NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6087 8.2233 120.5304 53.7929 42.4929 174.1624 2 V 4.0902 8.0136 115.1425 60.5023 32.7658 173.5535 3 K 5.1013 9.1585 126.4926 54.6701 36.0279 174.5487 4 L 4.7649 8.8154 128.1698 53.9181 44.9028 175.7830 5 V 4.2817 8.3742 128.2397 61.0598 32.6325 174.7385 6 E 4.9478 8.9199 127.7911 55.9805 30.3692 177.2505 7 S 4.3074 8.5568 113.2937 58.8581 63.0931 176.2803 8 G 3.3570 8.3585 109.5135 44.6714 0.0000 175.6588 9 G 3.8456 7.5554 103.3705 44.8100 0.0000 174.2982 10 G 3.9390 7.6803 109.0583 43.8136 0.0000 171.2864 11 L 4.6177 7.7979 122.3763 55.0034 42.9148 176.8856 12 V 4.5540 8.6626 124.7555 61.1313 35.4255 174.3599 13 Q 4.8255 8.6966 126.2171 54.7043 30.0466 173.9231 14 P 4.5710 0.0000 0.0000 64.5542 31.4807 175.4519 15 G 4.0177 9.3141 110.0566 45.4689 0.0000 173.8476 16 G 4.0277 8.1262 107.2213 46.0412 0.0000 172.0315 17 S 5.0936 8.0304 113.5942 56.9472 66.5204 173.0882 18 R 4.4615 8.0247 115.8703 55.2778 34.9976 174.5726 19 K 4.6115 8.2815 121.8334 54.8408 34.5941 175.7711 20 L 4.5534 8.4443 127.8652 54.2388 43.7045 176.0285 21 S 5.2806 8.6142 115.0909 57.2769 67.9321 174.0575 22 C 5.1484 8.7215 121.0536 55.4432 42.1377 172.9246 23 A 4.7779 8.8101 129.9293 50.5446 19.1433 175.7801 24 A 4.7819 8.1712 123.9221 52.7408 19.8410 176.5253 25 S 4.1906 8.9066 113.3715 58.4855 66.4077 176.1806 26 G 4.0023 10.7151 108.9019 46.5109 0.0000 172.7461 27 F 4.8341 6.9945 112.1851 55.7060 40.9606 174.9766 28 T 4.1886 8.4839 117.7590 62.0919 67.1273 175.1200 29 F 3.9527 8.5065 129.2068 61.1425 39.3757 177.5777 30 S 4.2046 8.2052 112.3924 60.0758 62.8070 174.5052 31 S 4.5850 8.2405 114.8627 57.8369 63.1547 173.7546 32 F 4.7961 8.0012 119.2295 55.7380 42.3037 174.9797 33 G 3.9979 8.3910 110.6283 45.5554 0.0000 171.9837 34 M 5.3786 8.3765 118.7826 53.7813 36.9802 174.0938 35 H 5.7213 9.1730 116.4271 54.0838 34.0125 172.6529 36 W 5.3212 9.0461 119.1076 55.1586 32.2798 175.0308 37 V 5.1832 9.5069 124.6346 61.2487 34.9279 174.1667 38 R 5.1496 9.1832 120.6112 54.9266 33.7912 173.9783 39 Q 4.7384 8.8393 120.5316 54.5710 32.0956 174.2164 40 A 4.3963 8.8611 129.8134 51.4164 18.5851 175.0032 41 P 3.9502 0.0000 0.0000 65.8084 32.0213 176.4444 42 E 4.5984 7.9356 117.7861 56.4358 30.1203 175.9657 43 K 4.6301 7.8035 117.6953 54.4022 35.4253 175.9038 44 G 4.0069 8.1885 109.3951 44.0285 0.0000 173.2445 45 L 4.3691 8.2553 118.5436 55.4889 42.3480 177.0405 46 E 4.7749 9.3829 122.6188 54.1958 33.1896 174.3558 47 W 4.7077 9.1828 135.0000 57.8979 31.4224 174.7357 48 V 4.0851 8.2474 125.1081 63.8405 33.4342 174.9408 49 A 4.4684 6.6396 118.8779 51.0583 22.7348 174.0427 50 Y 5.4609 9.0939 120.2485 56.0099 43.0400 174.1310 51 I 4.3598 7.4061 125.1233 58.9077 41.5409 174.8147 52 S 4.4390 8.6606 124.8467 57.7841 63.8224 175.6152 52A S 3.9893 8.7104 115.4601 60.8136 62.4779 175.2738 53 G 3.7542 7.9738 108.3562 44.7782 0.0000 174.2636 54 S 3.7708 8.1113 114.6416 59.2006 61.0913 173.3282 55 S 4.3472 7.6169 115.6853 59.9245 63.5333 174.2984 56 T 4.5865 8.1669 118.7203 61.5706 71.3853 173.3143 57 I 4.8420 8.0418 125.9143 59.7971 40.9148 174.1270 58 Y 5.3508 9.0524 124.5033 56.6211 41.3997 174.4171 59 Y 5.2512 8.8091 118.2980 56.0384 42.2879 175.1761 60 A 4.5447 8.8174 124.5578 51.9943 19.3116 178.5742 61 D 4.4195 9.0195 119.8831 57.8269 41.3057 178.4926 62 T 3.9514 8.1213 114.6484 66.2308 68.6491 175.2147 63 V 3.6770 7.3282 111.2849 60.2281 32.2926 175.1831 64 K 3.9363 7.5791 122.8957 58.1379 32.0452 176.8939 65 G 3.9751 8.8303 115.3875 44.9311 0.0000 173.4263 66 R 4.6491 8.0256 116.6642 55.7086 33.2299 175.4925 67 F 5.2110 8.2418 116.4695 55.8684 41.8722 175.2793 68 T 4.7627 8.7494 118.4530 61.9352 71.6750 172.9296 69 I 4.9754 8.8592 127.4212 60.4756 39.5217 174.6615 70 S 4.9596 8.9232 121.3766 57.9166 66.8545 172.8696 71 R 5.0791 8.5269 115.2397 55.2863 32.3180 174.5750 