NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -20 H 4.8505 8.4449 117.8269 56.1001 30.2060 171.8082 -19 H 4.7303 8.4187 116.8951 54.0235 31.3891 172.1768 -18 H 4.9749 8.4320 118.3731 54.1077 33.5691 172.3123 -17 H 4.5031 8.7979 121.8242 55.8839 30.8063 174.7195 -16 S 4.8154 8.2082 122.5928 56.7727 64.7530 173.6024 -15 S 5.1394 7.8951 118.5415 56.9574 64.1532 175.1702 -14 G 3.7615 8.9345 112.6928 48.8958 0.0000 175.4237 -13 V 3.9745 7.8192 117.7165 65.1597 31.5007 176.5309 -12 D 4.4807 8.1007 117.9617 55.3931 40.9078 176.1607 -11 L 4.1396 7.1776 120.9270 55.0395 42.1396 177.6688 -10 G 3.9538 8.8738 111.7936 45.5792 0.0000 173.7970 -9 T 4.2120 7.3428 108.5007 61.6868 69.5083 173.8316 -8 E 4.6398 8.4480 121.2031 56.0818 30.3735 176.1600 -7 N 4.7603 7.9916 115.6122 52.4715 38.7410 174.9500 -6 L 4.2586 8.4969 119.2553 57.5122 42.2950 177.6141 -5 Y 4.1519 7.9343 124.2756 56.7605 37.8557 175.1368 -4 F 5.1914 7.4860 125.0012 54.6124 38.8216 175.2304 -3 Q 3.1287 6.9100 119.4865 55.8602 27.9735 178.7080 -2 S 3.1113 8.5459 114.2973 60.3332 61.9981 171.9045 -20 A 4.4405 8.2649 123.4269 53.6001 20.3060 175.5081 -18 N 4.9849 8.4120 118.8731 52.2077 43.4691 173.4123 -17 E 4.1231 8.7979 123.8242 57.4839 31.7063 177.2195 -16 T 4.6954 8.0482 120.4928 60.2727 70.7530 173.7024 -15 E 5.0194 8.0051 123.0415 55.2574 30.2532 177.1702 -14 F 4.4215 8.9045 124.1928 61.4958 39.2562 176.3237 -13 Y 4.4045 7.9092 118.8165 60.8597 36.4007 176.1309 -12 A 4.1607 8.0007 121.3617 53.6931 18.9078 177.6607 -11 Y 4.3496 7.1376 119.4270 57.8395 37.5396 175.9688 -10 H 4.7238 8.9638 121.1936 55.4792 26.3126 172.9970 -9 I 4.0320 7.1928 114.8007 60.9868 38.5084 175.5316 -8 V 4.4098 8.0580 120.2031 61.6818 33.3735 175.8600 -7 T 4.3703 7.7416 110.5122 61.1715 69.6410 174.4500 -6 R 4.2586 8.5669 117.9553 58.4122 30.7950 176.3141 -5 K 3.9219 8.1043 124.3756 55.0605 33.1557 175.8368 -4 K 4.8914 7.4760 125.1012 53.1124 32.3216 176.0304 -2 H 3.3713 8.6559 116.7973 57.0332 27.1981 171.4045 19 I 3.5363 8.1560 120.4667 62.7299 37.9382 176.1574 20 G 3.9119 9.4336 116.8437 45.3951 0.0000 173.9156 21 Q 4.0394 7.3130 120.7450 55.3825 30.7148 173.7682 *23 I 4.3170 8.0577 116.5971 60.8541 38.6916 173.1088 24 P 5.1398 0.0000 0.0000 61.3410 33.2547 173.7072 25 F 4.5702 8.4971 121.7501 57.4905 37.8972 176.3735 *28 N 4.4875 9.3664 114.9412 52.5149 40.3234 172.4152 29 Q 4.4770 7.2707 116.1075 54.8613 31.2790 174.6866 30 H 4.5323 8.3267 119.3643 55.3847 29.9498 175.2298 31 N 4.9870 8.4286 120.6277 51.8165 40.8592 175.8895 32 T 3.9442 8.3910 115.6394 66.7825 68.4290 176.4647 33 L 3.6019 8.0365 121.8794 58.0934 42.1484 178.1251 34 Y 4.0028 8.5623 119.5735 60.9362 38.7333 177.5282 35 H 4.2435 8.2823 120.2821 58.9557 29.7591 177.3267 36 F 4.2488 8.1426 118.2547 60.0158 38.7576 177.0213 37 F 4.8796 8.2623 116.1010 58.7077 39.3306 177.1938 38 F 4.2885 8.4449 116.4103 58.0771 39.7986 176.6758 39 E 4.2541 7.5927 116.8924 58.1503 30.3410 176.5239 40 R 4.0203 7.3629 117.5819 56.5231 30.6404 174.9811 41 E 4.7887 8.2990 122.5200 54.8796 32.8787 174.1046 42 Q 4.6007 8.5849 120.7769 54.0722 31.6539 175.1448 43 L 4.8512 8.3645 121.9605 52.5880 44.9286 175.6087 44 N 4.7180 8.4986 117.8127 51.6788 38.9561 175.8489 45 A 4.0197 8.4267 120.0301 55.2547 18.4185 178.1599 46 N 4.5497 8.2696 110.8021 53.4885 38.8670 175.6837 47 G 3.8792 8.1959 106.5134 45.9707 0.0000 173.2616 48 E 4.4692 8.7710 119.6254 54.7083 31.1018 175.9873 49 D 5.0785 8.2024 122.7609 51.9322 42.6023 177.6810 50 G 3.4879 8.0926 105.5621 48.1021 0.0000 175.7898 51 I 3.5299 6.7689 121.4999 63.9964 37.1153 178.1872 52 Q 3.9333 8.1104 120.4017 59.0965 28.7331 178.3060 53 I 3.8919 7.7312 120.8750 64.2753 36.9255 178.1601 54 L 3.9996 7.7520 118.6590 58.1332 41.5255 179.1867 55 