NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.4074 8.3349 115.4060 57.8547 64.3794 172.8040 4 R 4.1737 8.1136 119.8186 55.3756 31.1516 175.0480 5 I 4.0855 9.2578 125.5420 60.2357 38.8968 173.5279 6 P 4.9087 0.0000 0.0000 62.6524 32.6314 175.5644 7 V 5.0173 9.1696 123.8141 61.0887 35.3006 174.0879 8 V 4.9511 8.8197 126.6805 61.1464 34.4005 173.9052 9 L 5.1919 9.1405 127.8676 52.9896 44.1911 174.9385 10 L 5.2093 8.9034 125.8261 53.1577 44.7360 174.6051 11 A 5.1193 9.4480 128.5617 50.5345 21.3857 174.5348 12 C 5.2091 8.6020 120.7321 58.7307 30.1998 173.6669 13 G 3.5724 8.3324 109.4815 46.0602 0.0000 174.4304 14 S 4.0882 8.6299 115.4332 60.3354 63.5621 175.1120 15 F 3.6689 7.0083 116.6949 58.8673 36.3750 175.2410 16 N 5.3636 7.8708 118.2432 50.3188 39.1214 170.4444 17 P 5.1649 0.0000 0.0000 59.9670 34.1532 175.7746 18 I 4.2021 8.2429 118.7345 61.3976 38.6195 174.9917 19 T 4.8112 8.3896 115.6665 59.2874 73.2287 174.6472 20 N 4.4355 8.8665 118.0515 56.4149 38.3369 177.5647 21 M 4.3012 7.8804 120.8331 58.3973 32.2132 177.7064 22 H 4.4125 7.7532 115.4217 59.0045 29.1005 177.5262 23 L 4.2479 7.9969 120.2708 57.8941 41.4815 179.4735 24 R 3.9808 8.5359 119.1022 59.5161 29.9436 177.9497 25 M 4.0203 8.3187 118.1548 58.8852 32.0675 178.2880 26 F 4.1978 8.2601 117.7581 60.6600 39.0953 177.5018 27 E 4.3156 8.5354 117.7858 59.5274 29.2843 179.4911 28 V 3.6035 8.1834 118.0627 65.8984 31.5717 177.8054 29 A 3.9794 8.1308 120.5374 55.2185 18.1694 179.5798 30 R 3.6420 8.3756 117.2665 59.6938 30.0563 178.4327 31 D 4.2852 8.0633 118.6798 57.4891 40.6393 178.2893 32 H 4.0877 8.4539 118.8464 59.3283 29.7005 177.2833 33 L 3.9284 7.8260 119.4354 58.2507 41.7545 179.0312 34 H 4.5788 8.3999 116.2129 58.8707 28.3581 177.6292 35 Q 4.0232 8.1460 121.2986 59.2551 28.8989 178.1903 36 T 4.0078 7.4158 110.2741 62.9156 68.8570 175.6332 37 G 3.9568 8.1047 109.0678 45.3505 0.0000 173.5242 38 M 4.2481 7.9929 118.1481 55.6523 33.4078 175.3317 39 Y 5.2657 7.9197 114.7611 56.0388 42.4721 175.0800 40 Q 4.4170 9.1271 122.4135 54.1118 31.7160 174.4503 41 V 4.3458 8.7784 127.7570 63.0441 31.4828 175.4106 42 I 4.4710 9.0738 121.4950 61.5038 39.4846 175.4575 43 Q 5.0928 8.1086 122.4061 55.0226 32.5335 172.9586 44 G 4.4575 9.2557 111.7468 44.4504 0.0000 171.7593 45 I 5.0283 9.1702 123.8151 59.3686 41.0510 174.3128 46 I 4.5681 8.5223 128.7395 59.9907 38.7825 174.8374 47 S 4.9417 9.1724 122.2710 55.4521 64.1108 170.9189 48 P 5.1020 0.0000 0.0000 62.3072 31.7956 176.9254 49 V 4.1012 8.5828 123.8194 61.4309 32.5018 175.7691 50 N 4.5770 8.7844 120.2902 53.4920 39.5331 175.8182 51 D 4.5401 8.6486 123.2098 57.2861 41.0562 177.8014 52 T 4.1252 8.2167 107.8854 62.9438 69.1929 174.4288 53 Y 3.8200 7.8223 123.9410 58.2121 39.3005 176.4309 54 G 3.2949 6.9043 115.3086 44.8510 0.0000 173.4157 55 K 4.2719 8.0830 115.2658 55.7888 32.5312 176.3456 56 K 4.3395 7.4805 119.9504 55.0180 33.7601 175.9247 57 D 4.7092 8.2770 122.8474 52.8136 40.1507 176.0759 58 L 4.4981 8.0640 123.4687 53.0469 43.0595 177.2483 59 A 4.0940 8.7444 124.8326 51.6598 19.1762 177.6204 60 A 4.1479 8.4797 122.8958 52.2621 19.2645 179.0198 61 S 4.1924 9.4366 117.7846 62.1572 62.8036 177.0723 62 H 4.2833 8.1946 117.9311 58.6153 28.1452 177.2799 63 H 4.3434 7.7905 120.3805 58.2423 28.5719 177.9607 64 R 3.9483 7.8258 119.4475 59.0564 29.9150 179.1688 65 V 3.5014 8.2581 118.4763 65.7925 31.5325 177.9551 66 A 3.8469 7.8886 120.5215 55.4121 18.1841 179.5619 67 M 3.6636 7.7791 117.0065 58.2337 31.9492 178.8584 68 A 3.8635 7.8181 120.9811 55.0314 18.2962 179.6214 69 R 3.7068 7.7323 116.1551 59.4657 30.5228 178.4098 70 L 4.0670 7.9399 118.5154 57.8393 41.4274 179.3420 71 A 4.0137 8.1588 119.7384 54.7108 18.4995 178.6998 72 L 4.2147 7.7265 115.2434 55.1365 41.7419 178.6464 73 Q 3.9772 7.7000 119.0971 58.7888 28.7246 177.3324 74 T 4.2458 7.6330 106.8297 61.7530 69.4933 174.0543 75 S 