3.86 2.18 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 1.51 0.98 1.00 0.00 0.00 104 G 8.45 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 0.00 105 A 8.30 4.10 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 V 8.17 3.53 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 1.04 0.00 0.00 1.01 0.00 0.00 107 D 8.50 4.46 0.00 2.94 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 0.00 108 S 8.22 4.35 0.00 4.28 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 0.00 109 G 8.13 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 I 7.79 3.69 2.06 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 1.42 0.86 0.93 0.00 0.00 111 M 8.17 4.08 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.84 0.00 112 A 8.29 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 8.13 4.12 0.00 2.34 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 114 N 7.90 4.38 0.00 3.06 2.92 0.00 0.00 6.94 7.53 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 0.00 115 C 8.09 4.32 0.00 3.29 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 0.00 116 L 8.10 3.92 0.00 1.65 1.77 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.16 4.01 0.00 1.80 1.72 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.94 3.98 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 0.00 119 A 8.05 4.09 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 0.00 120 E 8.86 4.51 0.00 2.15 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 2.39 2.40 0.00 121 S 8.18 4.31 0.00 4.04 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 M 7.76 4.42 0.00 2.04 2.27 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 2.84 2.55 0.00 123 G 8.03 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 0.00 124 L 7.62 4.43 0.00 1.68 1.59 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 125 G 9.17 4.57 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 0.00 126 G 8.41 5.08 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 0.00 127 V 7.80 4.91 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 0.89 0.00 0.00 1.05 0.00 0.00 128 Y 8.92 4.63 0.00 2.96 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 0.00 129 I 9.38 4.89 2.29 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.49 1.17 0.00 0.00 130 G 8.91 4.17 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 0.00 0.00 0.00 131 G 8.24 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 L 8.20 4.32 0.00 1.84 1.84 1.18 1.20 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 0.00 133 R 7.88 4.00 0.00 1.98 2.02 0.00 3.25 0.00 0.00 3.39 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.85 0.00 134 N 8.11 4.65 0.00 2.77 2.88 0.00 0.00 6.96 7.67 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 0.00 135 S 7.95 4.59 0.00 4.00 3.44 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 0.00 136 A 8.12 3.57 0.49 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 0.00 137 A 7.53 3.94 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 0.00 138 Q 7.55 3.68 0.00 1.18 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.86 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 139 V 7.39 3.52 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 1.05 0.00 0.00 0.94 0.00 0.00 140 D 8.45 4.41 0.00 3.00 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 0.00 141 E 8.10 4.03 0.00 2.05 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.18 0.00 142 L 7.80 4.23 0.00 1.85 1.98 1.06 1.03 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 0.00 143 L 7.84 4.44 0.00 1.71 1.70 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 144 G 7.97 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 0.00 145 L 7.91 4.08 0.00 2.02 1.66 1.02 0.79 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 0.00 146 P 0.00 4.57 0.00 2.18 2.10 0.00 3.77 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 1.99 1.96 0.00 147 E 8.42 4.06 0.00 1.92 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 2.31 1.90 0.00 148 N 9.44 4.50 0.00 2.94 3.09 0.00 0.00 6.58 7.53 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 0.00 149 S 7.76 5.33 0.00 3.76 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 A 8.12 4.97 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 0.00 151 V 8.77 4.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.96 0.00 0.00 152 L 8.12 4.87 0.00 1.53 1.97 1.03 0.86 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 0.00 153 F 7.33 4.92 0.00 3.37 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 0.00 154 G 9.09 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 0.00 155 M 7.95 5.33 0.00 2.20 1.96 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.48 0.00 156 C 9.33 5.32 0.00 3.26 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 0.00 157 L 9.07 5.09 0.00 1.47 1.42 0.91 0.61 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 0.00 158 G 7.87 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 0.00 0.00 0.00 159 H 8.11 4.92 0.00 3.20 3.31 0.00 5.63 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 0.00 160 P 0.00 4.71 0.00 1.96 1.97 0.00 3.72 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 2.08 2.23 0.00 161 D 8.45 5.08 0.00 2.54 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 0.00 162 Q 7.73 4.58 0.00 2.08 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.02 0.00 0.00 0.00 0.00 0.00 2.01 2.18 0.00 163 N 8.18 4.87 0.00 2.60 2.68 0.00 0.00 7.05 7.69 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 0.00 164 P 0.00 4.43 0.00 2.08 1.98 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.03 0.00 165 E 8.33 4.36 0.00 1.99 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.86 0.00 166 V 8.16 3.75 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.93 0.00 0.00 167 K 8.36 3.41 0.00 1.59 1.46 0.00 1.72 0.00 0.00 1.60 0.00 0.00 3.14 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.33 1.01 7.81 168 P 0.00 4.32 0.00 2.15 1.95 0.00 2.88 