NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2766 7.8827 121.4432 61.1605 38.8913 173.8053 17 V 4.3035 8.4106 125.1942 61.5643 33.2088 174.1691 18 G 3.8305 9.0125 114.6143 46.6676 0.0000 172.9615 19 G 4.3338 7.8701 110.5629 43.6600 0.0000 172.2228 20 Y 4.9547 7.7497 116.6853 55.2154 42.3241 174.6683 21 T 4.3653 8.5978 116.6699 63.8015 68.4407 175.3038 22 C 4.3011 8.6480 125.5066 61.4278 40.3237 173.9175 23 G 4.2216 8.3846 101.9993 42.8755 0.0000 173.3257 24 A 4.1106 8.3673 124.2130 52.7767 18.9278 177.6457 25 N 4.1716 8.6680 121.4679 54.6368 36.2138 174.9890 26 T 4.3337 7.8026 105.8560 61.8999 70.7674 175.0357 27 V 4.0580 6.9868 121.9888 60.3485 31.2559 173.7916 28 P 4.4675 0.0000 0.0000 64.4332 32.0722 178.0102 29 Y 5.1375 6.7446 115.8736 56.2856 38.7087 174.6364 30 Q 4.6122 7.3426 123.2494 56.2251 29.9921 175.1223 31 V 4.8612 9.0650 125.1082 61.1731 35.9460 173.6934 32 S 5.2015 8.6280 118.6380 56.4498 65.1421 172.5101 33 L 4.7204 8.6487 127.5847 53.3002 43.4334 175.0227 34 N 5.9898 9.0308 122.3939 50.0328 42.1395 174.9501 *37 S 4.8459 7.9006 119.9949 58.6923 64.1799 174.4561 38 G 3.9670 9.2798 109.0025 46.4576 0.0000 173.1005 39 Y 4.5396 6.4620 115.3549 56.1555 40.1139 172.7097 40 H 4.7603 8.8489 121.5195 56.0035 30.3576 174.8656 41 F 4.9936 7.9146 119.7471 56.7345 39.5515 173.6373 42 C 4.8008 6.7279 116.9102 56.1884 44.7899 173.0102 43 G 4.3813 8.7088 109.0479 45.3595 0.0000 172.2572 44 G 4.6076 8.3322 105.3285 46.2757 0.0000 172.5044 45 S 5.4431 8.8598 115.4023 56.4422 66.8642 173.5735 46 L 4.8105 9.1014 127.2329 54.6961 42.4859 177.0859 47 I 4.4114 8.4181 119.6251 60.9672 38.8606 174.5471 48 N 4.4721 7.6649 117.4656 52.1275 39.2662 175.1537 49 S 4.1451 8.4819 112.6283 60.8310 62.9096 175.6396 50 Q 4.4839 8.1790 117.3161 55.1560 30.3128 174.5711 51 W 5.4853 8.0498 118.0565 54.7474 33.4859 174.4597 52 V 5.1845 9.1051 122.3835 61.1026 34.7277 174.4558 53 V 4.9183 8.8487 126.2365 60.5007 33.8411 174.8772 54 S 5.1361 8.8821 116.2822 57.7725 66.1509 171.9750 55 A 4.6839 8.5300 120.6652 50.6584 20.3507 178.4941 56 A 3.8542 8.2933 124.4446 55.2595 18.4867 179.1464 57 H 4.5415 8.4476 109.5442 57.3022 28.6820 175.2632 58 C 4.7424 7.8464 117.2186 56.9802 40.4792 173.2578 59 Y 4.3052 7.7985 122.3757 57.8700 38.7633 175.2965 60 K 3.9559 7.2221 124.0066 55.2642 36.2924 175.1216 61 S 4.4000 7.9691 116.3797 58.2231 64.9215 174.1398 62 G 3.5398 8.5325 109.4307 46.2293 0.0000 173.2533 63 I 4.6564 7.1649 118.6068 59.5170 40.5299 176.2947 64 Q 4.8326 8.4672 126.2441 54.2475 32.1652 173.8597 65 V 4.5883 8.9434 126.3443 61.4097 34.0535 174.4776 66 R 5.1932 8.8076 126.4667 54.6118 32.8299 174.9265 67 L 4.7756 9.2320 124.5084 52.6081 44.9877 176.9871 *69 G 4.1022 8.2204 105.8047 46.3977 0.0000 172.7629 70 E 4.6800 8.4961 118.7456 55.1658 30.0377 174.2444 71 D 4.8014 7.8696 117.5735 54.9808 44.3481 173.9448 72 N 5.1985 9.0294 115.0074 52.9782 39.8798 176.2458 73 I 3.8305 8.6397 119.1813 61.9887 38.0609 176.0628 74 N 4.7684 8.8888 118.0255 52.9916 39.1032 174.7060 75 V 4.2908 7.2949 117.4309 60.7694 34.1954 174.9687 76 V 4.1236 8.4656 127.0632 62.4978 31.0172 175.1895 77 E 4.3510 9.1745 127.2669 55.9494 29.9315 177.1119 78 G 4.0710 8.2703 107.2688 45.2532 0.0000 174.2080 79 N 4.9495 8.1230 116.2993 53.2305 39.7724 174.3890 80 E 5.6303 7.9280 117.1988 54.4464 32.3099 175.5531 81 Q 4.3409 8.2886 119.1049 54.3227 33.0524 173.9329 82 F 5.6644 8.7969 122.5820 55.9257 41.3687 174.9492 83 I 4.7030 8.8501 124.5948 59.5083 41.0107 175.5938 84 S 4.6910 8.6689 121.6928 58.0919 64.4793 173.0853 85 A 4.7142 8.3229 124.4709 51.8025 18.7291 177.7457 86 S 4.5869 8.8092 116.4322 59.8298 64.6546 174.4943 87 K 4.6280 7.4361 116.7596 55.9525 35.3520 174.7367 88 S 5.3300 8.7535 116.7896 56.9808 66.7329 173.7502 89 I 4.6076 9.2067 123.8591 59.7134 40.2658 174.9105 90 V 4.3343 8.4352 127.2171 61.6227 33.0545 175.2563 91 H 3.5254 8.5255 126.0227 55.5232 