72 D 4.8938 9.5865 122.2752 52.2038 41.1647 175.7804 73 N 4.6907 8.9998 122.9044 55.5754 38.8951 175.2299 74 P 4.4610 0.0000 0.0000 63.6659 31.9469 176.2764 75 K 4.3104 7.9822 119.1758 55.3061 32.5449 175.0297 76 N 3.1400 7.3651 113.3471 54.6596 36.9258 173.5171 77 T 4.7136 7.0194 111.2925 61.4234 73.1014 173.0177 78 L 5.1784 8.2247 125.5470 53.4119 45.4627 175.1773 79 F 5.8243 9.4893 122.5662 54.8755 43.9277 174.3475 80 L 4.4769 8.2442 122.1539 53.9482 44.4162 174.3270 81 Q 4.4862 9.1399 129.9188 55.5648 30.1142 174.4377 82 M 3.9377 8.9274 127.5284 54.4388 34.0631 175.5486 82A T 4.6179 8.0079 116.4458 62.6176 73.3042 173.4516 82B S 3.8062 8.5113 116.5418 58.1836 60.5717 173.7404 82C L 4.3003 7.8090 119.4939 54.8581 41.6039 177.3940 83 R 4.7148 8.5975 123.5400 54.5834 31.6180 177.9215 84 S 3.8380 8.8694 116.0003 61.8083 62.7185 176.4563 85 E 4.1876 8.2154 118.5339 58.5363 29.3897 177.2271 86 D 4.7119 8.9738 119.1423 55.4302 41.3845 175.9749 87 T 4.1920 8.1946 116.5557 64.6359 68.1876 172.9351 88 A 4.4146 8.5343 127.2057 51.6168 23.8645 173.9470 89 M 4.6943 8.3738 119.2597 54.9638 33.7681 174.4088 90 Y 5.1284 8.8985 124.2327 56.6857 40.6442 174.3761 91 Y 5.3769 9.4559 120.9728 56.4914 42.2372 172.7683 92 C 4.5094 8.7322 118.0978 54.5341 42.8839 172.4526 93 A 4.6882 8.0183 118.9378 50.6661 22.7085 176.2095 94 R 4.1642 8.4355 120.7099 55.6394 31.1548 177.7028 95 G 3.8297 8.7702 112.0816 47.9869 0.0000 174.2651 96 D 4.8862 8.0687 117.0899 52.3805 39.7070 175.5196 97 Y 3.6493 7.4458 114.9788 59.2947 36.1344 171.0157 98 Y 3.9145 8.1817 119.4355 57.0790 39.5364 175.2325 99 G 3.5283 8.1152 116.5696 46.0264 0.0000 172.4145 100 S 5.1261 8.3389 120.0020 56.2919 65.6356 174.3886 100A R 4.0893 9.0970 121.6709 56.3203 30.9267 176.1559 100B G 4.4018 8.4245 109.4060 46.1085 0.0000 172.8913 101 A 4.0973 7.9671 126.0024 50.4310 20.0626 177.8127 102 Y 4.4964 7.8786 120.6434 60.2667 38.9146 177.7639 103 W 4.5738 7.7830 115.8538 56.5448 29.8465 177.4565 104 G 4.0668 6.1828 106.5195 45.7313 0.0000 170.6412 105 Q 4.6648 8.3110 123.1107 55.5757 32.0670 176.2139 106 G 3.5179 10.6783 111.4510 45.1048 0.0000 172.0013 107 T 4.5593 8.2879 112.6059 60.5601 70.9649 172.6270 108 L 4.8964 8.6643 131.6635 54.7597 44.0404 175.6272 109 V 4.8584 8.7334 124.9242 60.4339 34.5808 174.2342 110 T 4.8712 8.4766 121.7161 60.9023 70.9859 173.8875 111 V 5.0692 8.2618 126.5845 61.5621 32.5626 174.2656 112 S 4.6549 8.9194 126.8987 57.8679 68.5900 174.0057 113 A 4.5688 8.5429 128.1188 51.6769 16.9296 180.4967 110 K 4.8412 8.6166 128.5162 55.3023 34.2859 175.7875 111 T 5.2992 8.3818 120.9845 61.1621 69.4626 172.6656 112 T 4.5349 8.7594 124.7987 61.3679 74.5900 174.1057 113 A 4.5688 8.5429 128.1188 51.6769 16.9296 180.4967 119 P 4.9653 0.0000 0.0000 62.5419 33.5184 175.4325 120 S 4.4852 8.7744 115.8731 56.6513 65.3841 173.5712 121 V 4.4687 7.9856 125.0731 61.6615 32.8677 174.5595 122 Y 5.2005 8.8347 125.2386 55.5586 41.7002 172.8052 123 P 4.8319 0.0000 0.0000 62.5122 32.9983 175.8169 124 L 4.6231 9.1036 124.5628 53.3950 42.6386 175.4228 125 A 4.4812 8.2598 125.7403 51.0032 21.5625 176.0336 126 P 4.3257 0.0000 0.0000 62.5050 30.7320 178.6733 127 V 3.9262 9.3347 125.8866 62.3152 31.9160 172.3821 128 C 4.4027 7.5378 110.6746 60.3863 31.5079 176.9141 129 G 3.6633 7.8736 108.8042 48.9721 0.0000 174.8691 130 D 4.1766 7.1388 114.9441 55.6675 42.2667 178.9243 *133 T 4.5699 7.4786 114.4982 61.3632 70.0786 173.0993 134 T 4.3422 8.3917 117.6095 63.7026 75.5351 173.0357 135 G 4.0623 6.8398 113.2479 46.7365 0.0000 174.3136 136 S 4.5626 8.6017 121.0292 58.2914 62.7986 172.5986 137 S 5.2572 8.1034 115.6260 56.4188 65.8297 172.9427 138 V 4.5598 8.5275 123.3945 60.1043 33.6622 174.5298 139 T 4.9877 8.3796 113.9917 59.9601 70.8923 173.3793 140 L 4.6140 8.5927 124.0744 53.0202 46.1193 175.1764 141 G 4.5815 8.7326 106.4330 45.7814 0.0000 