NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1831 8.1633 120.2794 54.6647 33.0952 174.1901 2 K 3.9790 8.5002 126.3710 56.2483 32.4247 175.7394 3 G 3.9374 8.6803 113.6136 44.8543 0.0000 171.9588 4 D 4.5305 8.4849 119.8480 54.4195 41.8535 176.8137 5 T 3.8775 8.9929 123.1670 66.9538 68.4933 176.3846 6 K 3.8302 8.1426 120.7922 59.2161 32.2547 178.7650 7 V 3.9172 8.6563 118.9114 66.1955 31.4270 177.9008 8 I 3.7382 7.8462 119.4166 64.6939 36.9138 178.0945 9 N 4.2787 8.2251 117.0470 56.4258 38.3045 177.0829 10 Y 4.0607 8.0597 118.1016 61.0989 38.0246 178.5343 11 L 3.8709 8.4680 120.2257 58.0642 41.6773 179.4767 12 N 4.3859 8.5575 116.6780 56.0011 38.4122 177.4801 13 K 3.8699 8.1348 121.3339 59.3633 32.3009 178.9412 14 L 3.8067 8.1351 119.6831 57.5067 41.3829 178.9393 15 L 3.9822 7.7819 120.7953 58.2497 42.0398 179.0746 16 G 3.7204 8.1874 105.6194 48.1456 0.0000 175.1868 17 N 4.3447 8.0277 118.9744 56.0684 38.5804 177.3832 18 E 4.0037 8.3607 119.9225 59.3865 29.4120 179.3888 19 L 4.0022 8.1524 119.2225 57.6334 41.5595 179.8138 20 V 3.4663 7.6506 117.4373 65.9720 31.5323 177.9091 21 A 3.2231 7.8776 120.4794 54.8115 18.0945 179.3430 22 I 3.5617 7.9931 118.6081 64.8663 37.2197 178.3864 23 N 4.3549 7.7968 116.8176 56.3516 38.3254 177.4167 24 Q 3.8756 8.1513 121.1695 59.4805 29.0807 177.9028 25 Y 4.6145 8.2972 118.2444 60.8602 37.9430 178.0810 26 F 3.8311 8.4616 121.8690 61.0491 39.5355 176.9803 27 L 3.9500 8.2180 120.0292 58.5414 41.8562 178.4725 28 H 3.8285 8.3450 116.0705 58.6995 28.5512 177.4190 29 A 4.0631 8.1026 122.6066 55.5121 18.1830 179.8710 30 R 3.8386 7.6355 115.3752 58.5434 30.1067 179.2517 31 M 3.4534 7.7285 119.2391 58.1696 31.8414 178.3605 32 F 4.6409 7.5546 118.0305 60.6774 39.0247 177.7163 33 K 3.9297 8.2574 119.0975 59.5807 31.8257 178.1195 34 N 4.2455 7.9692 116.1506 56.6412 38.9031 176.1116 35 W 4.8280 7.9736 116.8807 57.0465 29.0452 177.1132 36 G 3.9821 8.5217 108.4590 45.9960 0.0000 174.3278 37 L 4.7332 8.2029 122.7223 52.6219 40.4460 176.9861 38 K 3.8578 8.1459 123.6825 59.6606 32.5897 177.6050 39 R 3.8982 8.1355 118.7534 59.4559 29.9096 178.5296 40 L 4.0508 7.7612 118.3849 57.5179 41.5750 178.6246 41 N 4.4383 8.3261 117.1130 56.8486 38.9009 176.5141 42 D 4.3992 8.2118 120.1147 57.4795 40.9656 179.0636 43 V 3.3603 7.6470 118.3925 65.9469 31.4841 177.6633 44 E 3.8558 8.5385 119.4668 59.3455 29.4858 178.1159 45 Y 3.9528 8.4232 120.0086 61.1141 38.9522 177.7912 46 H 4.0900 8.3848 116.7770 58.2645 28.8154 177.4439 47 E 3.8255 8.1324 121.8437 58.9641 29.4352 178.5688 48 S 4.2312 8.1748 113.3329 61.5373 62.4909 176.1862 49 I 3.5694 7.5803 122.4255 64.4672 36.7879 178.0800 50 D 4.2640 7.9397 119.5502 57.5201 40.5537 178.8228 51 E 4.0696 8.1896 118.6360 59.2930 29.3555 179.2708 52 M 4.0336 7.8680 119.0432 58.2754 31.9928 178.7566 53 K 3.9001 8.0805 118.5904 59.7752 32.2227 179.0851 54 H 4.0948 8.0460 116.1386 58.7854 28.6094 177.5863 55 A 4.2289 8.3456 122.8579 55.3568 18.1768 179.0990 56 D 4.2957 8.3071 116.5004 57.6056 41.3027 178.7377 57 R 3.8635 7.9118 118.4804 59.4107 30.0557 178.6682 58 Y 4.3116 7.8195 116.4024 61.1589 37.9125 178.5649 59 I 3.7578 8.2707 121.0954 64.6892 37.1906 178.3826 60 E 4.0386 8.3959 119.2929 59.2975 29.1703 179.4940 61 R 4.0261 8.2149 118.7762 59.5210 30.1421 178.5374 62 I 3.7616 8.4076 119.9873 64.4682 37.1258 178.4453 63 L 4.0021 8.1418 119.7029 57.7859 41.2615 179.2869 64 F 4.3541 8.4031 119.7388 61.2726 39.6818 176.4034 65 L 4.5171 8.1080 117.6262 53.9896 41.1927 177.3105 66 E 3.8554 8.0074 117.6580 57.2809 27.0490 174.5761 67 G 3.9356 8.0111 108.9498 44.1327 0.0000 173.6136 68 L 4.5336 8.0154 119.2212 52.0043 42.1007 175.0840 69 P 4.3660 0.0000 0.0000 62.5421 31.7692 175.9762 70 N 