NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 44 M 4.3102 8.3044 118.1696 54.3524 32.6439 175.0603 45 D 4.2133 8.3548 117.9310 54.6822 42.4192 176.1560 46 K 4.1121 9.4137 132.5694 59.9328 32.4829 176.4624 47 T 4.1441 7.9466 115.9893 66.8133 68.3979 176.7292 48 T 3.8800 8.0874 117.3947 66.5941 68.5313 176.2386 49 F 4.0979 7.8852 122.4606 61.5325 39.3343 177.3629 50 R 3.7932 8.1226 117.4597 59.0750 29.9172 178.9015 51 L 3.9474 7.9915 119.9904 58.1375 42.1553 179.0683 52 L 4.0002 8.0167 118.8764 57.8154 41.7109 179.3836 53 R 3.9029 7.8497 118.8059 59.2590 29.9361 178.6902 54 G 3.6200 8.0725 105.5642 47.8510 0.0000 175.2956 55 E 4.0689 8.2007 121.8299 58.9139 29.6950 178.7263 56 S 4.2137 8.3194 113.2858 61.6903 62.4922 176.0103 57 N 4.5029 8.4659 119.1615 56.1518 38.0349 177.2399 58 L 3.9199 7.8542 120.9659 58.2452 42.6458 178.7871 59 F 3.7625 8.4804 117.8462 60.2869 38.6273 176.9270 60 Y 3.7797 7.9107 119.5764 60.8789 38.3043 178.5027 61 T 3.6914 7.7274 108.7965 63.7629 69.0631 175.3890 62 L 4.1968 7.3262 119.7859 53.7528 42.3125 175.6729 63 A 4.6161 6.9354 124.0542 51.8640 19.5416 177.7877 64 K 4.6545 8.9438 124.1358 52.9818 36.5342 174.0661 65 W 4.9317 8.9726 133.7047 56.5742 32.4539 175.1555 66 E 4.4877 8.2074 122.9685 55.1315 33.2520 172.2638 67 N 3.7855 8.8298 118.1482 55.3096 36.5979 174.2347 68 N 3.1400 7.5994 109.4442 52.6659 36.5461 174.6724 69 K 4.0405 5.6600 114.8434 55.1031 36.2315 173.3956 70 I 5.0258 8.3724 126.3151 60.1283 39.2161 174.5924 71 S 4.9574 8.8231 122.5549 56.5376 66.9749 172.6858 72 V 4.5188 8.0618 119.5804 60.8776 33.7678 174.4768 73 E 4.1671 8.7589 129.5217 55.5765 30.4955 175.7979 74 L 4.2005 8.3941 128.9682 53.4117 42.3122 174.4656 75 P 4.4628 0.0000 0.0000 61.8208 32.5553 175.8944 76 E 4.0495 8.5687 119.4660 57.1539 29.9459 176.1715 77 N 4.3601 8.4552 113.8102 54.1476 36.2711 174.7234 78 L 4.3401 7.3819 122.0793 54.4121 41.9375 176.3894 79 D 4.6054 8.6332 126.5218 55.3013 40.2964 173.0434 80 M 4.8941 7.5282 112.8272 53.6066 34.3109 174.6014 81 Q 4.2606 8.5322 119.4383 54.7655 29.1159 176.0789 82 S 4.1559 8.7450 118.2324 58.6139 63.4849 173.0676 83 P 4.8568 0.0000 0.0000 61.2104 29.3526 174.3281 84 T 5.1820 7.4415 111.9555 61.4250 72.7026 174.1212 85 M 4.9156 9.0221 122.0832 54.2428 35.5310 173.9696 86 T 5.0240 8.8699 122.5965 61.7793 71.3569 173.4742 87 L 5.1902 9.1128 125.1779 52.9733 45.6068 175.4244 88 I 5.0484 8.8034 122.4839 59.8695 40.4645 174.2944 89 Y 5.3655 9.3797 124.3298 56.2092 42.1354 175.1731 90 D 5.1035 8.7334 124.2091 52.6851 41.6717 177.7414 91 E 4.0866 8.8437 113.8300 59.2099 29.7051 175.5849 92 T 4.0355 7.9877 113.3059 65.3857 68.7052 175.5241 93 G 4.0423 8.2169 108.2308 44.6812 0.0000 173.4998 94 K 4.1121 8.2977 122.2989 55.6142 32.6448 175.8142 95 L 3.8632 8.6152 128.7007 55.2959 42.3808 175.8840 96 L 4.6707 8.5609 126.3368 55.7414 43.7960 177.0519 97 W 4.9189 7.6271 127.3416 56.3502 34.2359 173.3365 98 T 4.6120 7.3600 120.6750 60.3066 69.2268 173.3213 99 Q 3.6405 8.5250 130.2156 58.4579 29.7398 176.6211 100 R 4.5245 7.3736 115.4151 54.3809 34.1416 175.3169 101 N 4.3746 8.4074 121.1638 52.5103 37.5293 172.9319 102 I 4.1525 7.2169 121.1431 58.1995 36.9892 174.7349 103 P 4.2718 0.0000 0.0000 65.0204 31.6052 179.1783 104 W 4.3134 8.0419 116.1513 59.2626 28.5215 177.7983 105 L 3.3359 6.4247 120.6221 57.5296 41.0489 178.5431 106 I 3.7281 7.3887 121.7794 65.1814 36.8041 179.1784 107 K 4.1365 7.5307 122.0102 59.5833 31.6207 181.2509 108 S 4.6234 7.6999 113.3776 60.2564 62.7295 174.5230 109 I 3.7626 6.8277 121.6630 60.4413 36.9755 175.5924 110 Q 3.8184 6.4251 125.1814 54.2082 29.5861 175.2937 111 P 4.0548 0.0000 0.0000 66.4296 31.4591 179.0685 112 E 4.0573 8.0767 