NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 Q 4.1495 8.3331 119.6885 56.1085 30.8527 175.6481 10 G 3.6497 8.2537 101.7892 44.0608 0.0000 170.0118 11 I 4.3972 8.3086 120.2960 59.6784 39.7430 174.2264 12 T 4.7721 8.1687 115.5149 59.8094 72.4953 175.2754 13 A 4.0286 8.4273 122.7668 55.4516 18.4666 179.9360 14 R 4.2251 8.3332 116.9497 59.4444 30.2501 178.8392 15 G 3.6428 8.0696 105.4511 47.6602 0.0000 175.7201 16 S 4.1244 8.5345 115.6424 61.2731 62.5390 176.0700 17 A 4.0087 8.0810 123.1416 55.1546 17.9937 179.2858 18 E 3.9271 8.2368 117.6349 59.4221 29.6978 179.0345 19 I 3.7745 7.7135 119.9223 64.4200 37.1080 178.6880 20 V 3.5896 8.0528 118.7738 65.7909 31.5038 177.7091 21 A 4.1491 8.0771 120.5918 55.4473 18.2675 179.2182 22 E 3.9804 8.4479 117.7158 59.2970 29.6378 178.5881 23 F 4.4882 8.6289 122.4869 60.9535 39.4168 177.1178 24 F 3.9694 8.1856 117.4840 60.3925 38.5936 177.6040 25 S 3.9669 7.9430 112.5122 61.5578 62.2713 176.3143 26 F 4.1434 8.2417 120.5161 60.2702 38.6075 177.9028 27 G 3.3547 8.3770 105.8379 47.7899 0.0000 175.8405 28 I 3.6200 7.9843 122.9597 63.9357 37.1197 178.1427 29 N 4.3223 7.9720 117.2939 56.5270 38.4056 177.5500 30 S 4.0559 8.0445 116.1581 61.6224 62.8728 176.6007 31 I 3.1912 7.4797 122.3263 64.5210 36.8256 178.5036 32 L 3.8920 7.9653 119.6989 57.6982 41.3404 179.1042 33 Y 3.2186 7.6294 119.5277 60.5220 38.7635 177.6830 34 Q 3.5531 8.3485 119.1581 58.5250 28.9804 178.1778 35 R 4.2155 8.1079 115.0538 55.4303 30.0990 176.5425 36 G 3.9302 7.6706 105.4860 46.6091 0.0000 175.7437 37 I 3.9181 7.9365 123.1617 63.2000 37.3258 176.2418 38 Y 4.7791 7.8702 115.3442 54.9766 41.4734 173.5669 39 P 4.5577 0.0000 0.0000 62.5607 32.3090 178.0333 40 S 4.7434 8.8258 115.7789 60.8879 63.1298 175.6362 41 E 4.3958 8.2634 117.8131 57.7967 30.1032 176.8874 42 T 4.2988 8.1126 110.2519 61.6959 69.0106 173.7178 43 F 5.2470 7.6329 118.7044 56.2167 42.2143 174.5688 44 T 4.7071 8.9969 115.6010 60.0935 70.9805 173.1249 45 R 4.5848 8.5755 126.6118 56.4476 30.7575 176.2724 46 V 4.6041 8.9983 116.6234 59.6199 36.6604 174.3522 47 Q 4.8464 8.4889 121.1183 54.9754 29.8376 175.5605 48 K 3.9637 9.1860 123.5640 56.5151 35.4538 174.9558 49 Y 3.6999 8.9180 120.7113 58.9993 35.3551 171.8023 50 G 4.0191 8.6615 106.8646 45.1693 0.0000 172.9631 51 L 4.8336 7.8078 119.1722 54.0885 43.6872 174.6729 52 T 4.9632 8.2834 114.8145 62.3460 69.6568 174.6575 53 L 4.9266 9.1024 125.4722 52.9765 46.7851 175.0909 54 L 5.0681 8.3335 119.9046 53.2100 43.5267 176.5744 55 V 4.8121 8.4304 116.3273 59.4536 35.7868 175.2504 56 T 3.9254 8.9444 118.6791 62.1299 67.8259 174.1114 57 T 4.4623 8.2028 116.2838 61.3491 70.0890 173.1809 58 D 4.5029 8.0835 123.8313 53.7006 42.0947 176.9889 59 L 3.9210 8.6242 127.0183 57.9343 41.6852 178.9697 60 E 3.9656 8.2034 118.0352 59.6264 29.4229 179.2624 61 L 4.0067 8.4491 120.2448 57.9906 42.0167 178.6227 62 I 3.5837 8.0822 120.2511 64.5444 37.1059 178.2019 63 K 3.8592 8.0713 118.7766 59.7214 31.9601 178.5817 64 Y 4.0383 8.2762 119.7438 60.9615 38.7358 178.3905 65 L 3.8292 8.4882 120.1385 57.5356 41.5955 179.1517 66 N 4.2601 8.4080 116.9513 56.3850 38.6078 177.1371 67 N 4.2238 8.0017 117.7357 56.1835 38.5405 177.5683 68 V 3.6629 7.4728 119.5428 66.0843 31.5390 178.2779 69 V 3.6127 8.1179 118.3095 65.9958 31.2550 177.4901 70 E 3.8461 8.3413 119.2926 59.3813 29.3883 178.6528 71 Q 3.5586 7.7978 119.1371 58.7747 29.0360 178.1042 72 L 4.1710 8.2152 120.5414 57.4837 41.6017 178.9612 73 K 3.8453 8.2475 119.9231 59.7875 31.9096 178.1593 74 D 4.3018 7.7504 117.7711 57.3115 41.1670 178.1952 75 W 4.5192 8.2157 119.4979 59.9166 29.1513 178.5645 