NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2355 8.1476 120.2495 54.6373 32.6795 174.6129 2 K 4.7400 7.7676 126.0002 56.1882 33.1172 176.4228 3 G 3.8346 8.4807 111.0345 45.1450 0.0000 167.4829 4 D 4.3934 8.5928 131.4308 54.0844 41.2265 174.4499 5 T 3.8304 8.5938 123.7885 66.7705 68.5519 176.1663 6 K 3.7109 8.1879 120.8317 59.5387 32.0434 178.7258 7 V 3.8940 8.1165 117.9155 66.2776 31.6551 178.1813 8 I 3.7863 7.7896 119.2505 63.9901 36.8102 178.2888 9 N 4.2894 8.1346 117.8735 56.3148 38.3432 176.9693 10 Y 4.0730 7.8795 118.0741 61.0684 37.9181 178.6404 11 L 3.8617 8.2528 120.0156 58.0425 41.7951 179.4836 12 N 4.2808 8.0644 116.0428 55.9337 38.3986 177.5276 13 K 3.9107 7.9353 121.2996 59.3409 32.2922 178.9624 14 L 4.0150 8.0536 119.7058 57.5806 41.4037 179.1775 15 L 3.9793 7.6923 120.5186 58.0218 42.1183 179.2509 16 G 3.5894 7.9506 105.5726 47.8846 0.0000 175.2636 17 N 4.3618 8.0227 118.9504 56.1356 38.5112 177.3365 18 E 4.0638 8.1539 119.8092 59.4953 29.3934 179.2625 19 L 4.0212 8.1438 119.3352 57.9221 41.6357 180.1057 20 V 3.6246 7.8066 118.3803 64.6854 31.3901 178.3657 21 A 3.8649 7.8970 121.8014 54.6893 18.2189 179.6366 22 I 3.8404 8.0803 111.8717 64.3139 37.7487 178.3412 23 N 4.3771 7.9317 118.2524 56.0592 38.4171 177.2708 24 Q 3.8850 8.2606 121.0707 59.3793 29.1532 177.7939 25 Y 4.4392 8.1009 117.8794 60.9800 37.9398 178.1286 26 F 3.9831 8.5726 121.8802 60.9223 39.4716 177.1876 27 L 3.9924 8.0496 119.8846 58.3564 41.8820 178.5096 28 H 3.7980 8.2735 115.9471 58.6902 28.5948 177.2415 29 A 4.1661 8.0144 122.3918 55.7498 18.2040 180.0986 30 R 3.8165 7.6683 115.6086 59.0795 30.0577 179.3968 31 M 3.4543 7.6575 119.0537 57.9261 31.8164 178.6292 32 F 4.3671 7.4828 117.8641 60.4645 39.1887 177.2598 33 K 3.7928 8.3149 119.6369 59.9041 31.6890 177.7878 34 N 4.2581 7.6630 115.4132 56.7669 38.8484 176.1620 35 W 4.7930 7.7078 117.5215 57.6526 29.3081 177.2390 36 G 4.0614 8.8549 108.6301 45.5146 0.0000 173.6888 37 L 4.6377 7.9062 122.0358 52.8384 39.4330 177.0361 38 K 3.9271 8.1177 122.6768 59.3500 32.5009 178.3258 39 R 3.8576 8.2596 119.0956 59.5095 30.0224 178.6453 40 L 4.0535 7.7569 118.3173 57.4910 41.5773 178.8636 41 N 4.4447 8.1681 116.9289 56.7992 38.8456 176.5710 42 D 4.3494 8.2040 120.4246 57.4271 41.0571 179.1579 43 V 3.3141 7.6113 118.2991 66.0965 31.4331 177.8915 44 E 3.7982 8.1105 118.2511 59.4125 29.3823 178.9796 45 Y 3.8710 8.1112 119.6352 61.0160 38.9465 177.5970 46 H 4.0568 7.9353 119.1395 59.0312 29.7851 177.0803 47 E 3.6898 7.6002 120.2935 58.9545 29.0633 179.1081 48 S 4.0899 7.3842 113.4127 61.4498 62.5184 176.3479 49 I 3.6383 7.2290 122.0846 64.1059 36.6480 178.2190 50 D 4.1553 7.8353 119.8358 57.4259 40.6035 178.5127 51 E 4.0218 8.2945 119.2504 59.8430 29.3369 179.3518 52 M 4.0433 8.1463 118.5742 58.4468 31.9397 178.9514 53 K 4.0544 7.9074 118.3280 59.2449 32.2297 179.1479 54 H 4.1232 8.3325 116.7285 58.7724 28.6411 177.4240 55 A 4.2189 8.3041 122.7104 55.5421 18.2446 179.1335 56 D 4.3082 7.9332 116.1856 57.4698 41.1685 178.6926 57 R 3.8394 7.7472 118.2426 59.4295 30.0409 178.6250 58 Y 4.2834 7.5404 115.8918 61.2754 38.0384 178.4769 59 I 3.7988 8.0583 120.7655 64.7498 37.2158 178.3768 60 E 4.0785 8.2877 119.2393 59.1525 29.3242 179.3647 61 R 4.0018 8.1377 118.8955 59.5321 30.1999 178.5722 62 I 3.7950 8.3047 120.0625 64.5437 36.9816 178.4652 63 L 4.0900 7.9809 119.5179 57.5434 41.1796 179.3917 64 F 4.2661 8.1032 119.8323 61.3423 39.8077 176.9091 65 L 4.5809 7.9268 118.1168 54.5657 41.4873 176.6171 66 E 3.5698 7.8658 117.3595 57.8514 26.6540 173.4277 67 G 4.1692 8.3288 107.2625 43.4575 0.0000 172.1731 68 L 4.6401 8.0803 120.2070 52.1008 43.7245 174.3726 69 P 4.3823 0.0000 0.0000 62.8196 31.8041 175.6808 70 N 4.7113 9.2529 121.7083 52.4953 38.5548 173.9542 71 L 4.6853 8.3526 124.6084 54.5386 42.3824 177.3725 72 Q 4.2135 8.3335 122.2912 57.3757 29.6807 175.6851 73 D 4.6779 8.0927 117.7251 52.8693 41.7513 175.2169 74 L 4.6225 8.3545 125.9516 53.0760 44.1834 176.2054 75 G 3.9677 8.2042 113.6930 43.9956 0.0000 172.7250 76 K 4.1437 8.3472 118.8902 55.8916 32.5056 176.7099 77 L 4.3448 8.3986 124.1490 53.3500 42.6834 175.8423 78 N 4.7101 8.3908 122.7878 51.7576 38.2161 174.3991 79 I 3.8000 7.8013 