113.4480 58.6506 29.6011 181.0338 113 W 4.4153 8.0285 118.9003 59.8718 29.1315 178.2242 114 L 4.0258 7.7538 118.8053 57.1622 41.0343 178.5214 115 K 4.3085 7.5528 118.5549 55.2384 32.1355 181.7622 116 T 4.6717 7.2953 109.9707 60.9172 70.5792 172.7442 117 N 4.5804 8.6497 123.0537 53.6220 39.0956 174.5920 118 G 4.0591 8.1342 110.8137 45.6840 0.0000 170.9676 119 F 5.1571 8.4725 117.3745 56.0789 42.3950 174.6055 120 H 4.7063 8.8770 118.2441 54.6081 33.6003 171.7204 121 E 5.3237 8.4430 116.7882 55.1270 33.7319 175.3423 122 I 4.7360 8.8673 123.6225 59.6466 39.9460 174.2521 123 E 4.9134 8.9873 128.4000 55.9639 30.9024 175.0706 124 T 4.5976 8.9870 120.3866 61.4626 71.5578 171.3423 125 N 5.4676 8.3663 120.2750 51.3027 40.4611 176.2934 126 V 3.6842 8.1573 117.7696 66.2521 31.1425 175.6128 127 D 4.5595 8.0451 118.6470 57.1272 40.4280 178.5240 128 A 3.9264 7.6203 120.1344 55.0386 18.8702 179.3149 129 T 4.1716 7.8903 114.5009 66.7447 67.9897 177.1029 130 S 4.2361 8.1601 116.0731 61.5688 62.7245 176.4556 131 T 3.9958 7.4554 117.5329 66.8284 68.3930 175.9284 132 L 4.2276 7.8728 118.1736 55.3732 42.0747 176.9480 133 L 4.7707 6.6812 117.2784 52.3203 44.2645 176.3115 134 S 4.2600 8.4521 117.9449 58.7183 62.9661 175.7801 135 E 4.0493 9.0093 124.7101 59.1227 29.4858 177.7069 136 D 4.8545 7.8635 113.0936 53.5247 41.1337 180.8980 137 H 4.4236 8.0493 119.8088 56.9925 30.6244 176.1245 138 S 4.2941 8.2328 119.3234 59.8883 63.4863 175.6449 139 A 4.1980 7.7296 123.0387 54.5237 18.3720 179.0700 140 Q 3.9653 8.0619 117.0603 59.1675 28.8378 178.6627 141 E 4.0259 7.8931 119.4608 58.8865 29.7243 178.8578 142 K 3.9993 7.9312 118.2413 59.5374 32.1939 179.1481 143 L 4.1583 8.5041 121.8928 58.0402 41.1734 180.3865 144 K 4.1072 8.0729 126.3645 60.4337 31.5620 183.5431 145 E 4.2434 8.1669 119.2437 60.6795 29.6175 181.3871 146 V 3.8167 7.8158 117.9183 66.0317 31.3571 178.0116 147 R 3.9038 7.8071 117.9859 59.4452 29.9688 177.9659 148 E 4.1640 7.7382 116.0162 59.3257 29.9172 178.4175 149 D 4.7117 7.9015 118.9687 56.0031 41.2728 175.5601 150 D 4.4065 7.8265 113.6774 53.6755 43.3750 175.8678 151 D 4.4942 8.8783 128.6704 55.5913 39.9222 177.1278 152 D 4.7142 7.7872 118.8819 53.3302 39.8746 181.5656 153 A 4.2785 7.5087 124.5696 52.6141 18.9590 177.9359 154 E 4.6560 8.5991 121.4829 55.7963 31.2725 175.6633 155 M 5.0161 8.9835 122.0341 53.8664 35.8545 174.7012 156 T 5.1412 9.2526 118.8851 62.1571 72.0310 172.5633 157 H 5.2530 9.0773 123.4539 53.9084 31.8304 174.2974 158 S 4.8099 8.7172 118.7769 58.7428 64.5263 173.4031 159 V 4.9265 8.8165 121.8601 61.4219 34.9526 173.5117 160 A 4.5401 9.0030 129.6755 49.8780 21.7314 174.8517 161 V 4.6667 8.0820 122.3716 61.0377 34.0562 174.0508 162 N 5.0935 9.1070 125.6327 51.8498 42.5819 172.6286 163 I 4.7454 8.5308 126.3546 59.7311 39.6869 174.7981 164 Y 4.2664 8.9139 125.0769 55.3119 39.5324 173.5117 165 P 4.6314 0.0000 0.0000 62.5689 32.2187 176.4777 166 A 4.3134 8.5767 123.9041 52.7830 19.3392 176.8547 167 T 4.6461 9.0861 116.5616 61.1220 72.8994 175.0616 168 A 4.0502 8.7592 125.3670 55.3205 18.1249 179.7866 169 R 4.7246 7.2703 112.6699 55.5315 31.3391 175.5960 170 M 4.0255 7.6897 113.0465 53.9982 35.9111 172.4183 171 P 4.6479 0.0000 0.0000 61.5391 33.3192 175.2525 172 Q 4.2061 8.4774 121.0297 56.8761 29.4042 175.1978 173 L 4.9147 8.8548 127.0677 53.3862 44.4568 175.6106 174 T 5.0781 9.0806 120.9600 62.0949 70.9202 173.2245 175 I 5.0490 8.9911 128.3194 59.4768 40.1076 174.9063 176 V 4.8516 8.9153 127.0384 61.1336 34.0583 174.1613 177 V 4.7758 8.7251 128.3988 61.1567 33.9874 174.1514 178 V 4.6695 8.7402 128.8997 61.2067 33.2184 174.2869 179 D 4.8637 8.6106 128.8305 54.8099 40.8718 176.1337 180 T 4.3170 8.5714 116.5512 63.4359 