NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.1077 8.1733 122.0311 56.0405 34.5489 175.0405 4 Y 5.3206 7.8250 115.5316 55.6596 40.3693 173.4480 5 A 4.8860 9.1322 124.4674 49.8841 23.4163 174.6275 6 L 4.7549 8.7570 122.3515 54.6590 43.5228 176.2679 7 V 5.0328 8.8433 118.9859 59.8350 35.8658 174.7313 8 G 4.3562 8.5501 107.8272 45.2757 0.0000 171.8385 9 D 5.0202 9.3604 121.3411 52.5117 43.7039 173.1700 10 V 4.7539 9.0534 126.3151 60.9136 33.9067 174.9288 11 G 3.9975 9.3111 116.3373 46.6646 0.0000 174.3891 12 G 3.8948 9.2838 119.9997 46.5839 0.0000 175.0276 13 T 3.9012 8.9190 118.0898 63.1671 69.8141 174.1240 14 N 5.5126 8.0368 118.6893 51.1141 42.4699 173.6317 15 A 5.0227 9.0378 123.5394 50.3162 22.0580 174.8563 16 R 4.9216 9.0976 124.1224 55.3433 31.9338 175.2577 17 L 5.1286 9.0952 125.4647 53.2143 45.8072 175.2245 18 A 5.0167 8.1930 121.8358 52.0541 23.6570 174.7874 19 L 4.9902 8.8724 119.2797 53.6807 43.9972 175.7820 20 C 5.2524 9.1365 123.3534 57.3514 34.5271 172.2580 21 D 4.7777 9.5608 126.9769 54.3455 40.9914 176.6594 22 I 3.7776 8.4167 128.3464 64.3787 37.0931 177.9012 23 A 4.2147 8.2612 124.0706 53.8220 18.6365 177.9568 24 S 4.5180 8.0686 107.8335 57.3955 64.9870 175.3394 25 G 3.9191 8.6278 108.6749 45.1651 0.0000 173.2887 26 E 4.2869 7.8997 119.3358 56.2094 30.8143 175.7424 27 I 5.0609 8.2630 123.4908 59.9288 39.3330 174.9464 28 S 4.5871 9.1596 120.0970 56.6152 67.3262 173.2848 29 Q 3.5945 8.7971 115.0985 56.6170 26.0961 174.2528 30 A 4.4327 8.1298 118.6844 52.2565 19.1507 178.1890 31 K 4.6583 9.8309 121.9560 54.8058 36.8522 175.5214 32 T 5.0193 8.3076 119.3455 62.2000 70.8288 173.0762 33 Y 4.7372 9.1280 124.6926 56.1472 41.2712 175.1273 34 S 4.5095 8.8424 117.0164 57.2920 63.6324 174.9632 35 G 3.5188 10.2756 117.7367 48.7322 0.0000 175.3067 36 L 3.9878 7.9624 118.6058 57.7145 41.6235 177.8056 37 D 4.6134 7.9858 115.2030 54.9837 40.9925 175.7484 38 Y 4.9260 8.0891 116.8097 55.6653 41.8338 173.7466 39 P 4.6692 0.0000 0.0000 64.7391 32.3906 176.6066 40 S 3.5391 7.2399 112.6093 55.6719 66.4553 175.0557 41 L 2.6596 6.3981 124.1259 57.5396 41.6323 178.7040 42 E 3.4714 7.3429 118.5127 59.1005 29.4395 178.1029 43 A 3.8569 7.6941 120.8300 55.4960 18.3925 179.6187 44 V 2.6586 7.0327 115.5442 66.0019 31.4176 178.2017 45 I 3.5546 7.6046 119.6334 64.4885 36.8922 178.6876 46 R 3.9423 8.0133 118.9513 58.9587 29.8856 179.1155 47 V 3.5172 7.8455 118.3078 66.1698 31.4184 177.1566 48 Y 4.1932 7.6468 120.3298 60.2643 38.4326 178.4343 49 L 4.1491 8.2991 118.0464 57.2106 41.7636 179.0348 50 E 4.0951 7.9182 118.5277 59.2844 29.4863 178.4282 51 E 3.9095 7.9112 118.2351 57.9811 30.1001 176.5674 52 H 4.7023 7.1204 114.7277 54.2224 30.4114 175.1525 53 K 4.6072 8.2856 121.9463 56.6932 32.6524 176.7571 54 V 4.5328 7.5688 110.4640 59.4709 34.6274 175.3831 55 E 4.4306 8.6914 122.9016 55.2887 30.2626 176.3781 56 V 4.3832 8.2655 123.0253 59.6261 34.0191 175.2194 57 K 4.1624 8.3435 120.7557 56.2743 34.7429 174.8907 58 D 5.2668 7.5064 121.1629 52.5356 44.3740 174.9946 59 G 5.2355 9.3104 108.8967 44.7907 0.0000 171.0315 60 C 5.3780 8.5856 120.2654 57.7677 35.1366 172.4319 61 I 4.8039 8.9596 127.6347 59.4082 39.4875 174.6532 62 A 4.8965 8.8874 129.8703 51.3603 20.3893 176.0775 63 I 4.9974 9.0578 122.6513 58.7696 40.9507 176.0928 64 A 4.9478 8.5915 130.3017 49.4743 15.5829 175.8227 65 C 4.6492 7.4585 114.7075 55.7481 32.7234 173.0082 66 P 4.3111 0.0000 0.0000 63.0341 31.2039 176.6362 67 I 4.2746 8.1326 123.8666 59.8899 37.6006 175.2054 68 T 3.9969 8.3701 124.4802 63.9112 68.6382 178.1969 69 G 4.2502 8.1784 117.7686 46.0140 0.0000 174.1603 70 D 4.4851 8.8225 119.5501 56.6510 42.6131 176.4349 71 W 4.7930 8.1656 128.5551 56.5862 31.8323 175.6636 72 V 3.9760 7.3593 127.1787 61.1872 33.1287 174.0795 73 A 4.5202 7.9926 132.8867 50.8059 21.7274 174.5850 *75 T 4.4597 8.4432 109.7946 64.1217 70.2620 175.3970 76 N 4.5905 8.1260 116.5072 55.1594 39.6857 174.7349 77 H 4.7837 8.2468 119.6100 56.0385 30.9468 174.5601 78 T 5.0541 8.7872 108.1440 62.0192 68.2472 172.7624 79 W 3.8275 8.7271 126.5940 57.2618 27.8385 174.7455 80 A 4.2621 7.8966 120.3526 52.1544 18.4466 176.6665 81 F 4.2544 7.5154 115.7160 55.3623 42.0742 173.0307 82 S 4.9365 8.4616 114.8063 57.1225 62.5593 173.7118 83 I 4.0017 8.4699 129.0338 64.6523 37.4935 177.4086 84 A 4.1340 8.7965 123.3449 55.4392 18.4506 179.7393 85 E 3.8734 8.2528 112.6634 57.2165 29.5315 178.1973 *87 K 3.9997 8.1618 119.6906 55.9790 34.0906 177.7294 88 K 3.9282 8.0010 119.5414 59.6154 32.3626 178.2580 89 N 4.2088 8.3870 115.4091 56.2081 38.4869 176.0333 90 L 4.2207 7.7107 114.5878 54.0350 42.2825 176.6416 91 G 3.9910 7.9078 106.6361 46.5176 0.0000 174.1573 92 F 4.7478 7.9883 117.1583 56.9815 39.8173 176.4318 93 S 4.3671 8.9464 121.0278 61.4653 63.4132 174.7551 94 H 4.9562 8.5663 115.7559 53.8691 32.6376 172.7341 95 L 5.2179 8.7344 123.9861 53.5997 44.2401 174.6353 96 E 4.6904 9.3917 127.0999 54.9190 31.4566 175.3480 97 I 5.1079 8.4946 125.1908 59.4792 39.8357 174.8566 98 I 4.7270 8.6010 119.8601 58.5861 41.6182 174.7592 99 N 4.9883 8.6242 121.1163 53.1823 39.3306 175.6265 100 D 4.4081 8.6562 122.8973 56.4894 39.2903 178.6836 101 F 4.0534 8.8284 118.8889 59.6598 38.8513 177.7345 102 T 3.9471 8.5730 115.8060 65.9135 68.5008 175.3180 103 A 4.0929 7.7754 121.7425 55.5048 18.1804 179.8913 104 V 3.3990 7.3533 115.2158 65.6630 31.8006 179.1476 105 S 4.1228 8.2983 114.1300 58.3786 62.6621 175.9438 *107 A 4.1717 8.0350 126.7854 53.1698 20.4338 178.8931 108 I 3.4787 7.2831 116.2289 64.1581 36.9932 177.8661 109 P 4.1509 0.0000 0.0000 62.0403 30.4430 176.0918 *111 L 4.1218 7.7737 