NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 Q 4.3584 8.2027 121.9615 55.2915 31.9325 174.3134 3 R 4.6646 7.5403 118.3465 53.9731 32.1265 173.4476 4 Y 4.6603 9.6224 124.9386 56.1167 42.4798 174.2775 5 F 5.0494 8.8552 122.0379 56.4684 39.7579 175.3961 6 I 4.3320 8.3320 125.4299 59.9431 38.2946 176.2356 7 E 4.6804 8.5414 125.2112 56.7833 29.0292 175.8804 8 L 5.0168 7.7659 117.5596 52.8399 46.2869 176.5764 9 T 4.8357 8.1511 116.7870 61.9503 71.3580 176.2872 10 K 3.8276 9.2863 123.7346 60.1683 32.1486 179.1008 11 Q 3.9141 7.8711 117.3905 58.9869 28.3320 178.7929 12 Q 4.0683 7.9211 118.0023 58.7526 28.9112 178.0317 13 I 3.9533 7.4532 119.9763 63.9418 37.2384 177.8623 14 E 4.2281 8.2553 118.9237 58.7449 29.2951 178.3239 15 E 3.9950 7.4149 118.4330 58.3041 29.9253 176.8152 16 A 4.8258 7.4740 118.0747 49.3946 21.9601 174.3822 17 P 4.4663 0.0000 0.0000 65.2098 31.5206 176.4777 18 T 5.1178 7.6034 106.2624 60.0844 72.3995 172.8057 19 F 5.2336 8.8607 115.8180 55.3708 41.6921 173.5334 20 S 5.1367 8.7666 113.5822 56.6780 66.0329 173.1079 21 I 4.5566 8.8965 123.7347 60.1863 38.5159 174.8175 22 T 4.5992 8.7692 117.0704 60.5984 71.1359 173.9636 23 G 4.0401 9.1026 106.9203 44.0843 0.0000 174.9524 24 E 4.0355 9.2662 118.9585 60.0329 29.5028 178.7680 25 E 4.0370 8.3349 117.5141 59.6058 29.3715 179.7822 26 V 3.4863 7.4063 110.8813 64.7675 31.7066 177.7999 27 H 4.0514 8.3245 117.2892 59.7847 29.3408 176.4575 28 H 4.1287 7.8637 118.6399 59.2501 29.7950 177.0615 29 I 3.8045 7.9812 120.8217 64.5697 37.1858 178.3766 30 V 3.6725 8.6112 120.1004 66.1506 31.2785 177.7966 31 N 4.3406 7.7496 115.1368 56.0943 38.9420 177.3331 32 V 3.6545 7.2746 116.7007 63.7118 31.6198 175.8026 *34 R 4.8529 7.3037 115.1985 56.9959 30.9783 174.6066 *36 N 4.5152 8.3243 119.6473 52.2200 39.8531 173.5929 37 E 4.2134 8.4662 117.5573 58.3401 29.7291 177.2477 38 G 4.0239 9.2607 111.3887 45.3485 0.0000 173.7746 39 D 4.6241 8.1461 119.6662 54.3992 42.1357 175.3372 40 Q 5.2883 8.5730 120.0590 54.2834 31.3114 174.7465 41 I 4.8337 8.8258 115.8556 59.4170 42.3304 173.6222 42 I 4.8824 8.9081 122.9123 59.7079 39.1316 174.9259 43 C 5.3180 8.9590 124.1044 57.9424 32.2938 172.5034 44 C 5.2849 8.6549 123.0675 57.3983 34.1584 173.9417 45 S 4.9000 9.3773 121.9066 57.9876 63.9765 175.2952 46 Q 4.1377 9.1990 119.3565 58.5139 28.4334 177.1915 47 D 4.7106 8.2993 115.9761 53.1105 39.5729 177.1676 48 G 4.1762 8.1677 106.2558 46.8675 0.0000 173.5152 49 F 4.6720 8.2140 119.5967 56.2991 40.7342 174.4098 50 E 5.0685 9.1062 124.7942 55.1401 31.2507 174.5382 51 A 4.8319 9.7802 128.1317 49.8088 23.1816 174.5054 52 K 4.5863 8.7479 122.2099 55.5722 33.5252 175.4418 53 C 5.3055 9.1122 125.3277 57.8806 32.1155 172.3683 54 E 4.9256 8.7550 122.4405 54.1856 31.9940 174.9217 55 L 4.3351 9.3431 128.4600 55.1448 41.8477 177.4238 56 Q 3.9508 8.6325 126.3231 58.0208 30.0681 176.0112 57 S 4.6461 8.2848 113.0134 56.4418 66.0836 173.5799 58 V 4.3231 8.4203 119.0413 59.9179 33.8609 174.1872 59 S 4.9217 8.5842 123.7863 56.8179 64.2935 173.1169 60 K 4.3666 8.5391 118.3132 57.2692 32.4466 177.6886 61 D 4.7897 8.0352 113.4034 53.5447 42.5039 175.1432 62 K 4.8274 7.8220 119.4402 54.8014 36.7794 175.1933 63 V 4.6427 8.3470 123.2148 61.3022 34.7088 174.1662 64 S 5.0155 9.3741 125.0691 57.2740 65.0308 173.1212 65 C 5.1110 8.8027 121.0934 57.6400 32.3870 172.5590 66 L 4.9499 8.3120 124.1455 53.0982 44.1315 175.5623 67 V 4.3295 8.5810 126.9363 61.4332 31.6227 175.9684 68 I 4.1516 8.5712 119.8671 61.2726 38.7419 175.5716 69 E 4.5821 7.3381 120.4179 55.3502 32.9410 174.4670 70 W 4.9365 8.9376 127.6555 55.4708 28.9582 176.1190 71 T 4.0330 8.6281 116.9648 62.4502 68.7619 175.0930 72 N 4.3849 8.4423 116.2714 53.9320 36.1161 173.1525 73 E 4.3624 7.9412 118.6281 55.2914 30.2015 175.4072 74 N 5.0537 8.7498 122.2277 52.1070 40.8517 173.8145 75 R 4.6404 9.1694 124.5228 55.9543 30.8014 175.8247 76 E 4.3274 8.9031 118.1776 55.2742 30.0976 176.8944 77 L 4.2871 8.3609 122.3137 54.5241 42.4006 176.5827 78 P 4.2724 0.0000 0.0000 64.8854 32.2396 175.7468 79 I 4.8468 7.1431 112.4788 58.6303 40.9069 175.7971 80 K 4.3407 