69.9557 175.0647 181 I 4.2316 7.7486 123.9032 59.3486 38.0252 174.0289 182 P 4.4673 0.0000 0.0000 62.1694 32.3567 177.3002 183 I 3.7159 8.4283 121.3685 64.7148 37.2005 178.5411 184 E 4.0009 8.2188 118.3289 58.6374 29.3559 177.5625 185 L 4.6673 7.6121 116.3668 54.2652 42.2885 177.4012 186 K 4.0199 8.3097 122.8563 59.9125 32.0750 178.3479 187 R 4.5470 7.6311 114.9849 54.8775 30.7484 178.0599 188 S 4.6198 8.5344 113.2147 59.4995 63.8904 173.1467 189 Y 4.7916 7.3481 117.4266 56.3225 40.3821 173.0737 190 M 4.4368 8.2895 119.4683 53.3809 34.4324 174.9855 191 H 4.3728 8.5196 123.0382 56.4346 29.5318 174.0157 192 H 4.8149 8.5971 121.5521 54.5807 32.1079 173.1911 193 H 4.5827 8.5686 124.0387 55.2482 27.8554 173.6563 194 H 4.8370 8.4678 124.0657 54.3461 31.5093 173.5399 195 H 5.0571 8.4900 122.9702 54.2018 31.3800 173.6986 196 H 4.4938 8.4619 117.6095 55.8281 28.5453 173.0846 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 44 M 8.30 4.31 0.00 1.93 1.96 0.00 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 45 D 8.35 4.21 0.00 2.78 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 46 K 9.41 4.11 0.00 1.80 1.79 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.44 1.09 7.81 47 T 7.95 4.14 4.42 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 1.24 0.00 0.00 48 T 8.09 3.88 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 49 F 7.89 4.10 0.00 2.86 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 50 R 8.12 3.79 0.00 2.09 1.99 0.00 3.24 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.87 0.00 51 L 7.99 3.95 0.00 1.79 1.94 0.96 0.51 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 52 L 8.02 4.00 0.00 1.88 1.76 1.14 0.81 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 53 R 7.85 3.90 0.00 1.43 1.38 0.00 3.18 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.56 0.00 54 G 8.07 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.20 4.07 0.00 2.33 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 0.00 2.43 2.62 0.00 56 S 8.32 4.21 0.00 4.09 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 57 N 8.47 4.50 0.00 3.00 2.94 0.00 0.00 6.71 6.36 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 58 L 7.85 3.92 0.00 1.77 1.90 0.86 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.48 3.76 0.00 3.26 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 60 Y 7.91 3.78 0.00 1.94 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 61 T 7.73 3.69 4.15 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 1.29 0.00 0.00 62 L 7.33 4.20 0.00 1.37 1.59 0.53 0.40 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 63 A 6.94 4.62 1.03 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 64 K 8.94 4.65 0.00 1.40 1.62 0.00 1.75 0.00 0.00 1.57 0.00 0.00 2.69 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.25 1.21 7.81 65 W 8.97 4.93 0.00 3.27 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 66 E 8.21 4.49 0.00 1.89 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 67 N 8.83 3.79 0.00 2.68 2.78 0.00 0.00 7.22 8.00 0.00 0.00 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 N 7.60 3.14 0.00 2.63 2.71 0.00 0.00 6.92 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 5.66 4.04 0.00 1.56 1.48 0.00 1.57 0.00 0.00 1.51 0.00 0.00 3.00 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.25 1.30 7.81 70 I 8.37 5.03 2.25 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.36 1.16 0.00 0.00 71 S 8.82 4.96 0.00 3.94 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 72 V 8.06 4.52 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 -0.52 0.00 0.00 73 E 8.76 4.17 0.00 1.92 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 2.23 2.19 0.00 74 L 8.39 4.20 0.00 1.63 1.57 0.92 