NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.6312 0.0000 0.0000 62.8139 33.6166 174.3788 2 I 4.3810 8.2029 120.6966 58.7722 39.5525 174.1271 *12 H 4.6638 9.5626 127.0351 56.3288 30.6706 172.1102 13 Q 4.2997 8.3332 124.6643 54.4662 29.9637 176.2239 14 A 4.1957 8.0615 123.3860 51.1260 19.4659 177.4459 15 I 3.6653 8.1414 120.5164 61.2626 38.7086 176.6584 16 S 4.4703 8.4212 122.4440 57.3899 65.3355 173.5061 17 P 4.3426 0.0000 0.0000 66.4027 31.1372 179.9819 18 R 3.9428 7.8888 118.9687 61.6721 29.3987 180.8318 19 T 4.1016 7.7255 116.7034 66.7169 68.4438 176.4847 20 L 4.1338 8.0451 120.3115 58.1729 41.6123 179.5327 21 C 4.1747 8.4915 116.9763 62.8463 28.0797 175.7337 22 C 4.0822 8.2245 120.2563 62.1706 31.2196 175.1710 23 W 4.4234 8.4183 130.1073 60.7780 30.2686 178.0951 24 V 3.1880 8.1796 118.2989 65.5421 31.0292 177.7726 25 K 3.7621 8.1642 119.6365 59.5211 32.0834 178.7850 26 V 3.4314 8.0749 118.6821 66.0938 31.1986 178.1843 27 V 3.0131 6.8616 116.5255 65.9095 31.1287 176.9799 28 E 3.8377 7.9038 119.3094 58.8173 29.1717 178.2606 29 E 3.8945 7.9411 119.1128 59.5124 30.0219 178.8864 30 K 4.1925 8.0991 115.2290 55.6668 33.6866 178.5526 31 A 3.1525 6.7121 122.7606 53.3609 18.7239 178.5969 32 F 4.5950 8.3278 112.7280 58.6639 39.6416 175.3012 33 S 4.2708 7.8833 115.0644 57.9393 63.3742 172.9084 34 P 4.3407 0.0000 0.0000 65.7847 31.1119 178.5397 35 E 4.1580 8.1648 115.2060 58.5230 29.5895 178.8484 36 V 3.6815 7.9400 120.0054 66.0950 31.3862 177.9845 37 I 3.8522 7.8221 119.5897 63.9700 37.0098 176.7022 38 P 4.3445 0.0000 0.0000 65.7750 31.2112 177.9549 39 M 4.0322 8.1017 118.1298 58.5957 31.9380 177.8406 40 F 4.0504 8.6882 119.9140 61.4392 39.7654 176.9928 41 S 3.9514 8.3601 114.4619 61.5383 62.4467 176.6099 42 A 3.9762 7.9533 122.3144 54.8892 18.1849 179.1541 43 L 4.1630 7.8207 116.1156 55.9750 42.0600 177.8419 44 S 4.4164 6.9599 113.3747 57.4002 63.1917 173.5374 45 E 3.9496 7.9693 120.8028 58.5958 29.5104 177.4580 46 G 3.8085 8.9417 110.8163 45.4604 0.0000 172.8596 47 A 4.3632 7.5919 123.7341 51.9488 19.0893 178.1877 48 T 4.3244 8.5287 113.0705 60.5825 71.3356 174.4393 49 P 4.5303 0.0000 0.0000 65.6173 31.1748 178.9081 50 Q 3.9781 8.2739 118.3171 59.4118 29.0752 177.6712 51 D 4.3754 7.9902 119.7206 57.6785 40.8152 179.1508 52 L 3.9352 8.1172 119.1898 57.8078 41.5992 179.3175 53 N 4.4462 8.4810 116.5092 56.5613 37.9705 177.4476 54 T 3.9317 8.1909 117.3228 67.0097 68.3302 176.4095 55 M 4.1796 7.8063 119.2429 58.5166 31.7269 178.5814 56 L 4.3620 8.1834 119.1352 57.8759 41.6589 178.9433 57 N 4.6582 8.8518 114.9112 54.9286 38.6571 176.2881 58 T 4.4866 7.4015 108.8316 60.4739 69.9327 175.0063 59 V 3.6255 7.3051 122.3552 63.0541 32.0987 175.1648 60 G 3.9952 8.5298 115.8393 44.8494 0.0000 174.7075 61 G 3.7233 8.5453 111.1601 45.9199 0.0000 172.1534 62 H 4.2995 8.4485 111.5399 56.9331 26.4699 177.1456 63 Q 4.0672 8.1363 118.4508 58.3280 28.6651 177.6508 64 A 3.9829 8.0840 121.7333 55.1373 18.4424 179.3223 65 A 3.8480 8.0343 118.7445 55.6362 18.5165 179.6275 66 M 4.0098 8.4130 117.5130 58.3675 31.9631 178.8471 67 Q 3.9596 8.4415 120.1243 59.5397 29.3229 178.1209 68 M 4.0419 8.3146 120.0474 58.2685 31.9010 178.4792 69 L 3.8966 8.1364 120.6929 57.9812 42.2767 178.9054 70 K 3.9496 8.1802 119.5155 59.6580 32.0493 178.4668 71 E 3.9989 8.1990 118.7732 59.8926 29.3619 179.6049 72 T 3.8390 8.0432 115.6495 66.4327 68.4101 176.9441 73 I 3.7537 7.9976 121.8761 64.4535 37.1964 177.9251 74 N 4.2357 8.5608 117.6617 56.7128 38.4291 177.2852 75 E 3.9056 8.3483 119.8009 59.3702 29.4591 179.2440 76 E 3.6199 7.8594 118.3208 58.4718 