4.7074 9.6508 122.3613 52.4101 38.7546 174.0030 71 L 4.6070 8.2930 124.2395 54.5251 42.4891 177.5119 72 Q 4.0919 8.5171 121.9705 58.0203 29.3089 175.8144 73 D 4.6763 8.0779 117.4041 52.6262 41.9504 175.2372 74 L 4.5255 8.2896 125.7297 52.6935 43.7945 176.1980 75 G 3.8088 8.4617 115.3406 44.6908 0.0000 171.9837 76 K 4.0353 8.3043 120.6849 56.1269 32.4520 176.4911 77 L 4.2679 8.2973 126.2758 54.4345 42.4142 176.4673 78 N 4.8058 8.7716 120.0918 51.7077 39.1902 172.4998 79 I 4.2448 8.1184 124.3292 59.7478 38.1796 176.6444 80 G 4.0468 8.7715 114.5928 45.1636 0.0000 172.7843 81 E 4.7342 8.6143 117.6763 56.1907 31.0803 176.3731 82 D 4.9138 7.7003 117.9658 50.3034 44.0646 176.0570 83 V 4.0048 8.4178 118.9054 66.5452 31.3558 177.5169 84 E 3.8636 8.1885 118.1875 59.3947 29.5171 178.2188 85 E 3.9801 8.4040 118.9010 59.4374 29.6576 178.7582 86 M 4.0506 8.2470 118.7369 58.4112 32.0104 178.7242 87 L 4.1437 8.2003 119.1000 58.0228 41.7379 179.8293 88 R 3.9308 8.4178 118.3885 59.2264 29.9598 179.1591 89 S 4.1493 8.3358 113.0192 61.4127 62.3673 175.8207 90 D 4.6949 8.4263 121.6841 57.3792 40.5896 178.4740 91 L 3.9431 8.2460 120.6054 58.3395 42.1318 178.9363 92 A 4.0346 8.3324 120.8133 55.0332 18.2672 179.3678 93 L 3.9762 8.1144 118.9293 58.3729 42.1165 179.1148 94 E 4.1141 8.6246 118.7884 59.3714 29.4480 179.3210 95 L 4.0275 8.1681 119.0672 58.0081 41.7828 179.3012 96 D 4.5117 8.3882 118.9691 57.3698 40.6479 179.1899 97 G 3.6375 8.3425 106.0938 47.6259 0.0000 175.6923 98 A 4.0258 8.4738 123.5643 54.6359 18.4924 179.4814 99 K 3.8360 8.0222 118.0966 59.9284 32.3207 178.7140 100 N 4.3895 8.0898 116.3901 56.2719 38.4012 177.2903 101 L 3.9990 8.1745 120.5104 57.9805 41.7458 179.8057 102 R 3.9009 8.2437 118.0734 59.1589 30.0315 178.6666 103 E 3.8277 8.0258 118.2935 59.3316 29.5925 178.7582 104 A 2.8922 7.7303 120.6163 54.8217 18.4258 179.6420 105 I 3.7223 8.1187 118.8899 64.3631 36.9281 178.9162 106 G 3.5807 7.7611 105.5688 47.9597 0.0000 174.8958 107 Y 4.1232 8.0050 122.0454 60.1879 38.8781 177.4234 108 A 3.7863 8.2166 122.1254 55.2702 18.4003 179.0490 109 D 4.1257 7.8218 116.0634 57.4439 41.1248 178.4992 110 S 4.1717 7.5002 112.6952 60.1131 63.2609 175.6610 111 V 3.9893 6.8482 113.9599 60.7423 31.6315 175.6174 112 H 2.7789 7.0843 114.2746 56.5864 26.9153 176.4653 113 D 4.5217 7.2984 121.3760 53.7117 37.8854 176.1413 114 Y 4.3213 7.4922 121.3140 60.5625 38.4980 177.8469 115 V 3.7318 7.8823 113.2282 64.2664 31.7588 178.4996 116 S 4.1955 8.3594 115.0088 61.4792 62.5766 176.6147 117 R 3.8918 8.0330 121.3852 59.5553 29.7822 178.0549 118 D 4.3189 8.3638 117.9081 57.5714 41.3045 177.8342 119 M 4.0073 8.2069 118.7030 59.0160 32.1629 178.1782 120 M 4.1764 8.2294 118.8564 58.2966 32.0762 178.8412 121 I 3.7290 8.1685 120.5466 64.3020 37.2413 178.2090 122 E 3.9748 8.0130 119.1957 59.4872 29.2229 179.5399 123 I 3.5494 7.5715 119.2823 64.2135 37.0759 178.1847 124 L 3.9551 8.1642 121.4094 58.1315 41.9888 178.9772 125 R 3.9071 8.1699 118.6577 59.6250 30.1588 178.2858 126 D 4.4400 8.1082 118.6912 57.3945 40.7851 178.6702 127 E 4.1370 8.4422 119.3362 59.5027 29.4445 179.2274 128 E 4.2529 8.7751 119.2379 59.1949 29.4490 179.5904 129 G 3.6797 8.0843 105.5417 48.0933 0.0000 175.2961 130 H 4.3909 8.2044 120.3492 59.0590 29.8683 177.2679 131 I 3.6965 8.3128 122.1395 64.4641 36.9421 177.7711 132 D 4.3388 8.3852 118.7868 57.0860 41.0018 178.0676 133 W 4.1074 8.2646 128.7082 60.4783 30.7339 177.6469 134 L 3.7680 8.4211 119.0718 58.0204 41.1361 179.3873 135 E 3.8986 8.4556 118.5766 59.7433 29.3040 179.7201 136 T 3.7511 7.8861 115.5530 66.5423 68.5345 176.5088 137 E 3.6762 7.7095 120.5614 59.4167 29.0351 179.4666 138 L 3.7546 7.6876 118.7849 57.8548 41.5539 179.4195 139 D 4.3403 