116.5273 54.6080 42.9225 176.5401 112 K 4.7195 8.2837 120.2069 53.9992 35.6070 177.1706 113 K 3.9558 8.6859 120.0577 59.7063 32.0956 179.3201 114 E 3.9802 8.0189 115.4853 59.2520 29.8479 177.2729 115 H 4.6691 8.6828 115.4705 56.1470 29.1410 174.2166 116 L 5.3602 7.5350 119.3142 52.8651 44.5922 176.0781 117 I 4.5436 8.6856 123.1104 59.4279 40.3237 174.5573 118 Q 4.4152 8.8005 129.0649 55.8493 29.7131 176.1019 119 F 4.4221 9.3581 126.2430 54.9646 38.5509 175.5613 120 G 3.6214 7.9525 110.5217 44.9798 0.0000 170.9711 121 G 4.3989 8.4744 106.5462 43.6139 0.0000 172.9062 122 A 4.4841 8.5650 122.8103 52.1917 18.7187 179.6230 123 E 4.8876 9.0018 115.0432 54.5390 32.8696 173.8576 124 P 4.7015 0.0000 0.0000 63.0199 32.7374 175.9772 125 V 4.2360 8.7124 123.4450 61.4606 32.7531 175.1614 126 E 4.3107 8.9262 128.3493 57.6679 29.8072 177.7145 127 G 3.6300 9.3082 111.3579 45.5640 0.0000 173.2196 128 K 4.7315 7.9447 119.0534 54.2612 34.4224 174.7077 129 P 5.0392 0.0000 0.0000 63.4101 32.8086 175.2155 130 I 5.2753 9.1423 122.2287 59.6138 40.8065 174.4430 131 A 5.2696 8.7220 127.5918 50.1400 22.1167 175.7544 132 V 5.4657 8.9165 120.0477 60.3328 34.4782 174.2181 133 Y 5.3422 9.5983 121.3872 56.1978 42.2499 173.8911 134 G 4.3522 8.8399 104.3594 46.1400 0.0000 172.0486 135 A 5.1328 8.5660 125.5553 49.7414 20.7449 174.4512 136 G 3.9546 9.1329 114.8477 45.4867 0.0000 176.0190 137 T 4.0827 9.1129 113.4495 63.7811 68.9832 173.7475 138 G 4.1213 7.7525 109.0130 43.6139 0.0000 169.6683 139 L 4.7892 8.8808 121.5829 53.4088 43.5946 176.0348 140 G 3.3456 8.2069 113.9297 44.4551 0.0000 172.1373 141 V 5.1723 7.6983 119.8615 61.3625 34.8018 173.6117 142 A 4.9823 9.3166 127.4933 51.3173 23.2645 174.5685 143 H 5.4122 9.0939 115.6752 53.9159 33.1548 172.8532 144 L 5.3193 9.0620 122.0429 53.5998 45.1188 175.6623 145 V 5.0969 9.1814 119.0034 59.9272 35.7657 174.4673 146 H 4.3837 8.8656 123.8202 54.8039 30.2277 174.6573 147 V 4.0273 8.3914 127.1155 61.6085 33.4279 174.4988 148 D 4.3794 9.6043 127.8156 55.0571 38.8401 173.5394 149 K 4.1443 8.0608 117.0511 55.8870 31.1503 176.8753 150 R 4.6987 7.1517 114.3356 53.7885 33.2213 174.4650 151 W 4.9655 8.7849 120.4966 56.4779 30.1910 175.7721 152 V 4.5044 9.5863 125.4408 61.1310 33.7303 174.0781 153 S 4.9731 8.7367 122.2970 57.4491 64.3686 172.6064 154 L 4.9182 9.2329 127.5744 52.2583 42.6868 174.3452 155 P 4.6974 0.0000 0.0000 62.7661 32.5142 176.5030 156 G 4.1197 7.7084 107.3626 46.1706 0.0000 172.7501 157 E 4.8194 8.2390 115.9467 55.7257 30.8697 177.9776 158 G 4.0461 8.3629 109.1361 48.0295 0.0000 176.2669 159 G 3.7648 8.0046 107.9315 47.5172 0.0000 174.1403 160 H 5.0001 8.2869 115.8821 55.7018 29.4430 175.8762 161 V 4.0368 7.5914 111.9876 60.8571 32.8462 175.3368 162 D 4.8759 8.7834 121.8296 54.9349 41.4041 176.5099 163 F 4.5000 9.1863 125.5778 58.4509 39.9963 175.4498 164 A 4.2774 8.3612 130.0921 49.2310 18.2575 173.2562 165 P 4.1014 0.0000 0.0000 62.7831 32.1356 177.1637 166 N 4.6883 8.3892 117.3806 53.1637 39.8541 174.1426 167 S 4.8000 7.4353 112.1330 55.6265 66.5006 173.9880 168 E 4.0207 8.5680 118.9364 58.8975 29.1847 178.2050 169 E 3.9759 8.4236 119.9358 59.2680 29.8651 178.4958 170 E 4.1396 8.2059 117.8544 59.2000 29.5678 179.0436 171 A 4.1075 8.0321 120.9821 55.0211 18.3390 179.7038 172 I 3.6780 7.7649 118.4154 64.5906 37.1089 178.6070 173 I 3.6924 7.9536 120.6296 64.2336 36.9466 177.9729 174 L 4.1281 8.5283 121.4327 58.6353 41.8732 179.0375 175 E 4.0893 8.7287 118.6255 59.3039 29.1931 179.4720 176 I 3.7017 8.0329 120.0935 64.4968 37.1380 178.5289 177 L 4.0072 8.2556 120.0986 57.5122 41.1722 179.4623 178 R 4.1272 8.6934 119.3916 58.8198 30.1224 177.9743 179 A 4.1547 8.0387 119.4482 55.4183 18.4496 179.2289 180 E 4.1168 7.8612 116.0118 59.4439 29.9995 176.4268 181 I 4.8573 8.0859 111.3317 59.1268 41.3125 175.0902 182 G 4.1376 8.1050 111.5578 45.3813 0.0000 176.0057 183 H 4.0841 9.0606 122.9904 56.2107 30.1432 172.6889 184 V 4.2304 8.3821 126.0768 61.3858 32.6504 175.1719 185 S 4.9284 8.3950 122.9583 57.3332 64.6802 175.0271 186 A 4.0633 9.0283 122.6952 55.5360 17.8041 179.7413 187 E 3.7448 8.0023 117.3863 59.1746 29.6974 178.7431 188 R 3.9362 7.8041 118.2482 58.5054 29.7641 177.6515 189 V 4.1916 7.2718 114.7442 62.1040 33.2336 175.1920 190 L 4.6273 7.7289 119.7796 51.4898 41.4488 175.4811 191 S 4.8304 8.3103 118.1614 56.5547 64.4949 178.8907 192 G 3.7561 8.4198 107.9746 48.1383 0.0000 174.1323 193 P 4.4526 0.0000 0.0000 64.6579 31.2956 178.7977 194 G 4.2343 8.6518 105.0438 47.7551 0.0000 175.6173 195 L 4.0167 8.1043 121.2147 57.4416 41.4968 179.8462 196 V 3.6423 7.4668 116.8363 66.0688 31.4976 177.7086 197 N 4.3125 8.4331 116.5170 56.3414 38.3751 177.2984 198 L 3.9338 8.2058 120.4413 57.9304 41.7681 178.6440 199 Y 4.1138 8.1333 119.4322 60.9984 38.5960 178.4684 200 R 3.3752 8.2344 118.6470 59.2429 30.0852 179.0211 201 A 3.9206 8.0420 120.3641 55.0847 18.2009 179.6992 202 I 3.6246 8.1117 118.8802 64.5177 37.1257 178.6532 203 V 3.4881 7.4729 119.0424 65.9139 31.3093 178.0952 204 K 4.0480 8.5152 119.5530 58.6444 31.6677 178.9100 205 A 4.1826 7.5133 120.1129 54.1085 18.6012 177.8135 206 D 4.6029 7.5914 115.2298 53.3681 42.2243 175.9447 207 N 4.1961 7.6210 112.5916 54.4803 36.4173 172.8067 208 R 4.6941 7.8753 115.3295 54.3497 34.2950 174.7245 209 L 4.7791 8.1631 118.5756 52.4768 43.1315 175.3307 210 P 4.4716 0.0000 0.0000 62.2610 32.2942 175.5678 211 E 4.4147 9.0092 120.1275 55.6571 31.1644 177.0296 212 N 4.6924 8.2422 119.5953 52.5248 37.4648 174.2814 213 L 4.3638 7.4123 119.7117 54.1615 43.6821 176.9598 214 K 4.5941 8.8536 120.1759 54.0569 34.5721 176.0961 215 P 