NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1649 8.2629 120.2770 54.7416 33.2113 174.8734 2 K 4.2564 8.4790 130.4025 54.8286 32.1903 172.2590 3 G 3.9587 8.7088 114.0010 43.9720 0.0000 172.0982 4 D 4.5925 8.4581 119.6790 54.2439 41.9329 176.9549 5 T 3.8708 8.9117 122.9916 66.9285 68.4907 176.5644 6 K 3.8271 8.1681 120.7556 58.9555 32.2008 178.9068 7 V 3.9225 8.4169 118.9074 66.2501 31.4451 177.9866 8 I 3.7932 7.9525 119.4760 64.5772 36.8797 178.1891 9 N 4.2525 8.2744 117.3367 56.4147 38.2194 177.0898 10 Y 4.0618 8.1851 118.4331 61.1027 37.9066 178.5553 11 L 3.8347 8.4923 120.3122 57.9054 41.6271 179.4317 12 N 4.2911 8.4106 116.6491 55.9230 38.4527 177.4245 13 K 3.8595 8.0645 121.2079 59.5181 32.2915 178.9658 14 L 3.8821 8.0220 119.6393 57.4210 41.3360 179.0720 15 L 4.0109 7.7505 120.8625 58.1624 42.0972 179.2530 16 G 3.6171 8.1263 105.6618 47.9663 0.0000 175.3294 17 N 4.3876 8.1411 118.8033 56.1749 38.4592 177.4137 18 E 4.1210 8.3958 120.0600 59.3562 29.3305 179.3474 19 L 4.1162 8.2728 119.3887 57.6989 41.5698 179.7534 20 V 3.5765 7.7780 117.6799 65.9997 31.4878 178.0135 21 A 3.8772 8.0949 120.5240 54.9685 18.1350 179.4061 22 I 3.7571 8.2580 118.8724 64.9311 37.2561 178.4107 23 N 4.3742 7.8882 116.8054 56.2955 38.3321 177.4239 24 Q 3.8200 8.3280 121.2614 59.4631 29.0844 177.9002 25 Y 4.2542 8.3711 118.2494 60.8253 37.8411 178.1650 26 F 3.7695 8.5950 121.8758 61.1265 39.4948 176.9555 27 L 3.9850 8.2007 119.9899 58.4832 41.8072 178.4194 28 H 3.7789 8.3159 116.0515 58.7362 28.5386 177.4297 29 A 4.1316 8.1366 122.5187 55.5430 18.2306 180.0218 30 R 3.7949 7.7846 116.0462 58.9984 30.0494 179.3161 31 M 3.4808 7.9304 119.2862 58.1145 31.7659 178.4830 32 F 4.6621 7.7769 118.2359 60.6891 39.1227 177.6895 33 K 3.9742 8.3800 119.3671 59.5319 31.7905 178.2710 34 N 4.3160 7.9662 116.2784 56.4964 38.9549 176.2098 35 W 4.7976 8.0034 117.6113 57.1948 29.3796 177.2301 36 G 3.9999 8.2972 108.0986 45.8247 0.0000 174.0788 37 L 4.7398 8.1908 122.6845 52.9052 40.4314 177.3475 38 K 3.9503 8.0939 122.2040 59.2988 32.4910 178.2169 39 R 3.8946 8.1160 118.9918 59.7676 29.8782 178.5511 40 L 4.0323 7.7567 117.9326 57.4692 41.6577 178.4212 41 N 4.5138 8.2579 117.1562 57.0745 38.8549 176.4658 42 D 4.3295 8.1339 119.8035 57.4349 40.9262 179.1150 43 V 3.3331 7.6277 118.4477 66.0631 31.4213 177.9785 44 E 3.8521 8.3221 118.3669 59.2345 29.2117 178.6803 45 Y 3.8051 8.4120 120.1143 61.1451 38.8079 178.1048 46 H 4.0081 8.2600 116.8323 58.5569 28.7214 177.7150 47 E 3.5173 8.1068 121.1960 58.9204 28.9688 179.0895 48 S 4.1478 7.8721 113.4194 61.5797 62.4591 176.3202 49 I 3.5512 7.5208 122.4023 64.4934 36.7788 178.1846 50 D 4.2508 8.0896 119.8474 57.3491 40.5167 178.7174 51 E 4.2480 8.1469 120.4661 58.9285 29.3997 179.1748 52 M 4.0664 8.2340 119.0685 58.3918 32.0276 178.9375 53 K 3.9668 8.1436 118.5517 59.6300 32.1578 179.0874 54 H 4.0941 8.2286 116.2564 58.8365 28.6092 177.5379 55 A 4.2150 8.4025 122.8409 55.3146 18.1200 179.0159 56 D 4.2977 8.2475 116.4037 57.6633 41.3107 178.6747 57 R 3.8690 7.9820 118.3192 59.5670 30.0031 178.6616 58 Y 4.3324 7.9441 116.3575 61.1624 37.8902 178.6229 59 I 3.7780 8.2790 121.0863 64.6310 37.2748 178.3394 60 E 4.0328 8.5148 119.5246 59.4033 29.2439 179.4918 61 R 4.0546 8.2314 118.7329 59.4552 30.1852 178.5272 62 I 3.7644 8.2622 120.0514 64.5329 37.1665 178.4420 63 L 4.0248 8.1356 119.7236 57.6726 41.2152 179.2002 64 F 4.3523 8.2016 119.6562 61.3411 39.6206 176.4177 65 L 4.7316 7.9683 117.3926 53.8067 41.1111 177.2688 66 E 3.8433 7.8959 117.3849 57.2854 27.1312 174.6434 67 G 3.9080 7.9184 108.3580 44.2192 0.0000 173.7564 68 L 4.5476 7.9959 118.9455 51.9813 42.2397 175.1946 69 P 4.3829 0.0000 0.0000 62.4871 31.7714 176.0321 70 N 4.6896 9.2565 122.5295 52.4545 