NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3248 8.2649 123.5834 51.5937 19.9335 176.8144 3 R 3.9453 8.4158 121.5099 55.4509 30.9362 174.8769 4 N 4.7255 8.7918 117.6046 53.7981 41.1617 173.4098 5 K 4.9260 9.3520 122.1492 54.7544 35.5155 174.7070 6 I 4.9540 9.2225 128.1908 59.4709 40.0001 174.1795 7 A 5.0585 9.0590 129.5228 50.2005 21.4422 175.2478 8 L 4.8174 9.1298 123.9207 53.3526 43.6180 176.3565 9 I 4.4353 8.7467 127.8193 63.3499 37.4637 175.3059 10 G 4.4447 8.9300 116.5008 46.1927 0.0000 173.0517 11 S 4.6593 9.1642 123.6361 58.0681 64.6461 176.4045 12 G 4.0158 7.8076 114.6929 45.0987 0.0000 175.7593 13 M 3.6560 8.3615 120.1459 58.3134 32.0630 178.5039 14 I 3.8819 7.6008 119.5588 64.2229 37.4818 178.3034 15 G 3.9390 7.6111 107.6064 47.2809 0.0000 175.7241 16 G 3.6238 8.2568 108.3363 47.7100 0.0000 176.0011 17 T 4.0446 7.7837 118.0739 66.3016 68.4734 176.6716 18 L 4.0240 8.5836 121.1164 57.8456 41.6668 179.4941 19 A 4.1414 8.2179 120.5247 55.4447 18.3243 179.0929 20 H 4.1847 8.3802 116.7060 59.6315 29.8977 177.5390 21 L 3.9316 8.2008 120.5121 57.6329 41.3829 179.3611 22 A 4.0872 8.3081 121.0502 54.8524 18.2746 179.9866 23 G 3.1974 8.3277 104.2790 47.9034 0.0000 175.8843 24 L 3.6960 7.3329 120.8115 56.8381 41.7194 178.9813 25 K 4.2582 7.9843 115.3636 55.1280 32.6575 176.3577 26 E 3.7968 7.8487 117.8374 57.4159 27.4791 175.8779 27 L 4.1144 7.9599 118.6904 56.2080 42.4882 178.3794 28 G 3.7233 7.5933 103.9316 44.5063 0.0000 172.2686 29 D 4.5054 8.2012 120.4937 54.2360 42.4515 175.9630 30 V 4.6898 8.4840 121.3083 61.0912 35.0339 174.1546 31 V 4.8402 8.8695 128.1189 61.2083 33.8157 174.0540 32 L 4.9215 9.3341 128.8382 53.4942 43.2272 175.3230 33 F 5.2714 9.1802 126.9683 56.7302 42.3293 173.5463 34 D 4.5265 7.2771 122.7245 53.1700 44.6790 175.9254 35 I 3.4304 8.0854 121.2336 63.2414 38.3107 176.3066 36 A 4.0738 8.2695 124.0111 51.6054 18.6584 176.8372 37 E 4.2621 7.9059 122.6098 56.8584 30.6569 175.3367 38 G 4.2721 9.4850 114.0195 46.6181 0.0000 175.6634 39 T 3.8165 7.9160 116.5281 66.0142 68.4529 174.7118 40 P 4.2569 0.0000 0.0000 65.8362 31.4545 178.3393 41 Q 4.0838 8.0575 117.5268 58.6005 28.6642 178.8265 42 G 3.5632 8.6692 106.9251 47.8760 0.0000 175.9348 43 K 4.0619 8.0388 121.8629 58.8101 31.9641 179.7579 44 G 3.6808 8.2022 106.0382 47.8539 0.0000 175.5664 45 L 3.9693 8.0397 122.9584 57.5371 41.8120 178.6159 46 D 4.2140 7.9852 117.4871 57.4200 41.6781 177.9877 47 I 3.6504 7.7257 120.1276 64.1275 37.0487 178.1258 48 A 3.9254 7.8183 121.8378 55.4205 18.0007 179.5854 49 E 3.9939 8.2019 115.8855 58.8910 29.8022 179.1128 50 S 4.2838 7.7811 113.8987 60.3342 63.2878 176.4874 51 S 2.7900 7.5354 118.5823 60.5154 62.3598 174.6291 52 P 4.3695 0.0000 0.0000 64.5839 31.0754 178.4962 53 V 3.6734 7.3956 116.9811 66.1349 31.6548 177.3511 54 D 4.6740 7.9750 115.8217 54.6860 41.0760 177.3923 55 G 3.8676 8.2994 107.7752 45.4785 0.0000 173.1642 56 F 4.6521 7.5666 113.4930 55.5951 39.1175 174.9794 57 D 4.8843 8.7692 122.9287 52.9386 41.5943 175.2941 58 A 4.8833 8.3704 124.6133 50.3549 22.6322 175.2682 59 K 4.3863 9.3876 121.2656 55.8208 33.7438 175.9471 60 F 5.1929 8.9763 123.1319 55.9822 41.3690 174.9477 61 T 4.7085 8.9710 120.0215 61.6751 72.0471 173.2378 62 G 4.5247 8.7515 111.9698 44.9057 0.0000 172.5088 63 A 4.8148 8.9396 123.1097 50.5041 23.1397 176.5390 64 N 4.5790 8.7235 114.3304 51.6904 40.1413 173.5615 65 D 5.0591 7.7147 118.7442 52.2223 43.5635 176.3702 66 Y 3.7250 8.7049 123.4896 60.6358 38.5191 178.2893 67 A 2.5800 8.2199 122.8145 54.2060 18.5536 179.3252 68 A 3.9665 7.5898 118.5916 55.0500 18.6380 178.2549 69 I 4.1204 7.7479 108.1957 60.6620 37.9984 175.2850 70 E 4.3954 7.6478 122.7189 58.2262 29.6259 177.0102 71 G 3.8863 8.9539 113.4945 45.5708 0.0000 173.3200 72 A 4.0676 7.8023 122.6776 52.5665 18.9618 178.2356 73 D 4.6954 8.9591 123.3082 56.7484 42.1800 176.8503 74 V 4.9208 7.7560 116.6166 60.9734 35.7134 174.5098 75 V 4.8359 8.9613 126.3234 61.2454 34.5909 173.9422 76 I 4.8669 8.8189 129.1029 59.4631 39.9828 174.6823 77 V 4.8663 8.7680 127.6867 61.5990 33.0374 175.5199 78 T 4.6280 9.0618 117.6621 60.9349 70.4444 173.9153 79 A 4.1006 8.3165 124.6456 51.6994 18.8693 177.7244 80 G 3.9712 7.6462 110.1770 45.7841 0.0000 171.5187 81 V 4.5115 8.3589 112.7974 58.4139 34.4288 174.5256 82 P 4.3649 0.0000 0.0000 62.6915 32.0228 176.9901 83 R 3.9278 8.6932 121.4281 57.5945 29.1870 177.2725 84 K 4.4316 8.6154 126.1167 54.5173 33.7202 173.7417 *90 D 4.6608 8.0865 117.4348 54.1938 41.8831 182.6468 91 D 4.6441 7.8702 120.9414 58.4622 39.9213 183.3400 92 L 4.1204 7.9084 119.6705 58.5243 42.1729 178.2888 93 L 4.0266 8.1848 119.9180 58.5022 41.6652 179.2156 94 G 3.6144 7.8041 105.2084 47.8774 0.0000 175.8850 95 I 3.7947 7.6465 122.0325 64.2375 37.2106 178.2347 96 N 4.4435 8.4171 117.3866 55.9464 38.2951 177.3059 97 L 4.1389 8.2823 124.5520 58.7046 42.2007 179.7452 98 K 3.9088 7.8554 123.8063 59.6769 31.5059 181.1841 99 V 3.7878 7.6439 118.9539 66.3221 31.5149 178.0822 100 M 4.1016 8.3706 118.6645 58.2870 31.7359 178.5038 101 E 2.8337 7.8190 119.5121 58.8774 29.7151 178.8536 102 Q 3.8507 7.8481 118.0539 58.8899 28.7721 179.0023 103 V 3.7684 7.5895 120.9903 65.3384 31.5904 177.9474 104 G 3.7278 8.4471 105.5953 48.0844 0.0000 175.3563 105 A 3.9780 7.9279 123.5859 54.5974 18.3439 180.0131 106 G 2.7668 7.4894 104.2414 47.5399 0.0000 176.1754 107 I 3.7110 7.6780 122.2549 63.8293 36.9047 178.1938 108 K 3.7638 7.7410 119.3746 59.4727 32.0705 178.3854 109 K 3.8008 7.6810 118.0518 59.2883 32.4265 177.5150 110 Y 4.6509 8.0238 115.4155 57.9267 40.2309 175.6467 111 