29.3856 179.0892 77 A 3.4242 7.4257 120.7748 54.8007 18.4715 179.3755 78 A 3.9112 7.7062 119.3137 55.4548 17.9592 179.3858 79 E 3.8496 8.0118 117.7172 59.0995 29.5849 178.8656 80 W 4.1844 8.2129 128.3963 60.5017 30.6234 177.4808 81 D 4.4033 8.1960 117.5504 57.8146 40.4434 178.6335 82 R 3.9929 7.6749 116.7338 59.0233 30.1772 178.1353 83 L 4.4398 7.1299 114.8574 54.5988 43.4149 177.2332 84 H 4.6426 7.3519 115.8061 53.9020 30.3798 171.7570 85 P 4.4087 0.0000 0.0000 61.2200 29.8807 176.3970 *97 R 4.2307 7.5103 120.6626 56.6217 30.9956 175.7127 98 E 4.4730 8.5776 117.9182 54.9488 30.4554 174.7255 99 P 4.1925 0.0000 0.0000 62.6239 32.2570 177.2521 100 R 4.5451 9.9764 122.9565 54.9310 31.0098 174.5512 101 G 3.8849 9.7985 102.7640 49.7593 0.0000 176.2429 102 S 4.2468 8.0645 116.1664 60.6535 63.1558 176.0003 103 D 4.3933 7.9725 123.1479 57.2935 40.2671 178.5765 104 I 3.3651 7.0969 119.3483 63.3959 37.0256 177.2352 105 A 2.5800 7.2967 118.7269 50.5331 18.6707 177.4495 106 G 3.8780 7.1007 105.1223 46.8042 0.0000 175.3841 107 T 4.1445 7.8006 111.5613 63.5120 69.1886 175.8725 108 T 4.6048 7.8427 109.8505 60.7495 69.0975 173.4231 109 S 4.9704 7.8262 114.9085 56.7975 66.3990 173.5217 110 T 4.4991 8.6177 111.8645 60.1558 71.6249 175.3312 111 L 3.8382 8.4211 123.6652 58.8126 41.8349 179.2753 112 Q 3.8538 7.8644 118.6394 58.8273 29.0144 177.4750 113 E 3.3313 8.2668 120.1365 59.3068 29.4784 179.3952 114 Q 4.3228 8.1729 118.1275 59.1399 28.8879 178.9232 115 I 3.8144 7.9936 121.1222 64.2182 37.0653 178.2350 116 G 3.5752 8.0795 106.8398 48.0572 0.0000 175.5416 117 W 4.4478 8.1924 121.9945 59.5343 28.9281 178.6130 118 M 4.3904 8.1278 117.5596 57.2914 31.5749 177.7151 119 T 4.4867 7.5028 106.9624 60.5692 69.6210 174.0310 120 H 4.1379 7.6746 122.5602 56.6441 30.4475 173.4656 121 N 5.0154 7.8887 120.3483 50.8030 40.4777 172.2658 122 P 4.5511 0.0000 0.0000 61.6139 32.3590 174.4899 123 P 4.5697 0.0000 0.0000 62.1658 32.0651 176.2015 124 I 4.2592 8.4834 122.9136 59.5777 37.4205 175.3614 125 P 4.5946 0.0000 0.0000 61.4578 28.3095 176.6403 126 V 3.3369 7.6650 118.2526 64.9715 31.8645 177.7317 127 G 3.8490 7.9678 106.2564 47.4684 0.0000 175.2384 128 E 3.9009 8.0109 120.9968 58.6645 29.5196 179.6445 129 I 3.3445 7.6372 119.7806 64.3353 37.0790 177.4542 130 Y 3.7242 7.3418 120.4503 60.6515 38.4645 178.0496 131 K 3.7908 8.1214 120.5049 59.9547 32.1473 178.8045 132 R 4.0866 7.9118 117.9396 58.9821 29.9284 179.1199 133 W 4.4255 7.9783 118.3982 59.9210 29.0483 178.6570 134 I 3.6409 8.0975 119.9580 64.4724 36.4336 178.5393 135 I 3.6908 8.2643 121.0266 64.2064 36.7273 178.2090 136 L 4.0685 8.2456 121.5416 58.1553 41.9182 179.3823 137 G 3.5488 8.1614 105.7214 47.5914 0.0000 175.7201 138 L 3.8630 8.2224 121.7816 57.6399 41.6577 179.2849 139 N 4.3215 8.4433 116.6879 56.3173 38.4726 177.5325 140 K 3.9571 7.7897 119.7591 59.5754 32.0481 179.5027 141 I 3.6131 7.6132 120.0348 64.2370 36.7982 178.6113 142 V 3.7380 8.0314 119.5367 66.1141 31.1109 178.1174 143 R 4.0581 7.9032 117.4762 59.5399 29.9540 178.0668 144 M 4.2618 7.8509 118.0102 58.3593 32.1718 177.9753 145 Y 4.2768 8.4275 115.8898 59.0590 39.3247 176.0497 146 S 4.6949 7.6385 114.4597 55.6352 62.0893 171.0645 147 P 4.5063 0.0000 0.0000 63.8395 32.4421 177.8858 148 T 3.7969 7.9249 115.1735 64.0966 68.9412 173.5392 149 S 4.9208 8.5600 119.4979 56.8896 63.6136 174.3474 150 I 3.4456 8.4958 125.7750 64.1896 37.7213 178.0088 151 L 4.0582 7.8372 118.7191 57.5116 41.5243 177.3770 152 D 4.5705 7.9450 116.0214 54.3723 41.0165 176.4396 153 I 4.2732 7.5097 121.6399 60.3742 36.6991 175.2474 154 R 4.9670 8.2215 