NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1835 8.1633 120.2794 54.6645 33.0935 174.1882 2 K 3.9745 8.5008 126.3698 56.2505 32.4247 175.7396 3 G 3.9376 8.6904 113.6257 44.8528 0.0000 171.9570 4 D 4.5289 8.4877 119.8425 54.4362 41.8438 176.8054 5 T 3.8759 8.9969 123.1738 66.9534 68.4956 176.3816 6 K 3.8230 8.1396 120.7863 59.2162 32.2559 178.7536 7 V 3.9163 8.6683 118.9231 66.2129 31.4171 177.8878 8 I 3.7390 7.8384 119.4120 64.7097 36.9116 178.0947 9 N 4.2745 8.2432 117.0479 56.4253 38.2979 177.0906 10 Y 4.0656 8.0694 118.1128 61.0941 38.0169 178.5318 11 L 3.8761 8.4790 120.2307 58.0508 41.6754 179.4697 12 N 4.3793 8.5415 116.6913 56.0031 38.4138 177.4787 13 K 3.8687 8.1580 121.3378 59.3493 32.2930 178.9304 14 L 3.8011 8.1301 119.6804 57.5332 41.3811 178.9211 15 L 3.9809 7.7555 120.7960 58.2827 42.0197 179.1051 16 G 3.7016 8.1848 105.5529 48.1280 0.0000 175.2109 17 N 4.3481 8.0307 118.9626 56.0787 38.5618 177.3952 18 E 4.0013 8.2975 119.9532 59.3753 29.4081 179.3815 19 L 4.0044 8.1817 119.2900 57.6170 41.5500 179.8087 20 V 3.4690 7.6495 117.4365 65.9849 31.5488 177.9181 21 A 3.2336 7.8914 120.4948 54.8074 18.0907 179.3656 22 I 3.5572 7.9645 118.6339 64.8478 37.2164 178.3964 23 N 4.3558 7.7944 116.8767 56.3406 38.3362 177.4099 24 Q 3.8732 8.1638 121.1886 59.4919 29.0851 177.9258 25 Y 4.6077 8.3033 118.2368 60.8792 37.9543 178.1156 26 F 3.8104 8.4733 121.8342 61.0499 39.5307 176.9629 27 L 3.9518 8.2127 120.0226 58.5438 41.8564 178.4712 28 H 3.8194 8.3146 116.0174 58.7081 28.5431 177.4133 29 A 4.0673 8.0795 122.5695 55.5021 18.1795 179.8253 30 R 3.8476 7.6247 115.2290 58.4583 30.1378 179.2292 31 M 3.4512 7.7335 119.2767 58.1715 31.8511 178.3665 32 F 4.6433 7.5799 118.0189 60.6635 39.0255 177.7024 33 K 3.9259 8.2798 119.1494 59.5850 31.8241 178.1022 34 N 4.2424 7.9542 116.1200 56.6531 38.8945 176.0902 35 W 4.8368 7.9689 116.8310 56.9953 29.0738 177.0938 36 G 3.9791 8.5153 108.4300 46.0417 0.0000 174.3502 37 L 4.7320 8.2069 122.7266 52.6377 40.4373 177.0044 38 K 3.8689 8.1329 123.6539 59.6312 32.5934 177.6063 39 R 3.8955 8.1498 118.8055 59.4661 29.9014 178.5330 40 L 4.0471 7.7601 118.3716 57.5287 41.5652 178.6422 41 N 4.4417 8.3428 117.0974 56.8415 38.9087 176.5253 42 D 4.3990 8.2183 120.1315 57.4848 40.9836 179.0568 43 V 3.3688 7.6551 118.4323 65.9495 31.4790 177.6759 44 E 3.8665 8.5342 119.4489 59.3268 29.4937 178.1122 45 Y 3.9493 8.4151 120.0193 61.1107 38.9385 177.7937 46 H 4.1004 8.3883 116.7535 58.2442 28.8072 177.4440 47 E 3.8242 8.1094 121.8297 58.9668 29.4149 178.5681 48 S 4.2269 8.1717 113.3245 61.5427 62.4743 176.1880 49 I 3.5693 7.5699 122.4194 64.4511 36.7801 178.0756 50 D 4.2545 7.9477 119.5925 57.5289 40.5609 178.8303 51 E 4.0675 8.1906 118.6626 59.3092 29.3857 179.2703 52 M 4.0380 7.8884 119.0801 58.2719 31.9956 178.7511 53 K 3.9082 8.1072 118.6255 59.7841 32.2210 179.0906 54 H 4.1036 8.0452 116.1329 58.7793 28.6146 177.5760 55 A 4.2274 8.3691 122.9135 55.3637 18.1574 179.1151 56 D 4.2922 8.2694 116.4193 57.6029 41.3139 178.7152 57 R 3.8605 7.9251 118.4903 59.4144 30.0496 178.6696 58 Y 4.3088 7.8304 116.4003 61.1590 37.9069 178.5837 59 I 3.7603 8.2763 121.0914 64.6781 37.1986 178.3890 60 E 4.0392 8.4143 119.3448 59.3080 29.1748 179.5018 61 R 4.0362 8.2030 118.7930 59.5170 30.1485 178.5599 62 I 3.7638 8.4006 120.0180 64.4452 37.1069 178.4678 63 L 4.0001 8.1578 119.7519 57.7770 41.2632 179.2557 64 F 4.3392 8.4343 119.8114 61.2552 39.6620 176.3643 65 L 4.5253 8.0751 117.6003 53.8869 41.1984 177.3081 66 E 3.8649 7.9905 117.6266 57.2607 27.0804 174.6165 67 G 3.9248 7.9783 108.9904 44.1769 0.0000 173.6320 68 L 4.5345 8.0124 119.2440 51.9967 42.1019 175.0615 69 P 4.3653 0.0000 0.0000 62.5485 31.7656 175.9947 70 N 4.7048 9.6652 122.4201 52.4168 38.7343 173.9828 71 L 4.6070 8.2990 124.2280 54.5288 42.4552 177.4913 72 Q 4.1015 8.5327 122.0480 57.9572 29.3304 175.8029 73 D 4.6771 8.0776 117.4033 52.6211 41.9564 175.2374 74 L 4.5251 8.2895 125.7153 52.6996 43.7920 176.2089 75 G 3.8076 8.4577 115.3705 44.6794 0.0000 