76 L 4.1332 8.8623 119.4014 57.9531 40.8109 178.9064 77 Y 4.2489 7.9350 118.5898 60.1223 38.8541 177.2303 78 K 4.2655 7.8048 116.5687 55.2725 32.8670 175.6327 79 C 4.3100 7.8086 115.4054 58.4249 38.2263 173.8187 80 S 4.4191 8.8162 113.1134 58.1293 63.0526 174.6973 81 V 4.2455 7.4711 120.1890 60.2430 32.8913 175.2049 82 Q 4.5590 9.4512 124.9632 56.6455 30.8817 175.9603 83 K 5.2781 7.9655 116.8188 54.5077 37.0386 175.1047 84 L 5.1875 8.9287 125.4108 53.2896 45.0961 175.1590 85 V 5.0115 9.3673 126.0043 61.1701 35.0887 174.1939 86 V 4.8283 9.0132 128.0588 61.7229 33.0807 174.3704 87 V 4.7208 9.1102 129.6785 61.6106 33.4157 174.4107 88 I 5.1951 8.9145 129.0425 59.9077 39.4144 174.9201 89 S 5.2723 9.0105 122.6338 56.2022 67.4938 173.0688 90 N 4.7635 8.9903 122.0115 53.8595 38.9900 175.7661 91 I 3.5965 8.5962 128.1407 64.9177 37.3881 177.8244 92 E 4.0886 8.9182 121.4247 59.2623 29.5917 178.4088 93 S 4.2044 8.1947 112.0832 58.9383 63.7132 175.4313 94 G 3.8723 8.4688 107.9766 44.9880 0.0000 172.8792 95 E 4.0197 7.8135 122.1235 56.2650 30.5507 176.1397 96 V 4.1945 8.5167 127.5731 63.1039 31.9072 175.2761 97 L 4.7590 9.1989 127.2608 55.5399 44.6847 175.9789 98 E 5.1451 7.9953 117.7246 55.1467 33.4442 174.4011 99 R 5.0225 9.1876 127.2316 55.2751 33.4080 173.3615 100 W 4.8113 9.4489 127.6945 55.4165 31.1196 175.3773 101 Q 4.9971 8.4863 124.8708 54.2848 31.9286 173.5262 102 F 5.2523 9.3730 125.3463 55.9728 41.7995 174.1868 103 D 5.5349 9.6954 123.9061 52.6154 43.6212 175.2379 104 I 5.0290 8.5868 123.5048 59.6848 39.5850 174.7771 105 E 4.7425 9.6444 127.3666 54.7450 31.9061 174.2012 106 C 5.1705 8.6575 123.0078 54.9056 47.6726 173.3746 107 D 4.6267 9.2804 126.7562 52.6432 40.0257 176.8229 108 K 4.0140 8.5647 125.6982 58.8073 32.6401 179.5919 109 T 3.8089 8.0077 109.3782 64.1426 68.1538 176.1866 110 A 4.3459 7.9423 124.9374 53.9205 18.0470 179.4859 111 K 3.9917 7.3655 116.0807 59.0419 32.2031 177.7724 112 D 4.5767 8.6206 117.9139 55.0254 41.6050 176.5767 113 D 4.4524 7.5573 120.2407 54.7359 41.1276 177.3557 114 S 4.4444 8.6502 118.9216 59.3748 63.6987 173.8927 115 A 4.7824 7.5045 121.0723 49.2371 22.0808 173.7047 116 P 4.6488 0.0000 0.0000 62.8085 32.3520 176.5461 117 R 4.3231 9.0562 121.3314 55.7377 31.9932 176.2675 118 E 4.6628 8.7030 122.1260 55.6248 29.2784 175.6859 119 K 4.5180 8.1585 124.7771 53.4261 35.6538 176.5404 120 S 4.3185 8.6330 121.5749 58.2889 64.8813 175.1821 121 Q 3.9730 8.6846 123.6702 59.0512 28.6024 178.8008 122 K 3.9371 8.2229 119.9468 59.7308 31.9043 178.1231 123 A 3.9604 7.4887 119.0634 55.3253 18.2661 179.6586 124 I 3.6392 7.7611 118.2709 64.5723 37.1909 178.4433 125 Q 3.9022 8.9269 121.5282 59.3529 28.9480 178.0842 126 D 4.3696 8.6606 120.2124 57.2207 40.7926 178.8024 127 E 3.9080 7.7976 118.9815 59.4504 29.5070 179.2071 128 I 3.0303 7.4533 119.9474 64.2330 36.9659 178.4217 129 R 3.7878 7.8200 119.3510 59.3593 29.9399 178.4526 130 S 4.0693 7.9504 112.7353 61.4257 62.4484 176.3216 131 V 3.7323 7.8587 120.8805 66.1557 31.2361 178.1190 132 I 3.8978 8.1437 119.8123 64.4250 36.9810 178.3905 133 R 3.9741 8.2818 119.1597 59.4598 29.6589 178.8994 134 Q 4.0643 7.8393 117.9784 59.2875 29.3077 177.7199 135 I 4.1816 8.0513 120.8727 65.1021 37.0666 178.4894 136 T 4.8309 8.5645 117.5142 66.2946 68.2832 176.5344 137 A 4.1363 8.2357 122.7459 55.0882 18.2976 179.6896 138 T 3.2348 7.8695 109.0145 64.4198 67.1341 176.8444 139 V 3.6207 7.5332 122.6475 64.9826 30.8517 177.9442 140 T 3.9954 7.7165 108.4910 63.0144 69.0542 175.1257 141 F 4.8879 7.1238 112.4724 56.2075 39.6826 175.4165 142 L 3.2704 7.2094 121.7920 53.8408 41.7911 175.3559 143 