38.4916 173.9634 71 L 4.6284 8.2895 124.0021 54.4979 42.4376 177.4931 72 Q 4.0713 8.3781 121.8364 57.9067 29.3190 175.5953 73 D 4.5932 8.1413 117.9453 52.9552 41.2009 175.1273 74 L 4.5119 8.3223 126.7503 52.8787 43.4640 176.4925 75 G 3.8687 8.3738 115.2593 44.3003 0.0000 172.3663 76 K 4.0414 8.3211 120.6541 56.1988 32.5630 176.2628 77 L 4.3716 8.2474 125.9895 53.8720 42.7846 176.2470 78 N 4.8219 8.8660 120.2321 51.7419 39.6898 174.4819 79 I 3.7434 8.3774 125.6386 63.9410 37.5927 178.2566 80 G 4.2147 8.1991 102.5226 45.8519 0.0000 172.6846 81 E 4.7975 9.2699 116.8223 55.3044 31.7193 176.1330 82 D 5.0178 7.7539 117.7594 50.3330 44.1135 176.3194 83 V 4.0206 8.3321 118.3852 66.4649 31.4484 177.4446 84 E 3.8867 8.2234 118.3883 59.3415 29.5204 178.2094 85 E 3.9479 8.7013 119.3302 59.3789 29.6721 178.7575 86 M 4.0429 8.3457 118.9048 58.4833 32.0291 178.7791 87 L 4.2306 8.2578 119.1442 57.8701 41.7192 179.7875 88 R 3.9421 8.3576 118.3953 59.2375 29.9124 179.0657 89 S 4.1006 8.3407 113.0300 61.4433 62.4202 175.8586 90 D 4.2175 8.2972 121.6532 57.2650 40.5350 178.6420 91 L 4.0360 8.2779 120.6660 58.0695 42.1012 178.7950 92 A 4.0005 8.2240 120.8997 55.1111 18.2601 179.3335 93 L 3.8960 8.1480 118.9136 58.3126 42.0582 179.0884 94 E 4.0426 8.3664 118.5078 59.5051 29.4419 179.3711 95 L 4.0306 8.1721 119.0545 57.8328 41.5230 179.3006 96 D 4.4723 8.4382 119.1344 57.3984 40.7018 179.1329 97 G 3.6408 8.4369 106.1333 47.6020 0.0000 175.6359 98 A 4.0280 8.3806 123.3481 54.8783 18.5343 179.6740 99 K 3.8583 8.0318 117.0048 59.9224 32.1843 179.2851 100 N 4.4109 8.0073 116.3770 56.1699 38.3735 177.4414 101 L 3.9914 8.1864 120.5805 58.0024 41.7590 179.7339 102 R 3.9141 8.2003 118.0742 59.2678 29.9895 178.8239 103 E 3.8562 8.1080 118.4430 59.1766 29.6440 178.7091 104 A 2.8704 7.7073 120.8026 54.7834 18.3640 179.7282 105 I 3.7517 8.1289 118.9273 64.2857 37.1536 178.8095 106 G 3.6049 7.9802 106.6346 48.0111 0.0000 175.1162 107 Y 4.0089 8.1921 123.3986 59.6806 38.8416 177.6584 108 A 3.7890 8.3214 122.1679 55.1305 18.3986 179.0221 109 D 4.0757 7.9247 116.5550 57.5428 41.0612 178.7155 110 S 3.9827 7.7452 114.6045 60.9164 62.5938 175.8004 111 V 3.9020 6.8079 112.9918 60.5183 31.4448 175.8793 112 H 2.8410 7.0969 114.4719 56.8233 26.8491 176.4030 113 D 4.5322 7.3174 120.9417 53.5263 37.7730 176.1371 114 Y 4.2956 7.4560 120.9044 60.3295 38.4710 177.8891 115 V 3.6530 7.8264 119.2632 66.0690 31.8183 178.0129 116 S 4.1996 8.4140 115.0035 61.5224 62.5668 176.6478 117 R 3.8985 8.0608 121.4315 59.4511 29.9561 177.9637 118 D 4.3168 8.3519 117.9376 57.5575 41.1958 177.8206 119 M 3.9668 8.1333 118.5325 59.1718 32.2029 178.2055 120 M 4.1443 8.2109 118.6459 58.3216 32.0907 178.8660 121 I 3.7442 8.0663 120.3334 64.3622 37.2831 178.2618 122 E 3.9822 8.1063 119.2099 59.4901 29.1865 179.5380 123 I 3.5576 7.7256 119.8842 64.0959 37.0281 178.1378 124 L 3.9256 8.2950 121.6923 58.0842 41.8804 178.9509 125 R 3.8727 8.0427 118.5456 59.6029 30.0295 178.1243 126 D 4.3185 7.9750 118.4599 57.6218 40.7643 178.8282 127 E 3.9960 8.3804 119.1566 59.3723 29.3501 179.2752 128 E 4.1190 8.7245 119.2763 59.1069 29.4479 179.6008 129 G 3.6435 8.1139 106.0380 48.1263 0.0000 175.5100 130 H 4.4459 8.2340 118.7838 58.6529 28.6832 177.8205 131 I 3.8123 8.2128 121.9161 64.5156 37.0130 177.7764 132 D 4.3688 8.4241 118.8485 57.1977 40.9772 178.1199 133 W 4.1756 8.3731 128.6504 60.5286 30.7505 177.8666 134 L 3.7460 8.4825 118.9905 57.8487 41.1213 179.3472 135 E 3.9363 8.3867 118.5687 59.6868 29.3158 179.6661 136 T 3.7919 7.8719 115.5970 66.6297 68.5341 176.6037 137 E 3.7554 7.8737 120.6807 59.3038 28.9876 179.3596 138 L 3.7647 7.7273 118.8820 57.9719 41.6551 179.4440 139 D 4.3038 8.0273 118.6907 57.2640 40.6478 178.8063 140 L 3.9929 8.0770 