171.9628 76 K 4.0342 8.3061 120.6836 56.1153 32.4344 176.5192 77 L 4.2505 8.3060 126.3225 54.4891 42.3732 176.4920 78 N 4.8062 8.7611 120.1689 51.7005 39.1755 172.4909 79 I 4.2385 8.1166 124.3105 59.7667 38.1568 176.6548 80 G 4.0446 8.7674 114.6131 45.1669 0.0000 172.7620 81 E 4.7353 8.6047 117.6459 56.1914 31.1050 176.3931 82 D 4.9100 7.7005 117.9440 50.3037 44.0422 176.0637 83 V 4.0064 8.4094 118.9287 66.5451 31.3627 177.5166 84 E 3.8575 8.1920 118.1996 59.4066 29.5092 178.2303 85 E 3.9737 8.4084 118.8933 59.4279 29.6534 178.7630 86 M 4.0483 8.2560 118.7390 58.4227 32.0281 178.7294 87 L 4.1450 8.2240 119.1371 58.0059 41.7311 179.8078 88 R 3.9357 8.4062 118.3832 59.2512 29.9631 179.1542 89 S 4.1518 8.3284 113.0034 61.4248 62.3650 175.8376 90 D 4.6947 8.4393 121.7000 57.3602 40.5666 178.5120 91 L 3.9441 8.2478 120.6020 58.2985 42.1468 178.9445 92 A 4.0322 8.3411 120.8701 55.0028 18.2738 179.3911 93 L 3.9749 8.1073 118.9654 58.3685 42.1217 179.0892 94 E 4.1154 8.6216 118.7986 59.3777 29.4446 179.3208 95 L 4.0253 8.1747 119.0671 58.0219 41.7725 179.3196 96 D 4.5114 8.3891 118.9576 57.3599 40.6524 179.1802 97 G 3.6386 8.3625 106.0916 47.6281 0.0000 175.6986 98 A 4.0257 8.4675 123.5465 54.6283 18.4832 179.4624 99 K 3.8315 8.0193 118.1173 59.9437 32.3154 178.7094 100 N 4.3907 8.0976 116.4006 56.2574 38.3916 177.3016 101 L 3.9973 8.1586 120.4827 57.9743 41.7525 179.7756 102 R 3.8998 8.2484 118.1064 59.1856 30.0341 178.6799 103 E 3.8270 8.0206 118.2416 59.3190 29.6031 178.7479 104 A 2.8760 7.7197 120.6260 54.8283 18.4143 179.6430 105 I 3.7289 8.1075 118.8771 64.3595 36.9228 178.9216 106 G 3.5793 7.7584 105.6057 47.9546 0.0000 174.9037 107 Y 4.1308 8.0096 122.0266 60.1888 38.8788 177.3734 108 A 3.7802 8.2393 122.1568 55.2911 18.3910 179.0379 109 D 4.1275 7.8212 116.0478 57.4273 41.1199 178.4427 110 S 4.1923 7.4998 112.6846 59.9989 63.2945 175.6481 111 V 4.0036 6.8284 114.0728 60.7377 31.6478 175.5535 112 H 2.7691 7.0856 114.1644 56.6105 26.9195 176.4706 113 D 4.5242 7.2881 121.3780 53.7292 37.8946 176.1267 114 Y 4.3159 7.5032 121.3560 60.5789 38.5019 177.8271 115 V 3.7285 7.8846 113.1967 64.2610 31.7369 178.5295 116 S 4.1921 8.3488 114.9806 61.4571 62.5825 176.5787 117 R 3.8898 8.0155 121.3989 59.5763 29.7425 178.0499 118 D 4.3233 8.3637 117.8949 57.5620 41.3021 177.8275 119 M 4.0031 8.2115 118.7084 59.0246 32.1693 178.1847 120 M 4.1785 8.2376 118.8489 58.2820 32.0770 178.8423 121 I 3.7300 8.1862 120.5961 64.2967 37.2589 178.2171 122 E 3.9757 8.0019 119.3211 59.4861 29.2245 179.5301 123 I 3.5626 7.5724 119.2994 64.1968 37.0613 178.1812 124 L 3.9530 8.1598 121.4023 58.1173 42.0060 178.9636 125 R 3.9002 8.1679 118.6368 59.6403 30.1587 178.2569 126 D 4.4373 8.2009 118.6298 57.4454 40.7910 178.6946 127 E 4.1396 8.4420 119.2971 59.4959 29.4458 179.2432 128 E 4.2528 8.7616 119.2267 59.1738 29.4576 179.5443 129 G 3.6974 8.0890 105.5937 48.1347 0.0000 175.2789 130 H 4.4012 8.2142 120.3320 59.0218 29.8619 177.2544 131 I 3.6963 8.3125 122.1555 64.4803 36.9357 177.7676 132 D 4.3373 8.3716 118.7440 57.0770 41.0024 178.0404 133 W 4.1086 8.2542 128.7052 60.4891 30.7347 177.6257 134 L 3.7795 8.4209 119.0508 58.0275 41.1369 179.3775 135 E 3.8998 8.4575 118.5555 59.7586 29.3082 179.7227 136 T 3.7465 7.9031 115.5469 66.5432 68.5399 176.4682 137 E 3.6825 7.7077 120.5625 59.4518 29.1542 179.4902 138 L 3.7590 7.6851 118.7398 57.8510 41.5516 179.4211 139 D 4.3546 7.9862 118.8064 57.2760 40.6535 178.7494 140 L 3.9499 7.9818 119.7409 57.7518 41.6008 179.5625 141 I 3.3766 7.3922 119.7593 64.3713 36.7419 178.2796 142 Q 3.9169 7.3324 117.8252 58.9782 28.9580 177.8871 143 K 4.1469 8.0662 119.1677 58.6440 32.3175 178.2857 144 M 4.3825 8.3363 115.0060 53.9706 32.5369 177.2652 145 G 4.1021 7.5542 105.6105 45.9558 0.0000 174.3715 146 L 3.9638 8.4160 121.5950 58.0157 42.1728 179.2987 147 Q 3.9736 8.0803 117.4474 59.3324 28.7340 178.6927 148 N 4.3505 8.1347 116.7332 56.3191 38.3744 176.6872 149 Y 3.9135 7.8939 120.0844 60.6085 39.1336 177.8465 150 L 4.0325 8.4215 