NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1829 8.1633 120.2793 54.6551 33.0838 174.1919 2 K 3.9843 8.5063 126.3751 56.2835 32.4244 175.7329 3 G 3.9401 8.6806 113.6062 44.8338 0.0000 171.9732 4 D 4.5298 8.4839 119.8546 54.4302 41.8617 176.8228 5 T 3.8750 8.9868 123.1665 66.9444 68.5072 176.3962 6 K 3.8320 8.1386 120.8011 59.1954 32.2434 178.7586 7 V 3.9145 8.6379 118.8952 66.2141 31.4248 177.8902 8 I 3.7408 7.8343 119.4073 64.7025 36.9179 178.0995 9 N 4.2758 8.2213 117.0300 56.4278 38.3097 177.0848 10 Y 4.0768 8.0582 118.0975 61.1088 38.0218 178.5430 11 L 3.8758 8.4706 120.2378 58.0554 41.6802 179.4843 12 N 4.4008 8.5568 116.6956 55.9723 38.3961 177.4917 13 K 3.8682 8.1390 121.3397 59.3572 32.3171 178.9396 14 L 3.8014 8.1473 119.6803 57.5199 41.3762 178.9402 15 L 3.9928 7.7818 120.7915 58.2540 42.0065 179.0994 16 G 3.7035 8.1484 105.5106 48.1202 0.0000 175.2182 17 N 4.3458 8.0062 118.9809 56.0736 38.5725 177.3908 18 E 4.0017 8.3406 119.9114 59.3835 29.4098 179.3819 19 L 4.0013 8.1748 119.2658 57.6292 41.5522 179.8091 20 V 3.4695 7.6287 117.3968 65.9908 31.5403 177.9194 21 A 3.2350 7.8922 120.4886 54.7995 18.0929 179.3691 22 I 3.5607 7.9738 118.6364 64.8481 37.2182 178.3997 23 N 4.3587 7.7920 116.8872 56.3380 38.3233 177.4088 24 Q 3.8732 8.1745 121.2226 59.4925 29.0832 177.9238 25 Y 4.6122 8.2923 118.2315 60.8602 37.9432 178.0767 26 F 3.7978 8.4503 121.8640 61.0396 39.5489 176.9728 27 L 3.9480 8.2167 120.0327 58.5413 41.8500 178.5058 28 H 3.8467 8.3514 116.0637 58.6749 28.5577 177.4317 29 A 4.0612 8.0886 122.6279 55.5005 18.1843 179.8372 30 R 3.8580 7.6292 115.2880 58.4639 30.1355 179.2382 31 M 3.4501 7.7058 119.2501 58.1706 31.8515 178.3564 32 F 4.6416 7.5705 118.0405 60.6694 39.0249 177.7081 33 K 3.9272 8.2425 119.0831 59.5803 31.8221 178.0952 34 N 4.2385 7.9415 116.1062 56.6604 38.8962 176.0997 35 W 4.8334 7.9629 116.8256 57.0177 29.1347 177.1073 36 G 3.9827 8.5092 108.4335 46.0213 0.0000 174.3055 37 L 4.7245 8.2036 122.7453 52.6535 40.4510 177.0147 38 K 3.8736 8.1481 123.6775 59.6186 32.6147 177.6196 39 R 3.9019 8.1344 118.7954 59.4598 29.8978 178.5275 40 L 4.0528 7.7630 118.3799 57.5254 41.5619 178.6183 41 N 4.5424 8.3560 117.1014 56.8692 38.8968 176.5271 42 D 4.3952 8.2063 120.0922 57.4865 40.9630 179.0484 43 V 3.3688 7.6472 118.4062 65.9451 31.4775 177.6703 44 E 3.8578 8.5351 119.4530 59.3334 29.4849 178.1302 45 Y 3.9518 8.4006 119.9973 61.1084 38.9483 177.7701 46 H 4.0934 8.3893 116.7915 58.2666 28.7931 177.4504 47 E 3.8218 8.1411 121.8537 58.9738 29.4516 178.5737 48 S 4.2262 8.1718 113.3257 61.5576 62.4968 176.2019 49 I 3.5767 7.5820 122.4224 64.4283 36.7717 178.0846 50 D 4.2631 7.9452 119.5918 57.5283 40.5666 178.8294 51 E 4.0665 8.1923 118.6889 59.3152 29.3473 179.2878 52 M 4.0367 7.8641 119.0164 58.2660 31.9928 178.7648 53 K 3.9041 8.0773 118.5936 59.7651 32.2217 179.0910 54 H 4.1017 8.0360 116.1545 58.7877 28.6253 177.5994 55 A 4.2265 8.3577 122.8807 55.3469 18.1652 179.1008 56 D 4.3006 8.3077 116.5110 57.5932 41.2982 178.7335 57 R 3.8601 7.9275 118.4808 59.4233 30.0602 178.6684 58 Y 4.3111 7.8272 116.3982 61.1576 37.9134 178.5738 59 I 3.7572 8.2962 121.1030 64.6813 37.1888 178.3781 60 E 4.0433 8.4114 119.3301 59.3027 29.1725 179.5084 61 R 4.0279 8.2056 118.7826 59.5346 30.1500 178.5487 62 I 3.7633 8.4260 119.9847 64.4621 37.1118 178.4658 63 L 4.0037 8.1334 119.7350 57.7678 41.2578 179.2712 64 F 4.3506 8.4143 119.8073 61.2505 39.6882 176.3840 65 L 4.4983 8.0869 117.6301 53.9122 41.2183 177.2853 66 E 3.8560 8.0062 117.6517 57.2873 27.0526 174.5659 67 G 3.9355 8.0016 108.9087 44.1266 0.0000 173.6457 68 L 4.5309 8.0120 119.2162 51.9951 42.0638 175.0667 69 P 4.3622 0.0000 0.0000 62.5566 31.7630 175.9766 70 N 4.7114 9.6432 122.3484 52.4053 38.7868 173.9787 71 L 4.6139 8.2993 124.2316 54.5283 42.4901 177.5018 72 Q 4.0929 8.5392 122.0579 58.0061 29.3096 175.8152 73 D 4.6798 8.0739 117.3986 52.6049 41.9629 175.2350 74 L 4.5242 8.2907 125.7511 52.6970 43.7740 176.1976 75 G 3.8088 8.4586 115.3519 44.6764 0.0000 171.9861 76 K 4.0303 8.3067 120.6826 56.1390 32.4418 176.5011 77 L 4.2642 8.2994 126.2835 54.4636 42.3985 