4.6161 7.9173 118.2420 57.3094 63.4040 173.2035 76 D 4.9117 8.7967 125.4951 53.0106 39.7261 176.5080 77 W 5.2986 7.7618 114.5575 55.9707 30.8437 174.1542 78 I 4.4358 7.2972 122.0795 59.2402 38.4088 175.2047 79 R 4.6678 8.6303 122.5791 54.2848 33.3208 174.2489 80 V 4.4757 8.1057 119.3559 60.4812 33.4064 174.9061 81 D 4.9309 8.7179 123.2114 51.5298 42.9575 174.4144 82 P 4.4738 0.0000 0.0000 63.7249 31.1106 177.4221 83 W 4.2823 8.6381 129.6802 61.1164 30.2865 176.9073 84 E 3.5313 8.6327 117.4951 59.4626 29.1404 178.7345 85 S 4.2630 7.9656 111.6785 60.5695 63.4524 175.0986 86 E 4.2113 7.6513 120.3991 56.1786 29.7672 176.6093 87 Q 3.8623 6.4637 117.5851 55.0564 29.4329 176.2340 88 A 4.0327 8.3398 122.7998 54.8304 18.5430 177.3795 89 Q 4.5891 7.3822 113.5010 53.4366 32.6244 173.8327 90 W 4.4551 8.7747 131.0207 58.0995 31.1630 175.0425 91 M 4.1384 6.4514 120.3741 52.9269 35.7302 175.2596 92 E 3.2922 7.5766 121.7453 56.2839 30.5651 178.3138 93 T 3.9133 8.3947 118.4423 66.7532 68.4697 177.3260 94 V 3.6558 7.8095 120.6620 64.7367 31.3506 178.4438 95 K 4.0217 7.8987 118.5617 58.9438 31.8588 179.4485 96 V 3.8662 7.5855 118.4367 65.6671 31.4618 177.9392 97 L 3.7223 7.8819 118.9142 57.5469 41.3388 179.5588 98 R 4.0745 7.9666 118.0172 59.5380 30.0651 178.4247 99 H 3.7847 8.0174 117.7889 59.7458 29.8322 177.0863 100 H 3.9321 8.0168 117.6070 58.5883 28.1837 177.3820 101 H 4.2100 8.2010 119.9512 59.2981 30.0601 177.1115 102 S 4.1487 8.0282 116.8294 61.7060 62.7910 176.6410 103 K 3.7611 7.6947 120.9321 59.7699 31.5390 179.2012 104 L 4.0229 7.4989 117.6865 57.4958 41.5152 178.9949 105 L 4.1145 8.1352 118.2995 55.1906 41.9045 177.9436 106 R 4.1738 7.4741 118.6019 56.4203 29.8198 176.8275 *127 V 3.8842 7.3860 114.4385 61.9106 32.3860 172.8568 128 P 4.7880 0.0000 0.0000 62.3644 32.4356 175.6842 129 E 4.4356 9.3416 122.9796 55.9515 31.0774 175.2236 130 L 5.0703 8.6683 125.7984 53.6429 43.6206 175.5467 131 K 4.9115 8.9201 125.2097 54.4002 36.2837 175.0559 132 L 4.5816 8.8799 126.5833 54.5857 43.4559 174.9397 133 L 5.1555 8.9679 129.2562 53.5693 43.5482 175.0172 134 C 4.6907 8.8234 120.0009 56.9843 33.6893 173.7281 135 G 4.1671 8.7782 107.3647 43.9523 0.0000 174.6813 136 A 3.9256 8.6484 122.5830 54.9377 17.6403 179.9489 137 D 4.0197 7.9569 117.2583 56.4880 39.1972 178.9961 138 V 3.4465 7.7764 120.0889 65.6980 31.1904 177.8810 139 L 2.7916 7.2939 118.3438 57.2903 41.3627 179.4734 140 K 3.1580 7.2719 118.7875 59.1285 31.9865 178.9976 141 T 4.0293 7.6126 110.0194 64.4450 68.4656 176.4706 142 F 4.2938 7.0707 119.7862 60.3285 38.8783 176.8494 143 Q 4.3385 7.7780 116.3269 56.6855 29.0263 176.3972 144 T 4.0044 7.7625 118.7057 62.5554 68.8024 172.0301 145 P 4.3742 0.0000 0.0000 64.5006 31.6529 176.4563 146 N 4.3192 9.0061 117.6762 53.7833 36.9932 175.1542 147 L 4.1025 8.2367 120.4026 56.9291 42.3926 177.1063 148 W 4.9733 8.0247 116.6966 53.8968 32.2704 175.7810 149 K 4.1717 8.7187 123.0320 56.2162 33.0719 177.5425 150 D 4.3696 8.9316 123.7502 57.7957 40.8399 179.0960 151 A 4.0075 8.0491 120.3694 55.5199 18.2275 179.3471 152 H 4.2993 8.0639 114.2162 58.9973 29.1037 177.7140 153 I 3.2734 7.8300 121.6563 64.2983 36.9159 178.0750 154 Q 3.8535 8.2280 120.4818 59.2935 28.8452 178.0894 155 E 3.9049 8.3063 120.1588 59.2388 29.6759 178.7040 156 I 3.9552 8.1008 120.1153 64.5418 37.0932 178.2569 157 V 4.1093 7.4681 109.4375 62.0866 31.7697 176.9673 158 E 4.2919 7.7754 118.3907 57.5375 30.5480 176.5481 159 K 3.9613 7.8626 118.6003 58.1450 33.4886 176.9295 160 F 4.9460 6.8909 114.8255 57.0605 41.2892 176.7360 161 G 4.2671 8.6331 114.7298 46.5233 0.0000 170.4462 162 L 5.2274 9.1739 121.7377 53.1527 45.5724 175.0130 163 V 4.7698 9.0486 126.7327 61.2812 34.0766 173.4714 164 C 5.2337 9.3535 129.0039 57.6225 33.9337 172.3189 165 V 4.6759 8.4025 126.4619 60.8393 33.0570 175.4475 166 G 4.1280 8.3737 115.1810 46.9679 0.0000 173.0626 167 