4.1762 0.0000 0.0000 65.8887 31.1963 179.3032 216 K 4.0484 7.8241 117.9377 58.6393 31.9519 178.9002 217 D 4.2803 7.7689 119.1661 57.2952 40.6684 178.8937 218 I 3.4438 7.1983 120.3996 64.4871 36.8127 178.6718 219 T 3.5096 7.5381 110.0678 64.6045 68.6970 175.8962 220 E 3.9351 8.0271 121.5735 59.5197 29.4928 179.8329 221 R 4.0117 8.1694 118.7493 58.3436 30.0764 178.8309 222 A 3.8811 7.9006 120.6989 55.4668 18.1608 179.8595 223 L 4.0425 7.9155 115.8063 57.4494 41.7773 179.0365 224 A 4.1655 8.3328 119.6192 52.0617 18.7239 176.6898 225 D 4.4559 7.8561 115.8059 55.6444 39.6726 174.1275 226 S 4.5751 8.1056 109.9227 57.6077 63.6211 173.0728 227 C 4.6000 7.4620 120.4991 58.1370 33.5955 174.0959 228 T 3.9695 8.5556 120.5083 64.6550 68.2836 176.1018 229 D 4.3995 8.0839 121.7785 57.4892 41.1216 178.1788 230 C 4.1126 8.0691 116.7654 62.6528 28.2176 175.7165 231 R 3.7944 8.2664 120.7029 59.6126 29.6596 178.3109 232 R 3.9391 8.0731 118.0247 59.5760 30.0298 178.1991 233 A 4.0649 8.3017 120.5995 55.1968 18.3750 179.3953 234 L 3.8814 7.8586 118.6442 58.0952 41.8871 179.3782 235 S 4.5040 8.1589 115.4519 61.4588 62.7523 176.3717 236 L 4.0945 8.0855 123.1792 57.9103 41.6817 178.3385 237 F 4.0968 8.5532 120.1361 61.8661 39.3056 176.5667 238 C 4.7873 8.3674 114.7054 63.0773 28.2035 176.1361 239 V 3.8857 7.8017 119.7566 65.9144 31.2132 179.5882 240 I 4.2144 7.9660 118.7699 61.3799 36.8945 178.4274 *242 G 3.4024 8.0823 110.2234 45.6598 0.0000 176.3417 243 R 3.8314 8.3353 120.0363 58.7554 29.9992 178.9332 244 F 4.1108 9.0126 121.0474 61.2177 39.4959 177.4500 245 G 3.7172 7.8039 106.4241 47.0824 0.0000 175.6985 246 G 2.8556 8.0768 108.1132 47.3470 0.0000 175.4793 247 N 4.1243 7.7321 118.7171 55.8663 38.5754 177.3797 248 L 3.7452 7.2379 119.5633 57.8006 41.7264 179.5257 249 A 4.5543 7.6193 121.6065 54.6724 18.2124 179.7144 250 L 3.9717 7.8851 117.5744 57.8923 41.4166 179.2730 251 N 4.2686 7.8481 116.1870 55.6001 38.9058 175.5773 252 L 4.5305 7.4921 117.1681 53.5515 42.6509 176.6319 253 G 3.7959 7.4676 105.4828 46.5893 0.0000 176.2477 254 T 4.3750 7.2439 110.0447 60.3616 67.9892 176.1629 255 F 4.5546 7.3635 123.3453 60.2273 39.8144 178.2073 256 G 4.0760 7.6813 109.0587 46.2016 0.0000 173.6668 257 G 4.2471 7.9664 107.3156 44.0925 0.0000 172.5303 258 V 4.9624 8.5383 120.0313 60.9845 34.0999 174.3876 259 F 5.4246 9.8062 126.4680 55.8284 42.3643 174.2335 260 I 4.7649 8.7436 123.8684 59.4189 39.2573 174.6811 261 A 4.4316 9.0664 130.5701 51.1367 19.6163 176.6296 262 G 3.0706 8.1783 112.0960 47.6372 0.0000 171.8055 263 G 3.8875 9.0019 114.4763 45.5948 0.0000 173.0384 264 I 3.9531 6.1029 117.9647 61.7377 39.5722 179.3088 265 V 2.0000 7.4370 121.0255 65.2244 30.9961 175.9398 266 P 4.0418 0.0000 0.0000 65.1527 31.2148 178.4047 267 R 4.1303 7.2200 113.9088 57.6536 29.6644 176.7488 268 F 5.0701 7.6378 116.2351 55.4832 38.7013 177.0957 269 L 3.9445 8.3206 124.3730 59.9361 41.8316 177.5341 270 E 4.1337 8.2996 117.6900 59.0916 29.3362 178.6140 271 F 4.0273 8.4985 119.5885 61.4218 39.7724 176.4168 272 F 4.6353 9.1595 120.4974 61.5872 39.0065 177.2669 273 K 4.2381 8.4293 116.6325 59.1617 31.9576 178.4044 274 A 4.2923 7.7825 118.7962 52.3447 18.9501 177.3974 275 S 4.3548 7.5592 112.6569 57.1625 64.8156 174.9191 276 G 3.9706 8.4861 103.8081 45.1194 0.0000 175.0672 277 F 4.2407 7.9688 124.5772 61.3461 39.2613 177.3619 278 R 3.7363 8.0869 117.3661 59.2770 29.8337 178.0674 279 A 4.0604 7.9812 118.9963 54.8396 18.7068 179.0788 280 A 4.0357 7.9297 119.2835 55.4334 18.3161 179.3263 281 F 4.0199 7.7929 117.9233 61.2571 39.0590 176.3341 282 E 4.4584 7.9286 115.2815 55.8425 30.9647 175.7296 283 D 4.9533 7.6333 120.6401 53.5430 39.5883 175.7943 284 K 4.5818 7.5014 118.1341 55.7173 34.7807 177.7483 285 G 3.9195 8.1902 108.1120 46.3065 0.0000 177.4106 286 R 3.8697 8.7753 118.4820 58.4678 29.3456 177.4832 287 F 4.3653 8.3293 117.4712 57.3488 39.1790 177.0481 288 K 4.1701 8.2673 126.3002 59.2996 31.5556 178.6216 289 E 4.0851 8.0852 116.7957 59.2007 29.2215 178.0922 290 Y 4.3152 7.8923 118.7268 60.3757 39.0687 177.7442 291 V 4.3853 7.8581 110.5063 61.6462 32.2315 177.1845 292 H 4.3842 8.2235 119.7978 59.0506 29.9981 176.0516 293 D 4.6867 8.0455 116.5144 54.3575 41.0221 175.5857 294 I 4.4709 7.7379 122.7206 60.2394 38.1598 173.9392 295 P 4.6241 0.0000 0.0000 62.2519 32.7040 175.1940 296 V 4.6423 7.8417 121.4427 61.3660 34.1764 173.6956 297 Y 5.2822 8.4018 124.7232 56.0034 41.4817 174.4594 298 L 4.5714 9.2215 127.0415 54.8323 42.8772 175.5159 299 I 4.7260 8.9567 128.0545 60.9173 38.2149 176.5452 300 V 4.1366 8.7976 119.5642 61.0507 32.6043 175.8491 301 H 4.1602 8.2991 120.7596 56.5694 30.1545 174.8863 302 D 4.5393 8.3190 124.8278 56.2746 42.0488 176.5613 303 N 5.0688 7.8747 115.6604 50.5009 39.3927 173.3159 304 P 4.1678 0.0000 0.0000 65.6061 31.9576 178.7577 305 G 3.5434 7.9124 105.0714 47.7170 0.0000 175.5151 306 L 3.9794 7.7341 121.0582 57.1820 41.7498 179.0493 307 L 3.9774 7.8152 120.3383 58.2549 41.9951 179.3454 308 G 4.1439 8.0904 106.7579 46.8755 0.0000 176.0063 309 S 4.2562 8.2384 117.6884 61.4048 62.8528 176.8393 310 G 3.6069 8.1052 108.1623 47.7390 0.0000 175.4888 311 A 3.9464 8.0342 123.4822 55.0368 18.4369 178.9241 312 H 3.9933 8.5455 117.1835 59.5017 29.8286 177.1467 313 L 3.8891 8.1393 121.8970 58.2008 42.0027 178.9863 314 R 3.7973 8.3689 118.4271 59.3823 30.1369 178.8158 315 Q 4.5437 8.1391 120.6133 59.0998 28.7862 178.5278 316 T 3.9300 7.6036 115.9254 66.1433 68.4812 175.6962 317 L 4.3261 7.6462 118.6139 54.7622 41.7956 177.6804 318 G 3.9949 7.8149 107.4587 45.2961 0.0000 173.9802 319 H 4.4149 8.3058 117.7084 55.3825 29.4646 