120.2183 57.9490 41.6557 179.1769 151 Q 3.8829 8.1063 119.1305 59.2213 28.7199 178.0050 152 A 4.0937 7.7297 119.5159 53.6941 18.6825 178.3264 153 Q 4.2294 7.9208 116.3491 55.9389 29.2023 177.3266 154 I 4.1401 7.3156 112.6613 61.5989 38.2207 176.1867 155 R 4.6622 7.5538 119.6514 53.8344 32.4954 175.4631 156 E 4.2486 8.5680 119.3948 55.9657 30.5871 175.6138 157 E 4.4963 8.4191 117.7928 54.3966 31.7148 176.2465 *158 G 3.7099 8.5917 110.1270 45.8800 0.0000 172.3684 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 1.42 1.80 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 2 K 8.50 3.97 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 8.69 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 8.49 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 9.00 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 3.82 0.00 1.71 2.06 0.00 1.38 0.00 0.00 1.41 0.00 0.00 2.53 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.30 0.96 7.81 7 V 8.67 3.92 2.37 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 1.12 0.00 0.00 1.14 0.00 0.00 8 I 7.84 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 0.62 0.91 0.00 0.00 9 N 8.24 4.27 0.00 2.62 2.66 0.00 0.00 7.09 7.10 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 10 Y 8.07 4.07 0.00 3.21 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 8.48 3.88 0.00 2.03 1.77 1.11 0.83 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 8.54 4.38 0.00 2.77 2.81 0.00 0.00 6.70 7.84 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 13 K 8.16 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 8.13 3.80 0.00 0.80 1.17 0.92 0.47 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 7.76 3.98 0.00 1.69 1.84 1.05 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.18 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.03 4.35 0.00 2.92 2.89 0.00 0.00 7.09 7.39 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 18 E 8.30 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 8.18 4.00 0.00 1.79 1.68 0.90 1.02 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 1.04 0.00 0.00 0.91 0.00 0.00 21 A 7.89 3.23 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.96 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 0.99 0.85 0.00 0.00 23 N 7.79 4.36 0.00 2.78 2.84 0.00 0.00 6.76 8.38 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 24 Q 8.16 3.87 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 3.02 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 8.47 3.81 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 8.21 3.95 0.00 1.95 1.59 0.90 0.87 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 28 H 8.31 3.82 0.00 3.46 2.97 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 8.08 4.07 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 7.62 3.85 0.00 1.75 1.87 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 1.02 1.63 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.19 0.00 32 F 7.58 4.64 0.00 3.30 3.21 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 33 K 8.28 3.93 0.00 2.07 1.89 0.00 1.65 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 7.95 4.24 0.00 2.66 2.65 0.00 0.00 7.35 8.68 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 35 W 7.97 4.84 0.00 3.75 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 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 8.21 4.73 0.00 1.89 1.62 1.19 0.60 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 38 K 8.13 3.87 0.00 2.02 1.81 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 8.15 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 1.68 1.09 1.10 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 8.34 4.44 0.00 3.10 3.01 0.00 0.00 7.21 7.81 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 42 D 8.22 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 7.66 3.37 1.83 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 -0.40 0.00 0.00 0.75 0.00 0.00 44 E 8.53 3.87 0.00 2.49 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 2.58 2.55 0.00 45 Y 8.42 3.95 0.00 