123.6459 53.8377 33.8974 175.3489 155 Q 3.8526 8.0590 124.7027 55.7418 28.9769 176.3983 156 G 3.9771 9.4818 114.6984 45.7840 0.0000 172.7073 157 P 4.4309 0.0000 0.0000 64.6293 31.5321 177.3484 158 K 4.4427 7.7594 114.8655 55.5828 33.2181 175.5234 159 E 4.0992 7.6357 120.5695 55.0234 30.0087 175.3153 160 P 4.4543 0.0000 0.0000 62.8246 33.3165 177.1897 161 F 4.4072 8.9453 122.6957 61.4881 39.3602 177.5967 162 R 3.8032 8.0997 118.0317 59.4363 29.9761 178.0449 163 D 4.3615 8.0998 118.2824 57.4800 40.8242 178.0217 164 Y 4.2242 7.8318 119.9509 60.7670 38.8471 178.1090 165 V 3.0644 7.5793 119.2677 65.7499 31.4608 177.7452 166 D 4.3971 8.1132 118.8047 57.4189 40.6000 178.9818 167 R 3.9073 7.9873 118.5367 59.0668 30.0856 178.6665 168 F 3.7571 8.2639 120.8624 61.6963 39.2873 176.7580 169 Y 4.1695 8.0821 115.6918 60.1428 37.7437 177.9382 170 K 3.9904 8.1475 121.0562 59.6737 32.2166 178.9556 171 T 3.7806 8.1030 116.2596 66.7365 68.5775 176.3632 172 L 3.8389 7.5586 120.7681 58.0061 41.6150 179.7978 173 R 3.9828 8.2177 118.1384 59.4065 29.8593 178.4480 174 A 4.1055 8.0373 119.4640 54.6796 18.7137 178.4046 175 E 4.2118 7.8661 115.1706 55.6923 30.7461 176.3945 176 Q 3.2657 7.6791 116.5419 56.8700 26.5419 174.4397 177 A 4.1467 7.5892 121.0078 51.4647 19.7057 178.9118 178 S 4.2953 8.5614 117.8730 58.5151 65.0018 175.4540 179 Q 4.0203 8.8605 126.1387 59.9404 28.6467 179.3928 180 E 3.9885 8.1322 118.9627 61.2155 29.9261 182.3227 181 V 3.8515 7.7464 121.8354 66.2204 31.4348 178.9206 182 K 4.0574 8.3631 123.6105 59.8857 31.5268 180.9998 183 N 4.5699 8.3848 117.9249 56.1864 38.4117 177.4191 184 A 4.0009 8.3698 122.0891 55.1353 18.5138 179.5597 185 A 4.0748 8.2648 119.3220 55.2821 18.4090 180.1108 186 T 3.9055 8.5088 117.1185 67.5178 68.4170 177.2753 187 E 4.0360 8.2056 118.8830 62.0774 29.9462 180.3852 188 T 4.4568 8.3157 117.2264 65.6947 68.6883 177.2664 189 L 4.1009 8.4169 120.8055 57.6761 41.7342 179.3351 190 L 3.3260 7.2152 119.1864 58.0433 42.2929 179.0075 191 V 3.7836 7.6562 117.3350 66.0651 31.4539 177.2870 192 Q 4.0317 8.0254 118.2189 59.0659 29.0629 177.1581 193 N 4.7500 8.7164 114.9410 52.8328 38.9320 174.9482 194 A 4.1327 7.7028 122.0920 51.3862 19.2486 178.3527 195 N 4.5068 8.7522 118.4614 52.1160 39.3240 174.6967 196 P 4.2093 0.0000 0.0000 65.8298 31.4375 178.4952 197 D 4.3322 8.0679 117.0541 57.8129 40.7518 178.7491 198 C 3.9868 8.5331 117.0619 62.6375 28.1297 175.9469 199 K 3.8624 8.4575 121.6085 59.8228 31.7506 178.9932 200 T 3.8123 7.9020 115.8246 66.7851 68.2366 176.6687 201 I 3.6686 7.3508 120.1940 64.5657 36.8396 178.2060 202 L 4.0857 8.2615 120.0948 57.4264 41.4285 179.6098 203 K 3.9528 8.1063 118.3763 59.4665 31.8029 179.0045 204 A 4.0092 7.6417 119.4532 55.4146 18.2395 179.3913 205 L 4.0504 7.4014 115.7304 55.1981 41.8357 178.6676 206 G 3.9535 7.6956 104.8049 44.0307 0.0000 171.0275 207 P 4.3563 0.0000 0.0000 63.4261 31.7908 177.0975 208 G 3.8317 8.7843 106.2608 45.9176 0.0000 173.3520 209 A 4.3800 7.7982 122.8426 51.3682 19.1529 179.0595 210 T 4.1323 8.9372 114.6521 61.2077 70.8968 175.3801 211 L 3.9561 8.5363 124.1517 58.4721 42.0530 178.7757 212 E 3.9349 8.2746 118.5552 59.6109 29.4368 178.6092 213 E 3.9846 8.2853 118.1951 59.7502 29.4031 179.2589 214 M 4.0253 8.3934 118.9818 58.8203 31.8123 178.8331 215 M 4.4434 8.2733 117.9320 58.5822 32.2990 178.6972 216 T 4.0292 8.1757 115.8683 66.6104 68.4344 176.5817 217 A 4.0149 8.0412 121.5499 54.5718 18.3504 178.4639 218 C 4.4581 7.3084 112.8005 59.4550 28.5579 173.9567 219 Q 4.2285 7.7276 125.2784 56.4025 28.5100 175.5843 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 