P 4.2533 0.0000 0.0000 62.1718 31.8821 176.3360 144 L 3.8411 8.4385 121.7415 55.3388 41.9370 177.0135 145 L 4.2315 8.4569 123.5326 54.7028 41.5070 176.4071 146 E 4.5358 8.7628 122.2888 55.9557 30.1017 175.8173 147 V 4.5440 7.2486 111.3400 58.9369 35.3682 175.1520 148 S 4.4143 8.3457 117.1002 59.0100 63.6541 173.4650 149 C 6.0630 8.9039 120.5562 57.1448 32.1537 172.8153 150 S 5.0657 8.5562 114.8296 56.5398 66.4756 171.9943 151 F 6.1859 8.6498 113.6066 54.4948 41.0530 173.6560 152 D 4.3701 8.5383 116.7785 52.8204 44.8397 173.3233 153 L 5.4662 8.4911 123.4254 53.1208 43.9592 175.7646 154 L 5.2706 9.1252 123.6701 52.9131 45.0977 175.5316 155 I 5.1537 8.6273 114.1951 59.3024 41.1313 173.7348 156 Y 4.5140 8.7927 124.1458 56.0303 41.1224 174.2743 157 T 4.6104 7.3727 120.3088 60.1012 70.1475 173.2756 158 D 4.3891 8.1923 124.9017 55.6894 40.3908 177.7210 159 K 4.2556 7.4263 120.9854 54.5917 30.6133 176.8810 160 D 4.3510 7.8993 122.4759 57.1319 41.4586 179.2572 161 L 4.0533 7.9180 117.8695 56.8370 41.7426 177.9637 162 V 4.2243 7.0936 114.6854 60.9641 31.6986 175.8953 163 V 3.9220 7.4422 121.7035 62.2611 31.7802 174.2015 164 P 4.5457 0.0000 0.0000 62.3820 31.9382 177.0866 165 E 4.0893 8.9451 119.2966 59.4936 29.4936 178.5973 166 K 3.9476 8.2616 117.6709 58.4922 32.2735 176.7429 167 W 4.4757 8.4276 119.2790 55.6542 29.5992 175.5536 168 E 4.5895 8.6470 123.3295 54.5147 30.4371 175.9954 169 E 4.0129 8.7872 122.0264 57.3329 30.0193 176.5147 170 S 4.6416 8.2845 115.9398 56.2459 65.7902 173.3797 171 G 3.9180 8.3706 113.6962 44.2298 0.0000 172.1195 172 P 4.0255 0.0000 0.0000 63.2659 32.0572 176.2026 173 Q 3.2789 7.7493 117.2750 57.0078 25.9452 173.6044 174 F 4.6756 7.4042 114.8474 57.2576 40.3261 175.9441 175 I 4.1483 8.2746 124.3560 61.0731 37.8337 176.1624 176 T 3.9084 8.8101 122.7886 66.4341 68.5313 174.2821 177 N 5.0120 8.0548 123.8822 51.4625 40.9229 173.2009 178 S 5.1868 8.4976 117.2699 56.2109 66.7652 172.7849 179 E 4.6690 8.7446 121.2051 54.1565 32.6487 174.3107 180 E 5.0043 8.3874 122.2653 54.6260 32.7539 174.9264 181 V 4.5245 8.3783 115.2473 59.4159 34.9379 175.3886 182 R 4.1878 8.6562 125.0907 56.3046 30.7969 175.7732 183 L 4.7672 8.5349 126.3388 52.9800 43.8127 176.2365 184 R 4.3601 10.3413 120.3681 56.7510 31.2542 176.2135 185 S 5.3447 8.5832 114.9493 56.7018 66.1783 172.7712 186 F 5.2576 8.3797 114.1185 55.6426 41.5648 173.6686 187 T 4.9187 9.2904 113.7589 60.9103 70.2095 173.9055 188 T 4.2985 8.7024 117.5792 62.0482 69.5145 175.4962 189 T 3.6247 8.1891 112.3990 61.2039 68.9755 172.3390 190 I 4.3162 7.6736 121.2675 62.1051 40.0705 175.2595 191 H 5.3549 8.5836 118.3461 53.6161 32.2743 172.9887 192 K 4.6550 9.0759 123.6954 54.4510 35.3241 174.6818 193 V 4.6262 7.8323 127.3064 61.3200 33.4713 173.8989 194 N 5.1673 9.4004 126.4794 52.3727 40.7209 174.6570 195 S 5.4269 8.3569 114.5303 55.4646 67.8931 172.9760 *197 V 3.8484 8.1010 118.3432 61.6965 32.4023 174.5615 198 A 5.2244 8.4284 125.2288 50.6188 22.5036 174.4803 199 Y 5.2034 8.0481 116.2732 55.4697 41.8641 173.9622 200 K 4.5291 8.6139 122.9604 56.2858 33.0409 176.6866 201 I 3.8476 8.4629 128.8494 60.9511 37.4400 174.4995 202 P 4.3090 0.0000 0.0000 62.5328 31.7627 176.1661 203 V 3.6483 8.4376 122.8755 65.8082 31.4062 175.5334 204 N 5.1290 7.5283 113.1911 50.7426 42.7686 174.2879 205 D 4.6511 8.7889 117.7026 55.1747 40.8578 177.4047 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 9 Q 8.33 4.15 0.00 2.07 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 5.38 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 10 G 8.25 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 11 