NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1793 8.1633 120.2790 54.6664 33.0964 174.1820 2 K 3.9691 8.4996 126.3570 56.2531 32.4319 175.7346 3 G 3.9398 8.6797 113.6467 44.8302 0.0000 171.9168 4 D 4.5353 8.4804 119.8063 54.4101 41.8694 176.8181 5 T 3.8789 8.9889 123.1616 66.9505 68.4982 176.3986 6 K 3.8358 8.1431 120.7956 59.2019 32.2389 178.7690 7 V 3.9178 8.6409 118.8925 66.2056 31.4356 177.8960 8 I 3.7398 7.8495 119.4106 64.6977 36.9144 178.1032 9 N 4.2791 8.2115 117.0312 56.4075 38.3021 177.0682 10 Y 4.0705 8.0462 118.1081 61.1243 38.0311 178.5735 11 L 3.8728 8.4504 120.2184 58.0468 41.6691 179.4721 12 N 4.3762 8.5587 116.7009 56.0066 38.4182 177.4728 13 K 3.8696 8.1409 121.2999 59.3552 32.3200 178.9336 14 L 3.8036 8.1324 119.6765 57.5201 41.3787 178.9246 15 L 3.9876 7.7629 120.7906 58.2710 42.0364 179.0829 16 G 3.7158 8.1897 105.5949 48.1484 0.0000 175.1806 17 N 4.3469 8.0298 118.9721 56.0791 38.5748 177.3973 18 E 3.9994 8.2658 119.8957 59.3680 29.4138 179.3671 19 L 4.0050 8.1770 119.2908 57.6378 41.5529 179.8189 20 V 3.4738 7.6568 117.4459 65.9837 31.5279 177.9203 21 A 3.2381 7.9024 120.5074 54.7976 18.0869 179.3802 22 I 3.5623 7.9999 118.6156 64.8513 37.2237 178.4121 23 N 4.3613 7.7895 116.9266 56.3377 38.3223 177.4305 24 Q 3.8780 8.1911 121.2503 59.4706 29.0832 177.8950 25 Y 4.6053 8.2804 118.2659 60.8733 37.9587 178.1143 26 F 3.8101 8.4788 121.8385 61.0597 39.5260 176.9673 27 L 3.9575 8.2088 120.0123 58.5541 41.8546 178.4891 28 H 3.8289 8.3538 116.0681 58.6825 28.5343 177.4325 29 A 4.0629 8.0869 122.5992 55.4998 18.1818 179.8467 30 R 3.8418 7.6243 115.2802 58.5078 30.1080 179.2379 31 M 3.4589 7.7559 119.2821 58.1748 31.8417 178.3577 32 F 4.6331 7.5784 118.0258 60.6860 39.0291 177.7167 33 K 3.9303 8.2749 119.1237 59.5591 31.8202 178.1067 34 N 4.2449 7.9686 116.1721 56.6562 38.9109 176.1385 35 W 4.8197 7.9743 116.8356 57.0766 29.0222 177.1222 36 G 3.9846 8.5410 108.4947 45.9711 0.0000 174.2764 37 L 4.7337 8.1993 122.7484 52.6370 40.4402 176.9948 38 K 3.8652 8.1523 123.6484 59.6352 32.5985 177.6279 39 R 3.8993 8.1539 118.8078 59.4438 29.9068 178.5278 40 L 4.0525 7.7600 118.4012 57.5026 41.5722 178.6340 41 N 4.4384 8.3249 117.1129 56.8439 38.9145 176.5090 42 D 4.3989 8.2067 120.1232 57.4899 40.9465 179.0679 43 V 3.3671 7.6449 118.3765 65.9438 31.4690 177.6697 44 E 3.8479 8.5444 119.4664 59.3463 29.5072 178.1092 45 Y 3.9425 8.4223 120.0176 61.1095 38.9234 177.7974 46 H 4.1033 8.3949 116.7813 58.2665 28.7999 177.4482 47 E 3.8212 8.1572 121.8793 58.9587 29.4430 178.5465 48 S 4.2228 8.1827 113.3431 61.5679 62.4848 176.2117 49 I 3.5722 7.5573 122.3682 64.4513 36.7831 178.0677 50 D 4.2639 7.9464 119.6003 57.5409 40.5581 178.8436 51 E 4.0689 8.1934 118.6629 59.3119 29.3748 179.2837 52 M 4.0359 7.8688 119.0295 58.2648 31.9937 178.7620 53 K 3.9095 8.0859 118.6073 59.7731 32.2191 179.0880 54 H 4.1003 8.0441 116.1504 58.7768 28.6050 177.5853 55 A 4.2289 8.3468 122.8651 55.3639 18.1833 179.1150 56 D 4.2950 8.2716 116.4532 57.5885 41.3069 178.7151 57 R 3.8660 7.9262 118.4961 59.4105 30.0557 178.6564 58 Y 4.3206 7.8346 116.3955 61.1686 37.9086 178.5902 59 I 3.7570 8.2661 121.0776 64.6962 37.2006 178.3967 60 E 4.0404 8.3937 119.2910 59.2769 29.1587 179.4949 61 R 4.0271 8.2083 118.7876 59.5268 30.1502 178.5282 62 I 3.7647 8.3951 119.9913 64.4881 37.1145 178.4518 63 L 4.0017 8.1512 119.6974 57.7714 41.2581 179.2747 64 F 4.3448 8.4257 119.8004 61.2775 39.6789 176.4067 65 L 4.5226 8.1470 117.6888 53.9880 41.1821 177.3246 66 E 3.8696 8.0170 117.6664 57.2689 27.0607 174.5885 67 G 3.9371 7.9917 108.9947 44.1384 0.0000 173.5906 68 L 4.5388 8.0169 119.2420 51.9988 42.1528 175.0714 69 P 4.3653 0.0000 0.0000 62.5427 31.7693 175.9754 70 N 4.7069 9.6493 122.3675 52.4122 38.7482 174.0061 71 L 4.6100 8.2921 124.2295 54.5231 42.4985 177.5135 72 Q 