P 0.00 4.63 0.00 2.07 2.19 0.00 3.48 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.93 0.00 2 I 8.20 4.38 1.87 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 1.16 0.85 0.91 0.00 0.00 *12 H 9.56 4.66 0.00 3.17 3.29 0.00 5.72 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.33 4.30 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.72 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 14 A 8.06 4.20 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 15 I 8.14 3.67 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.80 0.91 0.00 0.00 16 S 8.42 4.47 0.00 4.07 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 17 P 0.00 4.34 0.00 2.18 2.15 0.00 3.60 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 2.16 0.00 18 R 7.89 3.94 0.00 1.81 1.93 0.00 3.27 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.29 0.00 19 T 7.73 4.10 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 1.21 0.00 0.00 20 L 8.05 4.13 0.00 1.98 1.79 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 21 C 8.49 4.17 0.00 2.97 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 C 8.22 4.08 0.00 3.04 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 W 8.42 4.42 0.00 3.45 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 8.18 3.19 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 0.88 0.00 0.00 1.04 0.00 0.00 25 K 8.16 3.76 0.00 1.92 1.98 0.00 1.84 0.00 0.00 1.51 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.44 7.81 26 V 8.07 3.43 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 0.83 0.00 0.00 0.99 0.00 0.00 27 V 6.86 3.01 1.22 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 0.33 0.00 0.00 -0.58 0.00 0.00 28 E 7.90 3.84 0.00 2.05 1.91 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 2.24 2.29 0.00 29 E 7.94 3.89 0.00 1.93 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 2.31 2.33 0.00 30 K 8.10 4.19 0.00 1.75 1.72 0.00 1.74 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.28 7.81 31 A 6.71 3.15 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 32 F 8.33 4.59 0.00 2.36 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 33 S 7.88 4.27 0.00 3.96 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 34 P 0.00 4.34 0.00 2.22 2.13 0.00 3.67 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 2.14 2.19 0.00 35 E 8.16 4.16 0.00 2.18 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 36 V 7.94 3.68 2.24 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 1.09 0.00 0.00 0.85 0.00 0.00 37 I 7.82 3.85 2.04 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 1.64 0.58 0.99 0.00 0.00 38 P 0.00 4.34 0.00 2.29 2.34 0.00 3.94 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 2.24 2.05 0.00 39 M 8.10 4.03 0.00 2.54 2.19 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.74 0.00 40 F 8.69 4.05 0.00 3.14 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 41 S 8.36 3.95 0.00 4.06 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 7.95 3.98 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.82 4.16 0.00 1.44 1.62 1.19 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 44 S 6.96 4.42 0.00 3.40 3.11 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 45 E 7.97 3.95 0.00 1.89 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 0.00 2.22 2.20 0.00 46 G 8.94 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 0.00 0.00 0.00 47 A 7.59 4.36 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 48 T 8.53 4.32 4.45 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.53 0.00 2.31 2.25 0.00 3.80 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 