I 8.31 4.40 1.90 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 1.38 1.22 1.01 0.00 0.00 12 T 8.17 4.77 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 1.25 0.00 0.00 13 A 8.43 4.03 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 14 R 8.33 4.23 0.00 1.92 2.05 0.00 3.13 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.56 0.00 15 G 8.07 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 0.00 0.00 0.00 16 S 8.53 4.12 0.00 3.98 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 17 A 8.08 4.01 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 0.00 0.00 0.00 0.00 0.00 18 E 8.24 3.93 0.00 2.23 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 2.34 2.37 0.00 19 I 7.71 3.77 2.12 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 1.47 0.59 0.99 0.00 0.00 20 V 8.05 3.59 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.94 0.00 0.00 21 A 8.08 4.15 1.55 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 22 E 8.45 3.98 0.00 2.15 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 2.65 2.63 0.00 23 F 8.63 4.49 0.00 2.94 3.18 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 24 F 8.19 3.97 0.00 3.28 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 25 S 7.94 3.97 0.00 3.86 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 26 F 8.24 4.14 0.00 3.25 3.19 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 27 G 8.38 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 0.00 0.00 0.00 28 I 7.98 3.62 1.86 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 1.57 0.76 0.83 0.00 0.00 29 N 7.97 4.32 0.00 2.89 3.13 0.00 0.00 7.08 7.70 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 30 S 8.04 4.06 0.00 4.04 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 31 I 7.48 3.19 1.57 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.26 0.17 0.00 0.00 32 L 7.97 3.89 0.00 1.75 1.86 0.31 -0.02 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 33 Y 7.63 3.22 0.00 1.43 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 8.35 3.55 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.23 6.63 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 35 R 8.11 4.22 0.00 1.82 1.99 0.00 3.49 0.00 0.00 3.52 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.01 0.00 36 G 7.67 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 0.00 0.00 0.00 37 I 7.94 3.92 2.02 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.90 1.06 0.00 0.00 38 Y 7.87 4.78 0.00 3.12 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 39 P 0.00 4.56 0.00 2.41 2.04 0.00 3.78 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.11 0.00 40 S 8.83 4.74 0.00 4.34 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 41 E 8.26 4.40 0.00 2.15 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 0.00 2.30 2.27 0.00 42 T 8.11 4.30 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 1.26 0.00 0.00 43 F 7.63 5.25 0.00 3.13 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 44 T 9.00 4.71 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 45 R 8.58 4.58 0.00 1.71 1.83 0.00 3.19 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 46 V 9.00 4.60 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 0.76 0.00 0.00 1.05 0.00 0.00 47 Q 8.49 4.85 0.00 1.87 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.65 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 48 K 9.19 3.96 0.00 1.08 0.83 0.00 0.97 0.00 0.00 1.05 0.00 0.00 2.31 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 49 Y 8.92 3.70 0.00 3.13 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 50 G 8.66 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 