174.4948 320 I 4.4195 8.1147 123.8675 60.3870 38.2581 176.0352 321 L 4.2902 8.4568 123.4642 54.9916 41.6621 176.4989 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 3 K 8.17 4.11 0.00 1.65 1.51 0.00 1.42 0.00 0.00 1.36 0.00 0.00 2.77 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.43 1.12 7.81 4 Y 7.82 5.32 0.00 2.98 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 5 A 9.13 4.89 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 6 L 8.76 4.75 0.00 1.87 1.70 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.84 5.03 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 0.67 0.00 0.00 0.97 0.00 0.00 8 G 8.55 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 0.00 0.00 0.00 0.00 9 D 9.36 5.02 0.00 2.68 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 V 9.05 4.75 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.02 0.00 0.00 11 G 9.31 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 12 G 9.28 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 0.00 0.00 0.00 13 T 8.92 3.90 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 1.13 0.00 0.00 14 N 8.04 5.51 0.00 2.65 2.72 0.00 0.00 6.50 7.53 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 15 A 9.04 5.02 1.41 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 0.00 0.00 0.00 16 R 9.10 4.92 0.00 1.85 1.78 0.00 3.01 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 17 L 9.10 5.13 0.00 1.03 0.44 0.61 0.42 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 18 A 8.19 5.02 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 19 L 8.87 4.99 0.00 1.54 1.37 0.41 0.90 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 20 C 9.14 5.25 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 21 D 9.56 4.78 0.00 2.92 2.59 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 0.00 0.00 0.00 0.00 22 I 8.42 3.78 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.74 0.85 0.00 0.00 23 A 8.26 4.21 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 24 S 8.07 4.52 0.00 3.95 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 25 G 8.63 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 7.90 4.29 0.00 1.97 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 2.35 2.31 0.00 27 I 8.26 5.06 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.82 0.91 0.00 0.00 28 S 9.16 4.59 0.00 3.77 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 29 Q 8.80 3.59 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 30 A 8.13 4.43 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 0.00 0.00 0.00 0.00 0.00 0.00 31 K 9.83 4.66 0.00 1.93 1.43 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.73 7.81 32 T 8.31 5.02 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 1.21 0.00 0.00 33 Y 9.13 4.74 0.00 2.92 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 34 S 8.84 4.51 0.00 3.92 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 0.00 35 G 10.28 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 36 L 7.96 3.99 0.00 1.65 1.76 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 37 D 7.99 4.61 0.00 2.83 2.36 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 38 Y 8.09 4.93 0.00 3.31 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.67 0.00 2.20 2.23 0.00 4.00 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 2.00 1.99 0.00 40 S 7.24 3.54 0.00 3.54 3.67 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 41 L 6.40 2.66 0.00 0.65 0.78 0.36 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 42 E 7.34 3.47 0.00 1.67 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 2.15 2.09 0.00 43 A 7.69 3.86 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.03 2.66 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 0.23 0.00 0.00 0.51 0.00 0.00 45 I 7.60 3.55 1.75 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.27 0.83 0.00 0.00 46 R 8.01 3.94 0.00 1.94 1.94 0.00 3.06 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 47 V 7.85 3.52 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 1.15 0.00 0.00 1.13 0.00 0.00 48 Y 7.65 4.19 0.00 3.00 3.05 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 0.00 49 L 8.30 4.15 0.00 1.68 1.78 1.11 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 50 E 7.92 4.10 0.00 2.26 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 51 E 7.91 3.91 0.00 2.03 1.84 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 2.06 2.21 0.00 52 H 7.12 4.70 0.00 2.82 3.02 0.00 5.88 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 8.29 4.61 0.00 1.72 1.80 0.00 1.68 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.35 7.81 54 V 7.57 4.53 2.26 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 0.88 0.00 0.00 0.89 0.00 0.00 55 E 8.69 4.43 0.00 1.96 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 2.29 2.30 0.00 56 V 8.27 4.38 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.71 0.00 0.00 57 K 8.34 4.16 0.00 1.70 1.94 0.00 1.41 0.00 0.00 1.78 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.28 1.32 7.81 58 D 7.51 5.27 0.00 2.47 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 59 G 9.31 5.