170.4829 142 C 5.4640 9.4784 118.6135 55.2005 46.9369 172.4128 143 L 5.1719 9.4482 128.7380 53.4848 44.3269 175.1743 144 V 4.6825 9.1542 128.4176 61.3522 32.3831 174.3763 145 K 4.9496 8.7627 127.2253 54.8999 36.0697 175.6875 146 G 3.9632 8.5647 106.9985 47.2023 0.0000 172.0063 147 Y 5.8007 7.2302 115.6829 55.4475 42.4318 175.7080 148 F 5.0668 8.6885 118.1870 57.2953 42.3036 171.7141 149 P 3.6268 0.0000 0.0000 61.0278 33.7085 174.8972 150 E 4.1016 8.1047 118.6604 55.6554 30.0334 174.4551 151 P 4.6509 0.0000 0.0000 61.3154 33.5974 174.4552 152 V 4.3858 7.4777 117.0211 61.3491 34.3510 174.5710 153 T 4.6000 8.9199 123.9686 61.8469 70.8327 173.4027 154 L 5.7503 8.2653 126.6456 52.6502 45.8856 175.1934 *156 T 4.6408 8.3079 114.6842 61.6123 71.0660 172.1640 157 W 4.7533 8.3636 121.0501 54.3457 32.0370 176.2989 *162 N 4.8311 8.1858 122.5547 55.1567 39.0288 174.4840 163 S 3.7611 9.9928 106.7171 59.3583 61.7777 174.4223 164 G 4.0560 8.0904 109.6656 45.5891 0.0000 176.1010 165 S 4.0917 8.3655 115.7908 61.2475 62.8291 174.4219 166 L 4.3588 7.8383 123.7410 54.0599 40.7466 175.2991 167 S 4.6398 8.3958 120.1047 58.1311 65.1761 174.6873 168 S 4.2901 7.9521 115.2837 58.4717 63.2565 173.8612 169 G 3.6795 8.5321 114.4949 45.7796 0.0000 172.6530 *171 V 4.6879 7.3202 117.6003 61.7613 32.6936 174.4835 172 H 4.6777 8.8056 120.7987 54.1159 31.7835 172.7416 173 T 4.7504 8.2109 119.9490 61.5827 70.0939 174.0115 174 F 4.5738 8.6358 126.6995 56.0592 39.6297 174.3995 175 P 4.3370 0.0000 0.0000 62.8902 31.5367 175.8141 176 A 4.5123 8.5803 122.4207 52.3387 19.1888 176.8106 177 V 4.4168 8.6339 122.1324 60.8650 34.2584 174.1864 178 L 4.1563 8.5878 130.4941 54.4389 42.8074 175.3926 179 Q 4.3363 8.6088 127.4802 55.3809 32.3315 175.4217 180 S 4.0410 8.8696 125.0184 59.7709 59.8708 170.9169 *183 D 4.8176 8.7618 123.3881 54.9971 42.0986 174.5997 184 L 5.0752 7.4321 116.8390 53.3872 46.7433 175.6455 185 Y 4.9919 8.7040 118.4024 56.7273 41.1562 175.0381 186 T 5.1857 8.3123 117.3044 62.0492 73.0201 172.9499 187 L 5.3685 9.5050 126.9310 53.9678 46.6794 174.7993 188 S 5.2610 8.4672 114.4040 57.5440 66.2134 173.3298 189 S 5.5036 9.3869 116.6069 56.6779 66.0784 172.6306 190 S 5.4858 9.1880 120.4218 56.5054 66.1289 173.1848 191 V 4.5275 8.5537 121.0265 60.0649 34.5965 174.4827 192 T 4.8015 8.3234 119.6027 62.2385 70.5565 173.6250 193 V 4.5114 8.2127 120.0450 59.1561 35.5684 175.5385 194 T 4.4751 8.2435 111.2395 61.0418 69.5241 175.9200 195 S 4.3365 8.4651 118.4248 61.4889 62.9848 176.1004 196 S 4.1934 7.5223 115.1973 61.3376 63.1311 175.5157 *198 T 4.8342 7.8081 115.4901 62.9198 70.0472 173.1035 199 W 5.0150 7.8998 129.1630 55.1236 32.2443 174.2713 200 P 2.9700 0.0000 0.0000 64.1908 30.4023 177.3073 *202 S 4.3234 7.2264 113.5484 58.4985 65.1886 173.3619 203 Q 4.3351 9.0912 118.4850 55.7861 30.0942 175.5761 204 S 4.5211 8.8315 119.4316 58.5525 64.0613 173.3670 205 I 4.9087 8.8402 125.2064 59.8085 39.8132 174.7210 206 T 5.3348 9.5337 123.0261 60.8431 72.7787 172.2401 *208 C 4.6003 8.3931 122.2628 56.6327 46.0566 171.8342 209 N 5.4610 8.7890 123.7542 50.6980 40.7892 173.9622 210 V 4.7642 9.1180 123.3739 60.9132 35.2767 174.1031 211 A 4.8379 9.0975 128.8143 50.7662 22.0822 174.4234 212 H 4.7501 8.6033 124.2743 53.6057 29.1810 172.9630 213 P 3.9913 0.0000 0.0000 65.1563 31.5350 178.3026 214 A 4.0068 7.6774 117.8571 54.0863 17.9474 178.0858 215 S 4.4821 8.0129 107.8582 57.5459 64.9644 174.6763 216 S 3.8342 8.2505 115.4659 60.1286 60.8914 171.7272 217 T 4.3979 7.1059 117.1380 62.6833 70.0125 174.5405 218 K 4.5212 8.4018 127.1947 55.6637 34.4278 175.1605 219 V 4.5461 9.1151 121.4776 59.4694 35.4161 174.6058 220 D 5.2138 8.5912 123.0960 52.3690 43.5203 174.6647 221 K 4.5906 9.2304 125.7788 54.3267 34.6705 174.6427 222 K 4.7777 8.7111 129.5765 55.9145 33.1446 175.9321 223 I 4.3710 8.6570 129.2208 60.9465 37.6105 175.3971 224 E 