0.99 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 75 P 0.00 4.46 0.00 2.15 1.93 0.00 3.74 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 1.90 1.84 0.00 76 E 8.57 4.05 0.00 2.03 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 2.39 2.32 0.00 77 N 8.46 4.36 0.00 2.80 2.85 0.00 0.00 6.81 7.85 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 78 L 7.38 4.34 0.00 1.68 1.57 0.90 1.10 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 79 D 8.63 4.61 0.00 2.74 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 M 7.53 4.89 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.62 0.00 81 Q 8.53 4.26 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 82 S 8.75 4.16 0.00 3.89 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 P 0.00 4.86 0.00 2.17 2.19 0.00 3.79 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 84 T 7.44 5.18 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 1.26 0.00 0.00 85 M 9.02 4.92 0.00 1.98 1.86 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.57 0.00 86 T 8.87 5.02 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 0.72 0.00 0.00 87 L 9.11 5.19 0.00 1.62 1.30 0.80 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 88 I 8.80 5.05 2.03 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.89 0.99 0.00 0.00 89 Y 9.38 5.37 0.00 2.81 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 90 D 8.73 5.10 0.00 2.80 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 91 E 8.84 4.09 0.00 2.01 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 2.23 1.91 0.00 92 T 7.99 4.04 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 93 G 8.22 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.30 4.11 0.00 1.91 2.02 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.42 7.81 95 L 8.62 3.86 0.00 1.52 1.48 0.20 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 96 L 8.56 4.67 0.00 1.78 1.87 1.09 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 97 W 7.63 4.92 0.00 3.38 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 98 T 7.36 4.61 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 99 Q 8.52 3.64 0.00 2.35 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.39 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 100 R 7.37 4.52 0.00 1.67 1.66 0.00 3.25 0.00 0.00 3.13 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 101 N 8.41 4.37 0.00 2.57 2.67 0.00 0.00 7.00 7.94 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 0.00 102 I 7.22 4.15 1.39 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.91 0.29 0.00 0.00 103 P 0.00 4.27 0.00 2.24 2.30 0.00 3.71 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.97 0.00 104 W 8.04 4.31 0.00 3.53 3.24 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 0.00 105 L 6.42 3.34 0.00 0.27 1.00 0.56 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.39 3.73 1.78 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.82 0.90 0.00 0.00 107 K 7.53 4.14 0.00 1.90 1.73 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.35 7.81 108 S 7.70 4.62 0.00 4.07 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 0.00 109 I 6.83 3.76 2.07 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 1.55 0.60 0.89 0.00 0.00 110 Q 6.43 3.82 0.00 0.