A 5.0499 8.2765 122.4030 50.3547 19.0139 175.3251 112 P 4.2898 0.0000 0.0000 64.8662 32.1564 177.7205 113 E 4.3903 8.0518 116.3669 56.1305 29.7681 175.8922 114 A 4.4460 7.7817 121.5306 51.6595 19.5997 177.4304 115 F 4.4375 8.7198 123.4553 57.7806 40.5429 174.3719 116 V 4.5814 8.5102 126.9144 61.0596 33.8459 174.1316 117 I 4.5542 8.4996 129.1869 59.5904 39.5236 174.1692 118 C 4.5503 9.1539 128.9150 58.8109 32.2657 173.8639 119 I 4.2730 8.6294 126.2308 62.4041 39.6629 176.5654 120 T 3.8538 7.9163 117.2912 64.3020 69.1188 173.6147 121 N 4.9955 8.7068 123.0816 51.4177 40.3702 173.5592 122 P 4.4468 0.0000 0.0000 62.4720 32.9484 177.1194 123 L 4.3463 8.5051 125.3354 57.9493 42.0035 178.7209 124 D 4.3665 8.1110 118.1079 57.1863 40.6690 178.3726 125 A 4.1360 7.8584 120.6250 55.0149 18.8275 179.3815 126 M 4.1004 8.1123 117.6008 58.4046 32.0158 179.3567 127 V 3.5108 7.9347 119.5196 64.1268 31.5517 178.4142 128 W 3.7041 7.4829 125.8359 60.0891 30.5679 177.7947 129 A 3.1668 8.3864 120.8930 54.9051 17.8377 179.3664 130 L 3.9679 8.1593 119.2265 58.1299 42.1010 178.9199 131 Q 3.8565 7.8446 119.5155 59.0846 28.7791 178.5755 132 K 3.7129 7.0527 117.5905 59.4022 32.1021 179.0413 133 F 4.5405 7.6444 117.3542 60.6779 38.8980 177.5874 134 S 4.4685 8.1708 112.7077 59.0151 63.1086 175.5526 135 G 3.8730 7.8602 108.8241 45.4842 0.0000 173.7221 136 L 4.1891 7.3295 119.4669 53.3315 42.4129 175.3452 137 P 4.2820 0.0000 0.0000 62.7716 32.0756 177.5621 138 A 4.1192 8.8036 125.3155 55.5737 18.6134 178.9005 139 H 4.5554 8.3560 109.6085 57.2734 29.0081 176.1245 140 K 4.8441 8.2174 119.5970 56.2422 33.5582 175.5446 141 V 4.7197 7.9717 120.5717 61.2611 33.8288 174.9936 142 V 4.9423 8.7858 120.6908 59.6311 36.4716 174.5800 143 G 4.3639 8.9081 109.2331 44.6026 0.0000 172.3872 144 M 4.5838 8.8482 125.0372 55.4413 32.5386 174.2289 145 A 4.8492 8.8335 128.7762 52.4828 26.3000 178.0762 146 G 3.7529 8.2673 102.0714 48.0766 0.0000 175.6543 147 V 3.7104 7.7695 119.8727 65.5356 31.5419 177.8259 148 L 3.9154 7.8673 119.6093 58.3679 42.1678 178.3636 149 D 4.4155 8.1170 118.8588 57.4618 40.6632 178.8806 150 S 4.1931 8.7207 113.6731 61.3492 62.4623 175.8893 151 A 4.0009 8.5183 123.7654 55.3816 18.0238 179.8449 152 R 3.5038 8.0943 116.4081 59.1585 30.0639 179.1078 153 F 4.4274 8.2686 120.3296 61.5452 39.3405 177.3334 154 R 3.8712 8.3730 118.0747 59.2812 29.8283 178.4202 155 Y 4.0494 8.0072 119.1766 60.8421 38.9382 177.9185 156 F 4.2955 7.8743 118.8003 60.9220 39.0117 177.8261 157 L 3.9516 8.4209 118.7869 57.6376 41.4801 179.6773 158 S 4.2492 8.3484 114.7307 61.4684 62.6669 176.5210 159 E 3.8642 7.6883 121.4981 58.8798 29.2276 178.4987 160 E 3.8910 7.5878 118.2517 59.0482 29.8339 178.2723 161 F 4.7271 7.9401 114.3070 56.4862 40.2921 174.9259 162 N 4.1842 7.8469 116.4982 55.0944 37.5979 173.3065 163 V 4.5761 7.3846 108.3334 58.8691 35.8675 176.0952 164 S 4.2536 8.5003 115.5800 58.7179 62.9730 175.9299 165 V 3.7964 8.4541 119.0903 64.3873 31.5581 178.3567 166 E 4.0909 8.3365 118.6662 58.6427 29.5664 177.2658 167 D 4.7329 8.1932 117.6887 53.9317 41.2158 175.2666 168 V 4.8523 7.5167 119.8542 61.4871 33.1701 175.1491 169 T 4.7857 9.0597 124.1087 61.8709 71.9689 173.4212 170 V 4.7028 8.3577 117.1389 59.4230 36.0385 174.7086 171 F 4.7310 8.9466 125.0117 56.5602 41.6303 174.1778 172 V 4.7996 8.1123 125.7384 61.2092 33.9090 174.5732 173 L 4.6603 9.1113 127.6286 54.2142 44.9004 177.6199 174 G 3.7772 9.1868 108.0185 45.4836 0.0000 170.8411 175 G 4.5299 7.7213 109.9494 44.7410 0.0000 172.3887 176 H 5.0325 8.5371 117.0346 55.8954 30.9435 176.3723 177 G 4.0177 8.4283 108.9643 46.4497 0.0000 176.8401 178 D 4.4447 8.8288 122.4383 56.5636 40.9387 177.0271 179 S 4.4064 7.8275 112.9040 58.7243 63.6668 173.5361 180 M 4.6484 7.7964 122.1765 55.3302 32.8416 176.4074 181 V 4.5445 8.8888 125.9731 60.3160 32.0728 171.9086 182 P 5.0592 0.0000 0.0000 62.0723 33.2404 176.4780 183 L 4.6505 9.0813 122.4863 52.9178 43.0279 177.0251 184 A 4.1927 8.8154 128.7559 55.0077 18.6717 179.8115 185 R 4.0375 7.9877 111.0212 58.7454 29.6650 176.7448 186 Y 5.0385 7.7490 114.7938 57.7600 38.9124 175.5459 187 S 5.1477 8.2973 116.1434 57.0738 66.0721 173.4256 188 T 5.1051 9.0468 113.1087 60.1852 72.9464 172.7125 189 V 4.6532 8.3716 122.2677 61.2588 33.6900 175.3706 190 A 3.8600 9.8743 131.9982 53.0475 16.6048 177.8228 191 G 3.8849 8.5474 108.5741 46.5947 0.0000 174.3952 192 I 4.0292 7.6148 122.2087 59.1423 37.7219 173.9328 193 P 4.9498 0.0000 0.0000 62.1323 32.2533 177.3384 194 L 4.0058 8.5437 120.1790 57.6983 41.4638 178.3195 195 P 4.2743 0.0000 0.0000 65.5125 31.2061 178.3848 196 D 4.3341 8.1204 118.0360 57.0653 40.6858 178.6968 197 L 3.4782 7.5584 119.1988 57.4536 41.7171 179.3119 198 V 3.9423 8.0479 119.8720 65.4375 31.2291 177.9411 199 K 3.9542 7.6924 117.8121 59.7141 32.1163 177.9755 200 M 4.3670 7.9877 116.7883 55.9247 32.1012 177.2181 201 G 4.1170 7.8059 107.0361 45.3550 0.0000 174.7967 202 W 4.4141 8.4326 121.0970 59.3317 29.5489 175.6072 203 T 4.5141 7.8061 111.1995 60.5535 69.7754 171.3944 204 S 4.9978 8.1570 116.9217 56.2547 66.8433 174.4758 205 Q 4.0220 8.5395 122.7568 59.6239 28.7463 178.3305 206 D 4.4186 8.0391 119.4047 57.3113 40.9113 178.7408 207 K 4.0199 8.1184 119.0910 59.0384 31.9123 179.2671 208 L 4.0013 8.1167 120.7887 58.3086 42.0933 178.5463 209 D 4.4395 8.6809 121.7396 58.1989 40.7807 179.8816 210 K 4.0044 7.9659 123.9473 59.6767 31.6958 181.1535 211 I 3.8130 7.9148 121.0580 64.2653 37.0472 178.5064 212 I 3.2040 7.9153 120.8723 64.3729 36.9483 178.3248 213 Q 3.9052 7.9493 120.2703 59.0750 28.6599 177.9202 214 R 