NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1336 8.2629 120.2730 54.6141 33.1096 174.8669 2 K 4.0129 8.5475 130.2986 55.2313 32.1421 171.9642 3 G 3.9793 8.6109 114.1364 43.6683 0.0000 171.9967 4 D 4.5593 8.4510 119.5830 54.3695 41.7950 177.0203 5 T 3.8718 8.9127 122.9894 66.9012 68.4928 176.5010 6 K 3.8167 8.1928 120.7116 58.9312 32.2327 178.9333 7 V 3.9346 8.3819 118.9913 66.1907 31.4099 178.0556 8 I 3.8336 8.0025 119.5594 64.4933 36.9236 178.2143 9 N 4.2719 8.3717 117.6336 56.3507 38.2024 177.1113 10 Y 4.0713 8.2440 118.5499 61.0778 37.9964 178.5046 11 L 3.8076 8.4903 120.3159 57.9340 41.6505 179.4352 12 N 4.3955 8.5018 116.7637 55.9481 38.4405 177.4313 13 K 3.8624 7.9910 121.1557 59.4089 32.3195 178.9722 14 L 3.8385 7.9593 119.5113 57.4393 41.3910 178.8657 15 L 4.0280 7.7772 120.8331 58.4045 42.0089 179.3250 16 G 3.6189 8.1780 105.3833 47.9241 0.0000 175.2625 17 N 4.3688 8.1324 118.7175 56.2737 38.5753 177.3907 18 E 4.1244 8.3071 119.9206 59.3212 29.3115 179.3790 19 L 4.0519 8.2467 119.3587 57.6611 41.5774 179.6955 20 V 3.5772 7.7789 117.7850 66.0151 31.4783 177.9841 21 A 3.8573 7.9674 120.3800 55.0140 18.2181 179.4099 22 I 3.7614 8.2929 118.8019 64.8742 37.1969 178.4359 23 N 4.3771 7.8831 116.7790 56.2961 38.3616 177.3525 24 Q 3.8101 8.2517 121.1680 59.4952 29.0696 177.9822 25 Y 4.2562 8.3144 118.1690 60.9637 37.8688 178.3662 26 F 3.8814 8.4856 121.7009 61.0881 39.4840 177.0042 27 L 3.9850 8.2746 120.1449 58.4439 41.8082 178.4394 28 H 3.7585 8.3188 116.1043 58.7241 28.6203 177.3511 29 A 4.1220 8.1697 122.5813 55.6053 18.1702 180.0784 30 R 3.9590 7.8181 116.0255 59.0958 30.0396 179.3355 31 M 3.4564 7.8463 119.0611 58.1514 31.8186 178.6340 32 F 4.6523 7.7569 118.1783 60.6014 39.1076 177.6777 33 K 3.9793 8.5465 119.7099 59.4450 31.7612 178.2458 34 N 4.2955 8.0614 116.6719 56.5386 38.9616 176.2865 35 W 4.7596 7.9683 117.4935 57.3975 29.3215 177.2349 36 G 4.0044 8.3899 108.2459 45.6514 0.0000 174.0538 37 L 4.7617 8.0061 122.3107 52.8915 40.4283 177.2775 38 K 3.9341 8.0746 122.2351 59.4974 32.4988 178.5857 39 R 3.8903 8.2072 118.9465 59.5015 29.9656 178.6222 40 L 4.0911 7.7892 118.3162 57.4104 41.5715 178.5015 41 N 4.4154 8.3942 117.2266 56.9659 38.8644 176.5966 42 D 4.2618 8.2015 119.9881 57.3980 40.8738 179.0439 43 V 3.3507 7.6503 118.6125 66.0440 31.4057 177.9976 44 E 3.7743 8.3521 118.3879 59.1231 29.2788 178.6074 45 Y 3.8163 8.2674 120.1490 61.1752 38.8243 178.1667 46 H 4.1486 8.2442 116.7355 58.5899 28.6892 177.7392 47 E 3.5144 7.9618 121.0684 58.8797 29.0121 179.0653 48 S 4.1378 7.8701 113.4259 61.5314 62.4625 176.2742 49 I 3.5627 7.4664 122.3196 64.4650 36.7925 178.0026 50 D 4.2546 8.0165 119.7094 57.5975 40.5670 178.9141 51 E 4.1704 8.1263 118.8747 59.4285 29.3723 179.2840 52 M 4.0643 8.1141 119.0266 58.3174 32.0248 178.8950 53 K 3.9413 8.1327 118.6310 59.6746 32.1810 179.0788 54 H 4.0952 8.2583 116.2542 58.7908 28.5688 177.5326 55 A 4.2090 8.3315 122.7418 55.3047 18.1604 178.9861 56 D 4.2907 8.2846 116.4986 57.7228 41.2597 178.6449 57 R 3.8847 7.9113 118.3051 59.6093 29.9848 178.6924 58 Y 4.2982 7.9565 116.2739 61.1490 37.9015 178.6192 59 I 3.7834 8.1699 120.9281 64.5534 37.2587 178.3582 60 E 4.0319 8.6107 119.7573 59.3660 29.2767 179.5003 61 R 4.0366 8.2911 118.7677 59.4957 30.1752 178.4536 62 I 3.7737 8.2181 120.0265 64.6035 37.1652 178.4128 63 L 4.0163 8.1155 119.6363 57.6733 41.2036 179.2630 64 F 4.3649 8.2230 119.6950 61.3388 39.6944 176.4836 65 L 4.6997 7.9589 117.2472 53.9324 41.0990 177.2390 66 E 3.7628 7.9686 117.4870 57.3494 27.1078 174.5551 67 G 3.9373 7.9756 108.2167 44.0946 0.0000 173.7248 68 L 4.5590 7.9979 118.8765 51.9423 42.3458 175.1899 69 P 4.3724 0.0000 0.0000 62.5750 31.7319 176.1209 70 N 4.6913 9.0490 122.3342 