119.7213 57.6658 41.6789 179.4743 141 I 3.3618 7.4643 119.8691 64.3551 36.7442 178.2488 142 Q 3.9042 7.3681 118.5655 59.0898 28.9756 178.0498 143 K 4.1376 8.0625 118.8211 58.8998 32.2739 178.3782 144 M 4.3911 8.2968 114.5604 53.9317 32.4718 177.1266 145 G 4.1172 7.5315 105.6191 46.0245 0.0000 174.4370 146 L 3.9793 8.3415 121.5542 57.9664 42.1300 179.5324 147 Q 3.9839 7.9994 117.5494 59.1174 28.7813 178.3029 148 N 4.3379 8.1286 116.9946 56.3351 38.3965 176.6116 149 Y 3.9860 8.0027 120.0414 60.8187 39.2385 177.9810 150 L 4.0571 8.4605 120.2961 57.7305 41.3318 179.1763 151 Q 3.9408 8.0806 119.3498 59.0765 28.7900 177.8267 152 A 4.1163 7.7622 119.3174 53.5329 18.6903 178.2179 153 Q 4.2966 7.7409 116.1106 55.6927 29.3614 177.4516 154 I 4.0921 7.2664 112.6525 62.0987 38.1819 176.4438 155 R 4.5557 7.5515 119.0352 54.0349 31.6407 175.9725 156 E 4.0710 8.5643 120.7939 56.4648 30.1252 175.9375 157 E 4.4244 8.5054 122.3058 54.2549 31.5394 176.1147 *158 G 3.7389 8.6595 114.0207 45.8928 0.0000 172.1643 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 1 M 8.26 4.16 0.00 1.34 1.77 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.44 0.00 2 K 8.48 4.26 0.00 1.66 1.61 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.36 1.08 7.81 3 G 8.71 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 4 D 8.46 4.59 0.00 2.84 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 5 T 8.91 3.87 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 1.18 0.00 0.00 6 K 8.17 3.83 0.00 1.69 1.86 0.00 1.39 0.00 0.00 0.84 0.00 0.00 2.61 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.79 0.99 7.81 7 V 8.42 3.92 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.18 0.00 0.00 8 I 7.95 3.79 2.03 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 1.55 0.60 0.91 0.00 0.00 9 N 8.27 4.25 0.00 2.67 2.64 0.00 0.00 7.03 7.01 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 10 Y 8.19 4.06 0.00 3.18 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 11 L 8.49 3.83 0.00 1.82 1.80 1.06 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.41 4.29 0.00 2.90 2.81 0.00 0.00 6.63 8.45 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 13 K 8.06 3.86 0.00 1.75 1.96 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.43 1.45 7.81 14 L 8.02 3.88 0.00 0.93 1.25 0.93 0.51 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 15 L 7.75 4.01 0.00 1.69 1.80 1.02 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.13 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.14 4.39 0.00 2.96 2.91 0.00 0.00 7.05 6.95 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 18 E 8.40 4.12 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.87 0.00 19 L 8.27 4.12 0.00 1.82 1.72 0.93 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.78 3.58 2.22 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 1.10 0.00 0.00 1.00 0.00 0.00 21 A 8.09 3.88 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.26 3.76 2.06 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 1.62 0.79 0.92 0.00 0.00 23 N 7.89 4.37 0.00 2.91 2.86 0.00 0.00 6.74 7.62 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 24 Q 8.33 3.82 0.00 2.04 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 25 Y 8.37 4.25 0.00 3.12 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.59 3.77 0.00 3.31 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.20 3.99 0.00 1.83 1.67 0.88 0.93 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 28 H 8.32 3.78 0.00 3.47 3.11 0.00 5.70 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.14 4.13 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 30 R 7.78 3.79 0.00 1.78 1.93 0.00 3.20 0.00 0.00 3.07 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.87 0.00 31 M 7.93 3.48 0.00 0.88 