3.8134 8.1303 119.2239 59.7968 30.2379 178.3710 215 T 4.2853 7.8514 115.4650 66.6967 68.4257 176.7813 216 R 3.9614 8.0234 119.9762 59.1787 30.0701 177.8853 217 D 4.9424 8.1361 116.3327 54.1342 40.8463 178.4794 218 G 3.8798 8.0165 109.1931 47.9611 0.0000 176.3367 219 G 3.6000 8.0672 107.7004 47.5044 0.0000 175.5273 220 A 4.0607 7.9604 123.0055 54.5838 18.3386 179.0909 221 E 3.8868 8.4663 118.2053 59.4891 29.6579 179.2451 222 I 3.7036 7.6094 119.8126 64.3089 37.1268 178.2574 223 V 4.0920 7.2099 120.5962 65.5379 31.0542 178.1827 224 G 3.6830 8.2028 104.0417 47.6938 0.0000 175.2111 225 L 4.2564 7.4147 119.7755 57.5291 42.0782 179.0704 226 L 4.0985 8.2489 117.8325 55.4523 41.6314 178.5356 227 K 4.3841 8.2686 123.2520 57.5078 31.4556 177.2722 228 T 4.2538 7.8127 106.2659 63.5100 69.9690 174.5062 229 G 3.9500 7.5198 110.3120 45.0940 0.0000 170.7232 230 S 4.9436 8.3971 115.1782 55.6428 66.0821 173.2695 231 A 4.1726 8.4536 122.9628 52.6284 18.6751 177.3730 232 F 4.8867 7.8167 112.6989 56.4190 40.3038 176.9776 233 Y 4.0271 7.3266 118.8211 61.1114 37.7951 177.8099 234 A 4.0093 7.9124 121.1921 54.5853 18.5808 177.7729 235 P 4.2295 0.0000 0.0000 65.4953 31.4395 178.6848 236 A 4.0036 8.1982 119.4415 55.1788 18.3496 179.4237 237 A 3.9837 8.3401 119.6037 55.4826 17.9898 180.1210 238 S 4.0547 8.2405 113.2904 61.7562 62.9748 176.8029 239 A 4.0564 8.1114 123.4509 55.2582 18.0263 179.7641 240 I 3.7435 8.0532 118.4742 64.4428 37.1465 178.3770 241 Q 3.9892 8.1802 120.5496 59.4282 28.9909 178.3038 242 M 4.1696 7.9064 118.9803 58.4630 32.0287 178.6302 243 A 4.2934 8.2145 120.8688 55.3077 18.5545 179.5908 244 E 3.9650 8.6141 117.4462 59.5639 29.5666 179.3907 245 S 4.0902 8.2646 113.2385 61.4512 62.3793 175.6486 246 Y 3.8825 7.8991 121.6776 60.8359 38.3662 178.1784 247 L 4.0613 8.1304 118.1369 56.6018 41.8159 178.5134 248 K 4.2993 7.9369 115.9232 54.6751 33.3539 175.3723 249 D 4.2523 7.3960 117.8011 55.0441 39.9593 173.9287 250 K 4.0742 8.1095 119.0238 56.6317 32.9587 176.2147 251 K 4.2147 7.9281 115.6073 56.6560 29.5008 175.8365 252 R 4.1154 7.6627 116.4421 56.4194 31.5387 176.5629 253 V 4.5896 8.2552 122.2820 62.0544 32.4082 175.1627 254 L 4.9476 9.1475 128.3361 52.1520 45.9621 174.1487 255 P 4.9056 0.0000 0.0000 62.7556 31.8572 175.8017 256 V 4.6823 8.6955 117.0687 59.0699 36.7642 174.7211 257 A 4.8918 8.9995 124.7229 51.6609 19.4125 176.6232 258 A 4.9411 8.8068 123.9439 49.9026 23.1951 174.8387 259 Q 3.7603 7.6964 121.3221 55.7750 29.5200 175.7795 260 L 4.5683 8.7866 127.7416 53.6941 43.1703 177.3108 261 S 4.7587 9.3384 116.0735 56.6657 63.0218 173.3919 262 G 3.8936 9.1614 112.5967 46.7876 0.0000 173.7211 263 Q 4.3647 8.0979 119.3480 56.8798 29.2372 176.0355 264 Y 3.3498 9.6836 118.6545 58.8953 36.0919 171.1933 265 G 4.1070 8.4596 106.1009 45.8702 0.0000 173.8509 266 V 4.5258 7.8609 118.7212 60.5635 33.6803 174.8318 267 K 5.0306 7.9776 124.2467 55.5890 35.7785 175.4408 268 D 4.9815 8.3748 118.3320 55.2975 39.1889 173.4664 269 M 5.0493 7.4575 115.8929 54.2119 36.3305 173.1470 270 Y 4.6863 8.8599 122.2316 57.7124 39.1855 175.1365 271 V 4.4257 8.8617 123.3364 60.7467 36.0316 174.3450 272 G 4.2943 8.6191 113.9397 46.3477 0.0000 172.6322 273 V 5.0143 9.0340 119.6266 58.4570 36.8668 173.0882 274 P 4.8904 0.0000 0.0000 63.3652 32.2428 175.2363 275 T 5.1275 9.0531 114.2323 59.7126 72.9465 172.8847 276 V 4.5245 8.6539 123.7407 62.3713 32.9828 174.5616 277 I 4.8925 8.7047 129.3169 59.9389 39.3516 175.2907 278 G 4.0404 8.4322 115.6853 44.5513 0.0000 172.3984 279 A 3.3247 8.5268 121.8296 53.9767 18.3649 178.1879 280 N 4.8602 8.5325 113.5179 52.9932 40.2194 175.7982 281 G 3.8237 8.1845 105.5132 45.1696 0.0000 175.8152 282 V 3.7585 9.1205 128.5830 63.4698 30.8323 175.1193 283 E 4.5117 8.9989 128.5548 57.5551 31.1062 177.0662 284 R 4.6458 7.7647 118.8306 54.9680 33.8443 173.5887 285 I 4.7109 8.3541 126.7377 59.7381 39.0542 175.0809 286 I 4.1712 8.7399 129.0891 60.5508 37.8505 175.0094 287 E 4.4792 9.0881 127.4995 53.2789 31.1130 174.7630 288 I 4.4846 8.1671 118.7752 58.7541 40.4503 174.6872 289 D 4.5791 8.3993 120.6725 53.9227 41.4300 176.0352 290 L 4.7734 8.0948 122.4509 52.4889 44.2510 176.9170 291 D 4.6577 8.9544 126.0534 53.2605 41.4619 178.2496 292 K 3.8934 8.5691 124.1305 60.3541 31.4171 178.1272 293 D 4.5653 8.0746 119.6976 57.2046 40.8407 178.6349 294 E 3.9776 8.9261 119.5636 59.2895 29.4062 179.3449 295 K 4.0957 8.5524 119.9406 59.3548 32.2532 178.8179 296 A 4.0504 8.0389 121.2364 55.0938 18.3063 179.5708 297 Q 3.9480 8.3815 116.8316 59.0651 28.7604 178.7086 298 F 4.0428 8.7049 121.8962 61.6895 39.4043 176.9339 299 D 4.3047 8.6995 118.7555 57.1092 40.5830 178.7287 300 K 3.8910 8.1486 120.2404 59.4181 32.3327 178.8430 301 S 3.9582 7.8877 113.3705 61.4003 62.2687 176.2668 302 V 3.3302 7.6178 120.9246 65.7372 31.1525 177.7325 303 A 3.9061 8.2905 121.2098 55.2553 18.3812 179.8324 304 S 4.0507 8.0820 112.5745 61.2759 63.0939 176.8861 305 V 3.4599 7.6325 121.6375 65.6715 31.2084 177.8426 306 A 3.8668 8.1936 121.0031 54.8391 18.1279 179.8155 307 G 3.4811 8.0970 104.3350 47.8208 0.0000 175.7001 308 L 3.8964 7.6341 122.5038 58.0796 42.1119 178.8793 309 C 3.6914 7.7277 116.6183 62.5146 27.7759 175.9622 310 E 3.9398 8.1649 120.0629 59.3394 29.1658 179.2026 311 A 4.0297 8.1456 120.8570 55.3972 18.3198 179.4853 312 C 4.2440 8.2238 115.2634 63.0320 28.0060 176.3515 313 I 3.9149 8.2556 121.7172 64.1395 36.4333 178.4015 314 G 3.8929 8.0079 105.7875 48.2626 0.0000 175.4302 315 I 4.1583 7.5750 120.4458 62.2466 38.4884 176.3497 316 A 4.7130 8.3196 123.1482 48.8868 18.9267 174.1573 317 P 