4.0900 8.5041 121.9524 58.0244 29.3053 175.8137 73 D 4.6736 8.0809 117.4279 52.6241 41.9400 175.2325 74 L 4.5235 8.2913 125.7780 52.6943 43.7663 176.1930 75 G 3.8079 8.4584 115.3509 44.6856 0.0000 171.9774 76 K 4.0339 8.3047 120.6852 56.1217 32.4411 176.5116 77 L 4.2570 8.3005 126.2898 54.4696 42.3894 176.4820 78 N 4.8053 8.7598 120.0604 51.7154 39.2058 172.5106 79 I 4.2555 8.1224 124.3690 59.7218 38.2100 176.6337 80 G 4.0490 8.7670 114.5798 45.1365 0.0000 172.7968 81 E 4.7347 8.6013 117.6709 56.1927 31.0763 176.3864 82 D 4.9064 7.6979 117.9704 50.3080 44.0517 176.0407 83 V 4.0023 8.4231 118.9600 66.5538 31.3572 177.5234 84 E 3.8621 8.1926 118.1849 59.4065 29.5123 178.2308 85 E 3.9786 8.3982 118.8539 59.4349 29.6575 178.7622 86 M 4.0485 8.2470 118.7506 58.4242 32.0074 178.7405 87 L 4.1503 8.2110 119.1242 58.0006 41.7285 179.8275 88 R 3.9315 8.4280 118.4091 59.2093 29.9560 179.1580 89 S 4.1524 8.3136 113.0582 61.3937 62.3730 175.8123 90 D 4.6930 8.4271 121.6952 57.3827 40.5907 178.5028 91 L 3.9433 8.2562 120.6103 58.3201 42.1473 178.9443 92 A 4.0383 8.3380 120.8369 55.0094 18.2712 179.3846 93 L 3.9798 8.0982 118.9707 58.3721 42.1241 179.1017 94 E 4.1169 8.6048 118.7623 59.3669 29.4467 179.3205 95 L 4.0282 8.1639 119.0612 58.0146 41.8094 179.3150 96 D 4.5115 8.3787 118.9571 57.3545 40.6495 179.1799 97 G 3.6386 8.3607 106.0983 47.6333 0.0000 175.6889 98 A 4.0266 8.4832 123.5758 54.6283 18.4911 179.4895 99 K 3.8366 8.0242 118.0974 59.9232 32.3284 178.7231 100 N 4.3885 8.0772 116.3301 56.2700 38.4014 177.2984 101 L 4.0002 8.1628 120.4917 57.9773 41.7512 179.7938 102 R 3.9013 8.2304 118.0600 59.1721 30.0318 178.6741 103 E 3.8271 8.0311 118.2995 59.3242 29.5909 178.7660 104 A 2.9027 7.7226 120.6216 54.8163 18.3776 179.6456 105 I 3.7223 8.1177 118.8995 64.3540 36.9272 178.9080 106 G 3.5797 7.7460 105.5580 47.9667 0.0000 174.8909 107 Y 4.1264 7.9982 122.0610 60.1805 38.8818 177.4095 108 A 3.7855 8.2143 122.1234 55.2716 18.3946 179.0236 109 D 4.1235 7.8000 116.0546 57.4846 41.1210 178.5548 110 S 4.1641 7.4860 112.5821 60.1525 63.2395 175.6575 111 V 3.9880 6.8434 113.9528 60.7470 31.6207 175.6272 112 H 2.8019 7.0849 114.2527 56.5912 26.8806 176.4502 113 D 4.5189 7.2986 121.4610 53.7361 38.0259 176.0988 114 Y 4.3145 7.5384 121.4294 60.5124 38.4971 177.7369 115 V 3.7321 7.8824 113.2017 64.2488 31.7455 178.5064 116 S 4.1912 8.3413 114.9505 61.4882 62.5866 176.6026 117 R 3.8914 8.0225 121.3735 59.5587 29.7830 178.0470 118 D 4.3220 8.3589 117.8912 57.5601 41.3101 177.8205 119 M 4.0017 8.2101 118.7052 59.0391 32.1664 178.1844 120 M 4.1774 8.2323 118.8275 58.2797 32.0720 178.8534 121 I 3.7277 8.1821 120.5881 64.3093 37.2673 178.1912 122 E 3.9748 8.0068 119.1732 59.5039 29.2107 179.5495 123 I 3.5584 7.5736 119.2705 64.2079 37.0626 178.1851 124 L 3.9506 8.1646 121.4096 58.1182 42.0033 178.9676 125 R 3.8993 8.1630 118.6491 59.6335 30.1609 178.2713 126 D 4.4377 8.2052 118.6477 57.4099 40.8003 178.6815 127 E 4.1322 8.4591 119.3507 59.5200 29.4586 179.2437 128 E 4.2663 8.7418 119.1861 59.1942 29.4488 179.5689 129 G 3.6952 8.0912 105.5777 48.1240 0.0000 175.2842 130 H 4.3992 8.2069 120.3148 59.0354 29.8661 177.2504 131 I 3.6952 8.3369 122.1341 64.4816 36.9576 177.7725 132 D 4.3369 8.3693 118.7318 57.0729 40.9997 178.0527 133 W 4.1084 8.2661 128.7177 60.4835 30.7279 177.6361 134 L 3.7732 8.3912 119.0020 58.0289 41.1405 179.3706 135 E 3.8954 8.4615 118.5704 59.7653 29.3042 179.7369 136 T 3.7511 7.8742 115.5074 66.5405 68.5220 176.5019 137 E 3.6827 7.7366 120.6151 59.4211 29.0306 179.4454 138 L 3.7492 7.6924 118.7888 57.8854 41.5801 179.4330 139 D 4.3391 7.9866 118.7591 57.2771 40.6547 178.7455 140 L 3.9574 7.9756 119.7269 57.7698 41.6018 179.5882 141 I 3.3791 7.3615 119.7705 64.3528 36.7389 178.2871 142 Q 3.9151 7.3404 117.9465 58.9845 28.9559 177.8948 143 K 4.1489 