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 C 8.59 5.38 0.00 3.02 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 61 I 8.96 4.80 1.89 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 1.15 0.73 0.90 0.00 0.00 62 A 8.89 4.90 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 9.06 5.00 1.93 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.32 1.01 0.00 0.00 64 A 8.59 4.95 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 65 C 7.46 4.65 0.00 3.06 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 66 P 0.00 4.31 0.00 2.08 2.06 0.00 3.65 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 2.04 2.14 0.00 67 I 8.13 4.27 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.81 0.90 0.00 0.00 68 T 8.37 4.00 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 69 G 8.18 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 0.00 0.00 0.00 0.00 70 D 8.82 4.49 0.00 2.80 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 71 W 8.17 4.79 0.00 3.41 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 72 V 7.36 3.98 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 0.58 0.00 0.00 0.41 0.00 0.00 73 A 7.99 4.52 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *75 T 8.44 4.46 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 76 N 8.13 4.59 0.00 2.71 2.84 0.00 0.00 6.58 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 77 H 8.25 4.78 0.00 2.91 2.77 0.00 5.87 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.79 5.05 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 79 W 8.73 3.83 0.00 3.35 3.51 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 80 A 7.90 4.26 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 81 F 7.52 4.25 0.00 2.84 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 82 S 8.46 4.94 0.00 4.30 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 83 I 8.47 4.00 1.91 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 1.38 0.69 0.97 0.00 0.00 84 A 8.80 4.13 1.43 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 85 E 8.25 3.87 0.00 2.12 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 2.33 2.29 0.00 *87 K 8.16 4.00 0.00 1.98 2.02 0.00 1.81 0.00 0.00 1.77 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.45 1.50 7.81 88 K 8.00 3.93 0.00 1.90 2.01 0.00 1.61 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.45 7.81 89 N 8.39 4.21 0.00 2.58 2.95 0.00 0.00 7.13 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 L 7.71 4.22 0.00 1.14 1.29 0.34 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 91 G 7.91 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 F 7.99 4.75 0.00 2.90 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 93 S 8.95 4.37 0.00 4.04 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 94 H 8.57 4.96 0.00 3.20 3.20 0.00 5.75 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.73 5.22 0.00 1.71 1.60 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 96 E 9.39 4.69 0.00 2.01 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 2.35 2.50 0.00 97 I 8.49 5.11 1.92 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.05 1.06 0.00 0.00 98 I 8.60 4.73 1.80 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.90 0.75 0.00 0.00 99 N 8.62 4.99 0.00 2.79 2.78 0.00 0.00 6.64 8.49 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 0.00 100 D 8.66 4.41 0.00 2.93 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 0.00 101 F 8.83 4.05 0.00 3.13 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 0.00 102 T 8.57 3.95 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 1.19 0.00 0.00 103 A 7.78 4.09 1.32 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 0.00 0.00 104 V 7.35 3.40 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.45 0.00 0.00 105 S 8.30 4.12 0.00 4.01 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 0.00 *107 A 8.04 4.17 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 I 7.28 3.48 1.40 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.31 -0.18 0.00 0.00 109 P 0.00 4.15 0.00 1.99 2.05 0.00 3.45 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.41 0.00 *111 L 7.77 4.12 0.00 1.69 1.65 0.81 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.28 4.72 0.00 1.76 1.66 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.45 7.81 113 K 8.69 3.96 0.00 1.76 1.87 0.00 1.65 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.41 7.81 114 E 8.02 3.98 0.00 2.01 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 1.87 2.17 0.00 115 H 8.68 4.67 0.00 3.30 3.38 0.00 5.57 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 7.53 5.36 0.00 1.65 1.56 1.08 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 117 I 8.69 4.54 2.09 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.86 0.69 0.00 0.00 118 Q 8.80 4.42 0.00 2.17 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 7.25 0.00 0.00 0.00 0.00 0.00 2.18 2.04 0.00 119 F 9.36 4.42 0.00 2.83 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 0.00 120 G 7.95 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.47 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 0.00 122 A 8.57 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 9.00 4.89 0.00 1.97 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 2.22 2.26 0.00 124 P 0.00 4.70 0.00 2.11 2.45 0.00 3.80 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 2.19 2.40 0.00 125 V 8.71 4.24 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 0.99 0.00 0.00 0.97 0.00 0.00 126 E 8.93 4.31 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 127 G 9.31 3.63 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 0.00 0.00 0.00 128 K 7.94 4.73 0.00 2.20 2.00 0.00 2.01 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.79 7.81 129 P 0.00 5.04 0.00 2.17 2.13 0.00 3.83 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.26 0.00 130 I 9.14 5.28 1.77 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 1.42 0.92 0.92 0.00 0.00 131 A 8.72 5.27 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 V 8.92 5.47 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 1.01 0.00 0.00 1.23 0.00 0.00 133 Y 9.60 5.34 0.00 3.21 3.06 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 0.00 134 G 8.84 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 0.00 0.00 0.00 0.00 135 A 8.57 5.13 1.51 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 0.00 136 G 9.13 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 0.00 137 T 9.11 4.08 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 0.00 138 G 7.75 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 0.00 0.00 0.00 139 L 8.88 4.79 0.00 1.82 1.37 0.80 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 140 G 8.21 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 V 7.70 5.