NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2339 8.1476 120.2503 54.6477 32.7213 174.6240 2 K 4.3619 8.3332 126.5841 56.6239 33.1531 176.4526 3 G 3.8513 8.6848 111.3387 45.1393 0.0000 167.5795 4 D 4.3953 8.5645 131.0641 54.1451 41.1592 174.4338 5 T 3.8305 8.5962 123.8058 66.7828 68.5477 176.1534 6 K 3.7146 8.1897 120.8105 59.5321 32.0478 178.7261 7 V 3.8916 8.1278 117.9422 66.2797 31.6446 178.1868 8 I 3.7925 7.7918 119.2535 64.0102 36.8162 178.2726 9 N 4.2952 8.1135 117.8590 56.2931 38.3368 176.9965 10 Y 4.0738 7.9025 118.0854 61.0488 37.9405 178.5938 11 L 3.8615 8.2337 120.0004 58.0373 41.7771 179.4799 12 N 4.2943 8.0746 116.1009 55.9338 38.4043 177.5291 13 K 3.9060 7.9531 121.2861 59.3623 32.2951 178.9562 14 L 4.0180 8.0421 119.6834 57.5542 41.3848 179.1863 15 L 3.9677 7.6668 120.4774 58.0180 42.1334 179.2517 16 G 3.5860 7.9477 105.5959 47.8907 0.0000 175.2187 17 N 4.3519 8.0332 118.9949 56.1676 38.5249 177.3243 18 E 4.0607 8.1204 119.7448 59.4849 29.4428 179.2667 19 L 4.0229 8.1529 119.3550 57.9233 41.6255 180.1042 20 V 3.6205 7.8116 118.4149 64.6721 31.3750 178.3555 21 A 3.8557 7.8982 121.7488 54.7187 18.2289 179.6322 22 I 3.8420 8.0699 111.8367 64.2975 37.7359 178.3422 23 N 4.3729 7.9392 118.3397 56.0775 38.4313 177.2708 24 Q 3.8813 8.2707 121.1067 59.3769 29.1481 177.7990 25 Y 4.4361 8.0797 117.8885 60.9838 37.9266 178.1416 26 F 3.9907 8.5910 121.8686 60.9393 39.4590 177.1740 27 L 3.9861 8.0514 119.8862 58.3801 41.8678 178.4996 28 H 3.8045 8.2548 115.9398 58.7016 28.5752 177.2725 29 A 4.1684 8.0220 122.3662 55.7214 18.2139 180.0876 30 R 3.7658 7.6834 115.6954 59.0659 30.0962 179.3826 31 M 3.4474 7.6857 119.1103 57.9206 31.8232 178.6198 32 F 4.3716 7.4984 117.9120 60.4659 39.1894 177.2582 33 K 3.7948 8.2715 119.5770 59.9159 31.6905 177.7966 34 N 4.2585 7.6574 115.4073 56.7576 38.8411 176.1579 35 W 4.7945 7.6964 117.5325 57.6586 29.2607 177.2343 36 G 4.0740 8.8973 108.5610 45.4419 0.0000 173.6753 37 L 4.6383 7.9092 121.9210 52.9080 39.4482 177.0358 38 K 3.9362 8.1182 122.6777 59.3380 32.4842 178.3386 39 R 3.8582 8.2904 119.1691 59.4908 30.0146 178.6456 40 L 4.0515 7.7563 118.3335 57.4892 41.6009 178.8492 41 N 4.4499 8.1810 116.9835 56.8005 38.8335 176.5905 42 D 4.3522 8.2228 120.4457 57.4094 41.0499 179.1421 43 V 3.3210 7.6289 118.3546 66.0935 31.4325 177.8862 44 E 3.7978 8.1108 118.2619 59.4247 29.3896 178.9643 45 Y 3.8531 8.0969 119.5872 61.0202 38.9364 177.6398 46 H 4.0592 7.9319 119.0982 59.0367 29.7926 177.0806 47 E 3.6832 7.5977 120.2882 58.9637 29.0438 179.1183 48 S 4.0933 7.4030 113.2788 61.4475 62.4883 176.3375 49 I 3.6173 7.2287 122.1209 64.1283 36.6456 178.1965 50 D 4.1454 7.8379 119.8002 57.4476 40.6205 178.5277 51 E 4.0243 8.2600 119.1624 59.8592 29.3271 179.3647 52 M 4.0433 8.1704 118.5883 58.4447 31.9864 178.9485 53 K 4.0471 7.9228 118.4012 59.2439 32.2695 179.1470 54 H 4.1303 8.3506 116.7572 58.7917 28.6373 177.4517 55 A 4.2281 8.2841 122.6528 55.5167 18.2531 179.1590 56 D 4.3039 7.9369 116.3377 57.4277 41.1780 178.6863 57 R 3.8383 7.7577 118.2126 59.4222 30.0426 178.6251 58 Y 4.2691 7.5326 115.8585 61.2540 38.0105 178.4725 59 I 3.7997 8.0618 120.7795 64.7406 37.2199 178.3812 60 E 4.0698 8.2672 119.2210 59.1622 29.3211 179.3652 61 R 4.0017 8.1156 118.8767 59.5615 30.2293 178.5957 62 I 3.8005 8.3164 120.0606 64.5177 36.9704 178.4734 63 L 4.1141 8.0054 119.6304 57.5325 41.1826 179.3737 64 F 4.2852 8.1135 119.8363 61.3576 39.8059 176.9154 65 L 4.5677 7.9354 118.1458 54.5653 41.5076 176.5986 66 E 3.4988 7.8664 117.3287 57.8415 26.6393 173.4364 67 G 4.1438 8.3757 107.0473 43.4807 0.0000 172.2326 68 L 4.6284 8.0716 120.2608 52.1101 43.6030 174.3182 69 P 4.3960 0.0000 0.0000 62.7857 31.8195 175.6983 70 N 4.7213 9.2707 121.5101 