1.52 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.19 0.00 32 F 7.78 4.66 0.00 3.27 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 33 K 8.38 3.97 0.00 2.08 1.92 0.00 1.56 0.00 0.00 1.52 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.43 7.81 34 N 7.97 4.32 0.00 2.63 2.71 0.00 0.00 7.32 7.48 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 35 W 8.00 4.80 0.00 3.76 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.30 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.19 4.74 0.00 1.96 1.63 1.19 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.09 3.95 0.00 1.89 1.86 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.61 7.81 39 R 8.12 3.89 0.00 2.07 2.06 0.00 3.06 0.00 0.00 3.54 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 40 L 7.76 4.03 0.00 1.45 0.66 0.50 0.69 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 41 N 8.26 4.51 0.00 3.09 3.02 0.00 0.00 7.23 8.17 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 42 D 8.13 4.33 0.00 2.89 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 43 V 7.63 3.33 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 -0.48 0.00 0.00 0.80 0.00 0.00 44 E 8.32 3.85 0.00 2.37 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 0.00 2.59 3.15 0.00 45 Y 8.41 3.81 0.00 2.84 2.99 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 46 H 8.26 4.01 0.00 3.18 3.24 0.00 5.87 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 47 E 8.11 3.52 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 2.01 1.71 0.00 48 S 7.87 4.15 0.00 3.94 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 49 I 7.52 3.55 1.79 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.33 0.83 0.00 0.00 50 D 8.09 4.25 0.00 2.79 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 51 E 8.15 4.25 0.00 2.20 2.22 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 2.74 2.67 0.00 52 M 8.23 4.07 0.00 2.03 2.24 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.56 0.00 53 K 8.14 3.97 0.00 1.88 1.81 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.60 7.81 54 H 8.23 4.09 0.00 3.54 3.40 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.40 4.22 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.25 4.30 0.00 2.91 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 57 R 7.98 3.87 0.00 1.82 1.78 0.00 3.13 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 58 Y 7.94 4.33 0.00 3.20 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 59 I 8.28 3.78 2.06 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 1.58 1.07 0.95 0.00 0.00 60 E 8.51 4.03 0.00 2.02 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 2.35 2.62 0.00 61 R 8.23 4.05 0.00 2.10 2.18 0.00 3.37 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.86 0.00 62 I 8.26 3.76 2.11 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 1.58 0.71 0.99 0.00 0.00 63 L 8.14 4.02 0.00 1.90 1.77 0.99 0.86 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 64 F 8.20 4.35 0.00 3.00 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 65 L 7.97 4.73 0.00 1.91 1.61 0.99 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.90 3.84 0.00 2.08 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 2.15 2.24 0.00 67 G 7.92 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 68 L 8.00 4.55 0.00 1.61 1.62 0.91 1.00 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 69 P 0.00 4.38 0.00 2.06 2.02 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 2.06 2.11 0.00 70 N 9.26 4.69 0.00 2.61 2.81 0.00 0.00 7.08 7.33 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 71 L 8.29 4.63 0.00 1.63 1.64 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.38 4.07 0.00 1.99 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.58 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 