N 4.5876 8.2011 116.3126 56.2013 38.3652 176.7196 56 N 4.6046 8.2381 115.4996 54.4201 37.7727 175.6485 57 H 4.9811 7.7978 117.4857 55.0281 29.8937 173.9676 58 Y 4.8778 7.5685 122.6331 56.5382 37.9686 174.4236 59 K 4.2076 8.7771 126.3408 56.0473 36.6768 176.8200 60 N 3.7702 9.2731 119.6834 55.0531 36.8642 173.8059 61 D 4.6175 7.6490 115.0699 54.9824 39.0706 174.1599 62 E 4.7462 8.4031 118.4912 54.5109 32.9154 174.8887 63 L 5.1397 8.3424 123.0004 53.3956 42.4921 174.2538 64 H 4.9046 8.5594 120.4882 53.8602 29.2603 174.0640 65 I 4.5159 8.1332 124.7184 59.2916 40.0825 175.1197 66 N 5.1440 8.0290 119.8701 51.9825 43.5498 177.1511 67 N 4.0497 8.2835 117.7562 54.6053 38.0655 177.0786 68 E 3.9988 8.8953 125.9684 60.4054 29.2847 177.8511 69 N 4.2786 8.1845 115.9012 56.2274 38.6393 177.1163 70 A 3.9400 7.9059 121.8595 55.0552 18.4726 179.4022 71 K 3.8214 7.9459 118.1574 59.8501 32.1942 179.1155 72 V 3.6067 8.0193 118.4767 65.9529 31.2314 178.2466 73 V 3.6709 7.5382 116.9395 65.9198 31.4160 177.9063 74 I 3.9256 7.6726 119.0587 64.3863 37.2556 178.2750 75 S 4.3069 8.3253 115.2827 61.3658 62.6515 175.8706 76 Y 4.1876 7.9490 119.1281 58.5366 38.2199 176.9821 *78 D 4.3981 7.9449 119.0931 54.1214 42.9781 177.7107 79 Q 3.7756 8.0430 119.6105 59.3411 28.8612 178.3304 80 T 3.4907 7.5622 116.9257 66.3819 68.4653 176.6648 81 I 3.5768 7.3691 120.0088 63.8181 37.9968 178.0764 82 R 3.5965 7.2263 117.7360 58.8139 29.7000 178.7438 83 A 3.6637 7.7971 120.7132 54.7942 18.1528 179.5907 84 A 3.8171 7.9386 119.5358 55.0702 18.4459 179.7116 85 R 3.6422 7.6351 117.0232 59.8020 30.1459 178.7191 86 E 4.1801 8.2392 118.1710 59.5516 29.2135 179.5761 87 T 4.1830 8.0177 115.5253 66.6219 68.6521 176.6716 88 I 3.8892 7.7432 120.8475 64.4793 37.4729 178.3720 89 V 4.0230 7.9200 119.0887 65.8138 31.1791 177.5327 90 E 4.3365 8.3150 117.2601 56.8818 29.4391 178.4034 *92 V 4.2567 7.7731 119.1758 62.4622 33.7029 177.2953 93 R 3.3921 8.3451 119.7993 59.1618 30.0263 178.5138 94 L 3.9869 8.0480 116.9812 57.8263 41.9167 178.6995 95 Q 4.1145 8.1305 116.5135 58.4020 28.8291 176.8677 96 E 4.1342 8.1097 114.3492 56.1885 32.5058 176.2975 97 F 4.8414 7.8142 116.0347 54.5503 39.2878 174.3860 98 P 4.3508 0.0000 0.0000 64.3748 31.4253 177.4890 99 E 4.0786 7.5932 117.4087 58.4986 30.3197 176.5039 100 Y 4.5135 7.0388 116.3310 56.6951 38.5245 173.8054 101 P 4.3935 0.0000 0.0000 62.6555 32.3106 176.3576 102 S 4.5664 8.4636 116.0028 57.8871 63.0427 175.2199 103 R 4.2910 8.9617 125.3113 58.0832 30.2341 177.1176 104 L 4.6988 8.0766 117.7602 54.7422 42.3786 177.8984 105 S 4.7022 8.1293 110.1609 56.9128 64.7057 173.6335 106 C 4.5099 7.9284 115.6390 58.3766 30.2394 172.5581 107 L 4.8305 8.7940 120.5657 53.5951 44.5370 174.3430 108 Y 5.1754 8.6578 120.8275 56.5787 39.9641 174.7382 109 A 5.2623 9.0126 123.5341 50.7997 23.5421 174.4665 110 A 5.0377 8.4262 120.2764 50.2791 20.7543 177.5591 111 K 4.2138 9.0177 121.9942 58.6954 32.9078 177.5307 112 S 4.7997 7.7061 111.7856 55.6493 67.5876 174.1185 113 Y 3.4990 7.3908 122.1820 60.3804 37.9528 177.2890 114 E 3.6027 7.9799 119.7962 59.5537 29.6683 178.5383 115 D 4.2741 7.8751 117.9186 57.2381 40.7977 178.5324 116 A 4.2156 7.9956 121.3054 55.2842 18.3531 179.7159 117 L 3.8297 7.5876 117.4187 57.7518 41.6504 179.9075 118 K 3.9256 7.6200 117.4886 59.0792 31.9121 179.4486 119 W 4.3708 8.0976 119.3144 59.4815 28.8304 178.4111 120 K 3.7862 8.2793 119.5069 59.6112 31.7613 178.6676 121 A 3.9799 8.0262 120.8960 55.1293 18.0561 179.6268 122 L 4.1101 8.0565 117.4064 58.1356 41.7905 179.6788 123 F 4.1032 8.8911 117.8866 60.7305 38.9818 177.4426 124 D 4.4336 8.5852 118.7104 57.5839 40.3861 179.0558 125 S 4.1664 8.0111 114.5477 61.2090 62.7991 175.2045 126 Y 4.2485 7.7033 117.2879 56.9781 38.8154 175.2029 