5.0371 8.9655 125.9722 53.4560 32.7615 174.1000 225 P 4.6849 0.0000 0.0000 63.8119 32.7458 175.0986 226 R 4.7018 7.8592 118.9185 54.7716 29.6141 175.1968 227 G 4.4277 8.3678 114.9611 47.7494 0.0000 172.1523 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 1 D 8.22 4.61 0.00 2.74 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 2 V 8.01 4.09 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.84 0.00 0.00 3 K 9.16 5.10 0.00 1.77 1.56 0.00 1.42 0.00 0.00 1.45 0.00 0.00 2.65 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.23 1.45 7.81 4 L 8.82 4.76 0.00 1.62 1.50 1.08 0.74 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 5 V 8.37 4.28 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 0.96 0.00 0.00 0.77 0.00 0.00 6 E 8.92 4.95 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.44 0.00 7 S 8.56 4.31 0.00 3.87 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 G 8.36 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 0.00 0.00 0.00 9 G 7.56 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 7.68 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.80 4.62 0.00 1.70 1.63 1.26 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.66 4.55 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 0.84 0.00 0.00 0.94 0.00 0.00 13 Q 8.70 4.83 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.84 0.00 0.00 0.00 0.00 0.00 2.47 2.31 0.00 14 P 0.00 4.57 0.00 2.19 2.10 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 15 G 9.31 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 16 G 8.13 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 17 S 8.03 5.09 0.00 3.98 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 18 R 8.02 4.46 0.00 1.51 1.53 0.00 3.09 0.00 0.00 2.98 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.54 0.00 19 K 8.28 4.61 0.00 1.75 1.57 0.00 1.73 0.00 0.00 1.56 0.00 0.00 2.13 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.33 1.37 7.81 20 L 8.44 4.55 0.00 1.17 1.49 0.02 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.61 5.28 0.00 3.83 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 22 C 8.72 5.15 0.00 2.79 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 23 A 8.81 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 24 A 8.17 4.78 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 0.00 0.00 0.00 0.00 0.00 25 S 8.91 4.19 0.00 3.77 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 26 G 10.72 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 6.99 4.83 0.00 2.98 2.75 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 28 T 8.48 4.19 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 29 F 8.51 3.95 0.00 2.61 2.95 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 30 S 8.21 4.20 0.00 4.01 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 S 8.24 4.58 0.00 3.63 3.86 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 32 F 8.00 4.80 0.00 3.03 2.91 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 33 G 8.39 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 M 8.38 5.38 0.00 1.78 1.78 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 35 H 9.17 5.72 0.00 3.13 3.43 0.00 5.75 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 W 9.05 5.32 0.00 3.33 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 9.51 5.18 2.37 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 1.29 0.00 0.00 1.31 0.00 0.00 38 R 9.18 5.15 0.00 1.09 1.22 0.00 2.99 0.00 0.00 2.95 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.64 0.00 39 Q 8.84 4.74 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.97 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 40 A 8.86 4.40 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 3.95 0.00 2.11 2.09 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.22 0.00 42 E 7.94 4.60 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 43 K 7.80 4.63 0.00 