51 L 7.81 4.83 0.00 1.84 1.78 0.99 0.61 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 52 T 8.28 4.96 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 1.19 0.00 0.00 53 L 9.10 4.93 0.00 1.58 1.59 1.02 0.35 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 54 L 8.33 5.07 0.00 0.81 0.89 0.66 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 55 V 8.43 4.81 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 0.63 0.00 0.00 0.92 0.00 0.00 56 T 8.94 3.93 3.69 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 1.04 0.00 0.00 57 T 8.20 4.46 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 1.15 0.00 0.00 58 D 8.08 4.50 0.00 2.59 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 0.00 0.00 0.00 0.00 59 L 8.62 3.92 0.00 1.70 1.67 0.90 0.92 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 60 E 8.20 3.97 0.00 2.18 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 2.41 2.39 0.00 61 L 8.45 4.01 0.00 1.60 1.56 1.04 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 62 I 8.08 3.58 1.97 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.70 0.85 0.00 0.00 63 K 8.07 3.86 0.00 2.01 1.88 0.00 1.74 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.57 7.81 64 Y 8.28 4.04 0.00 3.10 3.25 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 65 L 8.49 3.83 0.00 1.64 1.63 0.87 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 66 N 8.41 4.26 0.00 2.82 2.81 0.00 0.00 6.97 6.86 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 67 N 8.00 4.22 0.00 2.76 2.75 0.00 0.00 6.69 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 68 V 7.47 3.66 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 1.26 0.00 0.00 0.33 0.00 0.00 69 V 8.12 3.61 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 1.02 0.00 0.00 1.01 0.00 0.00 70 E 8.34 3.85 0.00 2.17 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 71 Q 7.80 3.56 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 1.28 1.16 0.00 72 L 8.22 4.17 0.00 2.01 1.97 1.12 1.13 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 73 K 8.25 3.85 0.00 2.03 1.98 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.49 7.81 74 D 7.75 4.30 0.00 2.66 2.57 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 75 W 8.22 4.52 0.00 3.66 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 76 L 8.86 4.13 0.00 1.74 1.68 1.10 0.83 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 77 Y 7.94 4.25 0.00 3.08 3.30 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 78 K 7.80 4.27 0.00 1.87 1.89 0.00 2.22 0.00 0.00 1.85 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.69 7.81 79 C 7.81 4.31 0.00 3.12 3.15 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 80 S 8.82 4.42 0.00 3.96 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 81 V 7.47 4.25 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 0.93 0.00 0.00 0.91 0.00 0.00 82 Q 9.45 4.56 0.00 2.32 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 83 K 7.97 5.28 0.00 1.77 1.71 0.00 1.43 0.00 0.00 1.73 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.67 1.47 7.81 84 L 8.93 5.19 0.00 1.54 1.21 1.06 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 85 V 9.37 5.01 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 0.99 0.00 0.00 1.02 0.00 0.00 86 V 9.01 4.83 2.32 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 1.04 0.00 0.00 1.18 0.00 0.00 87 V 9.11 4.72 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 0.97 0.00 0.00 1.01 0.00 0.00 88 I 8.91 5.20 2.20 0.00 0.00 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 1.42 0.86 1.03 0.00 0.00 89 S 9.01 5.27 0.00 3.75 3.72 