8.0400 119.1082 58.6114 32.3223 178.2704 144 M 4.3911 8.3325 114.9809 53.9130 32.5396 177.2164 145 G 4.1105 7.5568 105.6478 45.9753 0.0000 174.3931 146 L 3.9568 8.4096 121.6018 58.0158 42.1807 179.2773 147 Q 3.9769 8.0904 117.4633 59.3391 28.7386 178.7200 148 N 4.3503 8.1345 116.7162 56.3201 38.3768 176.6917 149 Y 3.9195 7.9145 120.0887 60.6063 39.1450 177.8151 150 L 4.0329 8.4202 120.2247 57.9631 41.6642 179.1767 151 Q 3.8820 8.1006 119.1109 59.2350 28.7150 178.0206 152 A 4.0886 7.7544 119.4833 53.6921 18.6813 178.3248 153 Q 4.2282 7.9058 116.3242 55.9383 29.1996 177.3306 154 I 4.1361 7.3047 112.6988 61.6050 38.2214 176.1871 155 R 4.6599 7.5515 119.6544 53.8234 32.4582 175.4872 156 E 4.2446 8.5681 119.4046 55.9824 30.5700 175.6211 157 E 4.4979 8.4175 117.7717 54.3915 31.7229 176.2483 *158 G 3.7097 8.5929 110.1231 45.8800 0.0000 172.3685 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 -0.03 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 3.97 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 8.68 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 4.54 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 3.84 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 8.64 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 1.14 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 8.21 4.28 0.00 2.62 2.66 0.00 0.00 7.08 6.90 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 10 Y 8.05 4.07 0.00 3.22 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 11 L 8.45 3.87 0.00 2.03 1.77 1.14 0.79 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 4.38 0.00 2.76 2.81 0.00 0.00 6.69 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 8.14 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 0.78 1.18 0.91 0.48 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 15 L 7.76 3.99 0.00 1.68 1.84 1.00 1.11 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 4.35 0.00 2.92 2.89 0.00 0.00 7.09 7.37 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 18 E 8.27 4.00 0.00 2.23 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 1.03 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 7.66 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 1.07 0.00 0.00 0.97 0.00 0.00 21 A 7.90 3.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.00 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 7.79 4.36 0.00 2.78 2.84 0.00 0.00 6.76 8.23 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 24 Q 8.19 3.88 0.00 2.02 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 8.28 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 8.48 3.81 0.00 3.42 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 3.96 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 1.63 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.35 3.83 0.00 3.46 2.98 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 8.09 4.06 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.62 3.84 0.00 1.76 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 1.67 0.00 31 M 7.76 3.46 0.00 1.01 1.63 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 2.46 2.19 0.00 32 F 7.58 4.63 0.00 3.29 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 8.27 3.93 0.00 2.07 1.89 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 4.24 0.00 2.66 2.65 0.00 0.00 7.35 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 35 W 7.97 4.82 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 8.54 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 1.74 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.15 3.87 0.00 2.02 1.81 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.96 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 1.80 0.00 40 L 7.76 4.05 0.00 1.68 1.09 1.09 0.26 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 8.32 4.44 0.00 3.10 3.01 0.00 