127 N 4.1132 7.8858 114.5285 54.7654 36.7229 175.5902 128 R 4.4972 8.0172 116.3403 53.9184 32.2407 175.8338 129 E 4.1425 8.7517 121.9838 56.1308 30.3572 176.5995 130 V 4.3076 8.2158 116.5680 60.5945 32.3160 176.0663 131 L 4.5203 8.7758 124.9924 57.2893 43.0612 176.5173 132 Q 5.1570 7.9823 114.0818 54.9802 33.1418 173.9475 133 I 5.2395 8.6851 122.5115 59.9802 39.7911 175.2386 134 V 4.9214 8.6027 119.7010 59.3257 35.1966 174.9054 135 K 4.5777 9.1689 124.9217 55.3220 33.6468 175.2953 136 L 5.2478 8.1968 126.2075 52.9048 44.8521 175.4635 137 R 4.6133 9.1149 123.2399 54.6317 32.1472 174.7229 138 V 4.4756 7.6563 125.8298 60.9666 33.8553 174.5150 139 I 4.9804 9.7820 128.9703 59.4118 38.9256 174.6706 140 G 4.2351 7.9135 118.0820 45.5825 0.0000 171.0468 141 S 4.9694 8.4066 120.5497 57.5419 67.0698 172.5023 142 S 5.7393 8.2318 113.0367 58.0170 66.0338 173.1964 143 F 4.6756 8.5027 121.1372 56.4856 42.9074 172.6546 144 E 4.4068 7.7755 126.8926 54.7176 30.0966 174.8793 145 G 3.8101 8.5401 114.6382 44.2593 0.0000 170.8147 146 D 5.2033 8.3312 120.7208 52.0416 42.3465 176.8334 147 G 3.7358 9.0560 116.6293 48.4154 0.0000 173.5304 148 N 4.4170 8.1300 117.0586 55.7902 38.9765 175.4678 149 L 4.3519 7.9837 116.8308 55.9218 42.3068 177.2561 150 L 3.8882 7.2885 118.0501 53.6061 42.0512 175.2766 151 P 4.7467 0.0000 0.0000 62.4170 31.7150 176.5978 152 K 4.3600 8.1344 120.5537 55.4841 34.0498 176.0766 153 E 4.3739 8.2668 118.0236 56.9490 29.3145 175.2491 154 D 4.9833 7.7596 117.0415 51.6664 42.4963 175.4392 155 G 4.1195 8.3018 105.4317 45.3812 0.0000 174.2982 156 I 3.9832 7.5970 112.4897 59.2911 38.7128 173.8563 157 P 4.4691 0.0000 0.0000 62.7564 31.9967 177.5478 158 F 4.2720 9.3360 120.9574 61.0702 38.8667 178.1853 159 S 4.2997 8.2670 113.2153 61.6890 62.7929 176.5311 160 Q 4.2429 8.1770 121.2719 58.6100 28.4739 178.6315 161 K 4.2144 7.9613 119.2007 59.3543 32.0790 179.2838 162 I 3.7843 8.2742 120.6962 64.3966 37.0168 178.2167 163 E 4.0490 8.1303 118.9454 59.6145 29.4212 179.4651 164 Q 4.0199 8.1237 117.5822 58.9531 28.7823 178.7054 165 A 4.0573 8.2297 121.7727 55.1601 18.5139 179.9229 166 R 4.2085 8.2374 116.6104 59.5285 29.9942 179.3295 167 K 4.0284 7.9162 116.9870 59.5647 32.3551 178.3331 168 Y 4.2095 8.2163 119.7822 60.7796 38.5264 178.5336 169 W 3.7773 7.7485 117.7911 58.9005 29.0471 177.9725 170 K 4.5724 7.7854 116.4721 56.2874 31.7731 177.0697 171 G 3.8652 7.5911 110.1285 44.3937 0.0000 174.4323 172 N 4.6007 8.4222 121.2035 52.1935 36.8333 173.8679 *176 E 4.0552 8.4302 116.1897 55.9880 29.7989 176.1196 177 L 4.3531 8.1328 119.4034 52.2922 41.4347 174.5749 178 P 4.6935 0.0000 0.0000 62.7290 32.4732 175.4699 179 E 4.6920 9.3880 123.5175 54.5841 31.7544 174.6809 180 L 4.7698 8.8532 128.3469 54.3309 43.4542 175.9925 181 L 4.9913 9.2146 124.3739 53.3015 43.7698 175.6825 182 I 5.3406 8.7410 116.9887 59.2371 41.2184 173.9963 183 N 5.0770 9.1272 121.4525 51.0483 40.9159 171.8139 184 G 3.8004 7.9696 101.6417 44.1034 0.0000 172.2829 185 E 4.7802 9.3987 122.1398 55.1856 31.1362 175.5264 186 I 4.8807 8.2664 125.5455 59.3175 40.0328 174.8333 187 E 4.8287 8.9424 127.3362 54.1615 33.1320 174.6984 188 V 4.2868 8.8654 127.5606 63.0518 32.1294 176.3325 189 V 4.3891 8.0677 120.7469 60.8554 32.9249 175.6767 190 E 4.5649 7.5967 118.2401 55.5456 32.9088 174.7227 191 I 4.3442 8.4681 128.2365 60.1584 36.8951 175.6428 192 I 3.7975 8.4359 128.1348 63.7549 37.8319 176.4153 193 D 4.6018 8.3136 121.7323 52.3459 44.0586 174.5005 194 D 5.0027 8.4821 123.5748 53.0694 42.2004 176.6086 195 F 4.5846 8.8073 122.1219 57.5426 38.8181 175.8215 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 -20 H 8.44 4.85 0.00 3.10 3.23 0.00 5.61 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -19 H 8.42 4.73 0.00 3.10 