NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 V 4.0824 8.0393 120.3947 62.0518 33.2175 175.4552 25 P 4.3500 0.0000 0.0000 61.5138 32.3926 174.5459 26 N 5.2208 9.1111 120.1939 53.1059 40.2346 175.7199 27 E 4.2621 8.0747 117.2915 54.8893 30.3907 175.9221 28 P 4.4340 0.0000 0.0000 63.3097 32.1384 175.9436 29 I 4.4455 8.6665 124.2426 59.4504 41.2093 173.8552 30 N 5.3847 8.4740 123.4006 51.0838 40.2902 174.5600 31 W 4.0505 9.4665 135.0000 57.4995 31.1301 175.4513 32 G 3.6042 6.4721 113.8075 45.0564 0.0000 171.8428 33 F 4.2902 6.7193 112.3963 55.3707 39.7710 173.6181 34 K 4.0245 8.5811 123.6026 55.8967 32.5765 177.1433 35 R 4.3308 8.4484 125.0395 56.1475 30.6845 176.3551 36 S 4.2240 8.7134 115.0565 58.4820 63.1944 173.7175 37 V 4.3613 7.9592 125.8850 62.1771 34.1220 174.7932 38 N 3.9885 9.5333 120.5025 54.3225 36.0282 173.8710 39 H 4.8768 8.0468 111.2268 57.0848 25.9275 174.5009 40 Q 4.7636 7.7862 117.0804 53.1881 30.7912 174.3210 41 P 4.0451 0.0000 0.0000 62.0841 31.8995 174.7446 42 P 4.6698 0.0000 0.0000 61.9399 32.7304 174.6927 43 D 4.8944 8.2744 116.6725 52.4391 43.4785 175.0426 44 A 3.7584 8.7596 129.1059 52.7498 18.7566 177.7995 45 G 4.0300 9.7622 103.9019 44.5408 0.0000 175.0840 46 K 3.9591 8.5545 119.9086 58.8642 32.1628 179.1889 47 Q 3.9201 7.9359 119.7648 59.3033 29.2480 177.8340 48 L 4.1506 7.8157 119.5203 57.8051 41.7575 178.9202 49 N 4.5809 8.5735 116.7961 56.5994 38.4192 177.6225 50 S 4.1695 8.0288 115.8279 61.6071 62.9208 176.6363 51 L 4.1486 7.8689 121.1301 58.0402 41.2103 179.5670 52 I 3.9139 8.2964 118.6976 64.6779 37.1613 178.0869 53 E 4.1586 8.2045 118.1471 59.2249 29.4072 178.6079 54 K 3.7575 8.0967 118.9862 60.4315 32.5047 175.2938 55 Y 4.8991 7.7026 115.3274 56.6351 40.5817 174.9897 56 D 4.9724 8.5567 120.0135 53.9345 41.0523 175.3169 57 A 5.3592 8.5530 122.2688 52.0614 22.2398 174.8652 58 F 5.0970 7.5244 113.1305 56.3196 40.8858 174.0896 59 Y 4.7244 8.6842 115.5358 56.3777 39.1902 175.0400 60 L 4.8863 7.5344 119.0845 52.9079 45.6309 177.0979 61 G 3.7948 8.9592 109.9680 46.2599 0.0000 175.1947 62 N 4.8315 9.4853 126.4256 53.1580 39.0152 176.2439 63 T 4.3790 8.4766 115.5634 62.0211 69.4294 175.5751 64 K 4.2815 8.5581 121.8194 57.1607 32.5503 176.2761 65 E 4.7247 7.5573 115.8038 54.1799 33.1316 176.4639 66 K 4.2465 8.1235 119.9645 56.1403 29.9617 175.8330 67 T 4.9986 7.6527 118.1937 61.5451 73.0267 173.9834 68 I 4.7073 7.8235 124.3533 59.5300 41.5569 174.0011 69 Y 5.5037 8.7264 122.9030 55.3685 40.7547 174.7243 70 L 4.8097 8.6204 124.8829 54.0525 43.1971 175.9800 71 T 4.8590 8.3675 112.4027 60.0131 72.7985 172.7156 72 F 5.4863 9.0096 120.2730 54.8110 43.6006 173.3361 73 D 5.2813 8.5677 120.8736 52.6799 43.1401 175.6094 74 N 4.4820 9.4614 120.7248 51.6984 40.8172 174.9433 75 G 3.9768 8.5490 113.1797 46.3783 0.0000 171.4647 76 Y 5.0635 7.2640 115.0399 56.2823 40.4965 172.8305 77 E 4.7885 8.9207 120.9192 54.7142 31.5338 174.7387 78 N 4.9634 8.9670 122.3556 53.3342 39.8036 175.0011 79 G 3.7322 8.7397 104.9795 44.9828 0.0000 174.6243 80 Y 4.7722 7.4577 115.5547 58.5223 39.0264 177.4833 81 T 3.9245 8.2034 117.6401 66.0921 68.4963 174.5267 82 P 4.2119 0.0000 0.0000 65.5311 31.3136 178.7783 83 K 4.0502 8.0575 116.8936 59.2814 31.9835 179.4089 84 V 3.6107 7.8613 118.6870 66.0064 31.3825 178.1315 85 L 3.9536 8.0868 118.8122 57.8006 41.3499 179.1580 86 D 4.3451 8.1518 118.8850 57.3360 40.7613 179.0750 87 V 3.5875 8.0965 118.8919 66.0559 31.4974 178.0761 88 L 4.0339 8.1309 118.8233 57.5860 41.4300 179.4274 89 K 3.9211 8.3120 119.6991 59.3859 31.9541 178.5246 90 K 3.8227 7.9757 118.7395 59.7996 32.1686 177.5158 91 H 4.5294 8.0149 112.6993 54.6354 29.5272 174.8679 92 R 3.7761 7.8769 120.2419 57.6977 28.8216 175.5999 93 V 4.5363 8.0154 115.5884 61.3830 34.3490 175.0505 94 T 4.6515 8.6524 123.2554 62.2024 69.8633 174.4899 95 G 4.2123 9.1565 113.4891 45.0565 0.0000 172.0157 96 T 5.0623 8.0928 116.6409 61.5947 71.6424 173.3848 97 F 5.0124 9.3037 126.5680 55.7892 41.2412 175.3245 98 F 4.7512 9.3675 125.0623 56.8264 39.6620 175.5829 99 V 4.9121 8.6724 117.9795 59.8697 34.6852 175.8009 100 T 5.2290 7.6662 113.2496 59.5776 71.3104 176.1146 101 G 2.2073 8.3046 108.5181 47.6346 0.0000 175.4013 102 H 4.0055 7.8285 120.2807 58.8757 29.8147 176.8950 103 F 3.9107 8.1007 