0.00 7.20 8.00 0.00 0.00 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 7.64 3.37 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 -0.44 0.00 0.00 0.79 0.00 0.00 44 E 8.54 3.85 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 2.58 2.55 0.00 45 Y 8.42 3.94 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 8.39 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 8.16 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 1.64 1.76 0.00 48 S 8.18 4.22 0.00 4.09 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 7.56 3.57 1.82 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.42 0.83 0.00 0.00 50 D 7.95 4.26 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 2.11 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 2.72 2.51 0.00 52 M 7.87 4.04 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.07 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 8.09 3.91 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 8.04 4.10 0.00 3.41 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 8.35 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 4.30 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 3.87 0.00 1.82 1.76 0.00 3.13 0.00 0.00 3.05 7.55 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 4.32 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 8.27 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 0.96 0.95 0.00 0.00 60 E 8.39 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 8.40 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 0.70 0.99 0.00 0.00 63 L 8.15 4.00 0.00 2.11 1.79 0.95 0.93 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 2.94 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 8.15 4.52 0.00 1.84 1.62 1.04 0.93 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 8.02 3.87 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 7.99 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 4.54 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 1.72 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 3.81 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 8.28 0.00 0.00 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 8.50 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 4.67 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 4.52 0.00 1.51 1.51 0.88 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 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 4.03 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 8.30 4.26 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 7.14 7.23 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 79 I 8.12 4.26 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 0.96 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 8.60 4.73 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 8.42 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 1.15 0.00 0.00 1.18 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 1.79 2.41 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.38 0.00 87 L 8.21 4.15 0.00 2.02 1.71 1.25 0.76 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 8.43 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 8.31 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 8.43 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 8.26 3.94 0.00 1.84 1.89 0.94 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 8.34 4.04 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 8.10 3.98 0.00 1.99 2.05 0.93 0.68 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 94 E 8.60 4.12 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 8.16 4.03 0.00 2.05 1.75 0.95 0.96 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 8.38 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 8.48 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 8.02 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 