52.4916 38.6453 173.9940 71 L 4.6898 8.3691 124.7471 54.5521 42.3949 177.3430 72 Q 4.2229 8.3725 122.2542 57.3393 29.7300 175.6699 73 D 4.6706 8.1001 117.7396 52.8938 41.7158 175.2178 74 L 4.6101 8.3534 126.0073 53.0880 44.1157 176.1814 75 G 3.9683 8.2040 113.7480 43.9725 0.0000 172.7916 76 K 4.1432 8.3393 118.8677 55.9030 32.5243 176.7252 77 L 4.3622 8.3922 124.0324 53.2982 42.7362 175.8265 78 N 4.7046 8.3892 122.7756 51.7507 38.1425 174.3719 79 I 3.7950 7.7431 126.0453 61.9464 37.9065 177.3179 80 G 4.2892 8.2226 108.1999 45.7650 0.0000 172.8323 81 E 4.7177 8.7829 119.9171 55.9458 30.8599 176.3592 82 D 4.9826 7.7980 118.9829 50.4337 43.8191 176.2950 83 V 4.0690 8.6395 121.6152 65.6778 31.0189 178.2077 84 E 3.8653 8.2273 119.3023 58.7000 29.5409 178.3436 85 E 3.9708 8.5143 119.4319 59.4588 29.7960 178.4957 86 M 4.2204 8.4794 119.1422 58.6743 32.0725 178.8019 87 L 4.2121 8.4257 119.2461 58.0177 41.7821 179.9081 88 R 4.0239 7.9050 118.0620 59.0245 29.9469 179.3434 89 S 4.1275 8.0537 114.7259 61.7701 62.9161 176.1755 90 D 4.2617 8.0955 121.5497 57.3931 40.5645 178.9342 91 L 3.9837 7.9990 120.3797 58.1220 42.1869 178.7916 92 A 4.0000 8.0989 120.7649 55.0279 18.3015 179.3646 93 L 3.8850 8.0091 118.7370 58.4226 42.2309 178.9973 94 E 4.0618 8.1467 118.4703 59.4484 29.4212 179.4608 95 L 4.0384 8.1399 118.9664 57.8654 41.6217 179.2585 96 D 4.4714 8.2911 118.9470 57.3167 40.7602 179.0820 97 G 3.6272 8.1857 105.9476 47.8380 0.0000 175.4131 98 A 4.0361 8.1465 123.4408 54.7732 18.0333 179.5895 99 K 3.8929 7.9442 117.5440 59.8587 32.2748 178.8590 100 N 4.4028 7.9770 116.4686 56.1095 38.3537 177.3597 101 L 3.9883 8.0163 120.5378 58.0234 41.8398 179.8434 102 R 3.8900 8.0508 117.8858 59.0317 29.8144 178.7810 103 E 3.8366 7.8965 118.6901 59.2560 29.7096 178.8123 104 A 2.8849 7.6210 120.7517 54.8186 17.8280 179.7083 105 I 3.7830 8.0023 118.7443 64.3623 37.0624 178.9540 106 G 3.6034 7.9388 106.2692 47.8044 0.0000 175.2623 107 Y 3.9319 7.7630 121.8846 60.3793 38.7824 177.6754 108 A 3.8821 7.9576 121.7096 55.1220 18.3281 179.1360 109 D 4.1429 7.6938 115.5547 57.6099 41.1371 178.4251 110 S 3.9650 7.3310 114.2143 61.4533 62.9697 176.5206 111 V 3.6516 6.9724 118.0883 61.6502 31.5634 176.3363 112 H 2.9832 7.2728 115.6603 56.8006 26.7811 176.1081 113 D 4.4922 7.5624 122.1213 53.4449 38.6298 176.0995 114 Y 4.3608 7.4946 121.8694 60.3566 38.3854 177.4702 115 V 3.7164 7.8730 119.0441 65.8459 31.8207 178.1712 116 S 4.2370 8.3348 115.0712 61.4127 62.8375 176.7184 117 R 4.0706 8.1178 118.6815 58.7470 29.0924 178.5674 118 D 4.2661 8.2125 119.3408 57.5258 41.3131 177.6011 119 M 3.9906 7.9469 118.6769 59.1380 32.1210 178.0945 120 M 4.1287 8.0123 118.4061 58.5324 32.1067 178.8833 121 I 3.7527 7.7615 119.4432 63.9957 37.0535 178.4604 122 E 3.9234 7.9320 119.8893 59.5904 29.3903 179.3977 123 I 3.6161 7.6620 119.8307 64.1934 37.0758 178.3384 124 L 4.0007 8.2773 121.6324 58.0078 41.6838 178.9511 125 R 3.9244 7.8340 118.0508 59.3361 30.2302 178.0644 126 D 4.4512 7.8029 118.9918 57.2701 40.8143 178.4153 127 E 3.9347 8.1984 119.0294 59.6177 29.4951 179.3537 128 E 4.2132 8.4662 118.1307 58.7885 29.2642 179.4320 129 G 3.7350 7.9668 106.1569 47.5667 0.0000 175.7921 130 H 4.5728 7.9966 118.0376 58.8658 28.8371 177.7195 131 I 3.8525 8.3517 122.1675 64.4236 36.9372 178.0217 132 D 4.3653 8.1188 118.6542 57.0193 41.0808 178.0991 133 W 4.1687 8.1812 128.9121 60.4264 30.7103 177.9883 134 L 3.6332 8.1466 118.7774 57.7608 40.9787 179.2647 135 E 3.9157 8.1646 118.4653 59.7711 29.5339 179.6436 136 T 3.8283 7.8922 115.5668 66.5351 68.4410 176.5160 137 E 3.7985 7.7630 120.3864 59.4984 29.4081 179.5349 138 L 3.8216 7.7855 118.7148 57.7105 41.5790 179.3011 139 D 4.4414 7.7621 119.0091 56.8611 40.8061 178.7323 140 