122.0881 61.2847 39.0204 177.2638 104 V 3.5288 7.5767 116.6350 65.9964 31.3979 177.8910 105 K 4.0874 7.8658 117.3240 59.1730 31.9616 178.4411 106 D 4.4019 7.8602 117.4346 55.5169 42.6153 176.2136 107 Q 4.4217 7.8038 117.8987 53.1934 29.3530 174.4728 108 P 4.2025 0.0000 0.0000 66.1069 31.7153 178.4240 109 Q 3.9610 7.8785 117.2997 58.7364 28.5786 178.5306 110 L 3.9437 7.6718 119.5800 57.6393 41.8757 179.2985 111 I 3.6722 7.7455 119.8532 64.3221 36.9883 178.3946 112 K 3.9490 8.4216 120.8284 59.4688 31.8911 179.1441 113 R 3.8927 8.0300 118.4949 59.3003 29.9536 178.7189 114 M 3.9467 8.1070 118.7508 58.4695 31.8271 178.8423 115 S 4.0552 7.8792 112.5067 61.6793 62.4536 175.9978 116 D 4.4138 8.2804 120.4078 56.6512 40.4707 177.5146 117 E 4.5379 8.1968 117.6748 55.8749 29.9690 177.1522 118 G 3.8483 7.7773 107.0887 45.5748 0.0000 173.8333 119 H 4.8208 7.7226 116.7927 55.3607 30.4332 174.3906 120 I 4.5979 8.7257 119.9279 59.8485 39.6826 175.1936 121 I 4.7905 9.0933 127.8459 59.8092 38.6610 175.7808 122 G 3.6452 8.8032 115.0420 44.6414 0.0000 171.3528 123 N 5.2946 9.3399 119.6302 52.2711 40.2985 174.4708 124 H 5.4642 9.0884 125.5376 55.6776 31.1277 173.6871 125 S 4.5374 9.0880 111.3186 57.8907 64.0897 170.5107 126 F 3.7076 8.8998 124.1058 61.6243 39.2083 176.5535 127 H 4.8114 9.3440 114.7224 55.1232 29.0488 174.4889 128 H 4.4643 8.3520 117.4299 55.6177 27.8616 172.5006 129 P 4.4881 0.0000 0.0000 61.4551 32.7583 175.1853 130 D 4.5284 8.3575 117.8564 53.2882 40.5334 176.3985 131 L 4.0684 8.6000 128.5439 57.8588 41.7977 179.6295 132 T 4.2768 8.3271 107.5835 63.4947 68.8753 175.0603 133 T 4.4274 7.9761 111.6806 61.2558 69.1982 174.3786 134 K 4.8561 7.6162 121.3684 54.9214 34.7777 176.7022 135 T 4.3940 9.3316 112.8969 60.9280 71.1281 175.7619 136 A 4.0105 8.6709 123.2064 55.4778 18.4503 179.3910 137 D 4.2834 8.1069 115.7760 57.6711 41.3399 178.3498 138 Q 4.0126 8.0334 118.3412 59.0893 28.7556 178.7425 139 I 3.6895 8.1255 121.1812 64.5350 37.0948 178.1339 140 Q 3.9804 8.2022 120.2018 59.3600 28.8487 178.0181 141 D 4.3408 8.0629 118.5872 57.2842 41.2872 177.8829 142 E 4.0631 8.6600 119.6374 59.3315 29.3105 179.3378 143 L 4.0804 7.9763 118.7078 57.5975 41.9080 178.7921 144 D 4.4502 8.5761 118.6571 57.3289 41.2281 178.3879 145 S 4.1243 8.3844 114.9709 61.2535 62.7720 176.8726 146 V 3.8022 7.8649 122.0668 66.1368 31.3669 177.7995 147 N 4.4425 8.3134 115.8095 56.1419 38.4137 176.7546 148 E 3.9549 8.5782 121.0984 59.4711 29.9079 178.6478 149 E 4.0520 8.2840 119.0422 59.1848 29.7219 178.8623 150 V 3.6489 8.1602 118.5492 66.1956 31.6170 177.4220 151 Y 4.1426 8.6353 119.7766 60.4992 38.3954 177.6548 152 K 4.0166 8.1753 119.8063 59.6472 32.2824 178.5283 153 I 3.9106 7.4816 118.8242 64.0133 37.3329 177.6115 154 T 4.3313 8.2987 108.2820 60.7124 69.6296 175.6868 155 G 3.0656 7.7491 109.0058 45.3993 0.0000 172.7964 156 K 4.6964 7.4931 117.4269 54.6631 36.1185 175.9404 157 Q 4.4104 8.2759 120.2949 55.3034 30.9889 173.7929 158 D 4.6928 8.5936 125.5419 53.6059 41.7911 175.7957 159 N 4.2654 8.3809 117.5572 53.4203 39.1586 175.2859 160 L 4.0603 7.8236 120.8750 54.6087 42.0841 175.4534 161 Y 5.5571 8.5864 121.4448 56.0586 42.0345 174.5439 162 L 5.2709 9.2867 124.4903 53.3034 45.8822 174.8839 163 R 4.4111 8.6879 126.0923 53.5033 31.9745 173.6867 164 P 4.3639 0.0000 0.0000 61.5952 32.3422 174.2058 165 P 4.1621 0.0000 0.0000 64.3050 31.6273 176.7166 166 R 3.7447 9.5379 119.0514 56.5703 27.9791 176.6909 167 G 4.4037 8.5418 105.0924 46.4083 0.0000 173.1854 168 V 4.8802 7.9989 119.8564 61.8894 32.6790 175.3095 169 F 5.1397 9.0169 122.1737 57.1326 41.6484 172.4712 170 S 4.5418 8.6398 111.3898 56.6695 65.6016 175.5333 171 E 3.9478 8.9669 120.4062 59.5489 29.1539 177.9670 172 Y 4.0573 8.1407 119.4486 60.8349 38.8247 178.3119 173 V 3.1732 7.8359 119.0337 65.7494 31.5712 177.9676 174 L 3.7978 7.8623 118.6262 57.4939 41.4782 179.3033 175 K 3.6778 7.5151 119.7220 59.5033 32.0276 178.4167 176 E 3.8462 8.0807 120.1088 59.4102 29.4475 178.8283 177 T 3.9335 8.0179 109.9902 64.3146 68.8240 176.7418 178 K 4.2456 8.1233 124.1885 58.9037 32.0315 178.8054 179 R 3.9543 7.9692 117.9978 58.8513 30.0393 177.4811 180 L 4.4756 7.4410 116.6680 54.5571 41.9511 177.4287 181 G 3.8421 8.3505 108.1127 45.1862 0.0000 173.0682 182 Y 