1.74 1.72 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.37 7.81 44 G 8.19 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.26 4.37 0.00 1.54 1.67 0.83 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.38 4.77 0.00 2.01 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 47 W 9.18 4.71 0.00 3.43 3.23 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 48 V 8.25 4.09 2.27 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 1.15 0.00 0.00 1.09 0.00 0.00 49 A 6.64 4.47 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 50 Y 9.09 5.46 0.00 3.77 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 51 I 7.41 4.36 1.72 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.13 0.75 0.00 0.00 52 S 8.66 4.44 0.00 3.82 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 52A S 8.71 3.99 0.00 4.03 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 53 G 7.97 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 0.00 0.00 0.00 54 S 8.11 3.77 0.00 3.97 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 S 7.62 4.35 0.00 3.98 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 56 T 8.17 4.59 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 0.83 0.00 0.00 57 I 8.04 4.84 1.80 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 1.18 0.49 0.48 0.00 0.00 58 Y 9.05 5.35 0.00 3.48 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 59 Y 8.81 5.25 0.00 2.92 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 60 A 8.82 4.54 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 D 9.02 4.42 0.00 2.73 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 T 8.12 3.95 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 63 V 7.33 3.68 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 -0.16 0.00 0.00 0.85 0.00 0.00 64 K 7.58 3.94 0.00 1.98 1.84 0.00 1.91 0.00 0.00 1.91 0.00 0.00 3.14 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.48 1.40 7.81 65 G 8.83 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 0.00 0.00 0.00 66 R 8.03 4.65 0.00 1.96 2.36 0.00 3.14 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 67 F 8.24 5.21 0.00 2.67 2.91 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 68 T 8.75 4.76 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 69 I 8.86 4.98 2.07 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.34 0.76 0.00 0.00 70 S 8.92 4.96 0.00 4.10 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 71 R 8.53 5.08 0.00 2.08 1.98 0.00 2.85 0.00 0.00 3.12 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 72 D 9.59 4.89 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 73 N 9.00 4.69 0.00 2.87 2.98 0.00 0.00 6.77 8.03 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 74 P 0.00 4.46 0.00 2.19 2.18 0.00 3.83 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.98 0.00 75 K 7.98 4.31 0.00 1.83 2.04 0.00 2.11 0.00 0.00 1.80 0.00 0.00 3.27 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.38 7.81 76 N 7.37 3.14 0.00 2.65 2.47 0.00 0.00 6.76 6.71 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 77 T 7.02 4.71 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 0.46 0.00 0.00 78 L 8.22 5.18 0.00 1.86 1.41 1.03 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 79 F 9.49 5.82 0.00 3.06 2.91 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 80 L 8.24 4.48 0.00 0.36 0.50 0.21 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 9.14 4.49 0.00 2.12 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.59 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 82 M 8.93 3.94 0.00 1.20 1.55 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.01 0.00 82A T 8.01 4.62 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 82B S 8.51 3.81 0.00 4.02 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 82C L 7.81 4.30 0.00 1.83 1.66 0.79 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 83 R 8.60 4.71 