2.10 2.12 0.00 50 Q 8.27 3.98 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 51 D 7.99 4.38 0.00 2.82 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 52 L 8.12 3.94 0.00 1.82 1.48 0.85 0.41 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 53 N 8.48 4.45 0.00 2.97 2.96 0.00 0.00 7.02 6.62 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 54 T 8.19 3.93 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 1.25 0.00 0.00 55 M 7.81 4.18 0.00 1.25 2.05 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 2.63 2.24 0.00 56 L 8.18 4.36 0.00 1.77 1.80 0.88 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.85 4.66 0.00 2.78 2.94 0.00 0.00 6.98 7.40 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 58 T 7.40 4.49 4.34 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 1.34 0.00 0.00 59 V 7.31 3.63 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.11 0.00 0.00 60 G 8.53 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 61 G 8.55 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 0.00 0.00 0.00 62 H 8.45 4.30 0.00 3.52 3.67 0.00 5.62 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.14 4.07 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 64 A 8.08 3.98 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 65 A 8.03 3.85 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 M 8.41 4.01 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 3.05 0.00 67 Q 8.44 3.96 0.00 2.34 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 68 M 8.31 4.04 0.00 2.03 2.16 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 2.75 2.54 0.00 69 L 8.14 3.90 0.00 1.73 1.90 0.86 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.18 3.95 0.00 2.05 2.03 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.54 7.81 71 E 8.20 4.00 0.00 2.20 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 2.33 2.55 0.00 72 T 8.04 3.84 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 73 I 8.00 3.75 2.14 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.74 1.18 0.00 0.00 74 N 8.56 4.24 0.00 2.80 2.85 0.00 0.00 7.10 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 75 E 8.35 3.91 0.00 1.88 1.91 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 2.28 2.54 0.00 76 E 7.86 3.62 0.00 1.16 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 2.30 2.17 0.00 77 A 7.43 3.42 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 78 A 7.71 3.91 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.01 3.85 0.00 2.07 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 2.28 2.38 0.00 80 W 8.21 4.18 0.00 3.83 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 81 D 8.20 4.40 0.00 2.93 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 82 R 7.67 3.99 0.00 1.92 1.97 0.00 3.12 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 83 L 7.13 4.44 0.00 1.34 1.44 0.89 0.92 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 84 H 7.35 4.64 0.00 2.31 2.88 0.00 5.85 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.41 0.00 2.16 2.05 0.00 3.70 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.89 0.00 *97 R 7.51 4.23 0.00 2.11 2.13 0.00 3.17 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 2.06 0.00 98 E 8.58 4.47 0.00 2.06 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 2.35 2.36 0.00 99 P 0.00 4.19 0.00 1.24 0.49 0.00 3.66 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.11 0.00 100 R 9.98 4.55 0.00 1.63 1.87 0.00 3.28 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.44 0.00 101 G 9.80 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 0.00 0.00 0.00 102 S 