30.0511 174.4241 92 P 4.2263 0.0000 0.0000 65.4903 30.8715 177.0224 93 S 4.7083 7.7675 112.4723 58.0149 62.9632 173.2122 94 Y 4.3242 8.1246 122.9981 57.6979 39.1144 174.5352 95 N 4.6197 8.1049 125.2997 51.3890 40.0123 175.0240 96 S 3.9756 7.7131 120.0774 59.4615 63.5750 175.1243 97 N 4.4012 8.1594 119.0758 55.2467 38.5682 175.9853 98 T 4.0551 7.6219 105.1333 60.4624 70.1334 174.5754 99 L 3.7756 7.6663 120.7962 55.6132 39.8109 173.8857 100 N 4.4997 7.6356 117.5876 54.5652 39.6289 174.5062 101 N 4.8312 8.6995 120.0846 54.3681 35.7485 175.6237 102 D 4.6982 7.9107 117.6507 52.8786 39.6511 174.9199 103 I 4.8143 7.0887 120.7732 59.5040 42.2970 172.9405 104 M 5.4356 9.2028 126.5508 54.2746 36.4693 173.1996 105 L 5.4357 9.2747 123.0023 53.0709 45.4125 175.5671 106 I 5.0441 9.0192 123.1892 59.5060 40.5443 174.3297 107 K 3.8262 8.7460 129.0037 54.5372 33.7022 175.4035 108 L 4.6409 8.0597 126.6525 53.9580 42.7069 178.1868 109 K 4.0817 8.8892 122.3578 58.8616 32.5103 177.7221 110 S 4.6409 7.3917 110.6192 56.1626 66.6449 173.3874 111 A 4.4703 8.3536 124.3360 51.7062 18.9453 177.4694 112 A 4.3363 8.8830 123.8662 51.9565 19.7659 177.2112 113 S 4.6374 8.8152 116.2096 57.0611 63.8557 174.5970 114 L 4.5347 8.5265 125.4962 54.3255 42.5332 176.2693 115 N 4.8200 8.7018 117.8874 52.6280 39.6971 174.9043 116 S 4.1611 8.7635 112.9932 61.8975 62.9809 175.5997 117 R 4.1886 8.4454 117.9959 56.7257 30.5133 176.4329 118 V 4.4267 7.8709 116.8867 60.9167 33.4655 173.7405 119 A 5.2097 8.6431 128.3795 50.3895 23.1170 174.7597 120 S 5.1701 8.6732 113.6812 57.3347 65.3171 173.1146 121 I 4.4814 8.1925 120.6097 59.2153 39.7706 175.4557 122 S 4.4538 8.3560 123.0969 58.0021 63.7879 173.8748 123 L 4.4130 8.0678 122.9708 53.2283 42.6005 175.2086 124 P 4.5502 0.0000 0.0000 62.8982 32.2727 176.2048 125 T 4.1536 8.2143 108.5666 62.4122 70.0068 174.5390 *127 S 4.4523 7.5600 114.6810 58.1318 64.0663 173.5698 128 C 4.4730 8.3376 117.4438 56.1182 40.8959 173.8908 129 A 4.3360 7.9928 125.4194 51.6511 19.3476 177.5120 130 S 4.2477 8.0866 115.1722 57.7205 64.1398 173.7359 *132 A 4.1870 8.1887 124.4936 53.4182 19.2771 176.8435 133 G 4.0231 8.9333 109.8208 45.4596 0.0000 174.5995 134 T 3.9932 7.6076 116.9475 63.8537 69.4627 173.6532 135 Q 4.7770 8.5470 124.5078 55.3297 30.4071 175.5245 136 C 5.2522 9.2323 119.6889 55.0978 46.3686 172.3238 137 L 5.2842 9.0656 121.9970 53.5142 44.2436 174.9778 138 I 5.2500 9.0876 127.2317 58.8235 40.0453 174.8390 139 S 4.9198 8.6844 119.3018 56.3942 66.6585 173.0467 140 G 3.8398 7.3466 108.6820 46.1088 0.0000 172.7680 141 W 4.8485 8.6303 117.4145 56.2606 29.5592 177.0587 142 G 4.0792 8.3076 108.9103 43.8969 0.0000 173.6240 143 N 3.6583 8.2616 118.2023 54.3603 38.9177 174.4661 144 T 5.1184 8.1594 112.7372 60.3796 69.3372 174.0229 145 K 4.6524 7.7621 120.6816 54.9907 34.9636 176.4063 146 S 4.3289 8.7549 118.8822 60.9402 63.1572 174.8823 147 S 4.5353 8.9669 116.3742 54.6627 62.6920 173.4841 148 G 4.2505 7.1505 111.6175 44.1558 0.0000 169.3716 149 T 4.7810 7.7877 115.8496 61.7420 71.8089 174.4155 150 S 4.4399 9.5222 122.2701 57.6297 65.6600 172.1183 151 Y 4.7778 8.7426 126.0574 55.6975 38.9858 174.4362 152 P 4.6881 0.0000 0.0000 62.6646 32.8719 175.3937 153 D 4.9522 8.6481 116.8619 54.5531 42.9009 176.6498 154 V 5.3590 7.7189 110.4559 58.2993 34.6579 175.4343 155 L 3.2950 8.3403 123.9226 55.0024 43.0654 175.9717 156 K 4.8649 8.1462 124.5408 54.8032 35.3697 174.5069 157 C 5.3319 8.4306 119.6475 55.1847 43.2859 172.9794 158 L 4.9265 8.5686 122.5445 53.8481 45.5497 174.4102 159 K 5.1560 8.9453 125.3652 55.0243 33.7947 175.6541 160 A 4.8694 9.1096 125.4058 49.8056 23.1512 173.5772 161 P 5.0612 0.0000 0.0000 61.8231 34.0107 175.1156 162 I 4.2771 8.3533 122.3437 61.3753 38.1606 175.7182 163 L 4.8860 8.4691 126.6471 52.9913 43.8103 176.8518 164 S 4.3288 7.9939 115.8893 58.2269 63.7639 175.4162 165 D 4.4761 8.7398 122.3756 57.4621 40.5053 179.2502 166 