R 4.7588 8.2768 118.9799 53.8065 34.3123 175.0734 168 V 3.6500 8.0096 124.2195 65.6879 31.7562 177.1363 *169 S 4.3642 9.0071 121.6051 58.1076 60.2110 166.2503 170 H 4.9908 7.8605 116.1789 55.0003 31.2021 173.8967 171 D 4.5916 7.4180 122.7145 50.8274 41.0073 174.0306 172 P 4.0551 0.0000 0.0000 65.1399 31.5565 177.7623 173 K 3.9950 7.9792 116.6843 59.4236 31.8525 179.4858 174 G 3.5305 7.8425 106.1060 47.8452 0.0000 175.3521 175 Y 4.4424 7.4367 118.2469 61.0072 38.1907 178.7167 176 I 3.9098 8.1342 120.4558 64.5169 37.0897 178.3195 177 A 4.0632 7.9773 120.1291 55.0118 18.2736 178.6693 178 E 4.4006 8.4039 114.5521 55.8969 30.2114 176.1994 179 S 4.6666 7.6252 116.0569 55.8484 63.2406 172.5814 180 P 4.2857 0.0000 0.0000 66.2052 30.9217 178.3036 181 I 3.9349 7.6268 118.7192 64.1267 37.2797 178.0671 182 L 4.0604 7.9948 120.0254 57.8661 41.2936 179.8679 183 R 3.9816 7.9952 114.5273 59.0776 29.3515 177.9375 184 M 4.3267 7.6484 117.2285 56.1189 32.6481 175.7908 185 H 5.0299 8.2301 117.5264 55.3287 30.3195 175.7708 186 Q 4.0866 8.3215 120.4240 59.0356 28.9111 178.6638 187 H 4.1388 8.3173 116.6805 58.6491 30.1835 175.1259 188 N 4.9700 8.3860 115.3889 52.7970 39.7573 174.2030 189 I 4.8855 7.5313 120.4515 59.7796 39.7837 174.6734 190 H 4.8199 9.3002 124.8499 53.9536 31.3743 173.0934 191 L 4.8691 8.6083 123.8740 53.3303 42.9162 175.8210 192 A 4.3994 8.9366 127.3720 49.9752 20.8927 175.8485 193 K 4.2983 8.6096 122.9587 56.1241 33.1869 177.0252 194 E 4.3462 8.7205 126.6331 53.9117 28.6286 173.7857 195 P 4.3557 0.0000 0.0000 64.2858 31.8383 176.8934 196 V 4.1572 7.6830 119.3702 61.6045 32.7468 176.2868 197 Q 4.2413 8.3405 128.8430 54.7354 26.9363 174.3545 198 N 4.7982 7.8294 118.7750 51.0906 39.2422 171.6853 199 E 4.7271 8.1017 124.8893 53.7995 29.1138 173.3938 200 I 4.1449 7.6295 120.9367 59.7702 38.6601 175.8488 201 S 4.6193 8.4870 119.7601 56.8697 64.2203 174.6167 202 A 4.0060 8.5789 130.6010 55.4185 18.1897 179.7575 203 T 3.7516 7.8720 114.0690 66.9687 68.4995 175.9576 204 Y 4.0109 8.0535 121.3721 60.6043 38.7699 177.9745 205 I 3.4692 7.8047 120.7319 64.4838 37.1604 178.6203 206 R 3.5835 7.9345 118.9485 59.0351 29.8390 179.1643 207 R 3.7528 7.9364 118.2563 59.2224 30.0119 178.3666 208 A 3.7534 7.6742 120.8478 55.0792 18.3305 179.4709 209 L 3.9841 7.9272 117.6668 58.0678 41.5110 180.1082 210 G 3.6984 8.1076 104.3712 47.3318 0.0000 174.6796 211 Q 4.4615 7.7143 117.5324 55.0881 29.0171 176.2568 212 G 3.8559 7.8380 108.0305 46.2709 0.0000 173.9238 213 Q 4.4624 7.9350 118.0508 53.9249 30.2058 175.8307 214 S 4.3090 8.3620 114.7065 58.7238 63.2145 174.2123 215 V 4.4932 8.0935 117.6901 60.6266 32.9321 175.3645 216 K 3.9263 7.6566 121.4856 57.9792 32.2236 176.9629 217 Y 3.9237 8.0695 120.7750 58.3949 36.0355 169.8136 218 L 4.5843 8.0528 119.9584 55.2178 43.2013 176.3717 219 I 5.0739 7.2557 109.0390 57.1428 41.0173 173.5721 220 P 4.3160 0.0000 0.0000 62.9247 32.9533 177.0426 221 D 4.3286 8.8391 121.5819 57.8742 40.8503 179.4149 222 A 4.0748 7.9913 120.2952 55.0636 18.3062 179.7081 223 V 3.6522 7.6517 116.5584 66.0301 31.7016 178.1742 224 I 3.7485 7.6755 119.5579 64.6986 36.9692 178.5337 225 T 3.8907 8.0323 116.5449 66.7056 68.3947 176.0259 226 Y 3.9847 8.1389 121.4362 60.7994 38.8033 178.2253 227 I 3.9012 8.2066 120.8045 64.3225 37.2663 178.3781 228 K 3.9142 8.1378 120.2956 59.7228 31.8762 178.6218 229 D 4.3002 8.3436 118.1617 56.7797 40.6751 177.5588 230 H 4.6419 7.7651 113.8214 53.9607 29.5230 174.6401 231 G 3.9286 7.6323 108.4857 46.4370 0.0000 174.1901 232 L 4.0727 7.7725 117.3417 54.3552 43.2896 176.2452 233 Y 3.8080 7.5959 114.9670 59.4346 35.5291 170.9823 234 T 4.1967 7.9760 113.6569 61.8672 69.2012 174.3667 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 S 8.33 4.41 0.00 3.97 3.93 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 4 R 8.11 4.17 0.00 1.77 1.75 0.00 3.15 0.00 0.00 3.37 