8.06 4.25 0.00 4.06 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 0.00 103 D 7.97 4.39 0.00 2.60 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 0.00 104 I 7.10 3.37 1.47 0.00 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 -0.16 -0.33 0.00 0.00 105 A 7.30 2.58 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 0.00 106 G 7.10 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 0.00 0.00 0.00 107 T 7.80 4.14 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 108 T 7.84 4.60 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 1.23 0.00 0.00 109 S 7.83 4.97 0.00 4.23 4.30 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 0.00 110 T 8.62 4.50 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 1.18 0.00 0.00 111 L 8.42 3.84 0.00 1.75 1.68 0.86 0.70 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 0.00 112 Q 7.86 3.85 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.66 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 113 E 8.27 3.33 0.00 1.79 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 2.05 0.00 114 Q 8.17 4.32 0.00 2.26 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.56 2.67 0.00 115 I 7.99 3.81 1.92 0.00 0.00 0.63 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 1.27 0.87 0.00 0.00 116 G 8.08 3.58 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 0.00 117 W 8.19 4.45 0.00 3.46 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 M 8.13 4.39 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.56 0.00 119 T 7.50 4.49 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 0.00 120 H 7.67 4.14 0.00 3.46 3.42 0.00 5.52 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 N 7.89 5.02 0.00 2.63 2.60 0.00 0.00 7.04 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 P 0.00 4.55 0.00 2.27 2.07 0.00 3.93 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 2.07 2.00 0.00 123 P 0.00 4.57 0.00 2.24 2.27 0.00 3.38 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 124 I 8.48 4.26 1.87 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 1.41 0.73 0.84 0.00 0.00 125 P 0.00 4.59 0.00 2.21 2.19 0.00 3.66 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 126 V 7.67 3.34 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 0.35 0.00 0.00 1.01 0.00 0.00 127 G 7.97 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.01 3.90 0.00 2.05 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 2.35 2.31 0.00 129 I 7.64 3.34 1.22 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.90 -0.01 0.00 0.00 130 Y 7.34 3.72 0.00 2.82 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 0.00 131 K 8.12 3.79 0.00 1.99 1.83 0.00 1.48 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.49 1.46 7.81 132 R 7.91 4.09 0.00 2.08 2.09 0.00 3.25 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.84 0.00 133 W 7.98 4.43 0.00 3.64 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 I 8.10 3.64 1.80 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.34 0.24 0.00 0.00 135 I 8.26 3.69 1.93 0.00 0.00 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 1.54 1.01 0.96 0.00 0.00 136 L 8.25 4.07 0.00 1.92 1.96 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 137 G 8.16 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 L 8.22 3.86 0.00 1.73 1.72 0.52 0.57 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 0.00 139 N 8.44 4.32 0.00 2.86 3.05 0.00 0.00 7.06 7.35 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 0.00 140 K 7.79 3.96 0.00 1.84 1.82 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.47 7.81 141 I 7.61 3.61 1.55 0.00 0.00 