8.9775 124.1377 56.1314 32.9463 176.1798 81 V 4.8227 8.3303 125.6266 60.0989 34.0118 174.0856 82 Y 4.7501 9.6189 124.1602 56.3933 40.0996 174.6428 83 I 4.7313 8.2927 125.6498 59.9650 39.1815 174.6335 84 A 5.8775 9.2295 130.6712 50.0705 20.9080 175.5499 85 S 5.0884 8.7203 118.8063 56.5823 66.0021 174.0657 86 G 3.0448 8.5995 112.8788 46.1313 0.0000 172.5141 87 L 3.9561 7.9027 126.5738 54.0708 41.5077 175.9177 88 P 4.7350 0.0000 0.0000 60.7615 33.0979 175.5058 89 K 4.3775 9.0679 118.3041 56.5595 35.4806 177.9030 90 G 3.8431 8.1887 108.7015 47.7669 0.0000 174.1322 91 D 5.0915 8.2460 117.7325 53.7041 41.7943 178.2974 92 K 4.0409 8.0506 120.9819 59.0895 31.9583 178.5583 93 L 3.7806 7.8433 120.6977 57.9740 41.9314 178.6114 94 E 3.8963 8.0055 118.7915 59.0261 29.2917 179.1124 95 W 3.9790 8.1571 128.0531 60.4200 30.8582 178.0337 96 I 3.7233 7.9880 120.0592 64.2161 36.3834 178.5880 97 I 2.2770 7.4231 120.7335 63.9322 36.9096 177.9227 98 Q 3.8253 8.0835 120.7199 59.2649 28.8961 178.5147 99 K 3.9794 8.1014 119.6235 59.0997 32.0635 179.3828 100 G 4.0227 7.9526 106.1346 48.4822 0.0000 175.7709 101 T 3.9759 8.3443 118.4120 66.2872 68.2971 176.3819 102 E 3.9965 7.8732 119.1207 59.6815 29.6498 179.1426 103 L 4.3214 8.1028 114.6727 55.1853 41.5907 178.0255 104 G 3.9009 8.4490 108.1906 44.5541 0.0000 174.1232 105 A 3.8595 7.5498 122.3321 53.1828 18.7313 177.2296 106 H 4.3813 8.7558 121.1939 58.3018 30.8478 175.0112 107 A 4.3237 6.5943 116.4967 50.9710 22.1985 175.0767 108 F 5.2339 9.4148 118.2646 55.8476 42.4479 175.9196 109 I 4.6112 9.2879 122.7191 59.0733 40.0055 172.8407 110 P 5.1226 0.0000 0.0000 62.2724 32.9493 175.4501 111 F 5.5744 8.2335 116.4769 55.4174 41.7413 173.3360 112 Q 4.5177 9.8521 124.0898 56.2961 29.3973 175.3000 113 A 5.1120 8.6377 128.3403 49.9026 22.0525 176.5845 114 A 3.9686 9.0982 124.3825 55.5645 18.2971 179.4802 115 R 4.2802 7.8228 110.4101 56.1847 30.4206 176.5504 116 S 4.1679 8.8268 117.2918 58.7704 62.4959 175.7151 117 V 3.8036 8.4199 119.8116 63.3906 32.4729 178.1732 118 V 4.2859 6.7159 115.0920 61.0698 31.2209 177.2646 *128 K 3.8781 8.7754 123.9387 57.9718 33.9156 178.8920 129 R 3.5739 6.7960 119.2480 60.8563 29.3095 180.1565 130 E 4.2554 7.7917 116.3897 59.2145 29.4849 178.7109 131 R 4.0905 7.5080 118.4142 58.4783 30.3086 178.2169 132 W 4.3802 8.0429 118.9728 60.2457 29.1087 178.5531 133 T 3.9717 8.0269 115.4118 66.4976 67.9480 176.6797 134 K 4.0253 7.6943 120.7915 59.5369 32.2661 179.0757 135 I 3.7738 8.1216 120.2258 64.1958 36.9808 178.3149 136 A 4.0199 8.0608 121.8925 54.8521 18.2327 179.6374 137 K 3.8758 7.9497 117.8893 59.4809 32.2518 178.8201 138 E 4.6106 8.4633 120.5016 58.6859 29.6521 178.4517 139 A 4.0029 8.0930 120.6628 55.1981 18.5064 179.4086 140 A 4.0653 8.1551 119.1870 55.3547 18.2982 179.8277 141 E 3.9050 8.4327 117.0383 59.8049 29.4427 179.5381 142 Q 4.3019 8.5358 116.6893 57.6098 28.9035 177.5463 143 S 4.5883 7.8946 113.2618 57.2408 64.0635 173.1586 144 Y 3.4193 7.9142 117.4767 59.4495 35.2442 170.1852 145 R 4.2920 7.9520 117.1729 56.4965 31.1937 176.9980 146 N 4.9014 9.6855 116.8841 53.4509 39.1720 174.7979 147 E 4.7334 7.8163 114.8365 54.8832 32.3871 174.4011 148 V 3.9581 7.6286 120.0084 60.3282 32.4706 173.8374 149 P 4.5141 0.0000 0.0000 62.6705 32.0997 176.0735 150 R 4.2736 8.4436 124.2617 56.0468 31.4457 175.3997 151 V 4.8144 8.3377 124.9748 61.3177 34.3954 174.2487 *153 D 4.6211 8.3758 122.1325 53.6750 41.8092 176.1465 154 V 4.1294 8.6450 115.1774 62.7550 32.1096 175.3010 155 H 5.1865 9.6658 123.1465 54.2463 31.1297 175.2320 156 S 4.6621 9.6205 117.4053 57.9884 64.2641 175.0108 157 F 3.9779 9.1989 122.1926 61.4455 38.7865 176.9207 158 Q 3.9526 8.1648 117.5656 59.4589 29.3333 177.6848 159 Q 4.1218 8.4685 119.4162 58.8657 28.6897 178.7439 160 L 3.8675 7.7135 120.9043 58.3065 41.8622 178.8385 161 L 3.8181 7.1661 119.2890 58.6859 41.6299 179.8500 162 Q 4.1749 7.5958 117.9443 58.3924 29.3766 179.2348 163 R 4.2994 8.3205 120.8519 56.7079 27.8990 176.9259 *165 Q 4.1855 7.7640 119.7139 56.2116 31.2668 175.4893 166 D 4.2300 7.9065 116.6377 55.9023 41.0277 176.3704 167 F 4.7732 7.3788 