7.9857 118.7977 57.2756 40.6632 178.7538 140 L 3.9486 7.9664 119.7137 57.7348 41.5747 179.5628 141 I 3.3707 7.3744 119.7728 64.3707 36.7459 178.2815 142 Q 3.9113 7.3303 117.8664 58.9952 28.9574 177.9026 143 K 4.1451 8.0651 119.1570 58.6630 32.3120 178.2932 144 M 4.3887 8.3156 114.9241 53.9475 32.5130 177.2638 145 G 4.1050 7.5638 105.5815 45.9666 0.0000 174.3970 146 L 3.9553 8.4063 121.5250 58.0091 42.1837 179.2563 147 Q 3.9691 8.0919 117.4730 59.3442 28.7347 178.7214 148 N 4.3473 8.1363 116.7030 56.3244 38.3761 176.6761 149 Y 3.9209 7.9242 120.1028 60.6221 39.1400 177.8438 150 L 4.0278 8.4591 120.1737 57.9483 41.6540 179.1844 151 Q 3.8826 8.1068 119.1224 59.2160 28.7234 177.9943 152 A 4.0979 7.7456 119.4764 53.6822 18.6927 178.3172 153 Q 4.2310 7.9082 116.3429 55.9167 29.2011 177.3139 154 I 4.1504 7.3152 112.6898 61.5861 38.2300 176.1840 155 R 4.6600 7.5513 119.6682 53.8203 32.4588 175.4878 156 E 4.2425 8.5721 119.4298 55.9900 30.5632 175.6228 157 E 4.4976 8.4184 117.7822 54.3941 31.7204 176.2474 *158 G 3.7100 8.5921 110.1173 45.8809 0.0000 172.3693 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 8.16 4.18 0.00 1.41 1.79 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 2 K 8.50 3.98 0.00 1.71 1.72 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.46 7.81 3 G 8.68 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.48 4.53 0.00 2.77 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 8.99 3.88 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 8.14 3.83 0.00 1.71 2.06 0.00 1.38 0.00 0.00 1.41 0.00 0.00 2.54 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.30 0.96 7.81 7 V 8.66 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 1.14 0.00 0.00 1.18 0.00 0.00 8 I 7.85 3.74 2.06 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 0.58 0.91 0.00 0.00 9 N 8.23 4.28 0.00 2.62 2.66 0.00 0.00 7.09 7.06 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 10 Y 8.06 4.06 0.00 3.22 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 11 L 8.47 3.87 0.00 2.03 1.77 1.10 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.56 4.39 0.00 2.76 2.81 0.00 0.00 6.70 7.96 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 13 K 8.13 3.87 0.00 1.82 1.97 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.44 7.81 14 L 8.14 3.81 0.00 0.78 1.17 0.91 0.48 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 7.78 3.98 0.00 1.69 1.83 1.05 1.13 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 16 G 8.19 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.03 4.34 0.00 2.92 2.89 0.00 0.00 7.09 7.35 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 18 E 8.36 4.00 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.86 0.00 19 L 8.15 4.00 0.00 1.79 1.68 0.90 0.86 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 20 V 7.65 3.47 2.16 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 1.08 0.00 0.00 0.95 0.00 0.00 21 A 7.88 3.22 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 22 I 7.99 3.56 1.96 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 1.53 0.98 0.85 0.00 0.00 23 N 7.80 4.35 0.00 2.78 2.83 0.00 0.00 6.76 8.54 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 24 Q 8.15 3.88 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.60 2.22 0.00 25 Y 8.30 4.61 0.00 3.03 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 26 F 8.46 3.83 0.00 3.41 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 27 L 8.22 3.95 0.00 1.96 1.60 0.90 0.87 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 28 H 8.34 3.83 0.00 3.47 3.00 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 8.10 4.06 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 30 R 7.64 3.84 0.00 1.75 1.88 0.00 3.24 0.00 0.00 3.06 