52.3983 38.3964 173.8005 71 L 4.5915 8.2767 123.6182 54.4557 42.2779 177.4371 72 Q 4.1382 8.4189 121.8790 57.7138 29.4581 175.6616 73 D 4.5634 8.1828 118.0396 53.2292 41.2473 175.0634 74 L 4.5704 8.3411 126.4540 52.8766 43.8496 176.4834 75 G 3.8816 8.3602 115.0576 44.2265 0.0000 172.3620 76 K 4.0565 8.3112 120.6447 56.1313 32.5573 176.5052 77 L 4.3747 8.2487 126.0408 54.1583 42.6672 176.3855 78 N 4.8545 8.6939 119.8300 51.5788 39.2359 174.4588 79 I 3.7197 8.2039 124.0139 63.9873 37.6556 178.2222 80 G 4.1836 8.3733 102.1413 45.9266 0.0000 172.6420 81 E 4.8242 9.0413 115.9626 55.1028 31.6360 176.0777 82 D 4.9400 7.7561 118.0738 50.3870 44.0075 176.1985 83 V 4.0181 8.3446 118.9172 66.4326 31.4637 177.6039 84 E 3.8531 8.2051 118.3979 59.2956 29.5612 178.1398 85 E 3.9469 8.6726 119.3382 59.4810 29.6846 178.7652 86 M 4.0530 8.3203 118.6850 58.4779 32.0195 178.7582 87 L 4.2074 8.3189 119.2940 57.9548 41.7491 179.8008 88 R 3.9326 8.3723 118.3629 59.3213 29.9775 179.1063 89 S 4.1158 8.2919 112.9571 61.3987 62.3762 175.9043 90 D 4.2506 8.3382 121.7089 57.1833 40.4948 178.5233 91 L 4.0219 8.3009 120.7557 58.1643 42.1537 178.8741 92 A 3.9910 8.2316 120.8465 55.0205 18.3125 179.3622 93 L 3.9089 8.0978 118.8580 58.3180 42.1456 179.0345 94 E 4.0669 8.3806 118.5518 59.5483 29.4396 179.3995 95 L 4.0471 8.2341 119.1143 57.8904 41.5461 179.3630 96 D 4.4813 8.3919 119.0801 57.3403 40.7163 179.0991 97 G 3.6519 8.3594 106.0678 47.5448 0.0000 175.7463 98 A 4.0443 8.2857 123.2157 54.8431 18.4623 179.6862 99 K 3.8767 8.0458 117.0717 59.9346 32.1604 179.2925 100 N 4.4209 8.0397 116.3078 56.1556 38.3595 177.4572 101 L 4.0045 8.1631 120.5486 57.9450 41.7379 179.8091 102 R 3.9111 8.1505 117.9613 59.1787 29.9883 178.7729 103 E 3.8565 8.1330 118.7175 59.2261 29.5959 178.7540 104 A 2.9346 7.8619 120.8045 54.8022 18.4351 179.6933 105 I 3.7445 8.1364 118.9444 64.3576 37.1732 178.9142 106 G 3.5797 8.0187 106.6425 47.9080 0.0000 175.1597 107 Y 3.9474 7.9306 121.9605 60.3259 38.8142 177.8610 108 A 3.8147 8.3133 122.1135 55.0657 18.4261 179.0878 109 D 4.0851 7.9121 116.3468 57.6299 41.0963 178.6826 110 S 4.0120 7.4846 114.4414 60.9634 62.8040 176.1101 111 V 3.8132 6.7077 112.0123 60.5524 31.4526 175.8104 112 H 2.8352 7.0835 114.2334 56.9181 26.7965 176.3378 113 D 4.5294 7.3591 120.9553 53.5828 38.1259 175.8502 114 Y 4.3382 7.5835 121.1423 60.1440 38.4677 177.5549 115 V 3.6886 7.8182 119.2608 65.9257 31.7734 177.9893 116 S 4.1824 8.4019 115.0025 61.4966 62.5835 176.4460 117 R 3.8916 8.0683 121.3708 59.6478 29.8812 177.8583 118 D 4.3298 8.3034 117.6596 57.5572 41.1675 177.8622 119 M 3.9547 8.0484 118.4894 59.1208 32.2368 178.1243 120 M 4.1158 8.2408 118.7766 58.4413 32.0788 178.8287 121 I 3.7367 8.1365 120.3136 64.4021 37.2468 178.2864 122 E 3.9643 8.1180 119.2351 59.4846 29.2138 179.5358 123 I 3.5485 7.6959 119.8479 64.1591 37.0457 178.1757 124 L 3.9327 8.3057 121.6692 58.1197 41.8827 178.9881 125 R 3.8703 8.1480 118.6518 59.4631 30.1034 178.1685 126 D 4.3045 8.0543 118.6251 57.5276 40.8023 178.6639 127 E 3.9676 8.3472 119.0669 59.5626 29.3838 179.3295 128 E 4.1618 8.6194 118.9209 59.2654 29.4462 179.6819 129 G 3.6530 8.0448 105.9450 48.0786 0.0000 175.5662 130 H 4.4411 8.1337 118.4167 58.6918 28.6769 177.8088 131 I 3.8137 8.2894 122.0764 64.5251 36.9571 177.7134 132 D 4.3871 8.4831 119.0080 57.2114 40.9393 178.2048 133 W 4.1170 8.2982 128.5229 60.4899 30.7516 177.8143 134 L 3.7676 8.5368 119.1250 57.8912 41.1467 179.2835 135 E 3.9303 8.4616 118.6907 59.8153 29.3931 179.7227 136 T 3.7982 7.9487 115.5549 66.6266 68.5423 176.6233 137 E 3.7827 7.8882 120.6478 59.3119 29.1215 179.3768 138 L 3.7798 7.7763 118.9403 57.9141 41.6450 179.3760 139 D 4.3036 8.0246 118.7275 57.3408 40.7344 178.8846 140 