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 5 I 9.26 4.09 1.79 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.53 1.09 0.00 0.00 6 P 0.00 4.91 0.00 2.12 2.01 0.00 3.58 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 7 V 9.17 5.02 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 0.93 0.00 0.00 1.09 0.00 0.00 8 V 8.82 4.95 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 1.05 0.00 0.00 1.00 0.00 0.00 9 L 9.14 5.19 0.00 1.90 1.57 1.13 0.58 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 10 L 8.90 5.21 0.00 1.70 1.47 0.90 0.86 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 11 A 9.45 5.12 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 12 C 8.60 5.21 0.00 2.96 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 13 G 8.33 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 0.00 0.00 0.00 14 S 8.63 4.09 0.00 3.79 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 15 F 7.01 3.67 0.00 3.30 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 N 7.87 5.36 0.00 2.70 2.74 0.00 0.00 7.29 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 P 0.00 5.16 0.00 2.30 2.26 0.00 3.21 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.81 0.00 18 I 8.24 4.20 1.97 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.10 0.93 0.00 0.00 19 T 8.39 4.81 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 1.25 0.00 0.00 20 N 8.87 4.44 0.00 2.88 2.96 0.00 0.00 7.09 7.19 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 21 M 7.88 4.30 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.51 0.00 22 H 7.75 4.41 0.00 3.48 3.69 0.00 5.73 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.00 4.25 0.00 1.91 1.73 0.93 0.57 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 24 R 8.54 3.98 0.00 2.03 2.18 0.00 3.24 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 25 M 8.32 4.02 0.00 2.41 2.11 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.41 0.00 26 F 8.26 4.20 0.00 3.22 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.54 4.32 0.00 2.27 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 0.00 2.77 2.47 0.00 28 V 8.18 3.60 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 1.11 0.00 0.00 1.04 0.00 0.00 29 A 8.13 3.98 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.38 3.64 0.00 1.55 1.92 0.00 2.40 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.01 0.00 31 D 8.06 4.29 0.00 2.89 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 32 H 8.45 4.09 0.00 3.25 3.47 0.00 5.79 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 33 L 7.83 3.93 0.00 1.68 1.65 0.70 0.74 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 34 H 8.40 4.58 0.00 3.27 3.29 0.00 5.64 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 35 Q 8.15 4.02 0.00 2.28 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.00 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 36 T 7.42 4.01 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 1.26 0.00 0.00 37 G 8.10 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 0.00 0.00 0.00 38 M 7.99 4.25 0.00 1.43 1.61 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 39 Y 7.92 5.27 0.00 2.77 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 40 Q 9.13 4.42 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.00 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 41 V 8.78 4.35 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 0.83 0.00 0.00 0.82 0.00 0.00 42 I 9.07 4.47 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.90 1.00 0.00 0.00 43 Q 8.11 5.09 0.00 2.27 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 44 G 9.26 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 I 9.17 5.03 1.85 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 1.19 0.64 0.82 0.00 0.00 46 I 8.52 4.57 1.48 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.22 -0.17 0.00 0.00 47 S 9.17 4.94 0.00 3.89 