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 1.16 0.69 -0.23 0.00 0.00 142 V 8.03 3.74 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.10 0.00 0.00 143 R 7.90 4.06 0.00 1.99 2.05 0.00 3.31 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 144 M 7.85 4.26 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.58 0.00 145 Y 8.43 4.28 0.00 3.05 3.11 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 0.00 146 S 7.64 4.69 0.00 3.78 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 0.00 147 P 0.00 4.51 0.00 2.20 2.28 0.00 3.85 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.95 0.00 148 T 7.92 3.80 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 1.20 0.00 0.00 149 S 8.56 4.92 0.00 3.83 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 0.00 150 I 8.50 3.45 1.76 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.60 0.80 0.00 0.00 151 L 7.84 4.06 0.00 1.67 1.73 0.92 1.03 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 0.00 152 D 7.95 4.57 0.00 2.67 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 0.00 153 I 7.51 4.27 2.02 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 1.46 0.67 1.06 0.00 0.00 154 R 8.22 4.97 0.00 1.64 1.75 0.00 3.22 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 155 Q 8.06 3.85 0.00 0.93 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.89 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 156 G 9.48 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 0.00 157 P 0.00 4.43 0.00 2.18 2.18 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 158 K 7.76 4.44 0.00 1.74 1.85 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.33 7.81 159 E 7.64 4.10 0.00 1.99 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 2.40 2.33 0.00 160 P 0.00 4.45 0.00 2.26 2.03 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 2.32 2.19 0.00 161 F 8.95 4.41 0.00 3.13 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 R 8.10 3.80 0.00 1.98 1.95 0.00 3.26 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 163 D 8.10 4.36 0.00 2.91 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 Y 7.83 4.22 0.00 3.14 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 0.00 165 V 7.58 3.06 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 1.01 0.00 0.00 0.02 0.00 0.00 166 D 8.11 4.40 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 0.00 167 R 7.99 3.91 0.00 2.03 2.00 0.00 3.19 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 168 F 8.26 3.76 0.00 2.56 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 0.00 169 Y 8.08 4.17 0.00 3.14 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 0.00 170 K 8.15 3.99 0.00 1.93 2.10 0.00 1.55 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.53 7.81 171 T 8.10 3.78 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 1.11 0.00 0.00 172 L 7.56 3.84 0.00 1.80 1.72 0.86 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 173 R 8.22 3.98 0.00 2.12 2.03 0.00 3.13 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 174 A 8.04 4.11 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 0.00 175 E 7.87 4.21 0.00 1.94 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 2.26 2.49 0.00 176 Q 7.68 3.27 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 177 A 7.59 4.15 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 0.00 0.00 178 S 8.56 4.30 0.00 4.07 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 0.00 179 Q 8.86 4.02 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 6.95 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 180 E 8.13 3.99 0.00 2.01 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 2.31 1.94 0.00 181 V 7.75 3.85 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 0.91 0.00 0.00 0.94 0.00 0.00 182 K 8.36 4.06 0.00 1.79 1.80 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.35 7.81 183 N 8.38 4.57 0.00 2.94 2.94 0.00 0.00 6.96 6.92 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 0.00 184 A 8.37 4.