NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3766 8.1233 123.5852 52.3670 21.0627 179.0611 3 D 4.1923 8.1333 115.5723 56.6823 40.7676 175.1197 4 E 3.9188 8.5640 121.1932 59.2694 30.0205 178.1577 5 A 4.0342 8.0126 120.3075 55.4213 18.4589 179.6758 6 T 3.8525 8.0793 114.2003 66.7870 68.6298 176.8613 7 R 3.9217 8.1554 120.7114 59.5562 29.8472 178.3531 8 R 3.9052 8.1343 117.6306 59.5520 30.1048 178.3373 9 V 3.8507 7.5550 116.7779 65.0830 31.9438 177.4782 10 V 4.2341 7.7489 109.6925 60.8436 31.8371 177.6494 11 S 4.1717 8.0490 114.8562 60.8440 62.8246 175.1227 12 E 4.5768 8.1512 117.6697 55.8622 29.5821 174.9826 13 I 4.3539 7.5699 120.8300 58.9371 38.2657 174.1881 14 P 4.3404 0.0000 0.0000 62.6834 31.7833 176.3424 15 V 3.9553 8.2136 122.1658 62.4600 32.4692 175.3636 16 L 4.6519 8.5462 125.9562 53.5007 43.5090 177.1506 17 K 4.1685 9.0929 118.7212 58.1439 34.2590 176.8374 18 T 4.1881 8.1137 114.7180 62.9450 68.9707 174.7213 19 N 4.6140 8.5898 125.5792 52.2918 37.5971 173.0369 20 A 4.9181 8.1412 124.3531 50.3687 22.7206 175.7425 21 G 4.3365 9.2140 110.0619 41.7689 0.0000 171.8514 22 P 2.9700 0.0000 0.0000 64.7113 31.0685 177.6585 23 R 4.2929 7.5487 114.1084 56.4771 30.5514 176.0110 24 D 4.9003 8.2458 118.3570 53.6790 42.2335 177.7253 25 R 3.7866 7.8581 123.1107 57.1926 29.3079 179.3959 26 E 4.0494 9.0315 126.7159 60.5129 29.0123 178.2260 27 L 4.1601 8.0888 119.7732 57.0295 41.6702 179.1610 28 W 4.5298 8.1873 128.2652 60.4377 30.9131 177.8262 29 V 3.4443 8.1032 118.3962 66.2354 30.8589 177.8568 30 Q 3.9488 8.0550 118.8012 59.0921 28.8329 177.9886 31 R 3.9066 8.1928 119.8705 59.5157 30.0677 178.4560 32 L 3.8325 7.8542 119.0862 57.6335 41.4712 179.6666 33 K 4.0626 7.8811 118.1488 59.5374 31.9921 179.2281 34 E 4.0254 8.2547 118.8786 59.3330 29.2766 179.2564 35 E 3.9896 8.4682 118.8969 59.7854 29.4976 179.0950 36 Y 4.0797 8.5796 117.3850 61.0029 38.0326 178.5492 37 Q 4.0711 8.5096 118.8615 59.3879 28.6726 178.6918 38 S 4.1776 8.3667 115.0899 60.9538 62.3805 176.0835 39 L 4.1838 8.3185 122.1387 58.0200 41.4328 179.4253 40 I 3.7745 8.2451 118.7964 63.8688 37.7935 177.9413 41 R 3.9539 8.0597 119.4971 59.3829 29.4531 177.8283 42 Y 4.3423 8.2436 119.4673 60.7762 38.7491 178.1154 43 V 3.2803 8.1718 119.5227 65.8552 31.5755 177.5916 44 E 3.8681 8.2910 118.8941 59.3961 29.4807 178.3517 45 N 4.3606 8.4350 116.7507 56.6089 38.6430 177.1059 46 N 4.3841 8.3064 117.9540 56.2163 38.6532 177.5874 47 K 3.9479 8.2583 120.1179 59.6474 31.9654 179.1841 48 