L 4.0452 7.7020 119.3184 57.8148 41.6115 179.5681 141 I 3.4953 7.1840 119.4299 64.1357 36.6909 178.3037 142 Q 3.8685 7.2138 118.0645 59.1261 28.9912 178.1089 143 K 4.1578 8.2495 118.8513 58.7882 32.3900 178.3757 144 M 4.3989 8.5474 114.9423 54.1829 32.5206 177.2924 145 G 4.0529 7.5105 105.5718 45.6252 0.0000 174.3971 146 L 4.0269 8.3513 120.6024 58.1352 42.1300 179.3578 147 Q 4.1004 8.0231 117.6267 58.9949 28.7441 178.2885 148 N 4.3855 8.1124 117.1626 56.2821 38.4819 176.6864 149 Y 3.9729 7.7698 119.8036 60.6479 39.1919 177.8836 150 L 4.1084 8.5680 120.2851 57.9177 41.9325 179.3095 151 Q 3.9887 8.2535 119.2158 58.8626 28.7469 177.3635 152 A 4.2216 7.6749 118.9083 53.0231 18.6087 178.0349 153 Q 4.4121 7.7203 116.6087 55.5843 30.1239 177.0741 154 I 4.1685 7.0653 110.9383 61.6987 37.7760 176.2365 155 R 4.6317 7.4347 119.9485 54.2780 33.7859 174.6092 156 E 4.1443 8.5921 120.3956 55.8404 30.6584 177.2357 157 E 4.0894 8.2979 121.4724 55.5577 31.5071 176.8415 *158 G 3.7265 8.6139 107.8204 46.0880 0.0000 172.6669 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 8.15 4.23 0.00 1.24 1.76 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 2 K 8.33 4.36 0.00 1.92 1.88 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.46 7.81 3 G 8.68 3.85 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 0.00 0.00 0.00 4 D 8.56 4.40 0.00 2.89 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 5 T 8.60 3.83 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 1.21 0.00 0.00 6 K 8.19 3.71 0.00 1.98 1.73 0.00 0.92 0.00 0.00 1.17 0.00 0.00 2.39 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.30 1.14 7.81 7 V 8.13 3.89 2.35 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 1.24 0.00 0.00 1.23 0.00 0.00 8 I 7.79 3.79 2.00 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 1.56 1.16 0.92 0.00 0.00 9 N 8.11 4.30 0.00 2.77 2.61 0.00 0.00 6.85 6.82 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 10 Y 7.90 4.07 0.00 3.19 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 8.23 3.86 0.00 2.05 1.75 1.09 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.07 4.29 0.00 2.89 2.81 0.00 0.00 6.69 6.75 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 13 K 7.95 3.91 0.00 1.78 2.02 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 14 L 8.04 4.02 0.00 1.55 0.86 0.96 0.60 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 15 L 7.67 3.97 0.00 1.70 1.76 1.09 0.91 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 16 G 7.95 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.03 4.35 0.00 3.03 2.91 0.00 0.00 7.06 7.82 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 18 E 8.12 4.06 0.00 2.32 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 2.75 2.85 0.00 19 L 8.15 4.02 0.00 1.85 1.73 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.81 3.62 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.93 0.00 0.00 21 A 7.90 3.86 1.45 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 0.00 0.00 22 I 8.07 3.84 1.92 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 1.00 1.06 0.00 0.00 23 N 7.94 4.37 0.00 2.96 2.91 0.00 0.00 6.68 7.18 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 24 Q 8.27 3.88 0.00 2.00 1.89 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 2.00 2.18 0.00 25 Y 8.08 4.44 0.00 3.26 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.59 3.99 0.00 3.35 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.05 3.99 0.00 1.88 1.63 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.25 3.80 0.00 3.60 3.28 0.00 5.89 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 8.02 4.17 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.68 3.77 0.00 1.75 1.89 0.00 3.18 0.00 0.00 2.96 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.74 