125.9947 62.3050 37.8780 177.3689 80 G 4.3043 8.2319 107.8356 45.7797 0.0000 172.8297 81 E 4.7184 8.7781 119.8191 55.9390 30.8905 176.3769 82 D 4.9850 7.8031 118.9874 50.4511 43.8141 176.2985 83 V 4.0764 8.6542 121.6070 65.6857 30.9974 178.2175 84 E 3.8722 8.2221 119.2501 58.7143 29.5665 178.3453 85 E 3.9722 8.4736 119.4423 59.4513 29.7868 178.4864 86 M 4.2191 8.4900 119.1434 58.6686 32.0717 178.7764 87 L 4.2079 8.4337 119.2645 58.0496 41.7942 179.9232 88 R 4.0212 7.8996 118.0018 59.0385 29.9395 179.3580 89 S 4.1273 8.0557 114.7210 61.7696 62.9188 176.1857 90 D 4.2584 8.1203 121.5787 57.3942 40.5751 178.9221 91 L 3.9898 7.9975 120.4148 58.0833 42.1714 178.7941 92 A 4.0019 8.0763 120.7673 55.0172 18.3216 179.3394 93 L 3.8803 8.0182 118.7422 58.4496 42.2179 178.9925 94 E 4.0627 8.1361 118.4352 59.4670 29.3589 179.4796 95 L 4.0369 8.1237 118.9422 57.8568 41.6401 179.2635 96 D 4.4648 8.3123 118.9666 57.2855 40.7400 179.0468 97 G 3.6325 8.1912 105.9474 47.8641 0.0000 175.3823 98 A 4.0278 8.1547 123.5145 54.7772 18.0946 179.5932 99 K 3.8953 7.9296 117.5761 59.8542 32.2956 178.8577 100 N 4.3965 7.9781 116.4159 56.0987 38.3491 177.3449 101 L 3.9925 8.0463 120.5588 58.0308 41.8949 179.8296 102 R 3.8862 8.0480 117.8440 59.0628 29.8200 178.7684 103 E 3.8384 7.8975 118.7721 59.2703 29.6959 178.8152 104 A 2.8652 7.6447 120.7117 54.8066 17.8247 179.6998 105 I 3.7742 7.9997 118.7483 64.4035 37.0026 178.9559 106 G 3.6232 7.9639 106.3038 47.7948 0.0000 175.2738 107 Y 3.9487 7.7625 121.8223 60.3869 38.7729 177.6124 108 A 3.8823 7.9762 121.7463 55.1303 18.3402 179.1412 109 D 4.1405 7.6900 115.4097 57.5692 41.1243 178.4534 110 S 3.9702 7.3029 114.6456 61.4422 62.9759 176.5191 111 V 3.6324 6.9563 118.0792 61.7014 31.5502 176.3519 112 H 2.9575 7.2416 115.6373 56.7674 26.7953 176.1345 113 D 4.4961 7.5200 122.0397 53.4557 38.5361 176.1214 114 Y 4.3741 7.5037 121.7089 60.3293 38.3894 177.4833 115 V 3.7259 7.8511 119.1072 65.8542 31.7980 178.1559 116 S 4.2359 8.3765 115.2352 61.4266 62.7626 176.7379 117 R 4.0670 8.1502 118.7419 58.7703 29.0743 178.5780 118 D 4.2572 8.1964 119.2947 57.5029 41.3125 177.6037 119 M 4.0006 7.9554 118.6914 59.1249 32.1326 178.0633 120 M 4.1167 8.0072 118.4731 58.5746 32.1156 178.8983 121 I 3.7457 7.7336 119.3993 64.0279 37.0255 178.4713 122 E 3.9301 7.9202 119.8577 59.5786 29.3823 179.4037 123 I 3.6137 7.6658 119.8424 64.1717 37.0778 178.3348 124 L 4.0042 8.2629 121.6286 58.0083 41.6877 178.9526 125 R 3.9296 7.8399 118.0360 59.3383 30.2646 178.0501 126 D 4.4544 7.7858 118.9376 57.2299 40.7835 178.4301 127 E 3.9369 8.1821 119.0434 59.6045 29.4425 179.3404 128 E 4.1611 8.4545 118.1185 58.7609 29.2773 179.4637 129 G 3.7146 7.9263 106.1731 47.6430 0.0000 175.7761 130 H 4.5805 8.0032 118.0470 58.8573 28.8200 177.7552 131 I 3.8682 8.3239 122.1348 64.3982 36.9291 178.0297 132 D 4.3597 8.1081 118.9059 56.9985 41.0785 178.0954 133 W 4.1727 8.1986 128.7978 60.4189 30.6998 177.9884 134 L 3.6232 8.1109 118.5910 57.7611 40.9829 179.2484 135 E 3.9112 8.1158 118.4545 59.7864 29.5318 179.6597 136 T 3.8277 7.8831 115.5386 66.5364 68.4528 176.5149 137 E 3.7941 7.7544 120.3864 59.5011 29.0978 179.5234 138 L 3.8164 7.7869 118.7516 57.7600 41.5888 179.3256 139 D 4.4169 7.7695 118.9784 56.8976 40.7916 178.7458 140 L 4.0613 7.7018 119.3090 57.7907 41.6076 179.5601 141 I 3.4976 7.1961 119.4408 64.1464 36.6948 178.3021 142 Q 3.8750 7.2439 118.2079 59.0962 28.9827 178.0810 143 K 4.1585 8.2423 118.9234 58.7825 32.4006 178.3724 144 M 4.3924 8.5577 114.9949 54.2058 32.5396 177.3169 145 G 4.0528 7.4983 105.5867 45.6129 0.0000 174.3716 146 L 4.0258 8.3575 120.6955 58.1453 42.1374 179.3972 147 Q 4.1068 8.0240 117.6255 58.9808 28.7185 178.2667 148 N 4.3967 8.1125 117.1789 56.2700 38.4831 176.7035 149 Y 3.9600 7.7700 119.8058 60.6469 39.2243 177.8458 150 L 4.1078 8.5535 120.3230 57.9090 41.9273 179.3116 151 Q 3.9885 8.2282 119.2104 58.8522 28.7493 177.3527 152 A 4.2327 7.6222 118.9433 53.0086 18.6114 178.0331 153 Q 4.4149 7.7989 116.5677 55.5816 30.1305 177.0656 154 I 4.1842 7.0696 110.8959 61.6785 37.7859 176.2330 155 R 4.6295 7.4394 119.9724 54.2578 33.7660 174.6239 156 E 4.1413 8.5981 120.4438 55.8646 30.6619 177.3441 157 E 4.0883 