116.6913 55.6588 40.8670 175.3188 168 D 4.6511 8.9582 124.3411 57.3815 41.0439 177.0034 169 K 4.7474 8.1996 115.0803 55.0339 37.6401 175.0909 170 C 5.0145 8.4421 120.9202 58.0780 34.7923 172.8473 171 V 4.8435 8.9646 120.1089 59.6724 34.3043 175.1004 172 V 4.4021 8.2421 123.9271 60.9173 33.5669 174.7120 173 A 4.6710 8.1881 131.0189 52.4652 18.0343 175.6306 174 Y 4.6878 8.3865 119.9043 58.0191 42.4014 173.2418 175 E 4.4639 7.5156 123.9138 54.6824 31.9627 175.1962 *184 S 4.3828 8.3882 118.0255 58.3533 64.6155 176.2616 185 A 4.2282 8.1722 124.3670 54.8953 18.1166 178.9556 186 F 4.0453 7.7920 117.0866 62.0789 39.2984 177.6103 187 S 4.0774 8.3169 112.7257 61.2052 62.5389 176.1752 188 A 3.9430 7.8845 123.3821 54.9101 18.6227 179.1219 189 I 3.7321 8.0976 111.9586 64.2792 37.5172 178.5002 190 V 3.4244 7.5741 120.8524 65.2839 31.0952 177.6672 191 S 4.3289 8.1845 112.2765 59.7648 63.2235 175.2617 192 S 4.5300 7.6518 116.6942 57.4630 63.7192 173.7844 193 L 4.3551 7.0840 123.6548 53.4794 42.5733 174.7282 194 P 4.6221 0.0000 0.0000 60.9182 32.8894 175.0963 195 K 3.9066 8.4501 120.1673 58.7099 32.1311 177.0025 196 G 3.9621 9.0359 115.2027 45.0832 0.0000 173.5311 197 S 4.7385 8.1341 115.2952 58.0749 65.1237 173.0661 198 S 5.3626 9.2014 115.2905 56.6286 65.5738 172.8480 199 L 5.0937 9.5127 124.4934 53.3039 45.4099 174.4395 200 L 4.6571 8.4987 128.4833 53.3666 44.2418 174.9748 201 I 4.9152 8.5823 126.3472 59.7126 40.7405 174.5920 202 V 4.8785 8.2121 120.8426 59.6208 34.0963 175.2562 203 F 5.1401 9.6155 123.2289 55.7800 42.6609 175.3390 204 G 4.3638 8.7717 108.9146 44.5912 0.0000 170.8366 205 P 4.7991 0.0000 0.0000 61.0513 33.8101 176.2402 206 E 3.8947 9.0118 116.9510 59.9177 29.3676 180.2152 207 G 3.6052 8.0994 105.6730 47.4090 0.0000 174.3570 208 G 4.0752 8.0715 105.0543 44.4198 0.0000 173.1103 209 L 4.3384 8.2843 119.3166 55.0371 42.4671 177.1304 210 T 4.5920 9.2964 115.0373 60.3079 70.5454 175.0745 211 E 3.8845 8.6985 124.6179 59.5957 29.5839 179.4316 212 A 3.9337 7.9353 119.8727 55.3685 18.4111 179.1331 213 E 3.7852 8.0018 116.2810 59.5746 29.4943 179.6618 214 V 3.3952 7.9524 118.2953 66.0619 31.5227 177.5105 215 E 4.0116 7.9328 119.5549 59.0840 28.8937 179.9750 216 R 4.0141 8.0057 117.4342 59.0699 30.0357 179.1876 217 L 3.9814 8.2280 119.2923 57.9871 41.4118 179.6501 218 T 4.6898 8.8264 111.6586 64.1419 68.4151 175.9050 219 E 4.1682 7.9028 118.3696 57.9512 29.8987 177.6540 220 Q 4.4084 7.2259 117.3094 55.7239 29.1180 175.7463 221 D 4.6603 7.7610 118.0693 54.4017 39.1669 174.4713 222 G 3.7780 8.1619 108.0518 46.0198 0.0000 173.2547 223 V 4.8925 8.3814 124.3952 60.6369 33.8715 174.9245 224 T 4.7103 8.6246 118.9338 62.3215 69.5510 173.5176 225 C 4.8820 9.4383 122.2220 58.1471 32.9088 173.5411 226 G 4.2293 8.7311 109.3616 44.5998 0.0000 173.4955 227 L 4.4776 8.0905 119.9885 53.8339 42.2957 176.8009 228 G 3.9123 8.0583 103.5518 44.3137 0.0000 172.1133 229 P 4.3844 0.0000 0.0000 63.9069 31.9580 176.8225 230 R 4.2631 7.5265 118.1882 55.2533 31.0670 175.8217 231 I 3.9743 8.1176 122.6389 60.7746 37.7859 175.3708 232 L 4.6375 8.0951 125.2802 52.7867 43.6002 176.7944 233 R 4.2197 8.1747 121.3411 55.7449 30.9004 177.7288 234 T 3.8368 8.4375 110.2380 64.7711 68.6223 175.3649 235 E 4.1780 7.9976 118.2188 58.2402 30.6253 178.2068 236 T 4.2895 8.1138 116.8776 65.7262 68.9597 176.3838 237 A 3.9594 7.9313 122.2768 55.1912 18.3061 177.9598 238 P 4.1211 0.0000 0.0000 65.1421 31.1898 179.0755 239 L 3.9740 7.8482 118.2134 57.8271 41.6294 178.4089 240 Y 3.9688 8.1781 118.7506 60.8512 38.6765 177.8165 241 A 4.2325 8.3656 121.3621 55.5725 18.5476 179.6902 242 L 4.0820 8.2825 117.3401 57.9769 41.7088 179.8833 243 S 4.1396 8.4103 115.1495 61.4782 62.7105 176.6130 244 A 4.0115 8.4904 123.7926 55.2512 18.1695 179.6717 245 I 3.6701 7.9283 118.3792 64.6155 37.0825 178.5612 246 S 4.1265 8.2434 113.9307 61.4871 62.2471 175.6047 247 Y 3.9786 8.1103 122.2187 60.6200 38.1622 177.8782 248 Q 3.7974 8.3914 120.7198 59.4500 29.1392 177.9493 249 T 3.8407 8.2064 108.7384 63.2318 69.2134 174.9793 250 E 4.5234 8.3120 119.6726 56.6701 32.1023 176.9468 251 L 4.2096 