4.5656 8.1910 117.6813 56.8072 40.1580 174.2327 183 Q 4.6039 8.6913 124.2555 54.9462 31.2642 174.3660 184 T 4.4428 8.8768 124.5051 62.6660 69.9837 173.8531 185 V 3.5892 8.0049 127.6393 60.4991 32.3880 174.8221 186 F 4.7475 7.8708 134.6018 56.5839 40.0857 175.7097 187 W 4.8845 7.5648 123.1748 57.1110 30.0556 174.1838 188 S 4.1871 9.6103 111.8793 57.6970 63.9905 174.2003 189 V 4.8008 8.0514 120.8677 61.8218 34.5479 173.2106 190 A 5.0783 8.9013 127.4417 51.4759 22.0486 174.8292 191 F 4.8063 7.6438 114.2051 55.6151 40.8918 175.1919 192 V 3.6749 8.4809 120.8413 62.0353 29.4648 174.3898 193 D 5.0053 8.1834 124.3431 52.1922 39.9735 176.7683 194 W 4.6748 7.1905 113.2179 56.4574 29.0658 175.2711 195 K 4.2430 7.1332 119.9912 55.2764 30.9096 177.3491 196 I 3.8207 8.3940 126.4583 64.0604 37.2365 177.1863 197 N 4.6930 8.0517 114.8605 53.2891 37.7808 175.5323 198 N 4.7720 7.5000 116.1787 53.2722 40.3574 172.9955 199 Q 4.2357 7.7762 117.7182 54.5326 28.8762 176.4563 200 K 3.9631 8.3267 122.4841 56.8970 32.4410 177.5440 201 G 3.8811 7.9525 105.6530 44.2870 0.0000 174.1593 202 K 3.8897 8.6466 117.8206 59.4554 32.1589 178.5222 203 K 3.8945 8.1408 119.4514 59.7810 31.8944 177.4841 204 Y 3.9696 8.2053 118.8350 60.8341 38.6742 178.0876 205 A 3.7576 7.7873 121.0157 55.1626 18.5865 178.7822 206 Y 3.9673 8.3222 118.4228 61.1538 38.7942 178.1237 207 D 4.2117 8.5826 119.9861 57.7676 40.8066 178.6964 208 H 3.8113 7.3463 116.6493 58.9164 28.2956 177.8351 209 M 4.0265 7.4021 119.5552 57.9855 31.8558 178.7341 210 I 3.7962 7.3389 120.1208 64.1367 37.2116 178.4816 211 K 3.9596 7.8496 118.0416 59.5941 31.9002 178.2894 212 Q 4.2187 8.0753 114.6854 56.1920 29.3255 176.2572 213 A 4.1490 7.8533 122.2875 52.2817 19.1382 176.3031 214 H 5.2572 8.1841 114.4402 53.7905 31.0754 171.5343 215 P 4.5471 0.0000 0.0000 64.3070 31.7488 177.7090 216 G 4.2202 9.4120 111.0339 45.1063 0.0000 172.9250 217 A 4.4147 7.9284 122.6620 52.3341 19.8309 176.9219 218 I 4.9729 8.9631 123.3597 59.9542 39.0753 174.6205 219 Y 4.8926 9.0698 126.0995 57.3211 39.4697 174.6259 220 L 4.8159 8.7439 126.0047 52.4647 43.8361 175.4298 221 L 4.6810 8.3607 125.6586 53.2084 45.8358 175.4599 222 H 5.2546 9.3597 118.4960 54.0676 31.6989 174.3884 223 T 4.7376 8.3807 107.2138 61.7945 68.9526 175.1283 224 V 4.3222 7.9450 114.8857 62.2337 33.0116 175.9513 225 S 4.8027 7.3793 115.0476 56.2026 63.4449 173.0347 226 R 3.6163 8.8014 126.3678 58.3141 30.2236 175.7261 227 D 5.1939 8.6385 121.7467 54.6773 38.8249 175.2672 228 N 4.4039 7.8538 120.3683 56.0383 36.9589 177.0312 229 A 4.0521 7.8252 122.5888 55.0292 18.6092 179.3000 230 E 3.9118 8.1495 116.4596 59.3868 29.5291 179.2244 231 A 4.1086 8.1901 120.8671 55.1795 18.4117 179.4452 232 L 3.9849 8.2145 118.9049 58.1926 42.1675 178.5889 233 D 4.3625 8.4565 118.2711 57.6478 41.1326 178.0919 234 D 4.4263 8.3364 119.0656 57.2885 40.8184 178.6761 235 A 4.0643 8.6487 121.7160 55.1991 18.3142 179.7872 236 I 3.4767 7.9926 118.5972 64.6698 37.1884 178.5139 237 T 3.9109 7.7696 116.5113 67.1957 68.5152 176.3854 238 D 4.5126 8.5438 120.5843 57.2316 40.8541 178.9077 239 L 4.1761 8.7061 120.0938 57.5524 41.5880 179.6727 240 K 4.3702 8.5669 120.2979 58.9652 31.8435 179.1950 241 K 4.1236 7.8748 118.4190 59.5816 32.1140 178.1095 242 Q 4.2785 7.7931 115.9439 56.3454 28.8841 176.7091 243 G 4.0166 8.2717 108.5437 45.0954 0.0000 173.3379 244 Y 4.4105 8.0660 117.7067 57.5670 39.6714 174.6177 245 T 4.6781 8.4377 118.3947 61.7969 72.1291 172.9539 246 F 4.9706 8.8280 124.0646 56.0580 40.6504 175.2583 247 K 4.8690 8.5957 122.5096 54.4368 36.6025 175.8707 248 S 5.0636 9.2583 116.8724 57.2182 64.8346 175.5372 249 I 3.6904 7.7714 121.0856 64.3833 36.4204 178.6533 250 D 4.6634 7.9669 120.9266 56.8090 40.7410 178.2318 251 D 4.4227 8.3270 119.5021 57.2527 40.8239 178.3727 252 L 3.8847 8.0522 120.7586 58.5437 41.9761 179.0830 253 M 3.9065 8.0258 118.3190 58.3340 31.7310 178.6149 254 F 3.8856 8.3219 119.7022 61.3178 39.7830 176.7112 255 E 4.2385 9.0146 118.9023 59.2733 29.0265 179.5073 256 K 3.9373 7.6758 117.7431 59.7772 32.7426 178.3835 257 E 3.8979 7.6730 119.5904 59.4049 29.3728 177.9153 258 M 4.0574 7.5797 118.9093 57.8087 31.8858 177.0301 *259 R 4.1252 7.6595 123.3447 55.4220 30.3682 177.4172 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 