2.92 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 8.39 4.10 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 8.11 3.82 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 4.02 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 49 I 7.57 3.57 1.82 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.32 0.83 0.00 0.00 50 D 7.95 4.25 0.00 2.98 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 2.12 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 2.72 2.51 0.00 52 M 7.89 4.04 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.06 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 8.11 3.91 0.00 1.87 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 4.10 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 8.37 4.23 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.27 4.29 0.00 2.92 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 7.93 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 7.83 4.31 0.00 3.21 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 59 I 8.28 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 0.97 0.95 0.00 0.00 60 E 8.41 4.04 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 2.50 0.00 61 R 8.20 4.04 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 8.40 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 0.67 1.01 0.00 0.00 63 L 8.16 4.00 0.00 2.11 1.79 0.95 0.88 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 8.43 4.34 0.00 2.95 3.38 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 65 L 8.08 4.53 0.00 1.84 1.61 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.99 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 2.24 0.00 67 G 7.98 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 0.00 0.00 0.00 68 L 8.01 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 9.67 4.70 0.00 2.60 2.81 0.00 0.00 7.08 8.12 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 71 L 8.30 4.61 0.00 1.62 1.63 0.93 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 72 Q 8.53 4.10 0.00 1.97 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.60 6.69 0.00 0.00 0.00 0.00 0.00 2.33 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 1.05 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 8.31 4.03 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 8.31 4.25 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 8.76 4.81 0.00 2.65 2.74 0.00 0.00 7.15 7.22 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 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 4.04 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 81 E 8.60 4.74 0.00 1.98 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 8.41 4.01 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 1.15 0.00 0.00 1.19 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 2.28 0.00 85 E 8.41 3.97 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 8.26 4.05 0.00 1.80 2.42 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.39 0.00 87 L 8.22 4.15 0.00 2.02 1.71 1.23 0.73 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 8.41 3.94 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 8.33 4.15 0.00 4.04 4.16 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 90 D 8.44 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 1.89 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.34 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 3.97 0.00 1.99 2.05 0.93 0.69 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 4.12 0.00 2.24 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 2.70 2.49 0.00 95 L 8.17 4.03 0.00 2.05 1.75 0.95 0.99 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 8.36 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 1.43 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 99 K 8.02 3.83 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 8.10 4.39 0.00 3.00 2.90 0.00 0.00 7.11 6.72 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 0.00 101 L 8.16 4.00 0.00 1.98 1.75 0.98 1.24 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 