3.17 0.00 5.84 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -18 H 8.43 4.97 0.00 3.07 3.14 0.00 5.69 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 -17 H 8.80 4.50 0.00 3.13 3.23 0.00 5.71 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -16 S 8.21 4.82 0.00 3.85 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 -15 S 7.90 5.14 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 -14 G 8.93 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 -13 V 7.82 3.97 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 1.12 0.00 0.00 0.93 0.00 0.00 -12 D 8.10 4.48 0.00 2.80 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -11 L 7.18 4.14 0.00 1.74 1.51 0.87 0.88 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 -10 G 8.87 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 -9 T 7.34 4.21 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 -8 E 8.45 4.64 0.00 1.93 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 2.17 2.35 0.00 -7 N 7.99 4.76 0.00 2.91 2.85 0.00 0.00 6.22 7.79 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 -6 L 8.50 4.26 0.00 1.76 1.84 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 -5 Y 7.93 4.15 0.00 2.95 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -4 F 7.49 5.19 0.00 3.04 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 -3 Q 6.91 3.13 0.00 0.93 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.01 0.00 0.00 0.00 0.00 0.00 1.99 1.89 0.00 -2 S 8.55 3.11 0.00 3.94 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -20 A 8.26 4.44 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 -18 N 8.41 4.98 0.00 2.61 2.73 0.00 0.00 6.93 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 -17 E 8.80 4.12 0.00 1.90 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 2.28 2.27 0.00 -16 T 8.05 4.70 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 -15 E 8.01 5.02 0.00 2.20 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 0.00 2.36 2.17 0.00 -14 F 8.90 4.42 0.00 2.93 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 -13 Y 7.91 4.40 0.00 3.02 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 -12 A 8.00 4.16 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 -11 Y 7.14 4.35 0.00 3.15 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 -10 H 8.96 4.72 0.00 3.11 3.56 0.00 7.09 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -9 I 7.19 4.03 1.84 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 1.41 0.65 0.87 0.00 0.00 -8 V 8.06 4.41 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 0.79 0.00 0.00 0.93 0.00 0.00 -7 T 7.74 4.37 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 -6 R 8.57 4.26 0.00 2.00 1.98 0.00 3.21 0.00 0.00 3.15 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 -5 K 8.10 3.92 0.00 1.76 1.72 0.00 0.61 0.00 0.00 1.76 0.00 0.00 2.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.48 7.81 -4 K 7.48 4.89 0.00 1.74 1.63 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.43 7.81 -2 H 8.66 3.37 0.00 3.34 3.10 0.00 7.23 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 8.16 3.54 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.68 0.93 0.00 0.00 20 G 9.43 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 Q 7.31 4.04 0.00 1.68 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.62 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 *23 I 8.06 4.32 1.86 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 1.38 0.92 0.91 0.00 0.00 24 P 0.00 5.14 0.00 1.93 1.98 0.00 3.48 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 1.86 2.03 0.00 25 F 8.50 4.57 0.00 2.93 2.60 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 *28 N 9.37 4.49 0.00 2.58 2.67 0.00 0.00 6.69 7.08 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 29 Q 