S 4.1795 8.0699 114.8608 61.5150 62.8974 176.6304 167 S 4.1742 8.0627 117.5622 60.9299 62.9103 175.7463 168 C 4.3520 8.1156 121.6958 59.6937 43.2946 175.8238 169 K 3.9961 8.2879 118.9622 59.5061 31.6545 179.3332 170 S 4.2746 8.0244 114.6359 61.1310 62.7653 176.1214 171 A 4.0309 7.5775 123.2319 53.5431 19.7288 177.3101 172 Y 4.8351 7.6009 114.1780 55.1394 38.0508 172.6924 173 P 4.4550 0.0000 0.0000 63.9511 32.2488 177.1886 174 G 3.9863 9.0359 110.1084 46.1678 0.0000 173.7085 175 Q 4.5534 8.2166 117.0357 55.3712 30.5558 175.5867 176 I 4.4141 7.8649 119.4435 60.0408 38.4731 175.2566 177 T 4.6144 8.1954 115.0731 59.4996 71.0687 175.0813 178 S 4.3606 8.5531 114.8956 60.2801 63.1596 174.3628 179 N 4.9599 8.1653 118.4808 53.3444 38.5021 173.8423 180 M 5.5862 7.8608 116.8574 53.8643 36.2449 174.4403 181 F 5.0796 8.6193 114.7766 56.0062 42.2204 172.3615 182 C 5.8900 9.2872 115.8439 54.7703 41.7142 172.8286 183 A 5.0333 9.0934 121.8998 50.8028 22.3821 175.8101 184A G 4.0258 6.7692 106.9269 44.7755 0.0000 172.5221 184 Y 4.6539 8.2998 119.1868 56.0521 41.3311 176.3467 185 L 4.1508 8.6958 125.1104 57.6590 42.1444 179.3182 186 E 3.8176 8.2400 117.5086 57.8134 29.8391 176.4588 187 G 3.7637 7.8789 103.9063 44.3207 0.0000 171.8174 188A G 4.1149 9.0543 106.4830 44.6859 0.0000 174.2698 188 K 5.2070 7.0902 117.5108 53.5232 35.1863 175.5692 189 D 4.6131 8.3368 122.3925 53.8728 44.7617 174.8179 190 S 5.0093 8.7734 117.1513 58.1006 65.3577 172.7408 191 C 4.7244 9.0579 118.6166 55.4013 44.6342 172.1700 192 Q 4.4296 8.5269 121.8234 57.6097 28.8153 176.8618 193 G 4.4324 9.2463 112.7305 45.7626 0.0000 173.8620 194 D 4.7436 8.3539 118.6020 54.9463 41.9062 176.8221 195 S 4.4406 8.0751 115.6762 60.5269 63.4874 175.5105 196 G 4.0760 8.8213 112.4844 46.3542 0.0000 173.7032 197 G 4.4436 7.7872 107.4551 45.0255 0.0000 171.3178 198 P 5.1516 0.0000 0.0000 62.3276 33.6389 175.7258 199 V 4.5984 8.4459 120.4618 61.4792 34.4921 174.0251 200 V 4.8960 8.7709 128.8971 61.2544 34.0348 173.6940 201 C 5.1372 8.7970 124.5645 55.8164 44.0202 174.5711 202 S 3.7199 9.8182 119.3261 59.7074 60.1778 173.2278 203 G 3.9228 8.3868 104.1297 45.7139 0.0000 173.8609 204 K 4.7010 7.6104 117.8091 52.9980 35.3042 175.5360 *209 L 4.2820 8.2557 122.4823 55.4874 42.1123 175.9189 210 Q 4.5627 8.7436 125.6500 56.4444 30.8701 175.6982 211 G 5.3101 7.9522 104.7475 46.0041 0.0000 171.5535 212 I 5.1584 8.2122 119.5160 58.8801 41.2068 175.2871 213 V 3.7033 8.9434 127.3966 64.0333 31.7996 174.2748 214 S 4.8159 8.4701 120.8764 58.7646 64.2594 174.2131 215 W 4.9717 7.3900 114.2418 56.5607 31.9233 172.0227 216 G 3.8324 7.9180 105.5393 45.9779 0.0000 172.4187 217 S 4.5372 8.2033 114.7228 56.4282 63.7500 173.2297 *219 G 4.2944 8.0696 118.6599 45.5562 0.0000 170.9161 220 C 4.9676 8.2558 116.6606 56.6515 42.7350 173.7521 221A A 4.0015 9.1324 125.5096 53.2205 16.3906 177.2555 221 Q 4.5790 7.2858 116.6719 56.2064 29.8814 175.8915 222 K 4.2648 8.4049 121.3339 57.9247 32.7309 176.0442 223 N 4.2814 9.2619 121.6431 54.1969 37.0466 175.4084 224 K 4.4116 7.5185 114.8009 54.0120 32.5687 173.8445 225 P 4.6277 0.0000 0.0000 62.1634 33.3392 177.3544 226 G 3.7921 8.4754 106.7063 45.8033 0.0000 172.7685 227 V 4.4245 7.5061 120.6176 60.6909 34.0876 174.0870 228 Y 4.8157 8.1660 124.6405 55.9649 41.8904 175.0694 229 T 4.4039 8.5320 119.6400 63.5589 70.1709 174.3893 230 K 5.0945 9.3172 128.1980 55.3535 31.4647 177.1723 231 V 3.9820 8.7939 126.5723 65.9449 31.3557 174.9149 232 C 4.3469 8.3282 112.5072 58.0622 41.5191 174.6978 233 N 4.3016 7.8911 116.7381 54.1919 38.5760 174.9997 234 Y 4.8500 7.8013 117.6261 57.5393 39.2115 177.6042 235 V 3.6754 8.0539 121.7595 66.2513 31.5012 178.0863 236 S 4.1191 8.0996 114.3473 61.3564 62.6783 176.3229 237 W 4.1464 8.2900 130.4832 60.4626 30.4420 177.7908 238 I 2.9628 8.2774 120.0191 64.1728 36.6169 178.3616 239 K 3.6990 8.1112 119.3885 59.6814 31.6807 179.4474 240 Q 3.8769 7.8617 