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 169 R 7.93 4.48 0.00 1.66 1.69 0.00 3.18 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.56 0.00 170 L 7.40 3.05 0.00 1.20 1.16 0.73 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 171 P 0.00 4.22 0.00 1.90 2.06 0.00 3.32 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 172 A 8.56 3.93 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 0.00 173 H 7.93 4.20 0.00 3.25 3.39 0.00 5.52 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 V 7.15 3.72 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 0.71 0.00 0.00 0.72 0.00 0.00 175 V 7.44 3.69 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 0.84 0.00 0.00 0.79 0.00 0.00 176 V 7.46 4.14 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 0.81 0.00 0.00 0.91 0.00 0.00 177 H 8.61 4.75 0.00 3.08 3.30 0.00 5.74 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 0.00 178 E 8.58 4.33 0.00 1.98 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 2.31 2.24 0.00 179 N 9.27 4.42 0.00 2.88 2.97 0.00 0.00 6.80 7.69 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 0.00 180 Q 8.46 4.64 0.00 1.96 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.20 2.15 0.00 181 Y 8.80 3.92 0.00 2.88 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Q 8.15 4.66 0.00 2.10 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.72 0.00 0.00 0.00 0.00 0.00 2.20 1.89 0.00 183 E 8.51 4.26 0.00 1.99 1.92 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 2.34 2.36 0.00 184 L 8.45 3.99 0.00 1.70 1.62 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 185 N 8.52 4.77 0.00 2.76 2.89 0.00 0.00 7.21 6.66 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 0.00 186 L 8.51 4.15 0.00 1.76 1.76 0.95 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 187 D 8.55 4.46 0.00 2.85 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 D 8.31 4.45 0.00 2.90 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 0.00 189 I 7.82 3.96 2.14 0.00 0.00 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 1.59 1.10 1.19 0.00 0.00 190 Q 8.21 4.12 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 191 S 8.13 4.39 0.00 4.09 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 0.00 192 Y 7.98 4.10 0.00 3.02 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 0.00 193 D 8.74 4.43 0.00 2.96 2.79 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 0.00 194 Q 8.13 4.07 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 195 T 7.73 4.06 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 1.14 0.00 0.00 196 M 8.23 3.91 0.00 1.95 1.89 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.34 0.00 197 Q 8.03 4.16 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.98 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 198 A 7.68 4.33 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 0.00 199 Y 7.33 4.00 0.00 2.69 2.82 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 0.00 200 Y 8.09 4.48 0.00 3.09 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 0.00 0.00 0.00 *210 S 8.66 4.16 0.00 3.83 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 0.00 211 T 8.11 4.42 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 212 W 8.77 4.20 0.00 3.42 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 0.00 213 S 9.00 3.68 0.00 4.14 4.41 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 0.00 214 Q 7.93 4.05 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 215 E 8.17 4.08 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 216 V 7.45 3.65 1.72 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 0.51 0.00 0.00 -0.06 0.00 0.00 217 T 7.64 4.00 4.17 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 1.13 0.00 0.00 218 G 7.67 3.55 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 0.00 0.00 0.00 219 K 7.90 4.09 0.00 1.83 2.01 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.46 7.81 220 L 7.54 4.26 0.00 1.58 1.68 0.88 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 221 A 7.71 4.22 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 0.00 222 G 7.44 4.17 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 0.00 0.00 0.00 223 E 8.54 4.23 0.00 1.98 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 2.31 2.33 0.00 224 S 8.33 4.48 0.00 3.82 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 0.00 225 R 8.32 3.70 0.00 1.90 1.73 0.00 3.15 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.62 0.00 226 P 0.00 4.42 0.00 2.20 2.20 0.00 3.81 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 2.04 1.99 0.00 227 H 8.06 4.57 0.00 3.36 3.60 0.00 5.47 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 I 7.63 3.74 1.93 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 1.35 0.85 0.98 0.00 0.00 229 L 7.88 3.95 0.00 1.76 1.67 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 230 P 0.00 4.24 0.00 2.38 2.12 0.00 3.76 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 2.15 2.17 0.00 231 Y 8.18 4.14 0.00 3.11 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 0.00 232 L 8.08 3.59 0.00 1.82 1.63 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.66 4.47 0.00 2.86 2.82 0.00 0.00 6.32 7.90 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 0.00 234 S 7.88 4.11 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 0.00 235 K 7.42 4.34 0.00 1.64 1.82 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.96 1.35 7.81 236 G 8.16 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 L 7.88 4.68 0.00 1.71 1.51 0.94 1.27 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 0.00 238 A 8.31 3.55 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 0.00 239 K 8.07 4.24 0.00 1.75 1.77 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.41 7.81 240 R 7.48 4.13 0.00 1.89 1.84 0.00 2.68 0.00 0.00 3.12 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.11 0.00 * Residues marked with a * may have inaccurate shift predictions.