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.66 0.00 31 M 7.73 3.45 0.00 1.01 1.62 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.18 0.00 32 F 7.55 4.64 0.00 3.29 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 33 K 8.26 3.93 0.00 2.06 1.88 0.00 1.66 0.00 0.00 1.48 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.42 7.81 34 N 7.97 4.25 0.00 2.66 2.65 0.00 0.00 7.35 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 35 W 7.97 4.83 0.00 3.74 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 36 G 8.52 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 0.00 0.00 0.00 37 L 8.20 4.73 0.00 1.90 1.62 1.19 0.57 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 38 K 8.15 3.86 0.00 2.02 1.82 0.00 1.62 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.57 7.81 39 R 8.14 3.90 0.00 2.12 2.00 0.00 3.55 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 1.64 1.81 0.00 40 L 7.76 4.05 0.00 1.69 1.11 1.09 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.33 4.44 0.00 3.10 3.01 0.00 0.00 7.20 8.04 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 42 D 8.21 4.40 0.00 2.89 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 43 V 7.65 3.36 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 -0.48 0.00 0.00 0.80 0.00 0.00 44 E 8.54 3.86 0.00 2.48 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 2.59 2.55 0.00 45 Y 8.42 3.95 0.00 2.91 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 46 H 8.38 4.09 0.00 3.26 3.27 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.13 3.83 0.00 2.10 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 1.63 1.76 0.00 48 S 8.17 4.23 0.00 4.10 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.58 3.57 1.82 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.43 0.83 0.00 0.00 50 D 7.94 4.26 0.00 2.99 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 8.19 4.07 0.00 2.02 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 2.73 2.52 0.00 52 M 7.87 4.03 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.53 0.00 53 K 8.08 3.90 0.00 1.88 1.81 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.63 7.81 54 H 8.05 4.09 0.00 3.41 3.32 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 8.35 4.23 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 56 D 8.31 4.30 0.00 2.91 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 57 R 7.91 3.86 0.00 1.82 1.76 0.00 3.13 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 58 Y 7.82 4.31 0.00 3.22 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 59 I 8.27 3.76 2.03 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 1.57 0.99 0.94 0.00 0.00 60 E 8.40 4.04 0.00 2.03 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 2.49 0.00 61 R 8.21 4.03 0.00 2.13 2.20 0.00 3.35 0.00 0.00 3.25 7.55 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 8.41 3.76 2.07 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 1.58 0.72 0.95 0.00 0.00 63 L 8.14 4.00 0.00 2.11 1.79 0.95 0.89 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 64 F 8.40 4.35 0.00 2.93 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.11 4.52 0.00 1.85 1.62 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.01 3.86 0.00 2.07 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 2.15 2.25 0.00 67 G 8.01 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.02 4.53 0.00 1.59 1.62 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.37 0.00 2.05 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 2.05 2.11 0.00 70 N 9.65 4.71 0.00 2.60 2.81 0.00 0.00 7.08 8.31 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 71 L 8.29 4.61 0.00 1.62 1.63 0.93 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 8.52 4.09 0.00 1.97 