0.00 31 M 7.69 3.45 0.00 0.85 1.51 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.22 0.00 32 F 7.50 4.37 0.00 3.25 3.22 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 0.00 0.00 0.00 33 K 8.27 3.79 0.00 2.09 1.91 0.00 1.66 0.00 0.00 1.50 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.43 7.81 34 N 7.66 4.26 0.00 2.70 2.64 0.00 0.00 7.38 8.11 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 35 W 7.70 4.79 0.00 3.77 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 36 G 8.90 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.91 4.64 0.00 2.14 1.66 1.03 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.12 3.94 0.00 1.78 1.85 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.51 7.81 39 R 8.29 3.86 0.00 2.02 2.07 0.00 3.06 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 40 L 7.76 4.05 0.00 1.50 0.90 1.04 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.18 4.45 0.00 3.16 3.07 0.00 0.00 7.17 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 42 D 8.22 4.35 0.00 2.92 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 43 V 7.63 3.32 1.70 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 -0.75 0.00 0.00 0.78 0.00 0.00 44 E 8.11 3.80 0.00 2.34 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 0.00 2.66 3.15 0.00 45 Y 8.10 3.85 0.00 3.01 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 46 H 7.93 4.06 0.00 3.20 3.16 0.00 5.83 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 7.60 3.68 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 1.82 1.78 0.00 48 S 7.40 4.09 0.00 4.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.23 3.62 1.87 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.63 0.86 0.00 0.00 50 D 7.84 4.15 0.00 2.71 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 51 E 8.26 4.02 0.00 2.19 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 2.71 2.82 0.00 52 M 8.17 4.04 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 53 K 7.92 4.05 0.00 1.92 1.80 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.61 7.81 54 H 8.35 4.13 0.00 3.46 3.47 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 8.28 4.23 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 7.94 4.30 0.00 2.75 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 57 R 7.76 3.84 0.00 2.00 1.64 0.00 3.12 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 1.54 1.60 0.00 58 Y 7.53 4.27 0.00 3.23 2.97 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 0.00 0.00 0.00 59 I 8.06 3.80 2.05 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 1.59 1.48 0.95 0.00 0.00 60 E 8.27 4.07 0.00 2.18 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.70 0.00 61 R 8.12 4.00 0.00 2.14 2.22 0.00 3.31 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.85 0.00 62 I 8.32 3.80 1.94 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 1.59 0.71 0.92 0.00 0.00 63 L 8.01 4.11 0.00 2.12 1.79 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 64 F 8.11 4.29 0.00 2.99 3.31 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 0.00 0.00 0.00 0.00 65 L 7.94 4.57 0.00 1.99 1.68 0.99 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.87 3.50 0.00 2.01 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 2.13 2.23 0.00 67 G 8.38 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 68 L 8.07 4.63 0.00 1.57 1.54 0.92 0.91 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 69 P 0.00 4.40 0.00 2.10 2.01 0.00 3.72 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 70 N 9.27 4.72 0.00 2.59 2.79 0.00 0.00 7.02 7.74 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 71 L 8.37 4.69 0.00 1.64 1.62 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.37 4.22 0.00 1.99 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 