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 90 N 8.99 4.76 0.00 2.78 2.72 0.00 0.00 7.40 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 91 I 8.60 3.60 1.96 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.63 0.89 0.00 0.00 92 E 8.92 4.09 0.00 2.11 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 2.34 2.39 0.00 93 S 8.19 4.20 0.00 3.98 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 94 G 8.47 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 0.00 0.00 0.00 95 E 7.81 4.02 0.00 2.05 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 2.34 2.29 0.00 96 V 8.52 4.19 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 0.96 0.00 0.00 1.02 0.00 0.00 97 L 9.20 4.76 0.00 1.65 1.72 0.96 0.50 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 98 E 8.00 5.15 0.00 2.12 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 2.38 2.42 0.00 99 R 9.19 5.02 0.00 1.95 1.79 0.00 3.34 0.00 0.00 3.31 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 100 W 9.45 4.81 0.00 3.35 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 0.00 101 Q 8.49 5.00 0.00 2.12 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 102 F 9.37 5.25 0.00 3.21 3.25 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 0.00 103 D 9.70 5.53 0.00 2.60 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.59 5.03 2.16 0.00 0.00 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 1.62 0.88 1.05 0.00 0.00 105 E 9.64 4.74 0.00 1.85 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 0.00 2.24 2.24 0.00 106 C 8.66 5.17 0.00 2.96 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 0.00 107 D 9.28 4.63 0.00 2.76 2.50 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 0.00 108 K 8.56 4.01 0.00 1.83 1.82 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.41 7.81 109 T 8.01 3.81 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 1.22 0.00 0.00 110 A 7.94 4.35 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 0.00 111 K 7.37 3.99 0.00 1.91 1.83 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.75 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.29 1.30 7.81 112 D 8.62 4.58 0.00 2.68 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 0.00 113 D 7.56 4.45 0.00 2.88 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 0.00 114 S 8.65 4.44 0.00 3.86 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 0.00 115 A 7.50 4.78 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 0.00 116 P 0.00 4.65 0.00 2.04 2.00 0.00 3.68 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 2.14 2.14 0.00 117 R 9.06 4.32 0.00 1.73 1.84 0.00 3.12 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 118 E 8.70 4.66 0.00 1.86 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 2.30 2.31 0.00 119 K 8.16 4.52 0.00 1.67 1.65 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.08 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.44 7.81 120 S 8.63 4.32 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 0.00 121 Q 8.68 3.97 0.00 2.09 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.82 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 122 K 8.22 3.94 0.00 1.78 1.84 0.00 1.74 0.00 0.00 1.97 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.49 7.81 123 A 7.49 3.96 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 0.00 124 I 7.76 3.64 2.