8.25 3.90 0.00 1.97 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 8.02 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 7.72 2.88 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 8.11 3.73 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 1.46 0.97 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 8.01 4.13 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 8.24 3.78 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 0.00 109 D 7.82 4.13 0.00 2.86 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 S 7.50 4.19 0.00 3.99 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 6.83 4.00 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 0.53 0.00 0.00 0.64 0.00 0.00 112 H 7.09 2.77 0.00 3.15 3.27 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 7.29 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 7.50 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 0.94 0.00 0.00 0.96 0.00 0.00 116 S 8.35 4.19 0.00 4.18 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 8.02 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 1.69 1.68 0.00 118 D 8.36 4.32 0.00 2.97 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 0.00 119 M 8.21 4.00 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 120 M 8.24 4.18 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 2.13 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 8.19 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 0.82 0.92 0.00 0.00 122 E 8.00 3.98 0.00 2.08 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 3.56 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 0.75 0.00 0.00 124 L 8.16 3.95 0.00 1.85 1.85 0.95 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 0.00 125 R 8.17 3.90 0.00 2.07 2.12 0.00 3.16 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 1.64 1.69 0.00 126 D 8.20 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 2.68 2.57 0.00 128 E 8.76 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 2.52 0.00 129 G 8.09 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 H 8.21 4.40 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 2.07 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 1.45 0.66 0.94 0.00 0.00 132 D 8.37 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 8.25 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 3.78 0.00 2.01 1.70 1.18 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 2.50 0.00 136 T 7.90 3.75 4.18 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 1.14 0.00 0.00 137 E 7.71 3.68 0.00 1.49 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 138 L 7.69 3.76 0.00 1.69 1.60 0.87 0.85 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 4.35 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 7.98 3.95 0.00 1.83 1.82 0.93 1.08 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 7.39 3.38 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 -0.27 0.71 0.00 0.00 142 Q 7.33 3.92 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 8.34 4.38 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 2.14 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 7.55 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 0.00 0.00 0.00 146 L 8.42 3.96 0.00 1.74 1.66 0.94 0.70 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 0.00 147 Q 8.08 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 8.13 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 7.89 3.91 0.00 3.01 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 0.00 150 L 8.42 4.03 0.00 2.00 1.68 1.03 0.95 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 7.73 4.09 1.21 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 0.00 153 Q 7.92 4.23 0.00 2.01 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 2.12 2.14 0.00 154 I 7.32 4.14 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 1.20 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 1.55 0.00 156 E 8.57 4.25 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 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.