7.7198 117.0235 56.0987 42.5108 177.5030 252 L 4.1413 7.3915 117.1412 55.8426 42.4908 176.8415 253 R 4.1563 7.2182 120.9172 56.1938 30.1201 175.9884 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 Q 8.20 4.36 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 3 R 7.54 4.66 0.00 1.47 1.62 0.00 2.85 0.00 0.00 2.88 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.13 0.00 4 Y 9.62 4.66 0.00 2.93 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 5 F 8.86 5.05 0.00 3.05 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 6 I 8.33 4.33 1.91 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.81 0.96 0.00 0.00 7 E 8.54 4.68 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 8 L 7.77 5.02 0.00 1.59 1.48 1.05 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 9 T 8.15 4.84 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 1.30 0.00 0.00 10 K 9.29 3.83 0.00 1.41 1.20 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.18 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.65 0.21 7.81 11 Q 7.87 3.91 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.69 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 12 Q 7.92 4.07 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.13 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 13 I 7.45 3.95 2.08 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.56 0.50 0.00 0.00 14 E 8.26 4.23 0.00 2.05 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 2.39 2.21 0.00 15 E 7.41 3.99 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 16 A 7.47 4.83 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 17 P 0.00 4.47 0.00 2.08 2.15 0.00 3.66 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 18 T 7.60 5.12 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 19 F 8.86 5.23 0.00 3.07 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.77 5.14 0.00 3.82 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 21 I 8.90 4.56 1.78 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.49 0.85 0.00 0.00 22 T 8.77 4.60 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 23 G 9.10 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 24 E 9.27 4.04 0.00 2.07 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 0.00 2.46 2.47 0.00 25 E 8.33 4.04 0.00 2.04 1.82 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 2.55 2.74 0.00 26 V 7.41 3.49 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 1.02 0.00 0.00 0.89 0.00 0.00 27 H 8.32 4.05 0.00 3.26 3.58 0.00 5.87 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 28 H 7.86 4.13 0.00 3.25 3.60 0.00 5.81 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 29 I 7.98 3.80 1.86 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.32 0.81 0.00 0.00 30 V 8.61 3.67 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 1.17 0.00 0.00 1.05 0.00 0.00 31 N 7.75 4.34 0.00 2.61 2.81 0.00 0.00 6.83 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.27 3.65 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 0.80 0.00 0.00 0.88 0.00 0.00 *34 R 7.30 4.85 0.00 1.85 1.90 0.00 3.33 0.00 0.00 3.87 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.88 0.00 *36 N 8.32 4.52 0.00 2.76 2.77 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 37 E 8.47 4.21 0.00 2.01 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 2.25 2.36 0.00 38 G 9.26 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 39 D 8.15 4.62 0.00 2.77 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.57 5.29 0.00 1.91 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.80 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 41 I 8.83 4.83 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0.00 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 E 9.11 5.07 0.00 2.07 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 2.28 2.19 0.00 51 A 9.78 4.83 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.75 4.59 0.00 1.74 1.61 0.00 1.57 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 53 C 9.11 5.31 0.00 2.88 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 54 E 8.76 4.93 0.00 1.96 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 