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 48 P 0.00 5.10 0.00 2.05 2.13 0.00 3.76 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 2.01 2.09 0.00 49 V 8.58 4.10 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 0.71 0.00 0.00 0.82 0.00 0.00 50 N 8.78 4.58 0.00 2.89 2.88 0.00 0.00 6.99 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 51 D 8.65 4.54 0.00 2.74 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 52 T 8.22 4.13 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 53 Y 7.82 3.82 0.00 2.91 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 54 G 6.90 3.29 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 55 K 8.08 4.27 0.00 1.61 1.71 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.79 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.19 1.18 7.81 56 K 7.48 4.34 0.00 1.63 1.66 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.42 7.81 57 D 8.28 4.71 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 58 L 8.06 4.50 0.00 1.67 1.65 0.99 0.98 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 59 A 8.74 4.09 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 60 A 8.48 4.15 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 61 S 9.44 4.19 0.00 4.08 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 62 H 8.19 4.28 0.00 3.40 3.58 0.00 5.65 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 63 H 7.79 4.34 0.00 3.38 3.35 0.00 5.63 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 64 R 7.83 3.95 0.00 2.02 2.17 0.00 3.59 0.00 0.00 3.60 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.90 0.00 65 V 8.26 3.50 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 0.97 0.00 0.00 0.99 0.00 0.00 66 A 7.89 3.85 1.11 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 67 M 7.78 3.66 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 68 A 7.82 3.86 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 69 R 7.73 3.71 0.00 1.84 2.03 0.00 3.24 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 70 L 7.94 4.07 0.00 1.82 1.68 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 71 A 8.16 4.01 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 72 L 7.73 4.21 0.00 1.57 1.62 0.62 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 73 Q 7.70 3.98 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.97 0.00 0.00 0.00 0.00 0.00 2.36 2.67 0.00 74 T 7.63 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 1.21 0.00 0.00 75 S 7.92 4.62 0.00 3.63 3.71 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 76 D 8.80 4.91 0.00 2.87 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 77 W 7.76 5.30 0.00 3.45 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 78 I 7.30 4.44 1.06 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.33 0.00 0.00 79 R 8.63 4.67 0.00 1.70 1.86 0.00 2.72 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.46 0.00 80 V 8.11 4.48 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 0.61 0.00 0.00 0.85 0.00 0.00 81 D 8.72 4.93 0.00 2.68 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 82 P 0.00 4.47 0.00 2.47 2.29 0.00 3.84 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 2.13 2.04 0.00 83 W 8.64 4.28 0.00 3.49 3.32 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 84 E 8.63 3.53 0.00 2.25 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 0.00 2.28 2.32 0.00 85 S 7.97 4.26 0.00 4.07 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 7.65 4.21 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.52 0.00 87 Q 6.46 3.86 0.00 1.73 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 1.16 1.26 0.00 88 A 8.34 4.03 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 89 Q 7.38 4.59 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 90 W 8.77 4.46 0.00 3.33 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 M 6.45 4.14 0.00 1.68 1.54 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 