8.2959 121.5004 55.5763 31.5068 176.8392 *158 G 3.7267 8.5796 107.7354 46.1109 0.0000 172.6577 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 4.24 0.00 1.28 1.77 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 2.50 2.41 0.00 2 K 7.77 4.74 0.00 1.92 1.88 0.00 1.23 0.00 0.00 2.34 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.42 7.81 3 G 8.48 3.83 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 0.00 0.00 0.00 4 D 8.59 4.39 0.00 2.97 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 0.00 0.00 0.00 0.00 5 T 8.59 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 1.24 0.00 0.00 6 K 8.19 3.71 0.00 1.97 1.74 0.00 0.92 0.00 0.00 1.17 0.00 0.00 2.39 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.30 1.13 7.81 7 V 8.12 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 1.25 0.00 0.00 1.20 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 1.20 0.92 0.00 0.00 9 N 8.13 4.29 0.00 2.77 2.61 0.00 0.00 6.85 7.02 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 10 Y 7.88 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 8.25 3.86 0.00 2.04 1.75 1.10 1.05 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 8.06 4.28 0.00 2.89 2.81 0.00 0.00 6.70 6.59 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 13 K 7.94 3.91 0.00 1.78 2.02 0.00 1.70 0.00 0.00 1.72 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 8.05 4.02 0.00 1.56 0.86 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.69 3.98 0.00 1.69 1.76 1.09 0.95 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 8.02 4.36 0.00 3.03 2.91 0.00 0.00 7.05 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 18 E 8.15 4.06 0.00 2.31 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 8.14 4.02 0.00 1.85 1.73 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 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 0.89 0.00 0.00 0.90 0.00 0.00 21 A 7.90 3.86 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 22 I 8.08 3.84 1.92 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 1.53 0.97 1.03 0.00 0.00 23 N 7.93 4.38 0.00 2.97 2.91 0.00 0.00 6.68 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 24 Q 8.26 3.89 0.00 2.01 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 8.10 4.44 0.00 3.39 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 26 F 8.57 3.98 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 0.93 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 8.27 3.80 0.00 3.58 3.26 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 8.01 4.17 1.31 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 0.00 0.00 30 R 7.67 3.82 0.00 1.75 1.88 0.00 3.17 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 1.33 1.74 0.00 31 M 7.66 3.45 0.00 0.87 1.51 0.00 0.00 0.00 0.00 0.00 1.90 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 7.48 4.37 0.00 3.26 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 8.31 3.79 0.00 2.07 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 7.71 4.79 0.00 3.76 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.85 4.06 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 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 2.13 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.12 3.93 0.00 1.78 1.85 0.00 1.79 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 8.26 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 1.67 1.68 0.00 40 L 7.76 4.05 0.00 1.49 0.90 1.06 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.17 4.44 0.00 3.16 3.06 0.00 0.00 7.16 8.20 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 42 D 8.20 4.35 0.00 2.93 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 7.61 3.31 1.69 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 -0.68 0.00 0.00 0.73 0.00 0.00 44 E 8.11 3.80 0.00 2.34 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 0.00 2.66 3.15 0.00 45 Y 8.11 3.87 0.00 3.00 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 46 H 7.94 4.06 0.00 3.19 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 3.69 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 1.84 1.78 0.00 48 S 7.38 4.09 0.00 3.99 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 3.64 1.87 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.76 