L 4.0173 7.9242 119.5608 57.6593 41.6658 179.5016 141 I 3.4195 7.4452 119.9317 64.2584 36.6970 178.2670 142 Q 3.9051 7.3340 119.1934 59.1047 28.9866 178.0294 143 K 4.1487 8.1056 118.8874 58.6375 32.2250 178.2392 144 M 4.4594 8.1859 114.4579 53.6562 32.6903 176.7057 145 G 4.1372 7.5885 106.6583 45.9922 0.0000 174.4384 146 L 3.9789 8.3494 121.8798 57.9876 42.0734 179.6158 147 Q 3.9799 7.9981 117.5405 59.0920 28.8094 178.2578 148 N 4.3466 8.1240 117.0102 56.3629 38.4030 176.6232 149 Y 3.9900 7.9742 119.9839 60.7704 39.2040 177.9530 150 L 4.0779 8.3721 120.2259 57.7924 41.5627 179.1987 151 Q 3.9353 8.1588 119.3469 59.0274 28.7724 177.7678 152 A 4.1212 7.7245 119.5303 53.5267 18.6483 178.2024 153 Q 4.3152 7.7689 116.0808 55.6232 29.3843 177.5693 154 I 4.0277 7.2834 113.3800 62.4606 38.0700 176.6642 155 R 4.5071 7.5469 118.5683 54.0980 31.5103 175.9959 156 E 4.1433 8.5542 120.4974 56.8934 30.2615 175.7458 157 E 4.2801 8.6904 119.5685 57.6096 31.7166 176.1149 *158 G 3.7389 7.9850 110.0526 45.7509 0.0000 172.2441 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 4.13 0.00 1.27 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 0.00 2.51 2.42 0.00 2 K 8.55 4.01 0.00 1.66 1.62 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.36 1.08 7.81 3 G 8.61 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 4 D 8.45 4.56 0.00 2.85 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.19 3.82 0.00 1.69 1.78 0.00 1.42 0.00 0.00 0.96 0.00 0.00 2.49 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.79 1.01 7.81 7 V 8.38 3.93 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 1.19 0.00 0.00 8 I 8.00 3.83 2.02 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.69 0.91 0.00 0.00 9 N 8.37 4.27 0.00 2.63 2.65 0.00 0.00 7.01 8.34 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 10 Y 8.24 4.07 0.00 3.15 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 11 L 8.49 3.81 0.00 1.81 1.79 1.06 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.50 4.40 0.00 2.90 2.81 0.00 0.00 6.65 8.08 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 13 K 7.99 3.86 0.00 1.76 1.96 0.00 1.57 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.43 1.45 7.81 14 L 7.96 3.84 0.00 0.87 1.23 0.93 0.80 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 4.03 0.00 1.67 1.82 1.02 1.13 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 3.62 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 8.13 4.37 0.00 2.96 2.91 0.00 0.00 7.03 7.07 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 18 E 8.31 4.12 0.00 2.28 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 2.77 2.88 0.00 19 L 8.25 4.05 0.00 1.82 1.72 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 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 1.01 0.00 0.00 21 A 7.97 3.86 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 8.29 3.76 2.05 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 1.61 1.12 0.91 0.00 0.00 23 N 7.88 4.38 0.00 2.91 2.85 0.00 0.00 6.73 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 24 Q 8.25 3.81 0.00 2.05 1.89 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 2.15 2.14 0.00 25 Y 8.31 4.26 0.00 3.14 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 26 F 8.49 3.88 0.00 3.30 3.06 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 0.00 0.00 0.00 27 L 8.27 3.99 0.00 1.82 1.67 0.88 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.32 3.76 0.00 3.47 3.12 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 8.17 4.12 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 7.82 3.96 0.00 1.76 1.91 0.00 3.19 0.00 0.00 2.93 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.84 0.00 31 M 7.85 3.46 0.00 0.88 1.54 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.18 