7.27 4.48 0.00 1.89 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.82 0.00 0.00 0.00 0.00 0.00 2.17 2.09 0.00 30 H 8.33 4.53 0.00 2.93 2.96 0.00 5.70 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 N 8.43 4.99 0.00 3.11 3.21 0.00 0.00 7.13 6.58 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 32 T 8.39 3.94 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 1.52 0.00 0.00 33 L 8.04 3.60 0.00 1.63 1.91 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 8.56 4.00 0.00 3.13 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 35 H 8.28 4.24 0.00 3.26 3.17 0.00 5.88 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 36 F 8.14 4.25 0.00 2.84 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 37 F 8.26 4.88 0.00 3.28 2.78 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 38 F 8.44 4.29 0.00 1.91 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 7.59 4.25 0.00 1.94 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 2.40 2.20 0.00 40 R 7.36 4.02 0.00 1.63 2.02 0.00 3.45 0.00 0.00 3.44 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 41 E 8.30 4.79 0.00 1.94 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 0.00 2.24 2.42 0.00 42 Q 8.58 4.60 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 43 L 8.36 4.85 0.00 1.61 1.65 0.93 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.50 4.72 0.00 2.88 2.98 0.00 0.00 7.28 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.43 4.02 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 46 N 8.27 4.55 0.00 2.86 2.87 0.00 0.00 6.98 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.20 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 48 E 8.77 4.47 0.00 2.07 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 2.25 2.31 0.00 49 D 8.20 5.08 0.00 2.78 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 50 G 8.09 3.49 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 0.00 0.00 0.00 51 I 6.77 3.53 1.70 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 1.41 0.36 0.83 0.00 0.00 52 Q 8.11 3.93 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 53 I 7.73 3.89 1.97 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.02 0.89 0.00 0.00 54 L 7.75 4.00 0.00 1.73 1.70 0.90 0.97 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 55 N 8.20 4.59 0.00 2.75 2.89 0.00 0.00 6.88 6.21 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 56 N 8.24 4.60 0.00 2.80 2.91 0.00 0.00 6.96 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 7.80 4.98 0.00 3.17 3.41 0.00 5.65 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 58 Y 7.57 4.88 0.00 2.90 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 K 8.78 4.21 0.00 1.73 1.53 0.00 1.76 0.00 0.00 1.54 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.37 7.81 60 N 9.27 3.77 0.00 2.68 2.92 0.00 0.00 7.12 8.47 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 61 D 7.65 4.62 0.00 2.86 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 62 E 8.40 4.75 0.00 1.93 1.48 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 2.14 2.32 0.00 63 L 8.34 5.14 0.00 1.61 1.57 1.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 64 H 8.56 4.90 0.00 3.17 3.23 0.00 5.71 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 I 8.13 4.52 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.61 0.76 0.00 0.00 66 N 8.03 5.14 0.00 2.72 2.65 0.00 0.00 7.18 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 N 8.28 4.05 0.00 2.88 2.02 0.00 0.00 6.84 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 E 8.90 4.00 0.00 2.01 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 2.40 2.40 0.00 69 N 8.18 4.28 0.00 2.83 2.78 0.00 0.00 7.02 8.11 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 70 A 7.91 3.94 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 