92 E 7.58 3.29 0.00 1.88 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 0.00 2.45 2.11 0.00 93 T 8.39 3.91 4.57 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 1.36 0.00 0.00 94 V 7.81 3.66 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 0.55 0.00 0.00 1.09 0.00 0.00 95 K 7.90 4.02 0.00 1.94 1.92 0.00 1.53 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.36 7.81 96 V 7.59 3.87 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 1.31 0.00 0.00 1.12 0.00 0.00 97 L 7.88 3.72 0.00 1.41 0.13 0.71 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 98 R 7.97 4.07 0.00 2.04 2.04 0.00 3.18 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.99 0.00 99 H 8.02 3.78 0.00 2.62 2.83 0.00 5.78 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 0.00 100 H 8.02 3.93 0.00 3.13 3.26 0.00 5.68 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 H 8.20 4.21 0.00 3.42 3.72 0.00 5.96 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.03 4.15 0.00 3.91 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 0.00 103 K 7.69 3.76 0.00 1.80 1.75 0.00 1.29 0.00 0.00 1.24 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.22 1.12 7.81 104 L 7.50 4.02 0.00 1.86 1.73 0.99 0.94 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 0.00 105 L 8.14 4.11 0.00 1.60 1.67 0.83 0.85 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 0.00 106 R 7.47 4.17 0.00 1.96 2.11 0.00 3.36 0.00 0.00 3.13 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.74 0.00 *127 V 7.39 3.88 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 0.82 0.00 0.00 0.94 0.00 0.00 128 P 0.00 4.79 0.00 2.04 2.07 0.00 3.76 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 2.06 2.15 0.00 129 E 9.34 4.44 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 2.40 2.38 0.00 130 L 8.67 5.07 0.00 1.76 1.81 0.99 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.92 4.91 0.00 1.70 1.65 0.00 1.50 0.00 0.00 1.51 0.00 0.00 2.68 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.40 1.37 7.81 132 L 8.88 4.58 0.00 1.76 1.56 1.03 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 133 L 8.97 5.16 0.00 1.42 1.38 0.81 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 134 C 8.82 4.69 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 0.00 135 G 8.78 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 0.00 0.00 0.00 0.00 136 A 8.65 3.93 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 0.00 137 D 7.96 4.02 0.00 2.76 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 0.00 138 V 7.78 3.45 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 0.71 0.00 0.00 0.93 0.00 0.00 139 L 7.29 2.79 0.00 1.90 1.63 0.98 0.91 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 0.00 140 K 7.27 3.16 0.00 1.15 1.74 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.09 7.81 141 T 7.61 4.03 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 1.32 0.00 0.00 142 F 7.07 4.29 0.00 2.95 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 0.00 143 Q 7.78 4.34 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.84 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 144 T 7.76 4.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 145 P 0.00 4.37 0.00 2.06 2.05 0.00 3.84 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 146 N 9.01 4.32 0.00 2.89 2.97 0.00 0.00 7.03 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 L 8.24 4.10 0.00 1.69 2.05 0.84 1.08 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 0.00 148 W 8.02 4.97 0.00 3.22 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 0.00 149 K 8.72 4.17 0.00 1.62 1.67 0.00 1.63 0.00 0.00 1.49 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.50 7.81 150 D 8.93 4.37 0.00 2.69 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 0.00 151 A 8.05 4.01 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 0.00 152 H 8.06 4.30 0.00 3.51 3.50 0.00 5.66 