0.00 32 F 7.76 4.65 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 33 K 8.55 3.98 0.00 1.94 1.90 0.00 1.57 0.00 0.00 1.52 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 34 N 8.06 4.30 0.00 2.67 2.71 0.00 0.00 7.30 8.73 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 35 W 7.97 4.76 0.00 3.71 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.39 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 8.01 4.76 0.00 1.89 1.64 1.18 0.80 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 38 K 8.07 3.93 0.00 1.87 1.86 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.76 7.81 39 R 8.21 3.89 0.00 2.07 2.07 0.00 3.07 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 40 L 7.79 4.09 0.00 1.52 0.89 0.47 0.72 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 41 N 8.39 4.42 0.00 3.08 3.02 0.00 0.00 7.18 8.09 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 42 D 8.20 4.26 0.00 2.88 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 43 V 7.65 3.35 1.68 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 -0.50 0.00 0.00 0.83 0.00 0.00 44 E 8.35 3.77 0.00 2.39 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 2.54 3.11 0.00 45 Y 8.27 3.82 0.00 2.77 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 46 H 8.24 4.15 0.00 3.22 3.21 0.00 5.67 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 7.96 3.51 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 1.95 1.72 0.00 48 S 7.87 4.14 0.00 4.03 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 7.47 3.56 1.83 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.32 0.84 0.00 0.00 50 D 8.02 4.25 0.00 2.82 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.13 4.17 0.00 2.22 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 2.76 2.84 0.00 52 M 8.11 4.06 0.00 2.03 2.20 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 2.78 2.55 0.00 53 K 8.13 3.94 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 2.96 0.00 0.00 0.00 0.00 1.42 1.61 7.81 54 H 8.26 4.10 0.00 3.52 3.31 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 8.33 4.21 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 8.28 4.29 0.00 2.89 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 7.91 3.88 0.00 1.82 1.80 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 1.78 0.00 58 Y 7.96 4.30 0.00 3.20 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 8.17 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 1.57 1.11 0.95 0.00 0.00 60 E 8.61 4.03 0.00 2.06 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 2.57 0.00 61 R 8.29 4.04 0.00 2.11 2.19 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 1.76 1.86 0.00 62 I 8.22 3.77 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 0.63 1.00 0.00 0.00 63 L 8.12 4.02 0.00 1.91 1.78 0.99 0.82 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 8.22 4.36 0.00 2.97 3.34 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 65 L 7.96 4.70 0.00 1.88 1.62 1.04 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.97 3.76 0.00 2.07 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 2.16 2.25 0.00 67 G 7.98 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 8.00 4.56 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 1.59 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.37 0.00 2.06 2.02 0.00 3.66 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 2.06 2.11 0.00 70 N 9.05 4.69 0.00 2.63 2.81 0.00 0.00 7.12 8.25 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 71 L 8.28 4.59 0.00 1.64 1.65 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.42 4.14 0.00 1.97 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 73 D 8.18 4.56 0.00 2.69 2.58 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 74 L 8.34 4.57 