55 L 9.34 4.34 0.00 1.56 1.54 0.84 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 8.63 3.95 0.00 1.98 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 57 S 8.28 4.65 0.00 3.84 3.55 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 58 V 8.42 4.32 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 0.70 0.00 0.00 0.92 0.00 0.00 59 S 8.58 4.92 0.00 3.76 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.54 4.37 0.00 1.72 1.79 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.14 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.47 7.81 61 D 8.04 4.79 0.00 2.78 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 62 K 7.82 4.83 0.00 1.69 1.64 0.00 1.48 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.46 7.81 63 V 8.35 4.64 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 0.82 0.00 0.00 0.84 0.00 0.00 64 S 9.37 5.02 0.00 3.73 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 65 C 8.80 5.11 0.00 1.23 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 0.00 0.00 0.00 66 L 8.31 4.95 0.00 1.71 1.43 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 67 V 8.58 4.33 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.29 0.00 0.00 68 I 8.57 4.15 1.84 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 1.17 0.58 0.88 0.00 0.00 69 E 7.34 4.58 0.00 1.97 1.70 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 2.21 2.25 0.00 70 W 8.94 4.94 0.00 3.25 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 71 T 8.63 4.03 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 1.22 0.00 0.00 72 N 8.44 4.38 0.00 2.99 3.04 0.00 0.00 6.90 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 73 E 7.94 4.36 0.00 2.08 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 74 N 8.75 5.05 0.00 2.60 2.66 0.00 0.00 7.05 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 75 R 9.17 4.64 0.00 1.97 1.92 0.00 3.59 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 76 E 8.90 4.33 0.00 2.05 1.86 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 2.32 2.40 0.00 77 L 8.36 4.29 0.00 1.69 1.69 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.27 0.00 2.09 2.29 0.00 3.62 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 79 I 7.14 4.85 2.02 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 1.22 0.74 0.89 0.00 0.00 80 K 8.98 4.34 0.00 1.96 1.90 0.00 1.64 0.00 0.00 1.51 0.00 0.00 2.79 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.36 7.81 81 V 8.33 4.82 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 0.89 0.00 0.00 0.97 0.00 0.00 82 Y 9.62 4.75 0.00 2.57 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 83 I 8.29 4.73 1.96 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.92 1.14 0.00 0.00 84 A 9.23 5.88 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 S 8.72 5.09 0.00 3.68 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 86 G 8.60 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 0.00 0.00 0.00 87 L 7.90 3.96 0.00 1.51 1.67 0.95 1.24 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 88 P 0.00 4.73 0.00 2.13 2.01 0.00 3.29 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.82 0.00 89 K 9.07 4.38 0.00 1.95 2.01 0.00 1.44 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.62 1.35 7.81 90 G 8.19 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 8.25 5.09 0.00 2.71 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 92 K 8.05 4.04 0.00 1.80 1.82 0.00 1.82 0.00 0.00 1.51 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.38 7.81 93 L 7.84 3.78 0.00 1.60 1.38 -0.29 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.01 3.90 0.00 2.25 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 2.53 2.50 0.00 95 W 8.16 3.98 0.00 3.33 3.27 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 96 I 7.99 3.72 1.87 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.61 0.86 0.00 0.00 97 I 7.42 2.28 1.61 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 -0.05 0.56 0.00 0.00 98 Q 8.08 3.83 0.00 2.