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.63 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 73 D 8.08 4.68 0.00 2.67 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.29 4.53 0.00 1.51 1.50 0.88 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.46 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.30 4.04 0.00 1.73 1.74 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.46 7.81 77 L 8.30 4.27 0.00 1.65 1.57 0.88 0.96 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 78 N 8.77 4.81 0.00 2.65 2.74 0.00 0.00 7.14 7.25 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 79 I 8.12 4.24 1.90 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 1.35 0.95 0.95 0.00 0.00 80 G 8.77 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.61 4.73 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 82 D 7.70 4.91 0.00 2.75 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 83 V 8.42 4.00 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 1.14 0.00 0.00 1.20 0.00 0.00 84 E 8.19 3.86 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 85 E 8.40 3.98 0.00 2.41 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 2.36 2.39 0.00 86 M 8.25 4.05 0.00 1.80 2.42 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.39 0.00 87 L 8.20 4.14 0.00 2.02 1.71 1.25 0.75 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 88 R 8.42 3.93 0.00 1.86 2.00 0.00 3.12 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 89 S 8.34 4.15 0.00 4.04 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 90 D 8.43 4.69 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 8.25 3.94 0.00 1.84 1.90 0.94 0.99 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 92 A 8.33 4.03 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 93 L 8.11 3.98 0.00 1.98 2.06 0.93 0.70 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 94 E 8.62 4.11 0.00 2.25 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 2.69 2.49 0.00 95 L 8.17 4.03 0.00 2.05 1.75 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.39 4.51 0.00 2.87 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 97 G 8.34 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 8.47 4.03 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.02 3.84 0.00 2.13 1.90 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.66 7.81 100 N 8.09 4.39 0.00 3.01 2.90 0.00 0.00 7.11 6.69 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 0.00 101 L 8.17 4.00 0.00 1.97 1.75 1.01 1.33 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 0.00 102 R 8.24 3.90 0.00 1.98 1.98 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.92 0.00 103 E 8.03 3.83 0.00 2.08 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 2.33 2.38 0.00 104 A 7.73 2.89 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.12 3.72 2.03 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 1.47 0.96 0.92 0.00 0.00 106 G 7.76 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 8.00 4.12 0.00 3.16 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.22 3.79 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 0.00 109 D 7.82 4.13 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 0.00 110 S 7.50 4.17 0.00 4.