71 K 7.95 3.82 0.00 1.86 1.99 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.47 7.81 72 V 8.02 3.61 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 0.98 0.00 0.00 0.99 0.00 0.00 73 V 7.54 3.67 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 0.91 0.00 0.00 0.94 0.00 0.00 74 I 7.67 3.93 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 1.78 0.92 0.90 0.00 0.00 75 S 8.33 4.31 0.00 4.06 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 76 Y 7.95 4.19 0.00 3.19 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *78 D 7.94 4.40 0.00 2.93 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 79 Q 8.04 3.78 0.00 2.02 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.81 0.00 0.00 0.00 0.00 0.00 2.18 2.38 0.00 80 T 7.56 3.49 3.74 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 0.99 0.00 0.00 81 I 7.37 3.58 1.76 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 1.57 1.12 0.83 0.00 0.00 82 R 7.23 3.60 0.00 1.29 0.66 0.00 2.87 0.00 0.00 2.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.28 0.00 83 A 7.80 3.66 0.73 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 84 A 7.94 3.82 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 85 R 7.64 3.64 0.00 1.84 1.99 0.00 3.06 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 86 E 8.24 4.18 0.00 2.50 2.33 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 2.77 2.98 0.00 87 T 8.02 4.18 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 1.38 0.00 0.00 88 I 7.74 3.89 1.93 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.31 0.87 0.00 0.00 89 V 7.92 4.02 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 1.02 0.00 0.00 0.83 0.00 0.00 90 E 8.31 4.34 0.00 2.38 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 0.00 2.39 2.45 0.00 *92 V 7.77 4.26 2.43 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 1.38 0.00 0.00 1.15 0.00 0.00 93 R 8.35 3.39 0.00 1.75 1.94 0.00 3.10 0.00 0.00 2.96 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.50 0.00 94 L 8.05 3.99 0.00 1.67 1.70 0.95 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 95 Q 8.13 4.11 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 96 E 8.11 4.13 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.33 0.00 97 F 7.81 4.84 0.00 2.40 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 P 0.00 4.35 0.00 2.07 2.06 0.00 3.54 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.80 0.00 99 E 7.59 4.08 0.00 2.03 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 1.81 2.02 0.00 100 Y 7.04 4.51 0.00 2.51 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 0.00 101 P 0.00 4.39 0.00 2.12 2.00 0.00 3.86 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 2.12 2.24 0.00 102 S 8.46 4.57 0.00 3.91 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 0.00 103 R 8.96 4.29 0.00 2.07 2.27 0.00 3.01 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.97 0.00 104 L 8.08 4.70 0.00 1.77 1.70 0.81 0.68 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 0.00 105 S 8.13 4.70 0.00 4.09 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 0.00 106 C 7.93 4.51 0.00 3.10 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 0.00 107 L 8.79 4.83 0.00 1.74 1.50 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 108 Y 8.66 5.18 0.00 2.84 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 0.00 109 A 9.01 5.26 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 0.00 110 A 8.43 5.04 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 K 9.02 4.21 0.00 1.80 1.93 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.46 7.81 112 S 7.71 4.80 0.00 3.95 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 0.00 113 Y 7.39 3.50 0.00 2.30 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 