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.77 0.89 0.00 0.00 125 Q 8.93 3.90 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.45 2.60 0.00 126 D 8.66 4.37 0.00 2.83 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 0.00 127 E 7.80 3.91 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 128 I 7.45 3.03 1.21 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.40 0.00 0.00 129 R 7.82 3.79 0.00 2.04 2.11 0.00 3.11 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 130 S 7.95 4.07 0.00 4.11 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 0.00 131 V 7.86 3.73 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 1.12 0.00 0.00 132 I 8.14 3.90 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 1.64 0.65 0.98 0.00 0.00 133 R 8.28 3.97 0.00 2.07 2.05 0.00 3.16 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 134 Q 7.84 4.06 0.00 2.45 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.50 2.49 0.00 135 I 8.05 4.18 2.19 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.07 0.92 0.00 0.00 136 T 8.56 4.83 4.51 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 1.30 0.00 0.00 137 A 8.24 4.14 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 7.87 3.23 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 1.39 0.00 0.00 139 V 7.53 3.62 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 0.98 0.00 0.00 0.88 0.00 0.00 140 T 7.72 4.00 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 1.30 0.00 0.00 141 F 7.12 4.89 0.00 3.06 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 L 7.21 3.27 0.00 1.29 1.30 0.93 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 143 P 0.00 4.25 0.00 2.00 1.98 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 144 L 8.44 3.84 0.00 1.59 1.62 0.88 1.04 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 0.00 145 L 8.46 4.23 0.00 1.64 1.65 1.02 0.96 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 0.00 146 E 8.76 4.54 0.00 1.94 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 2.22 2.48 0.00 147 V 7.25 4.54 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 0.76 0.00 0.00 0.94 0.00 0.00 148 S 8.35 4.41 0.00 3.77 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 0.00 149 C 8.90 6.06 0.00 2.83 2.88 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 0.00 150 S 8.56 5.07 0.00 3.83 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 0.00 151 F 8.65 6.19 0.00 3.21 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 0.00 152 D 8.54 4.37 0.00 2.67 2.47 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 0.00 153 L 8.49 5.47 0.00 1.73 1.82 1.19 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 154 L 9.13 5.27 0.00 1.68 1.65 0.99 0.60 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 0.00 155 I 8.63 5.15 1.64 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.49 1.06 0.00 0.00 156 Y 8.79 4.51 0.00 3.01 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 0.00 157 T 7.37 4.61 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 0.75 0.00 0.00 158 D 8.19 4.39 0.00 2.87 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 0.00 159 K 7.43 4.26 0.00 1.74 1.73 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.33 7.81 160 D 7.90 4.35 0.00 2.71 2.65 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 0.00 161 L 7.92 4.05 0.00 1.62 1.74 0.91 0.86 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 0.00 162 V 7.09 4.22 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 0.76 0.00 0.00 1.00 0.00 0.00 163 V 7.44 3.92 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 0.91 0.00 0.00 0.81 0.00 0.00 164 P 0.00 4.55 0.00 2.45 2.05 0.00 3.85 0.00 0.00 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.13 0.00 165 E 8.95 4.09 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 166 K 8.26 3.95 0.00 1.85 1.89 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.52 7.81 167 W 8.43 4.48 0.00 3.59 3.38 