73 D 8.14 4.59 0.00 2.68 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 74 L 8.32 4.51 0.00 1.55 1.53 0.91 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.37 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 76 K 8.32 4.04 0.00 1.70 1.72 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.51 7.81 77 L 8.25 4.37 0.00 1.65 1.53 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.87 4.82 0.00 2.59 2.69 0.00 0.00 7.19 8.77 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 79 I 8.38 3.74 1.88 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 1.33 0.90 0.92 0.00 0.00 80 G 8.20 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 0.00 0.00 0.00 0.00 81 E 9.27 4.80 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 82 D 7.75 5.02 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 83 V 8.33 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 1.19 0.00 0.00 1.23 0.00 0.00 84 E 8.22 3.89 0.00 2.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 85 E 8.70 3.95 0.00 2.12 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 2.35 2.38 0.00 86 M 8.35 4.04 0.00 1.69 2.38 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.59 0.00 87 L 8.26 4.23 0.00 1.73 1.76 0.86 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.36 3.94 0.00 2.04 1.99 0.00 3.12 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 89 S 8.34 4.10 0.00 3.93 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 90 D 8.30 4.22 0.00 3.06 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 91 L 8.28 4.04 0.00 1.83 1.85 0.99 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.22 4.00 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 93 L 8.15 3.90 0.00 1.81 1.80 0.91 0.79 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 94 E 8.37 4.04 0.00 2.31 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 0.00 2.63 2.73 0.00 95 L 8.17 4.03 0.00 1.86 1.74 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.44 4.47 0.00 2.85 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 97 G 8.44 3.64 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 0.00 0.00 0.00 98 A 8.38 4.03 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.03 3.86 0.00 2.04 1.90 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.68 7.81 100 N 8.01 4.41 0.00 2.91 2.91 0.00 0.00 7.08 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 8.19 3.99 0.00 1.94 1.74 0.97 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.20 3.91 0.00 2.00 1.98 0.00 3.14 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 1.66 1.87 0.00 103 E 8.11 3.86 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 104 A 7.71 2.87 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.13 3.75 1.97 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 1.46 0.86 0.92 0.00 0.00 106 G 7.98 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 8.19 4.01 0.00 3.09 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 0.00 108 A 8.32 3.79 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 0.00 109 D 7.92 4.08 0.00 2.86 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 0.00 110 S 7.75 3.98 0.00 3.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 6.81 3.90 1.87 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 0.30 0.00 0.00 0.64 0.00 0.00 112 H 7.10 2.84 0.00 3.20 3.30 0.00 5.65 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.32 4.53 0.00 2.63 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 0.00 114 Y 7.46 4.30 0.00 3.06 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 0.00 115 V 7.83 3.65 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.00 0.00 0.00 116 S 8.41 4.20 0.00 4.07 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 0.00 117 R 8.06 3.90 0.00 1.91 2.18 