N 4.4715 8.1944 114.9650 55.2494 38.4025 176.2397 49 A 4.5375 7.4306 120.1125 50.4984 19.5452 175.9144 50 D 4.3542 8.0127 116.6064 56.1145 40.5340 173.0044 51 N 5.0923 8.4709 111.0994 52.6990 39.2370 175.5631 52 D 4.5764 8.1254 118.2350 53.5808 40.0642 174.7354 53 W 5.3784 8.4127 120.1712 56.0067 29.9081 175.2147 54 F 5.3772 7.3944 113.9771 56.2589 40.3165 173.5372 55 R 4.6634 9.1416 118.0412 54.5632 34.2561 174.4960 56 L 5.4849 8.6316 120.9963 53.1180 45.9393 175.2422 57 E 4.7935 9.1114 119.5028 54.5426 33.3132 174.1146 58 S 4.4292 7.5982 113.4889 55.6049 67.1110 173.1634 59 N 4.5839 8.3970 118.5284 51.9614 38.0633 175.9332 60 K 3.8633 8.5535 118.7813 59.6337 32.1241 177.3604 61 E 4.2508 8.1938 115.5366 56.6963 29.7939 177.0446 62 G 3.9814 7.9750 106.9177 46.3650 0.0000 174.4572 63 T 4.6975 8.4621 110.9091 61.4870 71.0065 173.9859 64 R 5.0422 8.1064 122.8969 54.3120 33.2893 173.7958 65 W 4.9619 8.9901 126.2363 54.9671 32.6612 174.5494 66 F 5.1190 7.8343 116.5753 56.1288 40.9900 173.9026 67 G 4.1431 8.3752 107.8942 46.1306 0.0000 172.1627 68 K 5.1327 8.1838 120.3728 54.7152 36.7984 175.4894 69 C 5.2901 8.8494 117.2977 56.2670 33.2440 172.7613 70 W 5.6516 9.8284 119.8689 55.3489 32.0386 174.4626 71 Y 4.9433 9.6899 123.6929 56.1545 41.8400 173.7455 72 I 4.8951 7.7870 126.8955 60.0252 39.4068 174.7877 73 H 4.7253 9.3211 126.0831 55.6772 32.5824 172.9095 74 D 4.1247 9.5575 127.5682 55.5267 38.2136 174.9265 75 L 3.7896 8.0630 115.5744 55.0408 40.4765 174.9570 76 L 4.3157 7.6764 119.7328 53.7013 43.2070 175.4823 77 K 5.0177 8.4480 124.4359 55.2052 33.7352 174.7136 78 Y 4.6892 9.5979 125.5579 56.2224 40.5494 174.1685 79 E 4.9134 8.4894 123.8243 54.3342 32.2525 174.9010 80 F 5.1652 8.7972 124.5702 55.6632 43.0547 174.0101 81 D 5.0966 9.5909 124.3033 54.2493 41.5131 175.8684 82 I 5.1249 8.6544 115.7472 59.4787 41.4126 173.9400 83 E 5.3820 9.0174 120.0297 55.8762 33.2425 173.6990 84 F 5.1568 8.7568 114.2968 56.4058 41.4640 172.6180 85 D 5.4016 8.8183 119.8446 53.1258 43.0058 176.0208 86 I 4.1877 8.5066 123.1267 59.6029 37.9611 174.5768 87 P 4.3931 0.0000 0.0000 62.4798 31.9194 177.5244 88 I 3.6357 8.4161 122.2181 64.3793 37.4200 177.0941 89 T 4.4544 7.7690 108.4645 61.2620 68.7944 173.6909 90 Y 4.6168 8.1160 123.5084 57.4334 39.1685 174.6581 91 P 3.5681 0.0000 0.0000 62.6950 31.8227 176.9223 92 T 4.0836 7.7769 117.1333 66.5238 68.8825 175.0022 93 T 4.4817 7.8266 117.4333 61.7590 70.1207 173.7564 94 A 3.8692 7.9021 128.4398 50.3959 19.4863 