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 0.00 153 I 7.83 3.27 1.82 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 1.13 0.42 0.00 0.00 154 Q 8.23 3.85 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 155 E 8.31 3.90 0.00 2.20 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 0.00 2.48 2.32 0.00 156 I 8.10 3.96 1.98 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.20 0.96 0.00 0.00 157 V 7.47 4.11 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 0.73 0.00 0.00 0.94 0.00 0.00 158 E 7.78 4.29 0.00 1.60 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.26 0.00 159 K 7.86 3.96 0.00 1.44 1.34 0.00 1.53 0.00 0.00 1.17 0.00 0.00 2.66 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 0.92 7.81 160 F 6.89 4.95 0.00 3.22 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 0.00 161 G 8.63 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 0.00 162 L 9.17 5.23 0.00 1.74 1.50 0.98 0.97 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 0.00 163 V 9.05 4.77 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 0.89 0.00 0.00 0.87 0.00 0.00 164 C 9.35 5.23 0.00 2.93 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 0.00 165 V 8.40 4.68 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 0.96 0.00 0.00 0.89 0.00 0.00 166 G 8.37 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 R 8.28 4.76 0.00 1.85 1.82 0.00 3.22 0.00 0.00 3.48 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 168 V 8.01 3.65 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 0.69 0.00 0.00 0.94 0.00 0.00 *169 S 9.01 4.36 0.00 3.83 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 0.00 170 H 7.86 4.99 0.00 3.27 3.25 0.00 5.76 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 0.00 171 D 7.42 4.59 0.00 2.51 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 0.00 0.00 0.00 0.00 172 P 0.00 4.06 0.00 2.11 2.05 0.00 3.50 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 2.11 0.00 173 K 7.98 3.99 0.00 1.72 1.83 0.00 1.62 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.46 7.81 174 G 7.84 3.53 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 0.00 175 Y 7.44 4.44 0.00 3.09 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 0.00 176 I 8.13 3.91 2.04 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 1.52 0.87 0.94 0.00 0.00 177 A 7.98 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 0.00 178 E 8.40 4.40 0.00 2.08 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 2.35 2.54 0.00 179 S 7.63 4.67 0.00 3.93 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 0.00 180 P 0.00 4.29 0.00 2.27 2.20 0.00 3.84 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 181 I 7.63 3.93 1.86 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 1.65 1.40 0.93 0.00 0.00 182 L 7.99 4.06 0.00 1.76 1.78 1.10 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 183 R 8.00 3.98 0.00 1.98 2.29 0.00 3.06 0.00 0.00 3.42 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.68 0.00 184 M 7.65 4.33 0.00 1.81 2.16 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.54 0.00 185 H 8.23 5.03 0.00 3.15 3.38 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 Q 8.32 4.09 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.89 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 187 H 8.32 4.14 0.00 3.15 3.37 0.00 5.71 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 N 8.39 4.97 0.00 3.00 2.84 0.00 0.00 6.65 7.09 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 0.00 189 I 7.53 4.89 1.85 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 1.25 0.80 0.91 0.00 0.00 190 H 9.30 4.82 0.00 2.97 3.23 0.00 5.60 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 L 8.61 4.87 0.00 1.47 1.56 0.89 0.79 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 0.00 192 A 8.94 4.40 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 K 8.61 4.30 0.00 1.65 1.75 