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 0.00 168 E 8.65 4.59 0.00 1.96 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 2.27 2.41 0.00 169 E 8.79 4.01 0.00 1.98 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 2.34 2.36 0.00 170 S 8.28 4.64 0.00 3.81 3.72 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 0.00 171 G 8.37 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 0.00 172 P 0.00 4.03 0.00 0.49 1.77 0.00 3.85 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.88 0.00 173 Q 7.75 3.28 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.06 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 174 F 7.40 4.68 0.00 3.07 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 0.00 175 I 8.27 4.15 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.56 0.97 0.00 0.00 176 T 8.81 3.91 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 177 N 8.05 5.01 0.00 2.59 2.70 0.00 0.00 6.50 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 0.00 178 S 8.50 5.19 0.00 3.73 3.73 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 0.00 0.00 0.00 179 E 8.74 4.67 0.00 1.73 1.12 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 1.78 2.02 0.00 180 E 8.39 5.00 0.00 1.84 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.22 0.00 181 V 8.38 4.52 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 0.78 0.00 0.00 1.21 0.00 0.00 182 R 8.66 4.19 0.00 1.82 1.83 0.00 3.23 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 183 L 8.53 4.77 0.00 1.82 1.82 1.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 184 R 10.34 4.36 0.00 1.75 1.93 0.00 3.14 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 185 S 8.58 5.34 0.00 3.96 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 0.00 186 F 8.38 5.26 0.00 3.16 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 0.00 187 T 9.29 4.92 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 188 T 8.70 4.30 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 1.36 0.00 0.00 189 T 8.19 3.62 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 0.00 190 I 7.67 4.32 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.93 0.81 0.00 0.00 191 H 8.58 5.35 0.00 3.09 3.12 0.00 5.75 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 K 9.08 4.66 0.00 1.70 1.56 0.00 1.54 0.00 0.00 1.84 0.00 0.00 2.78 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.24 1.36 7.81 193 V 7.83 4.63 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 0.00 0.00 1.23 0.00 0.00 0.53 0.00 0.00 194 N 9.40 5.17 0.00 2.69 2.74 0.00 0.00 6.36 7.54 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 0.00 195 S 8.36 5.43 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 *197 V 8.10 3.85 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 0.41 0.00 0.00 -0.34 0.00 0.00 198 A 8.43 5.22 1.14 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 0.00 0.00 199 Y 8.05 5.20 0.00 3.04 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 0.00 200 K 8.61 4.53 0.00 1.87 1.83 0.00 1.94 0.00 0.00 1.74 0.00 0.00 2.74 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.45 7.81 201 I 8.46 3.85 1.87 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 1.18 0.49 0.92 0.00 0.00 202 P 0.00 4.31 0.00 2.15 2.04 0.00 3.81 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 203 V 8.44 3.65 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 0.80 0.00 0.00 0.95 0.00 0.00 204 N 7.53 5.13 0.00 2.70 2.68 0.00 0.00 6.86 8.06 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 0.00 205 D 8.79 4.65 0.00 2.67 2.65 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 * Residues marked with a * may have inaccurate shift predictions.