176.4817 78 N 4.8067 8.7668 120.0828 51.7011 39.1717 172.4676 79 I 4.2362 8.1144 124.2276 59.7631 38.1529 176.6461 80 G 4.0452 8.7729 114.6112 45.1721 0.0000 172.7679 81 E 4.7338 8.6076 117.6883 56.2071 31.0894 176.3938 82 D 4.9075 7.7016 117.9444 50.3071 44.0531 176.0722 83 V 4.0101 8.4075 118.9557 66.5212 31.3667 177.5181 84 E 3.8597 8.1894 118.2081 59.4099 29.5055 178.2192 85 E 3.9731 8.4123 118.9544 59.4495 29.6588 178.7527 86 M 4.0525 8.2611 118.7308 58.4129 32.0167 178.7354 87 L 4.1477 8.2097 119.1139 58.0080 41.7340 179.8167 88 R 3.9349 8.4066 118.3886 59.2426 29.9642 179.1505 89 S 4.1530 8.3535 113.0325 61.4077 62.3622 175.8372 90 D 4.6938 8.4310 121.6898 57.3640 40.5745 178.4964 91 L 3.9434 8.2439 120.5976 58.3147 42.1534 178.9444 92 A 4.0324 8.3410 120.8536 55.0104 18.2708 179.3897 93 L 3.9805 8.1015 118.9734 58.3628 42.1281 179.0928 94 E 4.1157 8.6153 118.7858 59.3741 29.4430 179.3161 95 L 4.0287 8.1760 119.0743 58.0164 41.7984 179.3115 96 D 4.5110 8.3768 118.9484 57.3646 40.6517 179.1848 97 G 3.6395 8.3607 106.0846 47.6280 0.0000 175.6868 98 A 4.0246 8.4877 123.5812 54.6378 18.4882 179.4504 99 K 3.8301 8.0194 118.1059 59.9547 32.3106 178.6998 100 N 4.3898 8.0871 116.3245 56.2639 38.3933 177.2975 101 L 3.9973 8.1665 120.4914 57.9855 41.7482 179.7961 102 R 3.9015 8.2580 118.1064 59.1644 30.0246 178.6955 103 E 3.8285 8.0288 118.2710 59.3061 29.6001 178.7407 104 A 2.8945 7.7272 120.6437 54.8304 18.4212 179.6253 105 I 3.7190 8.1010 118.8632 64.3808 36.9298 178.9099 106 G 3.5850 7.7642 105.5445 47.9669 0.0000 174.8922 107 Y 4.1302 7.9917 122.0337 60.1805 38.8826 177.3713 108 A 3.7884 8.2197 122.1231 55.2910 18.3917 179.0381 109 D 4.1359 7.8242 116.0442 57.4476 41.1192 178.4876 110 S 4.1773 7.5203 112.7751 60.0802 63.2832 175.6600 111 V 3.9862 6.8414 113.9806 60.7415 31.6229 175.6064 112 H 2.7684 7.0829 114.2537 56.5976 26.9016 176.4555 113 D 4.5219 7.3047 121.4043 53.7094 37.9352 176.1285 114 Y 4.3273 7.5150 121.3549 60.5663 38.5104 177.8004 115 V 3.7385 7.8876 113.1865 64.2340 31.7500 178.5188 116 S 4.1983 8.3578 115.0357 61.4792 62.5814 176.6172 117 R 3.8918 8.0302 121.3926 59.5486 29.7729 178.0647 118 D 4.3237 8.3624 117.9240 57.5571 41.3069 177.8411 119 M 4.0078 8.2086 118.7138 59.0053 32.1659 178.1835 120 M 4.1738 8.2313 118.8702 58.3048 32.0864 178.8396 121 I 3.7294 8.1883 120.5697 64.2926 37.2578 178.2204 122 E 3.9774 8.0094 119.2405 59.4909 29.2191 179.5279 123 I 3.5588 7.5703 119.2902 64.2026 37.0697 178.1786 124 L 3.9510 8.1679 121.4157 58.1276 41.9950 178.9812 125 R 3.9049 8.1530 118.6282 59.6314 30.1639 178.2679 126 D 4.4401 8.2068 118.6518 57.4215 40.7899 178.6867 127 E 4.1373 8.4557 119.3414 59.5051 29.4501 179.2408 128 E 4.2723 8.7838 119.2383 59.1605 29.4418 179.5758 129 G 3.6857 8.0833 105.5857 48.1143 0.0000 175.2903 130 H 4.3988 8.2053 120.3668 59.0303 29.8535 177.2598 131 I 3.6961 8.3253 122.1430 64.4731 36.9342 177.7814 132 D 4.3367 8.3781 118.7606 57.0709 40.9997 178.0547 133 W 4.0969 8.2708 128.7301 60.4786 30.7407 177.6219 134 L 3.7762 8.4113 119.0621 58.0462 41.1329 179.4220 135 E 3.9007 8.4500 118.5354 59.7211 29.3018 179.7091 136 T 3.7468 7.9022 115.5977 66.5450 68.5281 176.5079 137 E 3.6799 7.7402 120.6132 59.4136 29.0781 179.4550 138 L 3.7533 7.6846 118.7843 57.8667 41.5471 179.4228 139 D 4.3464 7.9742 118.7901 57.2762 40.6625 178.7528 140 L 3.9472 7.9635 119.7040 57.7480 41.6086 179.5785 141 I 3.3722 7.3686 119.7837 64.3529 36.7397 178.2804 142 Q 3.9172 7.3330 117.8824 58.9832 28.9593 177.8955 143 K 4.1449 8.0861 119.2114 58.6638 32.3073 178.2912 144 M 4.3865 8.3103 114.9278 53.9298 32.5058 177.2345 145 G 4.1103 7.5489 105.5632 45.9725 0.0000 174.3992 146 L 3.9519 8.4136 121.5505 58.0308 42.1849 179.2511 147 Q 3.9729 8.0998 117.4633 59.3551 28.7274 178.7628 148 N 4.3505 8.1317 116.6952 56.3105 38.3804 176.6783 149 Y 3.9205 7.9252 120.1199 60.6180 39.1392 177.8456 150 L 4.0310 8.4521 120.1791 57.9589 41.6504 179.1915 151 Q 3.8821 8.1083 119.1133 59.2118 28.7200 177.9837 152 A 4.1018 7.7439 119.4943 53.6736 18.6963 178.3217 153 Q 4.2271 7.9097 116.3462 55.9310 29.1937 177.3000 154 I 4.1588 