0.85 0.00 0.00 50 D 7.84 4.16 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 8.29 4.02 0.00 2.18 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 2.72 2.82 0.00 52 M 8.15 4.04 0.00 2.03 2.20 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 2.71 2.55 0.00 53 K 7.91 4.05 0.00 1.92 1.80 0.00 1.62 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 1.62 7.81 54 H 8.33 4.12 0.00 3.36 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 8.30 4.22 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 56 D 7.93 4.31 0.00 2.76 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 7.75 3.84 0.00 1.99 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 7.54 4.28 0.00 3.23 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 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 1.53 0.95 0.00 0.00 60 E 8.29 4.08 0.00 2.18 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 2.70 0.00 61 R 8.14 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 8.30 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 0.75 0.96 0.00 0.00 63 L 7.98 4.09 0.00 2.12 1.79 0.98 0.90 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 8.10 4.27 0.00 3.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 7.93 4.58 0.00 1.99 1.68 0.99 0.71 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 3.57 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 8.33 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.08 4.64 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 1.56 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.38 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 9.25 4.71 0.00 2.60 2.80 0.00 0.00 7.03 7.62 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 71 L 8.35 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 1.23 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.33 4.21 0.00 1.99 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.21 6.73 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 73 D 8.09 4.68 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 4.62 0.00 1.56 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 8.35 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 8.40 4.34 0.00 1.61 1.57 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.39 4.71 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 7.80 3.80 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 0.93 1.00 0.00 0.00 80 G 8.23 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.65 4.08 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 1.13 0.00 0.00 1.12 0.00 0.00 84 E 8.22 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 8.47 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 8.49 4.22 0.00 1.80 2.42 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.51 0.00 87 L 8.43 4.21 0.00 1.87 1.74 1.22 0.84 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 7.90 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 8.06 4.13 0.00 4.15 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 8.12 4.26 0.00 3.09 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.00 3.99 0.00 1.93 1.87 0.98 1.04 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 8.08 4.00 1.38 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 0.00 0.00 93 L 8.02 3.88 0.00 1.87 1.79 0.89 0.69 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 8.14 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 2.57 2.71 0.00 95 L 8.12 4.04 0.00 2.06 1.73 0.96 1.00 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 8.31 4.46 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 4.03 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 99 K 7.93 3.90 0.00 1.96 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 2.95 2.89 0.00 0.00 7.05 8.03 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 0.00 101 L 8.05 3.99 0.00 1.90 1.74 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 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 7.56 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 2.01 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 2.36 0.00 104 A 7.64 2.87 1.11 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 0.00 105 I 8.00 3.77 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 