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.13 0.00 0.00 142 A 9.32 4.98 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 0.00 143 H 9.09 5.41 0.00 3.20 3.26 0.00 5.76 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 0.00 144 L 9.06 5.32 0.00 1.66 1.38 0.98 0.72 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 0.00 145 V 9.18 5.10 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.03 0.00 0.00 146 H 8.87 4.38 0.00 1.67 2.91 0.00 5.67 0.00 0.00 0.00 0.00 6.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 V 8.39 4.03 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 0.89 0.00 0.00 0.94 0.00 0.00 148 D 9.60 4.38 0.00 2.74 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 K 8.06 4.14 0.00 1.87 2.03 0.00 1.59 0.00 0.00 1.72 0.00 0.00 3.15 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.28 1.43 7.81 150 R 7.15 4.70 0.00 1.79 1.94 0.00 2.76 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 151 W 8.78 4.97 0.00 3.21 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 0.00 152 V 9.59 4.50 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.96 0.00 0.00 153 S 8.74 4.97 0.00 4.00 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 0.00 154 L 9.23 4.92 0.00 1.65 1.62 0.97 1.01 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 0.00 155 P 0.00 4.70 0.00 1.98 2.04 0.00 3.76 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 156 G 7.71 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 0.00 0.00 0.00 157 E 8.24 4.82 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 158 G 8.36 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 0.00 0.00 0.00 0.00 159 G 8.00 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 0.00 0.00 0.00 160 H 8.29 5.00 0.00 3.17 3.39 0.00 5.66 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 V 7.59 4.04 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 0.79 0.00 0.00 1.19 0.00 0.00 162 D 8.78 4.88 0.00 2.60 2.68 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 0.00 163 F 9.19 4.50 0.00 2.98 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 0.00 164 A 8.36 4.28 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 0.00 165 P 0.00 4.10 0.00 2.08 1.83 0.00 3.38 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.74 0.00 166 N 8.39 4.69 0.00 2.70 2.86 0.00 0.00 6.76 7.45 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 0.00 167 S 7.44 4.80 0.00 3.95 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 0.00 168 E 8.57 4.02 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 2.38 2.36 0.00 169 E 8.42 3.98 0.00 2.09 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 170 E 8.21 4.14 0.00 2.10 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 2.55 2.46 0.00 171 A 8.03 4.11 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 0.00 172 I 7.76 3.68 2.01 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 1.53 0.67 0.92 0.00 0.00 173 I 7.95 3.69 2.14 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 1.42 0.87 0.89 0.00 0.00 174 L 8.53 4.13 0.00 1.99 1.96 1.08 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 175 E 8.73 4.09 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 176 I 8.03 3.70 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 1.51 1.07 0.89 0.00 0.00 177 L 8.26 4.01 0.00 1.68 1.70 0.81 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 178 R 8.69 4.13 0.00 2.00 2.07 0.00 3.30 0.00 0.00 3.10 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.69 0.00 179 A 8.04 4.15 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 E 7.86 4.12 0.00 1.90 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 2.57 2.45 0.00 181 I 8.09 4.86 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.97 0.92 0.00 0.00 182 G 8.10 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 0.00 0.00 0.00 0.00 183 H 9.06 4.08 0.00 3.20 3.32 0.00 5.71 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 V 8.38 4.23 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 1.04 0.00 0.00 0.99 0.00 0.00 185 S 8.40 4.93 0.00 4.13 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 A 9.03 4.06 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 E 8.00 3.74 0.00 2.02 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 2.29 2.33 0.00 188 R 7.80 3.94 0.00 2.13 1.81 0.00 3.13 0.00 0.00 3.09 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.81 0.00 189 V 7.27 4.19 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.48 0.00 0.00 190 L 7.73 4.63 0.00 1.39 1.38 0.57 0.14 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 0.00 191 S 8.31 4.83 0.00 4.16 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 0.00 192 G 8.42 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 0.00 0.00 0.00 193 P 0.00 4.45 0.00 2.17 2.11 0.00 3.62 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 2.11 2.14 0.00 194 G 8.65 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 L 8.10 4.02 0.00 1.83 1.61 0.51 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 196 V 7.47 3.64 2.26 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 