4.4702 0.0000 0.0000 64.3643 31.9114 178.9416 318 S 4.1476 8.1737 111.5449 60.6822 62.7061 175.1297 319 L 3.8538 8.1874 122.6232 56.2666 41.7654 177.6642 320 K 4.1913 8.0866 125.6104 54.9192 31.5166 182.0567 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 2 A 8.26 4.32 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 3 R 8.42 3.95 0.00 1.89 1.88 0.00 3.56 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 4 N 8.79 4.73 0.00 2.86 2.79 0.00 0.00 6.29 7.90 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 5 K 9.35 4.93 0.00 1.78 1.62 0.00 1.57 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.36 7.81 6 I 9.22 4.95 1.86 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 1.20 0.65 0.93 0.00 0.00 7 A 9.06 5.06 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 8 L 9.13 4.82 0.00 1.60 1.66 1.05 0.70 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 9 I 8.75 4.44 1.93 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 1.17 1.04 1.09 0.00 0.00 10 G 8.93 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 9.16 4.66 0.00 3.74 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 G 7.81 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 13 M 8.36 3.66 0.00 0.75 1.76 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 14 I 7.60 3.88 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 1.65 0.62 0.94 0.00 0.00 15 G 7.61 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.26 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 17 T 7.78 4.04 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 1.36 0.00 0.00 18 L 8.58 4.02 0.00 1.83 1.77 0.95 0.76 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 19 A 8.22 4.14 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 H 8.38 4.18 0.00 3.37 3.49 0.00 5.61 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 21 L 8.20 3.93 0.00 1.92 1.71 0.98 0.82 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 22 A 8.31 4.09 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 23 G 8.33 3.20 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 0.00 24 L 7.33 3.70 0.00 1.63 1.67 0.71 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 25 K 7.98 4.26 0.00 1.75 1.82 0.00 1.95 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.49 7.81 26 E 7.85 3.80 0.00 2.10 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 2.34 2.27 0.00 27 L 7.96 4.11 0.00 1.63 1.74 0.95 0.82 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 28 G 7.59 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 29 D 8.20 4.51 0.00 2.55 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.48 4.69 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 1.03 0.00 0.00 0.73 0.00 0.00 31 V 8.87 4.84 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 0.87 0.00 0.00 0.98 0.00 0.00 32 L 9.33 4.92 0.00 1.76 1.60 1.01 1.05 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 33 F 9.18 5.27 0.00 3.02 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 D 7.28 4.53 0.00 2.63 2.34 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 35 I 8.09 3.43 1.80 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 1.31 0.73 0.85 0.00 0.00 36 A 8.27 4.07 1.18 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 0.00 0.00 37 E 7.91 4.26 0.00 1.91 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 2.23 2.19 0.00 38 G 9.49 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 0.00 0.00 0.00 39 T 7.92 3.82 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 40 P 0.00 4.26 0.00 2.33 2.22 0.00 3.56 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 41 Q 8.06 4.08 0.00 2.27 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.95 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 42 G 8.67 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.04 4.06 0.00 1.82 1.85 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.55 7.81 44 G 8.20 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.04 3.97 0.00 1.85 1.79 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 46 D 7.99 4.21 0.00 2.79 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 47 I 7.73 3.65 1.26 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 1.29 0.93 0.37 0.00 0.00 48 A 7.82 3.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.20 3.99 0.00 2.07 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 2.31 2.46 0.00 50 S 7.78 4.28 0.00 4.09 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 S 7.54 2.79 0.00 3.25 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 52 P 0.00 4.37 0.00 1.97 2.09 0.00 3.65 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.04 0.00 53 V 7.40 3.67 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 0.84 0.00 0.00 0.93 0.00 0.00 54 D 7.97 4.67 0.00 2.90 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 55 G 8.30 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 0.00 0.00 0.00 56 F 7.57 4.65 0.00 3.14 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 57 D 8.77 4.88 0.00 2.73 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 58 A 8.37 4.88 1.29 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 0.00 0.00 0.00 59 K 9.39 4.39 0.00 1.65 1.73 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.42 7.81 60 F 8.98 5.19 0.00 3.02 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 61 T 8.97 4.71 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 1.22 0.00 0.00 62 G 8.75 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.94 4.81 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 N 8.72 4.58 0.00 2.63 2.59 0.00 0.00 7.03 8.08 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 65 D 