7.3216 112.6006 61.5520 38.2425 176.1710 155 R 4.6600 7.5539 119.6780 53.8419 32.4532 175.4890 156 E 4.2494 8.5633 119.3869 55.9650 30.5870 175.6129 157 E 4.4967 8.4182 117.7728 54.3923 31.7155 176.2482 *158 G 3.7098 8.5934 110.1466 45.8775 0.0000 172.3662 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 -0.24 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 8.51 3.98 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 4.53 0.00 2.77 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.99 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 8.14 3.83 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 2.38 0.00 0.00 0.00 0.00 0.30 0.96 7.81 7 V 8.64 3.91 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 1.12 0.00 0.00 1.16 0.00 0.00 8 I 7.83 3.74 2.06 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 0.61 0.91 0.00 0.00 9 N 8.22 4.28 0.00 2.62 2.66 0.00 0.00 7.09 6.98 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 10 Y 8.06 4.08 0.00 3.22 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 8.47 3.88 0.00 2.03 1.77 1.10 0.81 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 4.40 0.00 2.76 2.81 0.00 0.00 6.69 7.68 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 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 8.15 3.80 0.00 0.79 1.18 0.93 0.51 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 3.99 0.00 1.69 1.83 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 8.15 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.01 4.35 0.00 2.92 2.89 0.00 0.00 7.09 7.75 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 18 E 8.34 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 8.17 4.00 0.00 1.79 1.68 0.90 1.00 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 7.63 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 1.10 0.00 0.00 0.95 0.00 0.00 21 A 7.89 3.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.97 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 1.54 1.00 0.85 0.00 0.00 23 N 7.79 4.36 0.00 2.78 2.84 0.00 0.00 6.76 8.36 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 24 Q 8.17 3.87 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 2.59 2.22 0.00 25 Y 8.29 4.61 0.00 3.03 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 8.45 3.80 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 8.22 3.95 0.00 1.95 1.59 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.35 3.85 0.00 3.34 2.99 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 1.36 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 30 R 7.63 3.86 0.00 1.75 1.87 0.00 3.24 0.00 0.00 3.06 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.66 0.00 31 M 7.71 3.45 0.00 1.01 1.63 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 2.45 2.18 0.00 32 F 7.57 4.64 0.00 3.29 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 8.24 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 7.94 4.24 0.00 2.66 2.65 0.00 0.00 7.35 8.79 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 35 W 7.96 4.83 0.00 3.75 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.51 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 4.72 0.00 1.90 1.62 1.21 0.61 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 38 K 8.15 3.87 0.00 2.02 1.81 0.00 1.62 0.00 0.00 1.76 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 8.13 3.90 0.00 2.12 2.00 0.00 3.56 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 40 L 7.76 4.05 0.00 1.69 1.10 1.09 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.36 4.54 0.00 3.10 3.01 0.00 0.00 7.21 7.77 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 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 7.65 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 -0.46 0.00 0.00 0.76 0.00 0.00 44 E 8.54 3.86 0.00 2.49 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.55 0.00 45 Y 8.40 3.95 0.00 2.92 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 H 8.39 4.09 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 8.14 3.82 0.00 2.10 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 48 S 8.17 4.23 0.00 4.10 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.58 