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.41 7.81 194 E 8.72 4.35 0.00 1.90 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 2.24 2.53 0.00 195 P 0.00 4.36 0.00 2.22 2.17 0.00 3.80 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 2.00 1.96 0.00 196 V 7.68 4.16 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 0.77 0.00 0.00 0.95 0.00 0.00 197 Q 8.34 4.24 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.89 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 198 N 7.83 4.80 0.00 2.77 2.67 0.00 0.00 6.52 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 0.00 199 E 8.10 4.73 0.00 1.90 1.80 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 2.18 2.34 0.00 200 I 7.63 4.14 1.87 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 1.32 0.69 0.96 0.00 0.00 201 S 8.49 4.62 0.00 3.90 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 0.00 202 A 8.58 4.01 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 0.00 203 T 7.87 3.75 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 1.22 0.00 0.00 204 Y 8.05 4.01 0.00 3.11 3.19 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 0.00 205 I 7.80 3.47 1.91 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.68 0.79 0.00 0.00 206 R 7.93 3.58 0.00 1.83 1.84 0.00 3.10 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 1.48 0.00 207 R 7.94 3.75 0.00 1.81 1.86 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 208 A 7.67 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 L 7.93 3.98 0.00 1.83 1.79 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 210 G 8.11 3.70 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 0.00 0.00 0.00 211 Q 7.71 4.46 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.26 0.00 0.00 0.00 0.00 0.00 2.32 2.62 0.00 212 G 7.84 3.86 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 0.00 213 Q 7.94 4.46 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.27 0.00 214 S 8.36 4.31 0.00 3.84 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 0.00 215 V 8.09 4.49 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 0.68 0.00 0.00 0.91 0.00 0.00 216 K 7.66 3.93 0.00 1.52 1.39 0.00 1.65 0.00 0.00 1.33 0.00 0.00 2.82 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.30 1.02 7.81 217 Y 8.07 3.92 0.00 3.26 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 0.00 218 L 8.05 4.58 0.00 1.95 1.76 1.09 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 219 I 7.26 5.07 1.90 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 1.42 0.66 0.93 0.00 0.00 220 P 0.00 4.32 0.00 2.18 2.03 0.00 3.64 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.33 0.00 221 D 8.84 4.33 0.00 2.67 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 A 7.99 4.07 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 0.00 223 V 7.65 3.65 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 1.20 0.00 0.00 0.95 0.00 0.00 224 I 7.68 3.75 2.04 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 1.52 0.84 0.90 0.00 0.00 225 T 8.03 3.89 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 1.22 0.00 0.00 226 Y 8.14 3.98 0.00 3.27 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 I 8.21 3.90 2.16 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.87 1.08 0.00 0.00 228 K 8.14 3.91 0.00 1.84 1.92 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.46 7.81 229 D 8.34 4.30 0.00 2.48 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 H 7.77 4.64 0.00 2.77 3.06 0.00 5.81 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 G 7.63 3.93 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 0.00 0.00 0.00 232 L 7.77 4.07 0.00 1.31 0.64 0.78 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 233 Y 7.60 3.81 0.00 3.22 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 T 7.98 4.20 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 1.25 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.