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.14 2.30 0.00 99 K 8.10 3.98 0.00 1.43 1.45 0.00 0.61 0.00 0.00 1.11 0.00 0.00 2.13 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.68 0.21 7.81 100 G 7.95 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 0.00 101 T 8.34 3.98 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 102 E 7.87 4.00 0.00 1.97 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 2.30 2.52 0.00 103 L 8.10 4.32 0.00 1.56 1.70 0.95 0.98 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 0.00 104 G 8.45 3.90 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 0.00 0.00 0.00 105 A 7.55 3.86 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 H 8.76 4.38 0.00 2.94 3.05 0.00 5.99 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 0.00 107 A 6.59 4.32 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 0.00 108 F 9.41 5.23 0.00 2.78 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 0.00 109 I 9.29 4.61 1.99 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.18 0.83 0.00 0.00 110 P 0.00 5.12 0.00 2.12 1.74 0.00 3.73 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.80 0.00 111 F 8.23 5.57 0.00 3.28 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 0.00 112 Q 9.85 4.52 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.71 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 113 A 8.64 5.11 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 0.00 114 A 9.10 3.97 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 0.00 115 R 7.82 4.28 0.00 1.83 1.98 0.00 3.40 0.00 0.00 3.29 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 116 S 8.83 4.17 0.00 4.00 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 0.00 117 V 8.42 3.80 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 0.70 0.00 0.00 0.93 0.00 0.00 118 V 6.72 4.29 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 0.71 0.00 0.00 1.01 0.00 0.00 *128 K 8.78 3.88 0.00 1.18 0.74 0.00 1.51 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.25 1.28 7.81 129 R 6.80 3.57 0.00 1.81 1.94 0.00 3.24 0.00 0.00 3.34 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.29 0.00 130 E 7.79 4.26 0.00 1.92 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 2.34 2.24 0.00 131 R 7.51 4.09 0.00 1.78 1.93 0.00 3.18 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 132 W 8.04 4.38 0.00 3.61 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 0.00 133 T 8.03 3.97 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 1.24 0.00 0.00 134 K 7.69 4.03 0.00 1.97 2.10 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.51 7.81 135 I 8.12 3.77 2.07 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.72 0.87 0.00 0.00 136 A 8.06 4.02 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 0.00 137 K 7.95 3.88 0.00 2.06 1.94 0.00 1.68 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.41 7.81 138 E 8.46 4.61 0.00 2.11 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 2.31 2.34 0.00 139 A 8.09 4.00 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 0.00 140 A 8.16 4.07 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 0.00 141 E 8.43 3.91 0.00 2.22 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 2.39 2.73 0.00 142 Q 8.54 4.30 0.00 1.99 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 143 S 7.89 4.59 0.00 4.07 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 0.00 144 Y 7.91 3.42 0.00 3.16 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 R 7.95 4.29 0.00 2.15 2.20 0.00 3.36 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.80 0.00 146 N 9.69 4.90 0.00 2.77 2.94 0.00 0.00 6.81 7.55 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 0.00 147 E 7.82 4.73 0.00 1.95 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 2.50 2.23 0.00 148 V 7.63 3.96 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 0.70 0.00 0.00 -0.17 0.00 0.00 149 P 0.00 4.51 0.00 2.13 2.06 0.00 3.70 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 2.16 2.19 0.00 150 R 8.44 4.27 0.00 1.88 1.75 0.00 3.19 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.69 0.00 151 V 8.34 4.81 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 0.97 0.00 0.00 1.04 0.00 0.00 *153 D 8.38 4.62 0.00 2.83 