0.00 2.08 2.12 0.00 3.19 0.00 0.00 3.55 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 84 S 8.87 3.84 0.00 4.05 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.22 4.19 0.00 2.01 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 0.00 2.34 2.44 0.00 86 D 8.97 4.71 0.00 2.97 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 87 T 8.19 4.19 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 88 A 8.53 4.41 1.06 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 89 M 8.37 4.69 0.00 2.18 1.94 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 2.01 2.30 0.00 90 Y 8.90 5.13 0.00 3.11 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 91 Y 9.46 5.38 0.00 3.03 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 92 C 8.73 4.51 0.00 2.29 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.02 4.69 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 94 R 8.44 4.16 0.00 1.48 1.67 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.16 0.00 95 G 8.77 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 96 D 8.07 4.89 0.00 2.88 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 97 Y 7.45 3.65 0.00 3.16 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 98 Y 8.18 3.91 0.00 2.97 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.12 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 0.00 0.00 0.00 100 S 8.34 5.13 0.00 3.88 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 100A R 9.10 4.09 0.00 1.76 1.86 0.00 3.08 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 100B G 8.42 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 0.00 0.00 0.00 0.00 101 A 7.97 4.10 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.88 4.50 0.00 2.73 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 0.00 103 W 7.78 4.57 0.00 3.38 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 0.00 104 G 6.18 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 0.00 105 Q 8.31 4.66 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.34 2.65 0.00 106 G 10.68 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 T 8.29 4.56 4.36 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 1.40 0.00 0.00 108 L 8.66 4.90 0.00 1.81 1.48 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.73 4.86 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 0.57 0.00 0.00 0.88 0.00 0.00 110 T 8.48 4.87 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 1.27 0.00 0.00 111 V 8.26 5.07 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 0.64 0.00 0.00 0.99 0.00 0.00 112 S 8.92 4.65 0.00 4.07 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 0.00 113 A 8.54 4.57 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.62 4.84 0.00 1.68 1.55 0.00 0.96 0.00 0.00 1.67 0.00 0.00 2.13 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.07 7.81 111 T 8.38 5.30 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 1.27 0.00 0.00 112 T 8.76 4.53 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 113 A 8.54 4.57 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 P 0.00 4.97 0.00 2.03 1.99 0.00 3.69 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 1.88 1.78 0.00 120 S 8.77 4.49 0.00 3.47 3.33 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 0.00 121 V 7.99 4.47 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.78 0.00 0.00 122 Y 8.83 5.20 0.00 2.95 2.71 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 0.00 0.00 0.00 123 P 0.00 4.83 0.00 2.19 2.15 0.00 3.95 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.10 0.00 124 L 9.10 4.62 0.00 1.77 1.70 1.02 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.26 4.48 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.33 0.00 2.31 2.00 0.00 3.61 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.09 0.00 127 V 9.33 3.93 2.27 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 0.73 0.00 0.00 0.97 0.00 0.00 