0.00 1.54 1.52 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 8.36 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 0.00 0.00 0.00 76 K 8.31 4.06 0.00 1.98 1.72 0.00 1.89 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.42 1.03 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 1.30 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.69 4.85 0.00 2.60 2.68 0.00 0.00 7.18 7.51 0.00 0.00 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 8.20 3.72 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 8.37 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 0.00 0.00 0.00 0.00 81 E 9.04 4.82 0.00 1.99 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 2.31 2.26 0.00 82 D 7.76 4.94 0.00 2.83 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 83 V 8.34 4.02 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 1.23 0.00 0.00 1.23 0.00 0.00 84 E 8.21 3.85 0.00 1.99 1.90 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 2.34 2.29 0.00 85 E 8.67 3.95 0.00 2.11 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 2.35 2.39 0.00 86 M 8.32 4.05 0.00 1.73 2.40 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.59 0.00 87 L 8.32 4.21 0.00 1.71 1.76 0.84 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.37 3.93 0.00 1.91 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 1.80 0.00 89 S 8.29 4.12 0.00 3.99 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 90 D 8.34 4.25 0.00 3.08 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.30 4.02 0.00 1.82 1.88 0.99 1.00 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 8.23 3.99 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 8.10 3.91 0.00 1.82 1.78 0.91 0.75 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 8.38 4.07 0.00 2.29 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 2.62 2.73 0.00 95 L 8.23 4.05 0.00 1.84 1.74 0.95 1.19 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 8.39 4.48 0.00 2.86 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 8.36 3.65 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 0.00 0.00 0.00 98 A 8.29 4.04 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 99 K 8.05 3.88 0.00 2.05 1.90 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.67 7.81 100 N 8.04 4.42 0.00 2.92 2.91 0.00 0.00 7.07 8.07 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 0.00 101 L 8.16 4.00 0.00 1.86 1.74 0.98 0.91 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 8.15 3.91 0.00 2.02 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 1.82 0.00 103 E 8.13 3.86 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 2.27 2.37 0.00 104 A 7.86 2.93 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 0.00 0.00 0.00 0.00 0.00 105 I 8.14 3.74 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 1.13 0.92 0.00 0.00 106 G 8.02 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 7.93 3.95 0.00 3.09 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 0.00 108 A 8.31 3.81 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 0.00 109 D 7.91 4.09 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 0.00 110 S 7.48 4.01 0.00 3.64 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 0.00 111 V 6.71 3.81 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 0.28 0.00 0.00 0.63 0.00 0.00 112 H 7.08 2.84 0.00 3.19 3.25 0.00 5.65 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.36 4.53 0.00 2.62 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 7.58 4.34 0.00 3.07 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 7.82 3.69 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 8.40 4.18 0.00 4.02 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.07 3.89 0.00 1.92 2.22 0.00 3.33 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 