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 A 8.26 4.07 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 0.00 186 T 8.51 3.91 4.50 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 1.31 0.00 0.00 187 E 8.21 4.04 0.00 2.06 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 0.00 2.26 2.23 0.00 188 T 8.32 4.46 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 1.26 0.00 0.00 189 L 8.42 4.10 0.00 2.30 2.10 0.97 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 190 L 7.22 3.33 0.00 1.08 1.61 -0.43 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 191 V 7.66 3.78 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 0.99 0.00 0.00 0.96 0.00 0.00 192 Q 8.03 4.03 0.00 2.12 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.84 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 193 N 8.72 4.75 0.00 3.11 2.93 0.00 0.00 6.95 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 A 7.70 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 N 8.75 4.51 0.00 2.95 3.00 0.00 0.00 7.23 8.14 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 0.00 196 P 0.00 4.21 0.00 2.15 2.12 0.00 3.58 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 197 D 8.07 4.33 0.00 2.77 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 0.00 198 C 8.53 3.99 0.00 2.96 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 0.00 199 K 8.46 3.86 0.00 1.89 1.94 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.65 7.81 200 T 7.90 3.81 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 1.18 0.00 0.00 201 I 7.35 3.67 1.90 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.60 0.84 0.00 0.00 202 L 8.26 4.09 0.00 1.73 1.66 0.77 0.51 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 0.00 203 K 8.11 3.95 0.00 1.90 1.84 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.69 1.59 7.81 204 A 7.64 4.01 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 0.00 205 L 7.40 4.05 0.00 1.86 1.74 0.89 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 206 G 7.70 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 P 0.00 4.36 0.00 2.06 2.01 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 208 G 8.78 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 0.00 209 A 7.80 4.38 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 0.00 210 T 8.94 4.13 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 0.00 211 L 8.54 3.96 0.00 1.80 1.72 1.02 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 212 E 8.27 3.93 0.00 2.08 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 2.40 2.44 0.00 213 E 8.29 3.98 0.00 2.22 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 2.33 2.36 0.00 214 M 8.39 4.03 0.00 2.14 2.38 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.60 0.00 215 M 8.27 4.44 0.00 2.12 2.23 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 2.98 2.84 0.00 216 T 8.18 4.03 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 217 A 8.04 4.01 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 0.00 0.00 218 C 7.31 4.46 0.00 2.57 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 Q 7.73 4.23 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.55 0.00 0.00 0.00 0.00 0.00 2.57 2.31 0.00 * Residues marked with a * may have inaccurate shift predictions.