116.9286 59.1662 28.9329 178.6766 241 T 3.7372 7.5727 117.1778 66.4616 68.2583 176.9256 242 I 2.4783 7.2443 115.0111 63.3760 37.1265 178.0526 243 A 4.0188 7.4326 121.0103 53.9946 18.2234 178.6546 244 S 4.6505 7.2955 111.0564 58.4020 63.3509 174.0533 245 N 4.7011 7.9232 125.4433 53.5661 39.4529 174.0963 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 16 I 7.88 4.28 1.78 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 1.46 0.52 0.85 0.00 0.00 17 V 8.41 4.30 2.09 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 1.03 0.00 0.00 0.90 0.00 0.00 18 G 9.01 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 0.00 0.00 0.00 19 G 7.87 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.75 4.95 0.00 3.01 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.60 4.37 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 1.23 0.00 0.00 22 C 8.65 4.30 0.00 2.77 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 23 G 8.38 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 0.00 0.00 0.00 24 A 8.37 4.11 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 25 N 8.67 4.17 0.00 2.82 2.87 0.00 0.00 7.25 7.57 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 26 T 7.80 4.33 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 1.26 0.00 0.00 27 V 6.99 4.06 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 0.35 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.47 0.00 2.36 2.38 0.00 3.60 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.99 0.00 29 Y 6.74 5.14 0.00 3.24 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 0.00 30 Q 7.34 4.61 0.00 1.81 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.52 0.00 0.00 0.00 0.00 0.00 1.92 2.48 0.00 31 V 9.06 4.86 2.16 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 0.87 0.00 0.00 1.07 0.00 0.00 32 S 8.63 5.20 0.00 3.18 3.34 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 33 L 8.65 4.72 0.00 0.50 0.98 0.80 0.28 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 N 9.03 5.99 0.00 2.45 2.49 0.00 0.00 6.55 8.13 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 *37 S 7.90 4.85 0.00 3.70 3.70 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 38 G 9.28 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 39 Y 6.46 4.54 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.85 4.76 0.00 2.88 3.19 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.91 4.99 0.00 3.16 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 42 C 6.73 4.80 0.00 2.29 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.71 4.38 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 0.00 44 G 8.33 4.61 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 0.00 0.00 0.00 45 S 8.86 5.44 0.00 3.83 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.10 4.81 0.00 1.87 1.67 1.08 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.42 4.41 1.90 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 1.55 0.91 1.01 0.00 0.00 48 N 7.66 4.47 0.00 2.93 2.98 0.00 0.00 6.26 8.52 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 49 S 8.48 4.15 0.00 4.04 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 50 Q 8.18 4.48 0.00 2.13 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 51 W 8.05 5.49 0.00 3.15 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 52 V 9.11 5.18 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 1.13 0.00 0.00 0.99 0.00 0.00 53 V 8.85 4.92 2.16 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 0.73 0.00 0.00 1.06 0.00 0.00 54 S 8.88 5.14 0.00 3.91 3.77 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 55 A 8.53 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.29 3.85 0.30 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 57 H 8.45 4.54 0.00 3.37 3.57 0.00 5.55 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 58 C 7.85 4.74 0.00 3.25 3.37 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 59 Y 7.80 4.31 0.00 2.93 