3.58 1.82 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.47 0.83 0.00 0.00 50 D 7.95 4.26 0.00 2.99 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 2.73 2.52 0.00 52 M 7.86 4.04 0.00 2.05 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 8.08 3.90 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 8.36 4.23 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 56 D 8.31 4.30 0.00 2.91 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 R 7.93 3.86 0.00 1.82 1.76 0.00 3.13 0.00 0.00 3.05 7.55 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 4.31 0.00 3.21 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.30 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 1.06 0.95 0.00 0.00 60 E 8.41 4.04 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.49 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 8.43 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 0.96 0.00 0.00 63 L 8.13 4.00 0.00 2.12 1.79 0.95 0.81 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 8.41 4.35 0.00 2.95 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.09 4.50 0.00 1.85 1.61 0.99 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.01 3.86 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 67 G 8.00 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 8.01 4.53 0.00 1.59 1.62 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.36 0.00 2.05 2.02 0.00 3.66 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 70 N 9.64 4.71 0.00 2.60 2.81 0.00 0.00 7.08 8.37 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 71 L 8.30 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 1.37 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.54 4.09 0.00 1.97 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 6.68 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 73 D 8.07 4.68 0.00 2.67 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.29 4.52 0.00 1.51 1.51 0.88 1.10 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 8.31 4.03 0.00 1.73 1.74 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.46 7.81 77 L 8.30 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 8.77 4.81 0.00 2.65 2.74 0.00 0.00 7.14 7.26 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 79 I 8.11 4.24 1.90 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.95 0.95 0.00 0.00 80 G 8.77 4.05 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 8.61 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 8.41 4.01 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.20 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 8.41 3.97 0.00 2.41 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 86 M 8.26 4.05 0.00 1.80 2.42 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.39 0.00 87 L 8.21 4.15 0.00 2.02 1.71 1.23 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.41 3.93 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 8.35 4.15 0.00 4.04 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 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 8.24 3.94 0.00 1.84 1.89 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.34 4.03 1.40 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 8.10 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 1.52 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.62 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 8.18 4.03 0.00 2.05 1.75 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.38 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 8.49 4.02 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 99 K 8.02 3.83 0.00 2.13 1.90 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.66 7.81 100 N 8.09 4.39 0.00 3.01 2.90 0.00 0.00 7.12 6.62 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 0.00 101 L 8.17 4.00 0.00 1.98 1.75 0.99 1.27 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 8.26 3.90 0.00 1.97 1.98 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.92 0.00 103 E 8.03 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 2.33 2.38 0.00 104 A 7.73 2.89 1.09 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 0.00 0.00 105 