24 V 8.04 4.08 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 1.06 0.00 0.00 0.97 0.00 0.00 25 P 0.00 4.35 0.00 2.36 2.17 0.00 3.79 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 2.13 2.06 0.00 26 N 9.11 5.22 0.00 2.41 2.66 0.00 0.00 7.10 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 27 E 8.07 4.26 0.00 1.87 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 28 P 0.00 4.43 0.00 1.88 1.97 0.00 3.57 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 29 I 8.67 4.45 0.56 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.77 0.56 0.00 0.00 30 N 8.47 5.38 0.00 2.54 2.77 0.00 0.00 6.97 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 31 W 9.47 4.05 0.00 3.02 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 32 G 6.47 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 6.72 4.29 0.00 2.92 2.44 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 34 K 8.58 4.02 0.00 1.71 1.78 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.46 7.81 35 R 8.45 4.33 0.00 1.88 1.95 0.00 3.28 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.58 0.00 36 S 8.71 4.22 0.00 3.79 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 37 V 7.96 4.36 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 0.98 0.00 0.00 0.99 0.00 0.00 38 N 9.53 3.99 0.00 2.91 2.89 0.00 0.00 7.03 8.16 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 39 H 8.05 4.88 0.00 3.40 3.53 0.00 5.72 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 7.79 4.76 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.74 6.85 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 41 P 0.00 4.05 0.00 2.05 2.01 0.00 3.70 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 2.07 2.34 0.00 42 P 0.00 4.67 0.00 2.32 2.19 0.00 3.56 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 1.92 1.91 0.00 43 D 8.27 4.89 0.00 2.66 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 44 A 8.76 3.76 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 9.76 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 46 K 8.55 3.96 0.00 1.85 1.83 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.52 7.81 47 Q 7.94 3.92 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 48 L 7.82 4.15 0.00 1.64 1.82 1.02 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 49 N 8.57 4.58 0.00 2.91 2.99 0.00 0.00 7.02 8.39 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 50 S 8.03 4.17 0.00 4.08 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 51 L 7.87 4.15 0.00 2.00 2.01 1.11 1.18 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 52 I 8.30 3.91 2.36 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 1.70 0.81 1.18 0.00 0.00 53 E 8.20 4.16 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 54 K 8.10 3.76 0.00 1.71 1.73 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.32 1.16 7.81 55 Y 7.70 4.90 0.00 3.06 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 56 D 8.56 4.97 0.00 2.71 2.89 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 57 A 8.55 5.36 1.13 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 0.00 0.00 58 F 7.52 5.10 0.00 3.09 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 59 Y 8.68 4.72 0.00 3.11 2.45 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 0.00 60 L 7.53 4.89 0.00 1.13 1.43 0.69 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.96 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 N 9.49 4.83 0.00 2.91 2.83 0.00 0.00 7.38 7.81 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 63 T 8.48 4.38 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 64 K 8.56 4.28 0.00 1.84 1.88 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.50 7.81 65 E 7.56 4.72 0.00 1.95 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 66 K 8.12 4.25 0.00 1.46 1.49 0.00 1.26 0.00 0.00 1.22 0.00 0.00 2.13 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.30 1.04 7.81 67 T 7.65 5.