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 0.00 154 V 8.65 4.13 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 1.01 0.00 0.00 1.06 0.00 0.00 155 H 9.67 5.19 0.00 3.39 3.31 0.00 5.81 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 S 9.62 4.66 0.00 3.95 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 0.00 157 F 9.20 3.98 0.00 3.36 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 Q 8.16 3.95 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 159 Q 8.47 4.12 0.00 2.34 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 160 L 7.71 3.87 0.00 1.54 1.33 0.69 -0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 161 L 7.17 3.82 0.00 1.71 1.64 0.47 1.18 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 0.00 162 Q 7.60 4.17 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.60 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 163 R 8.32 4.30 0.00 1.90 2.02 0.00 3.23 0.00 0.00 3.21 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.59 0.00 *165 Q 7.76 4.19 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.89 0.00 0.00 0.00 0.00 0.00 2.19 2.36 0.00 166 D 7.91 4.23 0.00 1.66 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 0.00 167 F 7.38 4.77 0.00 2.88 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 0.00 168 D 8.96 4.65 0.00 2.77 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 0.00 169 K 8.20 4.75 0.00 1.61 1.61 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.50 7.81 170 C 8.44 5.01 0.00 2.85 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 0.00 171 V 8.96 4.84 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 0.79 0.00 0.00 1.04 0.00 0.00 172 V 8.24 4.40 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 0.85 0.00 0.00 173 A 8.19 4.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 Y 8.39 4.69 0.00 2.88 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 0.00 175 E 7.52 4.46 0.00 1.73 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 2.10 2.24 0.00 *184 S 8.39 4.38 0.00 3.99 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 0.00 185 A 8.17 4.23 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 0.00 186 F 7.79 4.05 0.00 3.14 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 S 8.32 4.08 0.00 4.13 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 A 7.88 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 0.00 189 I 8.10 3.73 1.83 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 1.34 0.43 0.92 0.00 0.00 190 V 7.57 3.42 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 0.89 0.00 0.00 0.16 0.00 0.00 191 S 8.18 4.33 0.00 4.02 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 0.00 192 S 7.65 4.53 0.00 4.03 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 0.00 193 L 7.08 4.36 0.00 1.56 1.61 0.87 1.14 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 0.00 194 P 0.00 4.62 0.00 2.28 2.15 0.00 3.45 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 2.02 2.04 0.00 195 K 8.45 3.91 0.00 1.72 1.79 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.46 7.81 196 G 9.04 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 0.00 197 S 8.13 4.74 0.00 3.97 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 S 9.20 5.36 0.00 4.13 4.10 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 0.00 199 L 9.51 5.09 0.00 1.69 1.51 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 200 L 8.50 4.66 0.00 0.27 0.97 0.59 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 201 I 8.58 4.92 1.94 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.64 0.54 0.00 0.00 202 V 8.21 4.88 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 0.72 0.00 0.00 0.91 0.00 0.00 203 F 9.62 5.14 0.00 3.04 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 0.00 204 G 8.77 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 0.00 205 P 0.00 4.80 0.00 2.22 2.30 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 2.05 0.00 206 E 9.01 3.89 0.00 2.08 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 2.39 2.39 0.00 207 G 8.10 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 0.00 208 G 8.07 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 