7.71 5.06 0.00 2.63 2.47 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 0.00 66 Y 8.70 3.72 0.00 3.08 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 A 8.22 2.58 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 7.59 3.97 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 69 I 7.75 4.12 1.86 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 1.44 0.76 0.81 0.00 0.00 70 E 7.65 4.40 0.00 2.15 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 2.40 2.56 0.00 71 G 8.95 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 72 A 7.80 4.07 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 73 D 8.96 4.70 0.00 2.85 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 7.76 4.92 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 1.15 0.00 0.00 1.07 0.00 0.00 75 V 8.96 4.84 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 0.90 0.00 0.00 0.91 0.00 0.00 76 I 8.82 4.87 1.88 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 1.09 0.63 0.96 0.00 0.00 77 V 8.77 4.87 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 1.08 0.00 0.00 0.91 0.00 0.00 78 T 9.06 4.63 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 1.23 0.00 0.00 79 A 8.32 4.10 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 80 G 7.65 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 81 V 8.36 4.51 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.94 0.00 0.00 82 P 0.00 4.36 0.00 2.17 2.04 0.00 3.77 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 83 R 8.69 3.93 0.00 1.85 1.80 0.00 3.21 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 84 K 8.62 4.43 0.00 1.73 1.68 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.24 0.95 7.81 *90 D 8.09 4.66 0.00 2.72 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 7.87 4.64 0.00 2.68 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 92 L 7.91 4.12 0.00 1.75 1.70 0.96 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 93 L 8.18 4.03 0.00 1.81 1.81 0.94 1.02 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 94 G 7.80 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 95 I 7.65 3.79 1.88 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 1.65 1.11 0.92 0.00 0.00 96 N 8.42 4.44 0.00 2.89 2.90 0.00 0.00 6.70 6.25 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 97 L 8.28 4.14 0.00 2.15 1.75 1.11 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.86 3.91 0.00 1.76 1.81 0.00 1.87 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.38 1.32 7.81 99 V 7.64 3.79 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 1.14 0.00 0.00 0.99 0.00 0.00 100 M 8.37 4.10 0.00 2.24 2.43 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.96 0.00 101 E 7.82 2.83 0.00 1.40 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.47 0.00 102 Q 7.85 3.85 0.00 2.35 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 103 V 7.59 3.77 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 1.34 0.00 0.00 1.07 0.00 0.00 104 G 8.45 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 0.00 105 A 7.93 3.98 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 0.00 106 G 7.49 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 0.00 0.00 0.00 107 I 7.68 3.71 1.91 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 1.36 0.68 0.89 0.00 0.00 108 K 7.74 3.76 0.00 1.88 1.92 0.00 1.72 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.40 7.81 109 K 7.68 3.80 0.00 1.49 1.34 0.00 1.53 0.00 0.00 1.24 0.00 0.00 2.64 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.30 0.92 7.81 110 Y 8.02 4.65 0.00 3.18 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 0.00 111 A 8.28 5.05 1.29 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 0.00 0.00 0.00 112 P 0.00 4.29 0.00 2.18 2.32 0.00 3.77 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 113 E 8.05 4.39 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 114 A 7.78 4.45 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 0.00 115 F 8.72 4.44 0.00 1.51 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.51 4.58 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 0.88 0.00 0.00 0.83 0.00 0.00 117 I 8.50 4.55 1.75 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 0.85 -0.00 0.86 0.00 0.00 118 C 9.15 4.55 0.00 2.85 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 0.00 119 I 8.63 4.27 1.99 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 1.24 0.78 0.94 0.00 0.00 120 T 7.92 3.85 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 1.26 0.00 0.00 121 N 8.71 5.00 0.00 2.73 2.76 0.00 0.00 7.09 8.02 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 0.00 122 P 0.00 4.45 0.00 2.26 2.19 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.02 0.00 123 L 8.51 4.35 0.00 1.87 1.68 0.91 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 124 D 8.11 4.37 0.00 2.68 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 7.86 4.14 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 0.00 126 M 8.11 4.10 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.92 0.00 127 V 7.93 3.51 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 0.71 0.00 0.00 0.62 0.00 0.00 128 W 7.48 3.70 0.00 3.42 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 0.00 129 A 8.39 3.17 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 0.00 130 L 8.16 3.97 0.00 1.84 1.74 0.95 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 7.84 3.86 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.76 0.00 132 K 7.05 3.71 0.00 1.10 1.33 0.00 0.61 0.00 0.00 1.18 0.00 0.00 2.56 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.13 0.90 7.81 133 F 7.64 4.54 