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 6.85 3.99 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 0.54 0.00 0.00 0.64 0.00 0.00 112 H 7.08 2.78 0.00 3.15 3.28 0.00 5.84 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.30 4.52 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 7.49 4.32 0.00 3.10 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 0.00 115 V 7.88 3.73 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 0.95 0.00 0.00 0.97 0.00 0.00 116 S 8.36 4.20 0.00 4.17 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 0.00 117 R 8.03 3.89 0.00 1.91 2.20 0.00 3.33 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 118 D 8.36 4.32 0.00 2.98 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 8.21 4.01 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 120 M 8.23 4.18 0.00 2.17 2.25 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 2.92 2.84 0.00 121 I 8.17 3.73 1.88 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 1.54 0.81 0.92 0.00 0.00 122 E 8.01 3.97 0.00 2.10 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 2.32 2.50 0.00 123 I 7.57 3.55 1.94 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 1.08 0.53 0.73 0.00 0.00 124 L 8.16 3.96 0.00 1.85 1.86 0.95 1.09 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 0.00 125 R 8.17 3.91 0.00 2.07 2.12 0.00 3.16 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 126 D 8.11 4.44 0.00 3.01 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 0.00 127 E 8.44 4.14 0.00 2.15 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 0.00 2.67 2.57 0.00 128 E 8.78 4.25 0.00 2.03 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 2.37 2.53 0.00 129 G 8.08 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 H 8.20 4.39 0.00 3.38 3.56 0.00 5.62 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 8.31 3.70 2.06 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 1.45 0.67 0.94 0.00 0.00 132 D 8.39 4.34 0.00 2.94 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 0.00 133 W 8.26 4.11 0.00 3.52 3.44 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 0.00 134 L 8.42 3.77 0.00 2.00 1.70 1.20 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.46 3.90 0.00 2.09 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 2.31 2.49 0.00 136 T 7.89 3.75 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 1.14 0.00 0.00 137 E 7.71 3.68 0.00 1.49 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 138 L 7.69 3.75 0.00 1.69 1.60 0.90 0.84 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 0.00 139 D 7.99 4.34 0.00 2.77 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.97 3.95 0.00 1.83 1.82 0.92 1.03 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 0.00 141 I 7.37 3.37 1.71 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 -0.06 -0.36 0.71 0.00 0.00 142 Q 7.33 3.91 0.00 2.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 143 K 8.07 4.15 0.00 1.74 1.83 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.47 7.81 144 M 8.32 4.39 0.00 2.17 2.19 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 2.65 2.86 0.00 145 G 7.56 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.41 3.96 0.00 1.74 1.66 0.94 0.69 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 8.09 3.97 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 148 N 8.14 4.35 0.00 2.96 2.88 0.00 0.00 6.67 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 7.92 3.92 0.00 3.01 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 0.00 150 L 8.46 4.03 0.00 1.99 1.68 1.02 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.11 3.88 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 152 A 7.75 4.10 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 7.91 4.23 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 154 I 7.32 4.15 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 1.56 1.19 0.90 0.00 0.00 155 R 7.55 4.66 0.00 1.77 1.84 0.00 3.19 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 156 E 8.57 4.24 0.00 2.07 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 2.27 2.29 0.00 157 E 8.42 4.50 0.00 2.07 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 2.19 2.27 0.00 *158 G 8.59 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.