I 8.10 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 0.96 0.92 0.00 0.00 106 G 7.76 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 7.99 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 8.22 3.79 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 7.82 4.14 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 7.52 4.18 0.00 3.99 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 6.84 3.99 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 0.50 0.00 0.00 0.61 0.00 0.00 112 H 7.08 2.77 0.00 3.15 3.27 0.00 5.84 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.30 4.52 0.00 2.63 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 Y 7.52 4.33 0.00 3.10 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 7.89 3.74 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 0.96 0.00 0.00 0.97 0.00 0.00 116 S 8.36 4.20 0.00 4.17 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 8.03 3.89 0.00 1.92 2.20 0.00 3.33 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 1.69 1.68 0.00 118 D 8.36 4.32 0.00 2.97 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 M 8.21 4.01 0.00 2.26 2.02 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 2.48 2.44 0.00 120 M 8.23 4.17 0.00 2.17 2.25 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 2.92 2.84 0.00 121 I 8.19 3.73 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.87 0.92 0.00 0.00 122 E 8.01 3.98 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 123 I 7.57 3.56 1.94 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.55 0.73 0.00 0.00 124 L 8.17 3.95 0.00 1.85 1.86 0.95 1.10 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 8.15 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 4.14 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.57 0.00 128 E 8.78 4.27 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 2.37 2.52 0.00 129 G 8.08 3.69 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 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 8.33 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 0.68 0.94 0.00 0.00 132 D 8.38 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 4.10 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 8.41 3.78 0.00 2.01 1.70 1.19 1.17 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 8.45 3.90 0.00 2.09 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 2.31 2.49 0.00 136 T 7.90 3.75 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 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 7.68 3.75 0.00 1.69 1.60 0.86 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 139 D 7.97 4.35 0.00 2.77 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.96 3.95 0.00 1.84 1.82 0.93 1.00 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 0.00 141 I 7.37 3.37 1.71 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.08 -0.23 0.71 0.00 0.00 142 Q 7.33 3.92 0.00 2.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 143 K 8.09 4.14 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 8.31 4.39 0.00 2.17 2.19 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 2.65 2.86 0.00 145 G 7.55 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 3.95 0.00 1.74 1.66 0.94 0.69 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 8.10 3.97 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.46 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 7.93 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 8.45 4.03 0.00 1.99 1.68 1.03 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.11 3.88 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 152 A 7.74 4.10 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 7.91 4.23 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.12 2.14 0.00 154 I 7.32 4.16 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 1.23 0.90 0.00 0.00 155 R 7.55 4.66 0.00 1.77 1.84 0.00 3.19 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 156 E 8.56 4.25 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 157 E 8.42 4.50 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.27 0.00 *158 G 8.59 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.