0.00 114 E 7.98 3.60 0.00 1.98 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 2.27 2.31 0.00 115 D 7.88 4.27 0.00 2.97 2.81 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 0.00 116 A 8.00 4.22 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 0.00 117 L 7.59 3.83 0.00 1.66 1.56 0.65 0.75 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 0.00 118 K 7.62 3.93 0.00 1.68 1.58 0.00 1.48 0.00 0.00 1.47 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.48 7.81 119 W 8.10 4.37 0.00 3.48 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.28 3.79 0.00 1.85 1.92 0.00 1.32 0.00 0.00 1.44 0.00 0.00 2.65 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.20 7.81 121 A 8.03 3.98 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 0.00 122 L 8.06 4.11 0.00 2.31 2.01 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 123 F 8.89 4.10 0.00 3.24 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 8.59 4.43 0.00 2.85 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 0.00 125 S 8.01 4.17 0.00 4.16 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 0.00 126 Y 7.70 4.25 0.00 2.78 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 0.00 127 N 7.89 4.11 0.00 2.85 2.85 0.00 0.00 6.63 6.96 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 0.00 128 R 8.02 4.50 0.00 1.69 1.85 0.00 2.99 0.00 0.00 2.91 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.64 0.00 129 E 8.75 4.14 0.00 2.11 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 2.31 2.38 0.00 130 V 8.22 4.31 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 0.70 0.00 0.00 0.62 0.00 0.00 131 L 8.78 4.52 0.00 1.69 1.78 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 132 Q 7.98 5.16 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.72 0.00 0.00 0.00 0.00 0.00 2.48 2.43 0.00 133 I 8.69 5.24 2.16 0.00 0.00 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 1.40 1.20 1.24 0.00 0.00 134 V 8.60 4.92 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 0.72 0.00 0.00 1.00 0.00 0.00 135 K 9.17 4.58 0.00 1.68 1.50 0.00 1.51 0.00 0.00 1.25 0.00 0.00 2.13 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.00 0.66 7.81 136 L 8.20 5.25 0.00 1.45 1.44 0.86 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 137 R 9.11 4.61 0.00 1.96 1.74 0.00 2.90 0.00 0.00 3.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.20 0.00 138 V 7.66 4.48 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 0.65 0.00 0.00 0.55 0.00 0.00 139 I 9.78 4.98 1.81 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 1.05 0.62 0.88 0.00 0.00 140 G 7.91 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 0.00 0.00 0.00 0.00 141 S 8.41 4.97 0.00 3.90 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 0.00 142 S 8.23 5.74 0.00 3.81 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 0.00 143 F 8.50 4.68 0.00 2.81 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 E 7.78 4.41 0.00 1.73 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 1.95 2.14 0.00 145 G 8.54 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 D 8.33 5.20 0.00 2.77 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 0.00 147 G 9.06 3.74 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 0.00 0.00 0.00 148 N 8.13 4.42 0.00 2.70 2.98 0.00 0.00 7.20 8.32 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 0.00 149 L 7.98 4.35 0.00 1.96 1.80 0.99 1.03 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 0.00 150 L 7.29 3.89 0.00 1.55 1.35 0.70 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 151 P 0.00 4.75 0.00 1.90 1.89 0.00 3.53 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.23 0.00 152 K 8.13 4.36 0.00 2.01 1.72 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.37 7.81 153 E 8.27 4.37 0.00 1.88 