1.19 0.92 0.00 0.00 106 G 7.96 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 0.00 107 Y 7.76 3.95 0.00 3.05 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 7.98 3.88 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 109 D 7.69 4.14 0.00 2.87 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 S 7.30 3.97 0.00 3.52 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 6.96 3.63 1.81 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 0.63 0.00 0.00 0.81 0.00 0.00 112 H 7.24 2.96 0.00 3.14 3.23 0.00 5.84 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.52 4.50 0.00 2.61 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 7.50 4.37 0.00 3.09 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 0.00 115 V 7.85 3.73 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 1.08 0.00 0.00 0.99 0.00 0.00 116 S 8.38 4.24 0.00 4.11 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 8.15 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 8.20 4.26 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 7.96 4.00 0.00 2.29 2.03 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 120 M 8.01 4.12 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 2.21 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 7.73 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 0.84 0.92 0.00 0.00 122 E 7.92 3.93 0.00 2.23 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 7.67 3.61 1.93 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.84 0.73 0.00 0.00 124 L 8.26 4.00 0.00 1.85 1.86 0.94 1.15 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 7.84 3.93 0.00 2.04 2.12 0.00 3.32 0.00 0.00 3.22 7.59 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 7.79 4.45 0.00 2.99 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 8.18 3.94 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 2.61 2.55 0.00 128 E 8.45 4.16 0.00 2.25 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 7.93 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 0.00 130 H 8.00 4.58 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 8.32 3.87 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 8.11 4.36 0.00 2.94 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 8.20 4.17 0.00 3.45 3.32 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 0.00 134 L 8.11 3.62 0.00 1.87 1.73 1.27 1.06 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 8.12 3.91 0.00 2.17 1.99 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 2.33 2.66 0.00 136 T 7.88 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 1.19 0.00 0.00 137 E 7.75 3.79 0.00 1.56 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 1.61 0.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 139 D 7.77 4.42 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 4.06 0.00 2.07 1.85 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.20 3.50 1.67 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.03 0.68 0.00 0.00 142 Q 7.24 3.87 0.00 2.01 2.19 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 8.24 4.16 0.00 1.79 1.84 0.00 1.72 0.00 0.00 1.91 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 8.56 4.39 0.00 2.15 2.21 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 2.64 2.94 0.00 145 G 7.50 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 8.36 4.03 0.00 1.74 1.67 0.95 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 4.11 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.70 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 148 N 8.11 4.40 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 3.96 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 8.55 4.11 0.00 2.02 1.71 1.12 0.74 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 8.23 3.99 0.00 2.21 2.24 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 7.62 4.23 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 7.80 4.41 0.00 1.98 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 4.18 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 1.24 0.95 0.00 0.00 155 R 7.44 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 8.60 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 8.58 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.