0.00 3.32 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 118 D 8.35 4.32 0.00 2.99 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 M 8.13 3.97 0.00 2.28 2.03 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.43 0.00 120 M 8.21 4.14 0.00 2.17 2.14 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 2.89 2.84 0.00 121 I 8.07 3.74 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.05 0.92 0.00 0.00 122 E 8.11 3.98 0.00 2.19 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 2.32 2.53 0.00 123 I 7.73 3.56 1.91 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.66 0.72 0.00 0.00 124 L 8.30 3.93 0.00 1.81 1.84 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.04 3.87 0.00 1.93 2.11 0.00 3.15 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 1.63 1.68 0.00 126 D 7.97 4.32 0.00 2.94 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 0.00 127 E 8.38 4.00 0.00 2.12 2.22 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 2.62 2.55 0.00 128 E 8.72 4.12 0.00 2.14 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 2.36 2.51 0.00 129 G 8.11 3.64 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 0.00 0.00 0.00 130 H 8.23 4.45 0.00 3.53 3.54 0.00 5.65 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 0.00 131 I 8.21 3.81 2.11 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.81 0.97 0.00 0.00 132 D 8.42 4.37 0.00 2.98 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 0.00 133 W 8.37 4.18 0.00 3.52 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.48 3.75 0.00 2.00 1.78 1.22 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.39 3.94 0.00 2.14 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 2.57 0.00 136 T 7.87 3.79 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 1.17 0.00 0.00 137 E 7.87 3.76 0.00 1.49 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 138 L 7.73 3.76 0.00 1.74 1.62 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 139 D 8.03 4.30 0.00 2.79 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 0.00 140 L 8.08 3.99 0.00 1.88 1.83 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.46 3.36 1.70 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.16 0.07 0.70 0.00 0.00 142 Q 7.37 3.90 0.00 1.98 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.97 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 143 K 8.06 4.14 0.00 1.76 1.84 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.53 7.81 144 M 8.30 4.39 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.89 0.00 145 G 7.53 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 0.00 146 L 8.34 3.98 0.00 1.74 1.66 0.94 0.71 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 0.00 147 Q 8.00 3.98 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 148 N 8.13 4.34 0.00 2.94 2.88 0.00 0.00 6.71 7.48 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 0.00 149 Y 8.00 3.99 0.00 3.00 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 0.00 150 L 8.46 4.06 0.00 1.69 1.68 0.88 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.08 3.94 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 152 A 7.76 4.12 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 7.74 4.30 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 154 I 7.27 4.09 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.33 1.00 0.00 0.00 155 R 7.55 4.56 0.00 1.79 1.87 0.00 3.20 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 156 E 8.56 4.07 0.00 1.94 1.87 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 2.48 2.29 0.00 157 E 8.51 4.42 0.00 1.89 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 2.19 2.26 0.00 *158 G 8.66 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 * Residues marked with a * may have inaccurate shift predictions.