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 154 D 7.76 4.98 0.00 2.71 2.62 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 0.00 155 G 8.30 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 0.00 156 I 7.60 3.98 1.90 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 1.43 0.67 0.92 0.00 0.00 157 P 0.00 4.47 0.00 2.26 2.06 0.00 3.66 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 2.14 2.14 0.00 158 F 9.34 4.27 0.00 2.99 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 S 8.27 4.30 0.00 4.10 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 0.00 160 Q 8.18 4.24 0.00 2.36 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 161 K 7.96 4.21 0.00 1.81 1.69 0.00 1.24 0.00 0.00 1.51 0.00 0.00 3.22 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.65 7.81 162 I 8.27 3.78 2.11 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.77 1.00 0.00 0.00 163 E 8.13 4.05 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.66 0.00 164 Q 8.12 4.02 0.00 2.31 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 165 A 8.23 4.06 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 R 8.24 4.21 0.00 2.23 2.21 0.00 3.25 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.08 0.00 167 K 7.92 4.03 0.00 1.98 1.93 0.00 1.76 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.65 7.81 168 Y 8.22 4.21 0.00 3.05 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 W 7.75 3.78 0.00 2.49 1.74 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 0.00 170 K 7.79 4.57 0.00 2.00 1.96 0.00 1.84 0.00 0.00 1.85 0.00 0.00 3.24 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.77 1.87 7.81 171 G 7.59 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 0.00 172 N 8.42 4.60 0.00 2.80 2.51 0.00 0.00 6.19 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *176 E 8.43 4.06 0.00 1.94 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 2.17 2.23 0.00 177 L 8.13 4.35 0.00 1.32 1.25 0.57 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 178 P 0.00 4.69 0.00 2.15 2.01 0.00 3.90 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 179 E 9.39 4.69 0.00 2.17 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 2.43 2.16 0.00 180 L 8.85 4.77 0.00 1.90 1.62 0.90 0.35 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 0.00 181 L 9.21 4.99 0.00 1.69 1.58 1.28 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 182 I 8.74 5.34 2.01 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 1.50 1.34 1.13 0.00 0.00 183 N 9.13 5.08 0.00 2.33 2.84 0.00 0.00 6.90 6.55 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 0.00 184 G 7.97 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 0.00 185 E 9.40 4.78 0.00 1.83 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 186 I 8.27 4.88 1.85 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 1.02 0.58 0.84 0.00 0.00 187 E 8.94 4.83 0.00 1.95 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 2.16 2.19 0.00 188 V 8.87 4.29 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 0.89 0.00 0.00 0.89 0.00 0.00 189 V 8.07 4.39 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 0.74 0.00 0.00 0.88 0.00 0.00 190 E 7.60 4.56 0.00 1.89 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 0.00 2.10 2.15 0.00 191 I 8.47 4.34 1.84 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 1.34 0.70 0.98 0.00 0.00 192 I 8.44 3.80 1.97 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.46 0.28 0.00 0.00 193 D 8.31 4.60 0.00 2.36 1.54 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 0.00 194 D 8.48 5.00 0.00 2.45 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 0.00 195 F 8.81 4.58 0.00 3.12 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 * Residues marked with a * may have inaccurate shift predictions.