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 68 I 7.82 4.71 0.81 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.16 0.34 0.00 0.00 69 Y 8.73 5.50 0.00 2.88 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 70 L 8.62 4.81 0.00 1.54 1.20 0.72 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 71 T 8.37 4.86 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 1.31 0.00 0.00 72 F 9.01 5.49 0.00 2.67 2.83 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 73 D 8.57 5.28 0.00 2.29 2.45 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 0.00 74 N 9.46 4.48 0.00 1.85 1.42 0.00 0.00 6.40 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 75 G 8.55 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 76 Y 7.26 5.06 0.00 3.21 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 77 E 8.92 4.79 0.00 2.02 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 2.17 2.38 0.00 78 N 8.97 4.96 0.00 2.89 2.83 0.00 0.00 7.37 7.98 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 79 G 8.74 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 0.00 0.00 0.00 80 Y 7.46 4.77 0.00 3.31 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 81 T 8.20 3.92 4.39 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 1.10 0.00 0.00 82 P 0.00 4.21 0.00 2.15 2.08 0.00 3.55 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 83 K 8.06 4.05 0.00 2.05 1.92 0.00 1.77 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.58 1.55 7.81 84 V 7.86 3.61 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 0.86 0.00 0.00 1.05 0.00 0.00 85 L 8.09 3.95 0.00 1.82 1.65 0.76 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 86 D 8.15 4.35 0.00 2.90 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 87 V 8.10 3.59 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 1.13 0.00 0.00 1.06 0.00 0.00 88 L 8.13 4.03 0.00 1.94 2.03 0.97 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 89 K 8.31 3.92 0.00 1.93 1.97 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.45 7.81 90 K 7.98 3.82 0.00 1.73 2.03 0.00 1.78 0.00 0.00 1.59 0.00 0.00 2.74 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.18 1.40 7.81 91 H 8.01 4.53 0.00 3.13 3.24 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 R 7.88 3.78 0.00 1.93 1.98 0.00 3.22 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 93 V 8.02 4.54 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.85 0.00 0.00 94 T 8.65 4.65 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 95 G 9.16 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 0.00 0.00 0.00 96 T 8.09 5.06 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 0.68 0.00 0.00 97 F 9.30 5.01 0.00 2.90 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 98 F 9.37 4.75 0.00 3.05 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 8.67 4.91 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.08 0.00 0.00 100 T 7.67 5.23 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 1.23 0.00 0.00 101 G 8.30 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 H 7.83 4.01 0.00 3.19 3.34 0.00 5.68 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 0.00 103 F 8.10 3.91 0.00 3.47 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 0.00 104 V 7.58 3.53 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.05 0.00 0.00 105 K 7.87 4.09 0.00 1.77 1.84 0.00 1.92 0.00 0.00 1.74 0.00 0.00 3.16 0.00 0.00 3.50 0.00 0.00 0.00 0.00 1.55 1.60 7.81 106 D 7.86 4.40 0.00 2.41 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Q 7.80 4.42 0.00 1.07 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.56 0.00 0.00 0.00 0.00 0.00 1.68 1.57 0.00 108 P 0.00 4.20 0.00 2.20 2.25 0.00 3.68 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 109 Q 7.88 3.96 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 110 L 7.67 3.94 0.00 1.70 1.69 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 111 I 7.75 3.67 2.00 0.00 0.00 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 1.56 1.36 0.92 0.00 0.00 112 K 8.42 3.95 0.00 1.86 1.93 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.62 7.81 113 R 8.03 3.89 0.00 1.98 1.88 0.00 3.15 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 1.61 1.62 0.00 114 M 8.11 3.95 0.00 1.95 2.17 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.51 0.00 115 S 7.88 4.06 0.00 3.92 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 0.00 116 D 8.28 4.41 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 0.00 117 E 8.20 4.54 0.00 2.08 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 2.27 2.29 0.00 118 G 7.78 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 0.00 119 H 7.72 4.82 0.00 3.36 3.77 