1.19 0.00 0.00 0.94 0.00 0.00 197 N 8.43 4.31 0.00 3.04 2.82 0.00 0.00 7.08 7.34 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 0.00 198 L 8.21 3.93 0.00 1.89 1.76 1.14 0.87 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 0.00 199 Y 8.13 4.11 0.00 3.06 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 R 8.23 3.38 0.00 1.97 1.87 0.00 3.19 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.95 0.00 201 A 8.04 3.92 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 I 8.11 3.62 2.01 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 1.42 0.84 0.90 0.00 0.00 203 V 7.47 3.49 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 0.99 0.00 0.00 0.50 0.00 0.00 204 K 8.52 4.05 0.00 1.77 1.83 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.44 7.81 205 A 7.51 4.18 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 0.00 206 D 7.59 4.60 0.00 2.60 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 0.00 207 N 7.62 4.20 0.00 2.81 2.81 0.00 0.00 6.64 8.88 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 0.00 208 R 7.88 4.69 0.00 1.80 1.78 0.00 3.09 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.78 0.00 209 L 8.16 4.78 0.00 1.59 1.57 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 210 P 0.00 4.47 0.00 2.14 1.73 0.00 3.72 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.89 0.00 211 E 9.01 4.41 0.00 2.06 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 2.35 2.31 0.00 212 N 8.24 4.69 0.00 2.69 2.75 0.00 0.00 6.99 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 L 7.41 4.36 0.00 1.29 1.28 0.13 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 214 K 8.85 4.59 0.00 1.86 1.63 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.33 7.81 215 P 0.00 4.18 0.00 2.09 2.13 0.00 3.54 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 216 K 7.82 4.05 0.00 1.74 1.80 0.00 1.91 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.34 7.81 217 D 7.77 4.28 0.00 2.89 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 I 7.20 3.44 1.73 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.78 0.73 0.00 0.00 219 T 7.54 3.51 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 0.94 0.00 0.00 220 E 8.03 3.94 0.00 2.08 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 2.29 2.32 0.00 221 R 8.17 4.01 0.00 1.81 1.90 0.00 3.08 0.00 0.00 3.16 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.46 0.00 222 A 7.90 3.88 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 0.00 223 L 7.92 4.04 0.00 1.59 1.77 1.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 224 A 8.33 4.17 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 D 7.86 4.46 0.00 2.88 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 0.00 226 S 8.11 4.58 0.00 4.00 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 0.00 227 C 7.46 4.60 0.00 2.95 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 0.00 228 T 8.56 3.97 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 1.24 0.00 0.00 229 D 8.08 4.40 0.00 2.95 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 C 8.07 4.11 0.00 3.02 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 0.00 231 R 8.27 3.79 0.00 2.04 2.01 0.00 3.20 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.91 0.00 232 R 8.07 3.94 0.00 2.13 2.21 0.00 3.27 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 233 A 8.30 4.06 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 0.00 0.00 234 L 7.86 3.88 0.00 1.66 1.20 -0.69 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 235 S 8.16 4.50 0.00 4.27 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 0.00 236 L 8.09 4.09 0.00 2.06 1.85 0.99 1.06 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 0.00 237 F 8.55 4.10 0.00 3.09 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 C 8.37 4.79 0.00 3.48 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 V 7.80 3.89 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 1.18 0.00 0.00 1.01 0.00 0.00 240 I 7.97 4.21 1.86 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.70 1.07 0.00 0.00 *242 G 8.08 3.40 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 0.00 243 R 8.34 3.83 0.00 2.07 1.99 0.00 3.13 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.80 0.00 244 F 9.01 4.11 0.00 3.19 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 0.00 245 G 7.80 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 0.00 246 G 8.08 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 0.00 0.00 0.00 247 N 7.73 4.12 0.00 2.54 2.59 0.00 0.00 7.03 6.74 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 0.00 248 L 7.24 3.75 0.00 1.69 1.62 0.57 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 249 A 7.62 4.55 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 0.00 250 L 7.89 3.97 0.00 1.68 1.47 0.73 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 251 N 7.85 4.27 0.00 2.68 2.86 0.00 0.00 7.09 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 L 7.49 4.53 0.00 1.65 1.63 0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 253 G 7.47 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 T 7.24 4.37 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 1.32 0.00 0.00 255 F 7.36 4.55 0.00 3.30 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 0.00 256 G 7.68 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 G 7.97 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 0.00 0.00 0.00 0.00 258 V 8.54 4.96 2.26 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 1.50 0.00 0.00 1.21 0.00 0.00 259 F 9.81 5.42 0.00 3.06 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 0.00 260 I 8.74 4.76 1.65 