1.70 1.69 0.00 118 D 8.30 4.33 0.00 3.01 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 0.00 119 M 8.05 3.95 0.00 2.31 2.03 0.00 0.00 0.00 0.00 0.00 2.23 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 8.24 4.12 0.00 2.16 2.26 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 2.90 2.84 0.00 121 I 8.14 3.74 2.01 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 0.83 0.92 0.00 0.00 122 E 8.12 3.96 0.00 2.18 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 7.70 3.55 1.92 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 1.09 0.55 0.71 0.00 0.00 124 L 8.31 3.93 0.00 1.82 1.85 0.95 0.74 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 8.15 3.87 0.00 1.92 2.08 0.00 3.15 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 1.63 1.68 0.00 126 D 8.05 4.30 0.00 2.95 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 8.35 3.97 0.00 2.11 2.24 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 2.64 2.55 0.00 128 E 8.62 4.16 0.00 2.02 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 2.36 2.53 0.00 129 G 8.04 3.65 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 0.00 0.00 0.00 130 H 8.13 4.44 0.00 3.54 3.55 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 8.29 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 0.95 0.97 0.00 0.00 132 D 8.48 4.39 0.00 2.97 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 8.30 4.12 0.00 3.53 3.47 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 0.00 134 L 8.54 3.77 0.00 2.00 1.79 1.20 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.46 3.93 0.00 2.14 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 2.59 0.00 136 T 7.95 3.80 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 1.17 0.00 0.00 137 E 7.89 3.78 0.00 1.54 1.67 0.00 0.00 0.00 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 7.78 3.78 0.00 1.74 1.62 0.89 0.85 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 8.02 4.30 0.00 2.80 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 7.92 4.02 0.00 1.90 1.84 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.45 3.42 1.69 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 -0.23 0.01 0.68 0.00 0.00 142 Q 7.33 3.91 0.00 1.96 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.99 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 143 K 8.11 4.15 0.00 1.76 1.85 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.58 7.81 144 M 8.19 4.46 0.00 2.19 2.18 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 2.66 2.85 0.00 145 G 7.59 4.14 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 0.00 146 L 8.35 3.98 0.00 1.73 1.66 0.92 0.71 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 0.00 147 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 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 148 N 8.12 4.35 0.00 2.93 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 7.97 3.99 0.00 2.99 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 0.00 150 L 8.37 4.08 0.00 1.71 1.69 0.88 1.02 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 8.16 3.94 0.00 2.20 2.26 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 7.72 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 7.77 4.32 0.00 2.04 2.00 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 2.04 2.15 0.00 154 I 7.28 4.03 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 1.53 1.32 1.01 0.00 0.00 155 R 7.55 4.51 0.00 1.80 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 1.56 1.62 0.00 156 E 8.55 4.14 0.00 1.94 1.88 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 2.38 2.29 0.00 157 E 8.69 4.28 0.00 1.88 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 2.18 2.26 0.00 *158 G 7.99 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.