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 60 K 7.22 3.96 0.00 1.33 1.23 0.00 0.61 0.00 0.00 1.02 0.00 0.00 2.59 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 0.80 7.81 61 S 7.97 4.40 0.00 3.75 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 62 G 8.53 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 0.00 0.00 0.00 63 I 7.16 4.66 1.88 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 1.41 0.65 0.94 0.00 0.00 64 Q 8.47 4.83 0.00 1.99 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 65 V 8.94 4.59 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.91 0.00 0.00 66 R 8.81 5.19 0.00 1.61 1.85 0.00 2.67 0.00 0.00 2.38 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.24 0.00 67 L 9.23 4.78 0.00 1.59 1.61 0.95 0.69 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 *69 G 8.22 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 70 E 8.50 4.68 0.00 2.21 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 2.12 0.00 71 D 7.87 4.80 0.00 2.76 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 72 N 9.03 5.20 0.00 2.84 2.81 0.00 0.00 7.21 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 73 I 8.64 3.83 1.44 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 1.17 0.54 -0.51 0.00 0.00 74 N 8.89 4.77 0.00 2.79 2.87 0.00 0.00 6.58 7.68 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 75 V 7.29 4.29 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 0.74 0.00 0.00 0.99 0.00 0.00 76 V 8.47 4.12 2.09 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 0.78 0.00 0.00 1.03 0.00 0.00 77 E 9.17 4.35 0.00 2.00 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 2.30 2.46 0.00 78 G 8.27 4.07 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 0.00 79 N 8.12 4.95 0.00 2.80 2.80 0.00 0.00 7.06 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.93 5.63 0.00 1.30 1.56 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 2.50 2.41 0.00 81 Q 8.29 4.34 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.84 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 82 F 8.80 5.66 0.00 2.80 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 83 I 8.85 4.70 1.88 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 1.24 0.75 0.95 0.00 0.00 84 S 8.67 4.69 0.00 3.76 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 85 A 8.32 4.71 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 86 S 8.81 4.59 0.00 3.77 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.44 4.63 0.00 1.85 1.90 0.00 1.46 0.00 0.00 1.94 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.24 1.49 7.81 88 S 8.75 5.33 0.00 3.98 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 89 I 9.21 4.61 2.07 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.06 1.15 0.00 0.00 90 V 8.44 4.33 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 0.61 0.00 0.00 0.74 0.00 0.00 91 H 8.53 3.53 0.00 2.82 3.05 0.00 5.66 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.23 0.00 2.13 2.17 0.00 2.71 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.86 0.00 93 S 7.77 4.71 0.00 3.93 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 94 Y 8.12 4.32 0.00 2.95 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.10 4.62 0.00 2.60 2.44 0.00 0.00 6.60 7.39 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 96 S 7.71 3.98 0.00 3.98 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 97 N 8.16 4.40 0.00 2.78 2.79 0.00 0.00 6.76 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 98 T 7.62 4.06 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 99 L 7.67 3.78 0.00 1.51 1.90 0.74 0.84 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 0.00 100 N 7.64 4.50 0.00 2.77 2.65 0.00 0.00 7.28 6.54 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 0.00 101 N 8.70 4.83 0.00 3.09 2.67 0.00 0.00 7.25 8.32 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 0.00 102 D 7.91 4.70 0.00 3.08 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 