73 D 8.10 4.67 0.00 2.68 2.57 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 0.00 0.00 0.00 74 L 8.35 4.61 0.00 1.57 1.51 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.20 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.34 4.14 0.00 1.75 1.76 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.45 7.81 77 L 8.39 4.36 0.00 1.61 1.56 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.39 4.70 0.00 2.64 2.74 0.00 0.00 7.22 7.94 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 79 I 7.74 3.79 1.90 0.00 0.00 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 1.35 0.92 0.95 0.00 0.00 80 G 8.22 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.78 4.72 0.00 2.04 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 2.31 2.41 0.00 82 D 7.80 4.98 0.00 2.87 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 8.64 4.07 2.76 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 1.11 0.00 0.00 1.12 0.00 0.00 84 E 8.23 3.87 0.00 2.00 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 2.25 2.22 0.00 85 E 8.51 3.97 0.00 2.47 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 0.00 2.34 2.37 0.00 86 M 8.48 4.22 0.00 1.80 2.42 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.42 0.00 87 L 8.43 4.21 0.00 1.87 1.74 1.22 0.92 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 88 R 7.91 4.02 0.00 1.99 1.99 0.00 3.12 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 89 S 8.05 4.13 0.00 4.16 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.10 4.26 0.00 3.09 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 91 L 8.00 3.98 0.00 1.93 1.87 0.98 1.03 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 92 A 8.10 4.00 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 93 L 8.01 3.89 0.00 1.87 1.80 0.89 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.15 4.06 0.00 2.34 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 2.59 2.71 0.00 95 L 8.14 4.04 0.00 2.06 1.73 0.96 1.01 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 96 D 8.29 4.47 0.00 2.87 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.19 3.63 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 0.00 0.00 0.00 98 A 8.15 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 7.94 3.89 0.00 1.98 2.04 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.50 7.81 100 N 7.98 4.40 0.00 2.94 2.89 0.00 0.00 7.05 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 0.00 101 L 8.02 3.99 0.00 1.91 1.73 0.96 0.91 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 0.00 102 R 8.05 3.89 0.00 1.86 1.97 0.00 3.14 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.93 0.00 103 E 7.90 3.84 0.00 2.02 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 2.28 2.36 0.00 104 A 7.62 2.88 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 8.00 3.78 1.85 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 1.14 0.92 0.00 0.00 106 G 7.94 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 7.76 3.93 0.00 3.04 2.97 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 0.00 0.00 0.00 108 A 7.96 3.88 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 0.00 109 D 7.69 4.14 0.00 2.86 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 S 7.33 3.97 0.00 3.54 3.73 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 0.00 111 V 6.97 3.65 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 0.64 0.00 0.00 0.84 0.00 0.00 112 H 7.27 2.98 0.00 3.14 3.23 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 7.56 4.49 0.00 2.60 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 Y 7.49 4.36 0.00 3.09 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 0.00 115 V 7.87 3.72 2.15 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 1.09 0.00 