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.63 0.51 0.00 0.00 261 A 9.07 4.43 1.17 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 0.00 0.00 262 G 8.18 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 0.00 263 G 9.00 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 0.00 0.00 0.00 264 I 6.10 3.95 1.90 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.78 0.89 0.00 0.00 265 V 7.44 2.00 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 -0.15 0.00 0.00 0.50 0.00 0.00 266 P 0.00 4.04 0.00 1.94 1.99 0.00 3.63 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.96 0.00 267 R 7.22 4.13 0.00 1.82 2.01 0.00 3.01 0.00 0.00 3.26 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.76 0.00 268 F 7.64 5.07 0.00 3.20 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 0.00 269 L 8.32 3.94 0.00 1.90 1.77 1.09 0.99 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 0.00 270 E 8.30 4.13 0.00 2.14 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 2.48 2.37 0.00 271 F 8.50 4.03 0.00 3.20 3.57 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 0.00 272 F 9.16 4.64 0.00 3.37 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 0.00 273 K 8.43 4.24 0.00 2.03 1.95 0.00 1.99 0.00 0.00 1.96 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.77 2.04 7.81 274 A 7.78 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 275 S 7.56 4.35 0.00 4.10 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 0.00 276 G 8.49 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 0.00 0.00 0.00 277 F 7.97 4.24 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 0.00 278 R 8.09 3.74 0.00 2.17 1.99 0.00 3.18 0.00 0.00 3.54 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.82 0.00 279 A 7.98 4.06 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 0.00 280 A 7.93 4.04 1.43 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 0.00 281 F 7.79 4.02 0.00 2.49 3.09 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 0.00 282 E 7.93 4.46 0.00 2.12 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 2.52 2.75 0.00 283 D 7.63 4.95 0.00 2.86 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 0.00 284 K 7.50 4.58 0.00 1.71 1.72 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.20 1.21 7.81 285 G 8.19 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 286 R 8.78 3.87 0.00 1.78 2.05 0.00 3.05 0.00 0.00 3.35 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 287 F 8.33 4.37 0.00 3.26 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 0.00 288 K 8.27 4.17 0.00 1.95 1.86 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.46 1.53 7.81 289 E 8.09 4.09 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 290 Y 7.89 4.32 0.00 3.25 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 291 V 7.86 4.39 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 1.01 0.00 0.00 1.00 0.00 0.00 292 H 8.22 4.38 0.00 3.39 3.39 0.00 5.77 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 293 D 8.05 4.69 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 0.00 294 I 7.74 4.47 2.30 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 1.53 1.33 1.10 0.00 0.00 295 P 0.00 4.62 0.00 1.13 2.20 0.00 3.89 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 2.06 1.95 0.00 296 V 7.84 4.64 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.35 0.00 0.00 297 Y 8.40 5.28 0.00 2.49 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 0.00 298 L 9.22 4.57 0.00 1.68 1.78 0.59 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 299 I 8.96 4.73 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.96 0.94 0.00 0.00 300 V 8.80 4.14 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 0.66 0.00 0.00 0.98 0.00 0.00 301 H 8.30 4.16 0.00 3.01 3.11 0.00 5.72 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 302 D 8.32 4.54 0.00 2.61 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 0.00 303 N 7.87 5.07 0.00 2.72 2.67 0.00 0.00 6.92 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 0.00 304 P 0.00 4.17 0.00 2.08 2.15 0.00 3.64 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.93 0.00 305 G 7.91 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 L 7.73 3.98 0.00 1.67 1.69 0.94 0.47 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 0.00 307 L 7.82 3.98 0.00 1.80 1.64 0.74 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 308 G 8.09 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 0.00 0.00 0.00 0.00 309 S 8.24 4.26 0.00 4.01 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 0.00 310 G 8.11 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 311 A 8.03 3.95 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 0.00 312 H 8.55 3.99 0.00 3.30 3.53 0.00 5.79 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 0.00 313 L 8.14 3.89 0.00 1.88 1.77 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 314 R 8.37 3.80 0.00 1.82 1.80 0.00 3.23 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.77 0.00 315 Q 8.14 4.54 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 316 T 7.60 3.93 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 1.18 0.00 0.00 317 L 7.65 4.33 0.00 1.88 1.73 0.79 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 318 G 7.81 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 319 H 8.31 4.41 0.00 3.20 3.23 0.00 5.61 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 0.00 320 I 8.11 4.42 1.88 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 1.41 0.50 0.92 0.00 0.00 321 L 8.46 4.29 0.00 1.70 1.61 1.02 0.91 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 * Residues marked with a * may have inaccurate shift predictions.