0.00 103 I 7.09 4.81 1.52 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 1.38 1.16 0.10 0.00 0.00 104 M 9.20 5.44 0.00 2.12 1.83 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.65 0.00 105 L 9.27 5.44 0.00 1.71 1.80 -0.01 1.03 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 0.00 106 I 9.02 5.04 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 1.22 0.85 0.90 0.00 0.00 107 K 8.75 3.83 0.00 0.79 1.07 0.00 1.34 0.00 0.00 1.35 0.00 0.00 2.63 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.70 0.21 7.81 108 L 8.06 4.64 0.00 1.56 1.55 0.97 1.07 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 0.00 109 K 8.89 4.08 0.00 1.65 1.83 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.56 7.81 110 S 7.39 4.64 0.00 3.84 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 0.00 111 A 8.35 4.47 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 0.00 112 A 8.88 4.34 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 0.00 113 S 8.82 4.64 0.00 3.76 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.53 4.53 0.00 1.65 1.71 0.96 1.07 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 0.00 115 N 8.70 4.82 0.00 2.89 2.92 0.00 0.00 6.97 7.72 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 0.00 116 S 8.76 4.16 0.00 3.89 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 0.00 117 R 8.45 4.19 0.00 1.92 1.98 0.00 3.10 0.00 0.00 3.15 7.37 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.45 0.00 4.00 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 0.00 128 C 8.34 4.47 0.00 2.93 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 0.00 129 A 7.99 4.34 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 0.00 130 S 8.09 4.25 0.00 3.84 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *132 A 8.19 4.19 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 0.00 133 G 8.93 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.61 3.99 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 1.15 0.00 0.00 135 Q 8.55 4.78 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 136 C 9.23 5.25 0.00 2.75 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 0.00 137 L 9.07 5.28 0.00 1.73 1.55 1.04 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.09 5.25 1.87 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 0.74 1.46 0.98 0.00 0.00 139 S 8.68 4.92 0.00 3.52 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 0.00 140 G 7.35 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 0.00 141 W 8.63 4.85 0.00 3.23 2.98 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 0.00 142 G 8.31 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 0.00 0.00 0.00 143 N 8.26 3.66 0.00 2.14 2.57 0.00 0.00 7.36 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 0.00 144 T 8.16 5.12 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 145 K 7.76 4.65 0.00 1.78 1.71 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.29 1.34 7.81 146 S 8.75 4.33 0.00 3.87 4.13 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 0.00 147 S 8.97 4.54 0.00 3.81 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 0.00 148 G 7.15 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 7.79 4.78 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 1.48 0.00 0.00 150 S 9.52 4.44 0.00 3.83 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.74 4.78 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.69 0.00 2.40 2.09 0.00 4.00 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 153 D 8.65 4.95 0.00 2.68 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 0.00 154 V 7.72 5.36 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 1.04 0.00 0.00 0.97 0.00 0.00 155 L 8.34 3.30 0.00 1.31 1.26 -0.75 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.15 4.86 0.00 1.67 1.48 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.45 7.81 157 C 8.43 5.33 0.00 1.43 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 