0.00 2.90 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 0.00 134 S 8.17 4.47 0.00 3.99 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 0.00 135 G 7.86 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 0.00 0.00 0.00 136 L 7.33 4.19 0.00 1.54 1.59 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 137 P 0.00 4.28 0.00 2.05 2.03 0.00 3.58 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 2.11 2.11 0.00 138 A 8.80 4.12 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 0.00 139 H 8.36 4.56 0.00 3.65 3.62 0.00 5.62 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 0.00 140 K 8.22 4.84 0.00 1.81 2.05 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.09 1.47 7.81 141 V 7.97 4.72 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.88 0.00 0.00 142 V 8.79 4.94 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 0.84 0.00 0.00 0.72 0.00 0.00 143 G 8.91 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 0.00 144 M 8.85 4.58 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.68 0.00 145 A 8.83 4.85 1.14 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 0.00 146 G 8.27 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 V 7.77 3.71 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 0.91 0.00 0.00 0.98 0.00 0.00 148 L 7.87 3.92 0.00 1.84 1.93 0.94 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 149 D 8.12 4.42 0.00 2.84 2.80 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 0.00 150 S 8.72 4.19 0.00 3.87 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 A 8.52 4.00 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 0.00 152 R 8.09 3.50 0.00 1.95 1.61 0.00 3.18 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.77 0.00 153 F 8.27 4.43 0.00 3.20 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 0.00 154 R 8.37 3.87 0.00 2.07 1.99 0.00 3.18 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 155 Y 8.01 4.05 0.00 2.99 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 0.00 156 F 7.87 4.30 0.00 3.32 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 8.42 3.95 0.00 1.92 1.95 0.61 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 158 S 8.35 4.25 0.00 4.31 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 0.00 159 E 7.69 3.86 0.00 1.96 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 2.17 1.58 0.00 160 E 7.59 3.89 0.00 1.80 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 1.79 1.60 0.00 161 F 7.94 4.73 0.00 3.20 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 0.00 162 N 7.85 4.18 0.00 2.79 2.78 0.00 0.00 6.93 7.64 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 0.00 163 V 7.38 4.58 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 0.97 0.00 0.00 1.11 0.00 0.00 164 S 8.50 4.25 0.00 3.88 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 0.00 165 V 8.45 3.80 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 0.97 0.00 0.00 0.98 0.00 0.00 166 E 8.34 4.09 0.00 1.98 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 2.37 2.30 0.00 167 D 8.19 4.73 0.00 2.77 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 0.00 168 V 7.52 4.85 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.09 0.00 0.00 169 T 9.06 4.79 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 170 V 8.36 4.70 1.77 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 -0.04 0.00 0.00 0.95 0.00 0.00 171 F 8.95 4.73 0.00 3.54 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 0.00 172 V 8.11 4.80 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 0.95 0.00 0.00 1.16 0.00 0.00 173 L 9.11 4.66 0.00 1.88 1.68 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 174 G 9.19 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 175 G 7.72 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 H 8.54 5.03 0.00 3.21 3.20 0.00 5.77 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 G 8.43 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 0.00 178 D 8.83 4.44 0.00 2.67 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 0.00 179 S 7.83 4.41 0.00 3.89 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 0.00 180 M 7.80 4.65 0.00 2.09 2.10 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 2.66 2.38 0.00 181 V 8.89 4.54 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 1.14 0.00 0.00 1.04 0.00 0.00 182 P 0.00 5.06 0.00 2.35 2.17 0.00 3.82 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 183 L 9.08 4.65 0.00 1.87 1.57 1.09 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 184 A 8.82 4.19 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 0.00 185 R 7.99 4.04 0.00 1.85 2.00 0.00 2.72 0.00 0.00 3.03 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.98 0.00 186 Y 7.75 5.04 0.00 2.56 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 0.00 187 S 8.30 5.15 0.00 3.97 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 T 9.05 5.11 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 189 V 8.37 4.65 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.78 0.00 0.00 190 A 9.87 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 0.00 191 G 8.55 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 0.00 192 I 7.61 4.03 1.58 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.61 0.62 0.00 0.00 193 P 0.00 4.95 0.00 2.21 2.30 0.00 3.61 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.97 0.00 194 L 8.54 4.01 0.00 1.81 1.90 1.04 1.08 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 0.00 195 P 0.00 4.27 0.00 2.14 2.10 0.00 3.55 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 196 D 8.12 4.33 0.00 2.71 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 