8.08 4.39 0.00 3.01 2.90 0.00 0.00 7.11 6.56 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 0.00 101 L 8.16 4.00 0.00 1.98 1.75 0.98 1.21 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 8.23 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 2.32 2.38 0.00 104 A 7.72 2.90 1.10 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 0.00 105 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 1.02 0.92 0.00 0.00 106 G 7.75 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 4.13 0.00 3.16 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 0.00 108 A 8.21 3.79 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 7.80 4.12 0.00 2.85 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 7.49 4.16 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 6.84 3.99 1.93 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 0.52 0.00 0.00 0.67 0.00 0.00 112 H 7.08 2.80 0.00 3.16 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 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 Y 7.54 4.31 0.00 3.10 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 0.00 115 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 0.93 0.00 0.00 0.97 0.00 0.00 116 S 8.34 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 1.70 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 4.00 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 2.09 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 8.23 4.18 0.00 2.17 2.25 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 2.92 2.84 0.00 121 I 8.18 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 8.01 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 3.56 1.93 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.56 0.73 0.00 0.00 124 L 8.16 3.95 0.00 1.85 1.85 0.95 1.08 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 8.16 3.90 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 8.21 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 8.46 4.13 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 8.74 4.27 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 8.09 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 8.34 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 0.65 0.94 0.00 0.00 132 D 8.37 4.34 0.00 2.95 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 8.27 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 8.39 3.77 0.00 2.01 1.70 1.20 1.02 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 7.87 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 7.74 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 3.75 0.00 1.69 1.60 0.86 0.83 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 0.00 139 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 7.98 3.96 0.00 1.84 1.82 0.92 1.06 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 7.36 3.38 1.71 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 -0.27 0.71 0.00 0.00 142 Q 7.34 3.92 0.00 2.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 143 K 8.04 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 8.33 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 0.70 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 8.09 3.98 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 7.91 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 8.42 4.03 0.00 2.00 1.68 1.03 0.94 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 8.10 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 4.09 1.18 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 0.00 153 Q 7.91 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 7.30 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 1.18 1.01 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 2.05 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 2.18 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.