0.00 0.00 0.00 158 L 8.57 4.93 0.00 1.69 1.44 1.03 0.67 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 0.00 159 K 8.95 5.16 0.00 1.81 1.81 0.00 1.86 0.00 0.00 1.77 0.00 0.00 2.75 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.62 7.81 160 A 9.11 4.87 1.17 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 0.00 161 P 0.00 5.06 0.00 2.03 2.09 0.00 3.17 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.77 0.00 162 I 8.35 4.28 1.75 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.51 0.77 0.00 0.00 163 L 8.47 4.89 0.00 1.57 1.59 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 164 S 7.99 4.33 0.00 4.20 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.74 4.48 0.00 2.73 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 0.00 166 S 8.07 4.18 0.00 4.05 4.13 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 0.00 167 S 8.06 4.17 0.00 4.11 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 0.00 168 C 8.12 4.35 0.00 3.23 3.39 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 0.00 169 K 8.29 4.00 0.00 1.87 1.91 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.64 7.81 170 S 8.02 4.27 0.00 3.89 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 0.00 171 A 7.58 4.03 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.60 4.84 0.00 3.24 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 0.00 173 P 0.00 4.45 0.00 2.08 2.04 0.00 3.84 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 2.05 2.22 0.00 174 G 9.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.22 4.55 0.00 2.46 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.30 6.51 0.00 0.00 0.00 0.00 0.00 2.26 2.55 0.00 176 I 7.86 4.41 1.98 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 1.88 0.96 0.99 0.00 0.00 177 T 8.20 4.61 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 1.28 0.00 0.00 178 S 8.55 4.36 0.00 4.01 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 0.00 179 N 8.17 4.96 0.00 3.06 3.09 0.00 0.00 6.63 8.15 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 0.00 180 M 7.86 5.59 0.00 1.79 1.97 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 181 F 8.62 5.08 0.00 3.08 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 0.00 182 C 9.29 5.89 0.00 2.96 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 0.00 183 A 9.09 5.03 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 184A G 6.77 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 0.00 184 Y 8.30 4.65 0.00 3.04 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 0.00 185 L 8.70 4.15 0.00 1.74 1.89 0.92 0.96 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 0.00 186 E 8.24 3.82 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 187 G 7.88 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 188A G 9.05 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.09 5.21 0.00 1.44 1.76 0.00 1.01 0.00 0.00 1.24 0.00 0.00 2.22 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.49 1.06 7.81 189 D 8.34 4.61 0.00 2.78 2.54 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 0.00 190 S 8.77 5.01 0.00 3.99 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.06 4.72 0.00 2.94 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 0.00 192 Q 8.53 4.43 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 5.55 0.00 0.00 0.00 0.00 0.00 2.71 2.54 0.00 193 G 9.25 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 0.00 0.00 0.00 0.00 194 D 8.35 4.74 0.00 3.01 2.78 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 0.00 195 S 8.08 4.44 0.00 3.97 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 0.00 196 G 8.82 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 0.00 0.00 0.00 197 G 7.79 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.15 0.00 2.30 2.33 0.00 3.70 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 2.25 2.26 0.00 199 V 8.45 4.60 2.28 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 