L 8.28 4.34 0.00 1.69 1.63 0.98 1.09 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 0.00 210 T 9.30 4.59 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 211 E 8.70 3.88 0.00 2.04 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 2.48 2.44 0.00 212 A 7.94 3.93 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 0.00 213 E 8.00 3.79 0.00 2.18 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 1.47 1.88 0.00 214 V 7.95 3.40 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 0.74 0.00 0.00 -0.01 0.00 0.00 215 E 7.93 4.01 0.00 2.30 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 216 R 8.01 4.01 0.00 2.06 2.08 0.00 3.30 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.98 0.00 217 L 8.23 3.98 0.00 1.78 1.63 0.97 0.22 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 0.00 218 T 8.83 4.69 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 219 E 7.90 4.17 0.00 2.13 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 0.00 2.54 2.39 0.00 220 Q 7.23 4.41 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.07 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 221 D 7.76 4.66 0.00 2.79 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 0.00 222 G 8.16 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 0.00 223 V 8.38 4.89 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 1.02 0.00 0.00 0.93 0.00 0.00 224 T 8.62 4.71 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 1.24 0.00 0.00 225 C 9.44 4.88 0.00 2.88 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 G 8.73 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 L 8.09 4.48 0.00 1.18 0.72 0.90 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 228 G 8.06 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 0.00 229 P 0.00 4.38 0.00 2.16 2.16 0.00 3.75 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 1.97 0.00 230 R 7.53 4.26 0.00 1.77 1.85 0.00 3.20 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 231 I 8.12 3.97 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.69 0.87 0.00 0.00 232 L 8.10 4.64 0.00 1.52 1.52 0.88 0.63 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 0.00 233 R 8.17 4.22 0.00 1.81 1.94 0.00 3.05 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 234 T 8.44 3.84 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 1.29 0.00 0.00 235 E 8.00 4.18 0.00 2.26 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 0.00 2.14 1.93 0.00 236 T 8.11 4.29 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 237 A 7.93 3.96 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 0.00 238 P 0.00 4.12 0.00 1.97 1.55 0.00 3.24 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.99 0.00 239 L 7.85 3.97 0.00 2.11 1.77 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 240 Y 8.18 3.97 0.00 3.10 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 0.00 241 A 8.37 4.23 1.66 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 0.00 0.00 242 L 8.28 4.08 0.00 1.72 1.76 0.96 0.83 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 0.00 243 S 8.41 4.14 0.00 3.92 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 0.00 244 A 8.49 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 I 7.93 3.67 2.08 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.55 0.92 0.00 0.00 246 S 8.24 4.13 0.00 3.93 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 0.00 247 Y 8.11 3.98 0.00 3.12 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 Q 8.39 3.80 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.59 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 249 T 8.21 3.84 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 1.18 0.00 0.00 250 E 8.31 4.52 0.00 1.98 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 2.20 2.27 0.00 251 L 7.72 4.21 0.00 1.36 1.26 0.90 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 252 L 7.39 4.14 0.00 1.64 1.58 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 253 R 7.22 4.16 0.00 1.91 1.78 0.00 3.16 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.80 0.00 * Residues marked with a * may have inaccurate shift predictions.