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 8.73 4.60 1.88 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 1.32 0.76 1.02 0.00 0.00 121 I 9.09 4.79 2.03 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 1.21 0.63 0.97 0.00 0.00 122 G 8.80 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 N 9.34 5.29 0.00 3.07 2.79 0.00 0.00 7.06 7.43 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 0.00 124 H 9.09 5.46 0.00 3.32 3.34 0.00 6.07 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 S 9.09 4.54 0.00 4.25 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 0.00 126 F 8.90 3.71 0.00 3.31 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 H 9.34 4.81 0.00 3.23 3.43 0.00 6.06 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 H 8.35 4.46 0.00 3.20 3.38 0.00 5.74 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 0.00 129 P 0.00 4.49 0.00 2.25 2.10 0.00 3.85 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 2.01 2.01 0.00 130 D 8.36 4.53 0.00 2.71 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 L 8.60 4.07 0.00 1.79 1.74 0.88 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 132 T 8.33 4.28 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 1.31 0.00 0.00 133 T 7.98 4.43 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 1.31 0.00 0.00 134 K 7.62 4.86 0.00 1.96 1.79 0.00 1.75 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.54 1.52 7.81 135 T 9.33 4.39 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 0.00 136 A 8.67 4.01 1.46 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 0.00 0.00 0.00 137 D 8.11 4.28 0.00 2.74 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 0.00 138 Q 8.03 4.01 0.00 2.36 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 139 I 8.13 3.69 2.01 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 0.88 0.82 0.00 0.00 140 Q 8.20 3.98 0.00 2.14 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 141 D 8.06 4.34 0.00 2.86 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 0.00 142 E 8.66 4.06 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.56 0.00 143 L 7.98 4.08 0.00 1.68 1.49 0.20 0.76 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 0.00 144 D 8.58 4.45 0.00 2.76 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 0.00 145 S 8.38 4.12 0.00 3.75 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 0.00 146 V 7.86 3.80 2.45 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 1.13 0.00 0.00 1.10 0.00 0.00 147 N 8.31 4.44 0.00 2.99 2.93 0.00 0.00 6.71 7.66 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 0.00 148 E 8.58 3.95 0.00 2.17 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 2.34 2.43 0.00 149 E 8.28 4.05 0.00 2.36 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 2.41 2.42 0.00 150 V 8.16 3.65 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.07 0.00 0.00 151 Y 8.64 4.14 0.00 3.12 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 K 8.18 4.02 0.00 1.89 2.08 0.00 1.88 0.00 0.00 1.75 0.00 0.00 3.18 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.54 7.81 153 I 7.48 3.91 2.01 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 1.56 0.75 0.92 0.00 0.00 154 T 8.30 4.33 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 1.19 0.00 0.00 155 G 7.75 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 0.00 0.00 0.00 156 K 7.49 4.70 0.00 1.69 1.69 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.45 7.81 157 Q 8.28 4.41 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.03 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 158 D 8.59 4.69 0.00 2.77 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 0.00 159 N 8.38 4.27 0.00 2.62 2.39 0.00 0.00 6.93 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 0.00 160 L 7.82 4.06 0.00 1.23 0.53 0.71 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 161 Y 8.59 5.56 0.00 2.98 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 L 9.29 5.27 0.00 1.49 1.44 0.83 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 163 R 8.69 4.41 0.00 0.67 1.25 0.00 2.94 0.00 0.00 2.83 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.39 0.00 164 P 0.00 4.36 0.00 2.42 2.10 0.00 3.56 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.94 0.00 165 P 0.00 4.16 0.00 2.16 1.38 