0.82 0.00 0.00 0.75 0.00 0.00 200 V 8.77 4.90 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.61 0.00 0.00 201 C 8.80 5.14 0.00 2.79 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 0.00 202 S 9.82 3.72 0.00 3.92 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 0.00 203 G 8.39 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 0.00 0.00 0.00 204 K 7.61 4.70 0.00 1.71 1.64 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.40 7.81 *209 L 8.26 4.28 0.00 1.51 1.65 1.01 0.75 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 0.00 210 Q 8.74 4.56 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.31 0.00 0.00 0.00 0.00 0.00 2.42 2.34 0.00 211 G 7.95 5.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.21 5.16 1.92 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 1.30 0.94 1.01 0.00 0.00 213 V 8.94 3.70 2.34 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 0.96 0.00 0.00 1.19 0.00 0.00 214 S 8.47 4.82 0.00 3.87 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 0.00 215 W 7.39 4.97 0.00 3.32 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 0.00 216 G 7.92 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 0.00 0.00 0.00 217 S 8.20 4.54 0.00 4.22 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 *219 G 8.07 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 0.00 220 C 8.26 4.97 0.00 2.95 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 221A A 9.13 4.00 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 0.00 221 Q 7.29 4.58 0.00 2.20 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.12 0.00 0.00 0.00 0.00 0.00 2.56 2.47 0.00 222 K 8.40 4.26 0.00 1.72 1.71 0.00 1.93 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.64 7.81 223 N 9.26 4.28 0.00 2.80 2.80 0.00 0.00 6.74 8.26 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 0.00 224 K 7.52 4.41 0.00 1.70 1.78 0.00 1.73 0.00 0.00 1.37 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.50 7.81 225 P 0.00 4.63 0.00 2.13 2.11 0.00 3.68 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 226 G 8.48 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 0.00 227 V 7.51 4.42 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 0.00 0.00 0.27 0.00 0.00 -0.78 0.00 0.00 228 Y 8.17 4.82 0.00 1.43 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 0.00 229 T 8.53 4.40 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 0.00 230 K 9.32 5.09 0.00 2.13 1.97 0.00 1.84 0.00 0.00 1.86 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.66 7.81 231 V 8.79 3.98 2.34 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 1.17 0.00 0.00 1.15 0.00 0.00 232 C 8.33 4.35 0.00 3.16 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 0.00 233 N 7.89 4.30 0.00 2.33 2.39 0.00 0.00 6.88 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Y 7.80 4.85 0.00 3.15 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 0.00 235 V 8.05 3.68 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 1.13 0.00 0.00 1.10 0.00 0.00 236 S 8.10 4.12 0.00 3.97 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.29 4.15 0.00 3.48 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 0.00 238 I 8.28 2.96 1.98 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.03 0.72 0.00 0.00 239 K 8.11 3.70 0.00 1.77 1.79 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.62 7.81 240 Q 7.86 3.88 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 241 T 7.57 3.74 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 242 I 7.24 2.48 0.56 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.65 -0.41 0.00 0.00 243 A 7.43 4.02 1.27 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 0.00 0.00 244 S 7.30 4.65 0.00 3.79 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 N 7.92 4.70 0.00 2.95 2.99 0.00 0.00 6.94 7.72 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 * Residues marked with a * may have inaccurate shift predictions.