0.00 197 L 7.56 3.48 0.00 1.76 1.44 0.25 -0.41 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 0.00 198 V 8.05 3.94 2.28 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 1.20 0.00 0.00 1.05 0.00 0.00 199 K 7.69 3.95 0.00 1.98 2.00 0.00 1.83 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.48 7.81 200 M 7.99 4.37 0.00 2.03 1.81 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 201 G 7.81 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 0.00 202 W 8.43 4.41 0.00 3.42 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 0.00 203 T 7.81 4.51 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 1.47 0.00 0.00 204 S 8.16 5.00 0.00 4.09 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 0.00 205 Q 8.54 4.02 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.95 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 206 D 8.04 4.42 0.00 2.73 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 0.00 207 K 8.12 4.02 0.00 1.97 1.82 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.44 7.81 208 L 8.12 4.00 0.00 1.87 1.92 1.18 1.21 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 0.00 209 D 8.68 4.44 0.00 2.86 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 0.00 210 K 7.97 4.00 0.00 1.79 1.81 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.35 7.81 211 I 7.91 3.81 2.08 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 1.47 0.51 1.21 0.00 0.00 212 I 7.92 3.20 1.96 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 1.06 0.99 0.81 0.00 0.00 213 Q 7.95 3.91 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 214 R 8.13 3.81 0.00 1.64 1.68 0.00 2.70 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.42 0.00 215 T 7.85 4.29 4.20 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 1.25 0.00 0.00 216 R 8.02 3.96 0.00 2.01 1.98 0.00 3.09 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.83 0.00 217 D 8.14 4.94 0.00 2.68 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 0.00 218 G 8.02 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 0.00 219 G 8.07 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 0.00 220 A 7.96 4.06 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 0.00 221 E 8.47 3.89 0.00 2.06 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 0.00 2.34 2.36 0.00 222 I 7.61 3.70 2.00 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 1.65 0.70 0.96 0.00 0.00 223 V 7.21 4.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 1.06 0.00 0.00 224 G 8.20 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 L 7.41 4.26 0.00 1.77 1.75 0.94 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 226 L 8.25 4.10 0.00 1.77 1.79 1.10 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 227 K 8.27 4.38 0.00 1.92 1.99 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.49 7.81 228 T 7.81 4.25 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 229 G 7.52 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 0.00 230 S 8.40 4.94 0.00 3.98 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 0.00 231 A 8.45 4.17 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 0.00 232 F 7.82 4.89 0.00 3.02 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 0.00 233 Y 7.33 4.03 0.00 2.84 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 0.00 234 A 7.91 4.01 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 0.00 235 P 0.00 4.23 0.00 2.21 2.14 0.00 3.67 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 2.25 2.16 0.00 236 A 8.20 4.00 1.47 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 0.00 0.00 0.00 237 A 8.34 3.98 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 0.00 238 S 8.24 4.05 0.00 4.12 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 0.00 239 A 8.11 4.06 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 0.00 240 I 8.05 3.74 2.03 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 1.60 0.97 0.94 0.00 0.00 241 Q 8.18 3.99 0.00 2.17 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 242 M 7.91 4.17 0.00 2.30 2.38 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.66 0.00 243 A 8.21 4.29 1.47 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 0.00 0.00 0.00 244 E 8.61 3.97 0.00 2.21 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 2.36 2.46 0.00 245 S 8.26 4.09 0.00 4.03 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 0.00 246 Y 7.90 3.88 0.00 2.47 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 0.00 247 L 8.13 4.06 0.00 1.72 1.75 1.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 248 K 7.94 4.30 0.00 1.83 1.80 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.41 7.81 249 D 7.40 4.25 0.00 2.57 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 0.00 250 K 8.11 4.07 0.00 1.75 1.80 0.00 2.00 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.39 7.81 251 K 7.93 4.21 0.00 1.94 1.88 0.00 1.90 0.00 0.00 0.75 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.32 7.81 252 R 7.66 4.12 0.00 1.80 1.87 0.00 3.28 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 253 V 8.26 4.59 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 0.80 0.00 0.00 0.94 0.00 0.00 254 L 9.15 4.95 0.00 1.58 1.52 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 255 P 0.00 4.91 0.00 2.04 2.05 0.00 3.71 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 256 V 8.70 4.68 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.03 0.00 0.00 257 A 9.00 4.89 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 0.00 258 A 8.81 4.94 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 Q 7.70 3.76 0.00 1.37 