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.26 6.81 0.00 0.00 0.00 0.00 0.00 1.97 1.60 0.00 111 P 0.00 4.05 0.00 2.08 2.04 0.00 3.39 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 2.02 2.01 0.00 112 E 8.08 4.06 0.00 1.89 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 0.00 2.32 1.91 0.00 113 W 8.03 4.42 0.00 3.36 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 0.00 114 L 7.75 4.03 0.00 1.67 1.60 0.53 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 115 K 7.55 4.31 0.00 1.78 1.70 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.35 1.24 7.81 116 T 7.30 4.67 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 1.21 0.00 0.00 117 N 8.65 4.58 0.00 2.59 2.68 0.00 0.00 6.70 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 0.00 118 G 8.13 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 F 8.47 5.16 0.00 2.80 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 0.00 120 H 8.88 4.71 0.00 1.76 1.89 0.00 5.75 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.44 5.32 0.00 1.84 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 0.00 2.23 2.32 0.00 122 I 8.87 4.74 2.15 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 1.54 1.17 1.22 0.00 0.00 123 E 8.99 4.91 0.00 2.06 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 2.28 2.34 0.00 124 T 8.99 4.60 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 1.25 0.00 0.00 125 N 8.37 5.47 0.00 2.80 2.83 0.00 0.00 6.10 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 0.00 126 V 8.16 3.68 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 0.85 0.00 0.00 0.93 0.00 0.00 127 D 8.05 4.56 0.00 2.63 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 0.00 128 A 7.62 3.93 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.89 4.17 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 1.38 0.00 0.00 130 S 8.16 4.24 0.00 4.29 4.15 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 0.00 131 T 7.46 4.00 4.69 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 1.52 0.00 0.00 132 L 7.87 4.23 0.00 1.88 1.76 0.89 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 133 L 6.68 4.77 0.00 1.71 1.60 1.00 0.84 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 0.00 134 S 8.45 4.26 0.00 3.88 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 0.00 135 E 9.01 4.05 0.00 2.03 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 2.23 1.89 0.00 136 D 7.86 4.85 0.00 2.68 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.05 4.42 0.00 3.19 3.31 0.00 5.55 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 S 8.23 4.29 0.00 4.00 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 0.00 139 A 7.73 4.20 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 Q 8.06 3.97 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.77 0.00 0.00 0.00 0.00 0.00 2.50 2.81 0.00 141 E 7.89 4.03 0.00 2.17 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 142 K 7.93 4.00 0.00 2.05 1.86 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.55 7.81 143 L 8.50 4.16 0.00 1.87 1.74 0.97 0.91 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 0.00 144 K 8.07 4.11 0.00 1.80 1.81 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.32 7.81 145 E 8.17 4.24 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.18 0.00 146 V 7.82 3.82 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.97 0.00 0.00 147 R 7.81 3.90 0.00 2.07 2.03 0.00 3.31 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 148 E 7.74 4.16 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.34 0.00 149 D 7.90 4.71 0.00 2.73 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 D 7.83 4.41 0.00 2.66 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 0.00 151 D 8.88 4.49 0.00 2.81 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 0.00 152 D 7.79 4.71 0.00 2.68 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 0.00 153 A 7.51 4.28 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 0.00 154 E 8.60 4.66 0.00 1.99 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 2.34 0.00 155 M 8.98 5.02 0.00 1.93 2.02 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 2.52 2.63 0.00 156 T 9.25 5.14 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 