128 C 7.54 4.40 0.00 3.05 3.03 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 0.00 129 G 7.87 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 D 7.14 4.18 0.00 2.69 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *133 T 7.48 4.57 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 134 T 8.39 4.34 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 135 G 6.84 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 0.00 136 S 8.60 4.56 0.00 3.90 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 0.00 137 S 8.10 5.26 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 0.00 138 V 8.53 4.56 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 0.91 0.00 0.00 0.91 0.00 0.00 139 T 8.38 4.99 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 1.20 0.00 0.00 140 L 8.59 4.61 0.00 1.10 1.25 0.38 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.73 4.58 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 0.00 0.00 0.00 142 C 9.48 5.46 0.00 2.99 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 0.00 143 L 9.45 5.17 0.00 1.87 1.71 1.10 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 144 V 9.15 4.68 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.88 0.00 0.00 145 K 8.76 4.95 0.00 1.92 1.98 0.00 1.67 0.00 0.00 1.95 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.51 7.81 146 G 8.56 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 Y 7.23 5.80 0.00 3.01 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 0.00 148 F 8.69 5.07 0.00 3.13 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 P 0.00 3.63 0.00 1.65 1.16 0.00 3.88 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.89 0.00 150 E 8.10 4.10 0.00 1.59 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 1.47 1.47 0.00 151 P 0.00 4.65 0.00 2.07 1.98 0.00 3.60 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.84 0.00 152 V 7.48 4.39 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 0.53 0.00 0.00 -0.21 0.00 0.00 153 T 8.92 4.60 4.14 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 1.16 0.00 0.00 154 L 8.27 5.75 0.00 1.51 1.33 0.78 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 *156 T 8.31 4.64 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 1.22 0.00 0.00 157 W 8.36 4.75 0.00 3.48 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *162 N 8.19 4.83 0.00 2.95 2.91 0.00 0.00 7.36 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 0.00 163 S 9.99 3.76 0.00 3.94 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 0.00 164 G 8.09 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 0.00 165 S 8.37 4.09 0.00 3.93 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 0.00 166 L 7.84 4.36 0.00 1.66 1.95 0.87 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.40 4.64 0.00 3.96 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 0.00 168 S 7.95 4.29 0.00 3.82 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 0.00 169 G 8.53 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *171 V 7.32 4.69 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 1.12 0.00 0.00 1.15 0.00 0.00 172 H 8.81 4.68 0.00 2.52 2.48 0.00 5.56 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.21 4.75 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 1.24 0.00 0.00 174 F 8.64 4.57 0.00 3.02 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 P 0.00 4.34 0.00 2.26 2.15 0.00 3.98 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 2.08 0.00 176 A 8.58 4.51 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 V 8.63 4.42 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.00 0.00 0.00 178 L 8.59 4.16 0.00 1.20 1.40 0.11 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 8.61 4.34 0.00 2.07 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 5.19 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 180 S 8.87 4.04 0.00 4.07 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 *183 D 8.76 4.82 0.00 2.51 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 L 7.43 5.08 0.00 1.43 1.44 0.89 0.88 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 0.00 185 Y 8.70 4.99 0.00 1.43 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 0.00 0.00 0.00 0.00 186 T 8.31 5.19 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 1.35 0.00 0.00 187 L 9.51 5.37 0.00 1.87 1.71 0.99 0.78 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 0.00 188 S 8.47 5.26 0.00 4.10 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 0.00 189 S 9.39 5.50 0.00 4.05 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 9.19 5.49 0.00 3.95 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 V 8.55 4.53 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 -0.43 0.00 0.00 0.45 0.00 0.00 192 T 8.32 4.80 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 193 V 8.21 4.51 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 0.62 0.00 0.00 0.96 0.00 0.00 194 T 8.24 4.48 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 0.00 195 S 8.47 4.34 0.00 4.05 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 0.00 196 S 7.52 4.19 0.00 3.97 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 *198 T 7.81 4.83 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 1.33 0.00 0.00 199 W 7.90 5.02 0.00 3.18 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 P 0.00 2.97 0.00 1.62 1.13 0.00 3.51 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 1.52 0.67 0.00 *202 S 7.23 4.32 0.00 4.04 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 Q 9.09 4.34 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.00 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 204 S 8.83 4.52 0.00 3.96 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 0.00 205 I 8.84 4.91 2.04 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 1.46 1.42 1.06 0.00 0.00 206 T 9.53 5.33 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 1.29 0.00 0.00 *208 C 8.39 4.60 0.00 2.13 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 0.00 209 N 8.79 5.46 0.00 2.55 2.65 0.00 0.00 6.25 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 0.00 210 V 9.12 4.76 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.72 0.00 0.00 211 A 9.10 4.84 1.10 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 0.00 212 H 8.60 4.75 0.00 2.99 3.06 0.00 5.65 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 P 0.00 3.99 0.00 2.05 1.96 0.00 3.68 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 214 A 7.68 4.01 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 0.00 0.00 0.00 0.00 0.00 215 S 8.01 4.48 0.00 3.96 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 S 8.25 3.83 0.00 3.96 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 T 7.11 4.40 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 218 K 8.40 4.52 0.00 1.65 1.62 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.26 1.37 7.81 219 V 9.12 4.55 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 0.67 0.00 0.00 0.83 0.00 0.00 220 D 8.59 5.21 0.00 2.53 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 K 9.23 4.59 0.00 1.75 1.63 0.00 1.51 0.00 0.00 1.55 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.43 7.81 222 K 8.71 4.78 0.00 1.88 1.78 0.00 1.89 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.56 1.75 7.81 223 I 8.66 4.37 1.99 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 1.65 1.16 0.91 0.00 0.00 224 E 8.97 5.04 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 225 P 0.00 4.68 0.00 1.90 1.82 0.00 3.52 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.68 0.00 226 R 7.86 4.70 0.00 1.97 1.91 0.00 3.43 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.37 0.00 227 G 8.37 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 * Residues marked with a * may have inaccurate shift predictions.