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 166 R 9.54 3.74 0.00 1.98 2.03 0.00 3.31 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 167 G 8.54 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 0.00 168 V 8.00 4.88 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.12 0.00 0.00 169 F 9.02 5.14 0.00 3.18 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 0.00 170 S 8.64 4.54 0.00 3.91 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 0.00 171 E 8.97 3.95 0.00 2.17 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 0.00 2.53 2.54 0.00 172 Y 8.14 4.06 0.00 3.20 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 V 7.84 3.17 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.04 0.00 0.00 174 L 7.86 3.80 0.00 1.36 1.27 1.25 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 175 K 7.52 3.68 0.00 1.56 1.77 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.63 7.81 176 E 8.08 3.85 0.00 1.65 1.49 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 2.04 2.20 0.00 177 T 8.02 3.93 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 178 K 8.12 4.25 0.00 2.00 2.14 0.00 1.97 0.00 0.00 1.92 0.00 0.00 3.41 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.51 1.54 7.81 179 R 7.97 3.95 0.00 2.06 2.06 0.00 3.33 0.00 0.00 3.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 180 L 7.44 4.48 0.00 1.96 1.89 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 181 G 8.35 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 8.19 4.57 0.00 3.12 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 0.00 183 Q 8.69 4.60 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.82 2.70 0.00 184 T 8.88 4.44 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 0.14 0.00 0.00 185 V 8.00 3.59 1.72 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 0.51 0.00 0.00 0.83 0.00 0.00 186 F 7.87 4.75 0.00 1.94 1.45 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 0.00 187 W 7.56 4.88 0.00 3.60 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 0.00 188 S 9.61 4.19 0.00 3.84 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 0.00 189 V 8.05 4.80 1.65 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 0.49 0.00 0.00 0.87 0.00 0.00 190 A 8.90 5.08 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 0.00 191 F 7.64 4.81 0.00 2.94 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 0.00 192 V 8.48 3.67 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 0.07 0.00 0.00 0.98 0.00 0.00 193 D 8.18 5.01 0.00 2.87 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 0.00 194 W 7.19 4.67 0.00 3.39 2.73 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 0.00 195 K 7.13 4.24 0.00 1.43 1.57 0.00 1.27 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.68 0.21 7.81 196 I 8.39 3.82 1.95 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.92 0.99 0.00 0.00 197 N 8.05 4.69 0.00 2.82 2.92 0.00 0.00 5.74 8.04 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 0.00 198 N 7.50 4.77 0.00 2.50 2.57 0.00 0.00 7.11 7.95 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 0.00 199 Q 7.78 4.24 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.63 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.60 0.00 200 K 8.33 3.96 0.00 1.41 1.68 0.00 0.61 0.00 0.00 0.86 0.00 0.00 2.76 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.21 1.30 7.81 201 G 7.95 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 0.00 202 K 8.65 3.89 0.00 1.84 1.82 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.60 7.81 203 K 8.14 3.89 0.00 1.88 1.86 0.00 1.80 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.66 1.56 7.81 204 Y 8.21 3.97 0.00 3.13 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 0.00 205 A 7.79 3.76 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 Y 8.32 3.97 0.00 3.09 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 D 8.58 4.21 0.00 2.55 2.53 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 0.00 208 H 7.35 3.81 0.00 1.87 2.37 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 M 7.40 4.03 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.90 0.00 210 I 7.34 3.80 1.56 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.70 0.84 0.00 0.00 211 K 7.85 3.96 0.00 1.70 1.80 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.38 7.81 212 