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 260 L 8.79 4.57 0.00 1.69 1.77 1.25 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 261 S 9.34 4.76 0.00 3.90 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 0.00 262 G 9.16 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 0.00 263 Q 8.10 4.36 0.00 2.30 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.24 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 264 Y 9.68 3.35 0.00 3.25 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 0.00 265 G 8.46 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 266 V 7.86 4.53 2.35 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 1.04 0.00 0.00 1.19 0.00 0.00 267 K 7.98 5.03 0.00 1.83 1.66 0.00 1.89 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.46 7.81 268 D 8.37 4.98 0.00 2.85 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 0.00 269 M 7.46 5.05 0.00 1.87 1.82 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 270 Y 8.86 4.69 0.00 3.01 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 271 V 8.86 4.43 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.88 0.00 0.00 272 G 8.62 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 0.00 0.00 0.00 0.00 273 V 9.03 5.01 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.07 0.00 0.00 274 P 0.00 4.89 0.00 2.08 1.86 0.00 3.69 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.65 0.00 275 T 9.05 5.13 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 0.00 276 V 8.65 4.52 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.95 0.00 0.00 277 I 8.70 4.89 1.91 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.71 0.92 0.00 0.00 278 G 8.43 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 279 A 8.53 3.32 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 280 N 8.53 4.86 0.00 2.65 2.80 0.00 0.00 7.28 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 281 G 8.18 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 282 V 9.12 3.76 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 0.83 0.00 0.00 1.10 0.00 0.00 283 E 9.00 4.51 0.00 2.00 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 2.28 2.48 0.00 284 R 7.76 4.65 0.00 1.85 1.72 0.00 3.16 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 285 I 8.35 4.71 1.92 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 1.40 0.78 1.04 0.00 0.00 286 I 8.74 4.17 2.12 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.54 1.06 0.00 0.00 287 E 9.09 4.48 0.00 1.65 1.58 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 1.85 1.47 0.00 288 I 8.17 4.48 2.03 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 1.80 1.04 1.11 0.00 0.00 289 D 8.40 4.58 0.00 2.67 2.61 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 0.00 290 L 8.09 4.77 0.00 1.57 1.52 0.61 1.04 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 0.00 291 D 8.95 4.66 0.00 2.84 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 0.00 292 K 8.57 3.89 0.00 1.78 1.88 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.12 7.81 293 D 8.07 4.57 0.00 2.71 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 294 E 8.93 3.98 0.00 2.14 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 2.32 2.38 0.00 295 K 8.55 4.10 0.00 1.93 1.99 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.13 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.69 7.81 296 A 8.04 4.05 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 0.00 297 Q 8.38 3.95 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.59 0.00 298 F 8.70 4.04 0.00 3.10 3.20 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 0.00 299 D 8.70 4.30 0.00 2.74 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 0.00 300 K 8.15 3.89 0.00 1.90 1.96 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.42 7.81 301 S 7.89 3.96 0.00 3.91 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 0.00 302 V 7.62 3.33 1.79 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 0.89 0.00 0.00 0.06 0.00 0.00 303 A 8.29 3.91 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 304 S 8.08 4.05 0.00 4.02 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 0.00 305 V 7.63 3.46 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 0.88 0.00 0.00 0.90 0.00 0.00 306 A 8.19 3.87 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 0.00 307 G 8.10 3.48 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 0.00 0.00 0.00 308 L 7.63 3.90 0.00 1.90 1.64 0.89 0.73 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 0.00 309 C 7.73 3.69 0.00 2.42 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 0.00 310 E 8.16 3.94 0.00 2.11 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 2.41 2.43 0.00 311 A 8.15 4.03 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 0.00 312 C 8.22 4.24 0.00 3.48 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 0.00 313 I 8.26 3.91 2.14 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 1.63 1.60 0.98 0.00 0.00 314 G 8.01 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 0.00 315 I 7.58 4.16 1.94 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 1.49 0.73 0.96 0.00 0.00 316 A 8.32 4.71 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 0.00 317 P 0.00 4.47 0.00 2.21 2.15 0.00 3.93 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 318 S 8.17 4.15 0.00 4.01 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 0.00 319 L 8.19 3.85 0.00 1.68 1.39 0.93 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 320 K 8.09 4.19 0.00 1.76 1.60 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.39 1.27 7.81 * Residues marked with a * may have inaccurate shift predictions.