1.26 0.00 0.00 157 H 9.08 5.25 0.00 3.27 3.43 0.00 5.81 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 S 8.72 4.81 0.00 3.86 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 0.00 159 V 8.82 4.93 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 1.08 0.00 0.00 1.06 0.00 0.00 160 A 9.00 4.54 0.98 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 0.00 0.00 161 V 8.08 4.67 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 0.96 0.00 0.00 0.91 0.00 0.00 162 N 9.11 5.09 0.00 2.67 2.44 0.00 0.00 6.67 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 I 8.53 4.75 1.74 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 1.19 0.79 0.87 0.00 0.00 164 Y 8.91 4.27 0.00 2.89 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 P 0.00 4.63 0.00 1.91 1.99 0.00 3.59 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.06 0.00 166 A 8.58 4.31 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 0.00 167 T 9.09 4.65 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 1.28 0.00 0.00 168 A 8.76 4.05 1.31 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 0.00 169 R 7.27 4.72 0.00 1.80 1.96 0.00 3.27 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 170 M 7.69 4.03 0.00 2.07 1.82 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 171 P 0.00 4.65 0.00 1.74 1.58 0.00 3.07 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.44 0.00 172 Q 8.48 4.21 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 173 L 8.85 4.91 0.00 1.86 1.73 0.87 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 174 T 9.08 5.08 4.37 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 1.28 0.00 0.00 175 I 8.99 5.05 2.16 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.93 1.01 0.00 0.00 176 V 8.92 4.85 2.33 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 0.93 0.00 0.00 1.05 0.00 0.00 177 V 8.73 4.78 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 0.99 0.00 0.00 1.01 0.00 0.00 178 V 8.74 4.67 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 0.91 0.00 0.00 0.95 0.00 0.00 179 D 8.61 4.86 0.00 2.84 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 0.00 180 T 8.57 4.32 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 1.25 0.00 0.00 181 I 7.75 4.23 1.92 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 1.43 0.60 0.95 0.00 0.00 182 P 0.00 4.47 0.00 2.31 1.94 0.00 3.75 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 183 I 8.43 3.72 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.88 0.90 0.00 0.00 184 E 8.22 4.00 0.00 1.93 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 2.41 2.40 0.00 185 L 7.61 4.67 0.00 1.65 1.68 0.95 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 186 K 8.31 4.02 0.00 1.88 1.87 0.00 1.60 0.00 0.00 1.90 0.00 0.00 3.32 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.45 7.81 187 R 7.63 4.55 0.00 1.82 1.70 0.00 3.25 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.17 0.00 188 S 8.53 4.62 0.00 4.06 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 0.00 189 Y 7.35 4.79 0.00 3.04 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 0.00 190 M 8.29 4.44 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 191 H 8.52 4.37 0.00 3.11 3.21 0.00 5.89 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 H 8.60 4.81 0.00 3.03 3.19 0.00 5.92 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 0.00 193 H 8.57 4.58 0.00 3.15 3.24 0.00 5.74 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 H 8.47 4.84 0.00 3.01 3.16 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 H 8.49 5.06 0.00 3.14 3.10 0.00 5.70 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 H 8.46 4.49 0.00 3.17 3.11 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00