Q 8.08 4.22 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 213 A 7.85 4.15 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 0.00 214 H 8.18 5.26 0.00 3.42 3.45 0.00 5.47 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 0.00 215 P 0.00 4.55 0.00 2.35 2.22 0.00 3.77 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 216 G 9.41 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 A 7.93 4.41 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 I 8.96 4.97 2.20 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.77 1.10 0.00 0.00 219 Y 9.07 4.89 0.00 2.82 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 L 8.74 4.82 0.00 1.23 1.16 -0.72 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 221 L 8.36 4.68 0.00 1.27 1.50 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 222 H 9.36 5.25 0.00 3.25 3.26 0.00 5.79 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 0.00 223 T 8.38 4.74 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 224 V 7.94 4.32 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 0.30 0.00 0.00 1.03 0.00 0.00 225 S 7.38 4.80 0.00 4.15 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 0.00 226 R 8.80 3.62 0.00 1.94 1.86 0.00 3.49 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 227 D 8.64 5.19 0.00 2.87 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 0.00 228 N 7.85 4.40 0.00 3.03 3.20 0.00 0.00 6.89 6.41 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 0.00 229 A 7.83 4.05 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 E 8.15 3.91 0.00 2.21 2.01 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 2.40 2.45 0.00 231 A 8.19 4.11 1.57 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 0.00 0.00 232 L 8.21 3.98 0.00 2.00 1.96 0.96 1.26 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 0.00 233 D 8.46 4.36 0.00 2.98 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 0.00 234 D 8.34 4.43 0.00 2.99 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 0.00 235 A 8.65 4.06 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 0.00 236 I 7.99 3.48 1.42 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.53 0.34 0.00 0.00 237 T 7.77 3.91 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 238 D 8.54 4.51 0.00 2.84 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 0.00 239 L 8.71 4.18 0.00 1.98 1.68 0.89 0.50 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 0.00 240 K 8.57 4.37 0.00 2.14 1.95 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.69 1.74 7.81 241 K 7.87 4.12 0.00 2.02 2.06 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.53 7.81 242 Q 7.79 4.28 0.00 2.47 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.70 0.00 0.00 0.00 0.00 0.00 2.44 2.61 0.00 243 G 8.27 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 0.00 244 Y 8.07 4.41 0.00 2.83 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 T 8.44 4.68 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 1.17 0.00 0.00 246 F 8.83 4.97 0.00 2.87 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 K 8.60 4.87 0.00 1.49 1.90 0.00 1.61 0.00 0.00 1.86 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.21 7.81 248 S 9.26 5.06 0.00 4.04 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 0.00 249 I 7.77 3.69 1.54 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 1.51 1.04 0.20 0.00 0.00 250 D 7.97 4.66 0.00 2.77 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 251 D 8.33 4.42 0.00 3.03 2.83 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 0.00 252 L 8.05 3.88 0.00 1.38 1.58 -0.04 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 253 M 8.03 3.91 0.00 2.18 2.36 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.02 2.98 0.00 254 F 8.32 3.89 0.00 3.16 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 0.00 255 E 9.01 4.24 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.62 0.00 256 K 7.68 3.94 0.00 1.78 1.81 0.00 1.28 0.00 0.00 1.39 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.52 1.32 7.81 257 E 7.67 3.90 0.00 1.89 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 258 M 7.58 4.06 0.00 2.11 2.08 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 2.72 2.60 0.00 *259 R 7.66 4.13 0.00 1.60 1.79 0.00 3.23 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.