0.00 0.99 0.00 0.00 116 S 8.33 4.24 0.00 4.10 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.12 4.07 0.00 2.14 2.33 0.00 2.91 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.93 0.00 118 D 8.21 4.27 0.00 3.00 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 0.00 119 M 7.95 3.99 0.00 2.29 2.03 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 120 M 8.01 4.13 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.81 0.00 121 I 7.76 3.75 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 7.93 3.92 0.00 2.21 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 2.54 0.00 123 I 7.66 3.62 1.93 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.86 0.69 0.00 0.00 124 L 8.28 4.00 0.00 1.85 1.82 0.94 1.14 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 0.00 125 R 7.83 3.92 0.00 2.04 2.12 0.00 3.32 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 126 D 7.80 4.45 0.00 2.97 2.70 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 0.00 127 E 8.20 3.93 0.00 2.14 2.19 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 2.52 2.55 0.00 128 E 8.47 4.21 0.00 2.26 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 129 G 7.97 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 0.00 130 H 8.00 4.57 0.00 3.65 3.63 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.35 3.85 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.83 0.97 0.00 0.00 132 D 8.12 4.37 0.00 2.96 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 W 8.18 4.17 0.00 3.44 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 8.15 3.63 0.00 1.86 1.73 1.24 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.16 3.92 0.00 2.17 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.65 0.00 136 T 7.89 3.83 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 137 E 7.76 3.80 0.00 1.57 1.64 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 1.47 1.47 0.00 138 L 7.79 3.82 0.00 1.66 1.62 0.88 0.85 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 0.00 139 D 7.76 4.44 0.00 2.83 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.70 4.05 0.00 2.08 1.85 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.18 3.50 1.54 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.06 0.67 0.00 0.00 142 Q 7.21 3.87 0.00 2.01 2.20 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 8.25 4.16 0.00 1.78 1.84 0.00 1.72 0.00 0.00 1.92 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.42 7.81 144 M 8.55 4.40 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.94 0.00 145 G 7.51 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 0.00 146 L 8.35 4.03 0.00 1.74 1.67 0.94 0.70 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 0.00 147 Q 8.02 4.10 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 148 N 8.11 4.39 0.00 2.95 2.89 0.00 0.00 6.77 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 7.77 3.97 0.00 3.10 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 0.00 150 L 8.57 4.11 0.00 2.01 1.71 1.11 0.76 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 0.00 151 Q 8.25 3.99 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 152 A 7.67 4.22 1.22 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 0.00 0.00 0.00 0.00 0.00 153 Q 7.72 4.41 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 154 I 7.07 4.17 1.88 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 1.21 0.92 0.00 0.00 155 R 7.43 4.63 0.00 1.73 1.79 0.00 3.19 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 156 E 8.59 4.14 0.00 2.08 1.92 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 2.25 2.34 0.00 157 E 8.30 4.09 0.00 1.95 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 0.00 2.29 2.26 0.00 *158 G 8.61 3.73 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.