175.6939 95 P 4.2212 0.0000 0.0000 62.5184 31.9631 176.3294 96 E 4.2577 8.2605 120.6981 54.6650 29.8471 175.9396 97 I 4.1930 7.8043 125.5618 60.9643 38.6360 175.0154 98 A 5.0067 9.0805 128.6393 50.2647 21.9382 175.6895 99 V 4.9279 8.5182 121.9098 59.9801 31.4554 174.1802 100 P 4.3050 0.0000 0.0000 64.9280 31.8206 178.7725 101 E 4.0717 8.3087 116.6609 58.8439 29.6353 177.4679 102 L 4.5261 8.1411 117.3738 54.1259 41.9403 175.5874 103 D 4.3980 7.6777 119.7251 55.9169 41.2104 176.8973 104 G 3.9740 8.9220 113.7743 45.8490 0.0000 173.7416 105 K 4.3439 8.1960 118.4729 56.7601 33.1203 176.5264 106 T 4.5954 7.5077 111.3383 59.6844 70.3068 173.5493 107 A 4.0474 8.4964 128.9738 54.4311 19.3339 178.5333 108 K 4.0638 7.7577 120.1637 55.1135 30.9021 174.6687 *110 Y 4.6572 7.2747 120.0003 56.9859 39.6282 175.0847 111 R 4.0851 8.5125 119.7409 58.5060 30.3653 177.6057 112 G 3.8621 8.7151 110.7937 44.8262 0.0000 174.3301 113 G 3.8537 8.2805 107.4829 45.3730 0.0000 173.0872 114 K 4.6358 7.8374 119.3471 55.7421 32.4105 177.1696 115 I 3.4155 8.2853 119.9580 60.7995 38.3966 175.0886 116 C 4.5839 8.3244 125.2467 57.8548 32.3927 173.5897 117 L 4.5239 8.3758 126.5563 53.4700 42.7887 176.5242 118 T 4.2724 8.1235 110.1194 61.3509 69.5883 175.3312 119 D 4.4809 8.6501 121.5164 57.5542 40.7504 178.4571 120 H 4.1959 7.9759 118.7823 59.0053 29.6749 177.0504 121 F 4.0904 8.1858 122.8686 60.9548 39.1277 177.3461 122 K 4.0240 7.8471 117.6554 59.2501 31.9181 177.7648 123 P 4.2526 0.0000 0.0000 65.1358 30.9797 178.5020 124 L 3.8036 7.3846 118.3574 57.7222 42.3091 178.5358 125 W 4.0135 8.1172 128.2688 60.3684 30.1286 177.6365 126 A 4.0347 8.3756 121.1404 55.3727 17.6022 179.5638 127 R 3.8439 8.0140 115.6974 58.4236 30.4529 177.3047 128 N 4.2466 7.3755 114.5652 51.5933 39.1648 174.8502 129 V 3.3895 6.3472 120.1065 62.9225 31.8424 173.6595 130 P 4.6071 0.0000 0.0000 62.5117 31.7571 176.7574 131 K 4.4557 7.8932 121.7804 59.1578 32.1617 177.5505 132 F 4.5467 7.1740 116.5045 56.5659 40.3501 175.5208 133 G 4.5365 8.2021 112.8881 44.3168 0.0000 173.1521 134 L 3.9253 9.3065 119.2256 57.7834 41.9096 178.4996 135 A 4.0612 8.0270 120.4152 55.4963 18.7320 178.3587 136 H 3.9708 8.0262 112.6276 58.7480 29.1305 177.8783 137 L 4.3461 8.2960 117.6119 55.9263 41.3185 178.1650 *139 A 4.6084 7.9284 120.7110 51.4296 20.0699 178.9995 140 L 4.7202 8.5644 113.5429 55.7828 42.5941 177.0088 141 G 3.5750 8.1684 103.7920 45.7755 0.0000 175.1983 142 L 4.0271 7.5928 121.0006 57.2236 42.6991 179.3264 143 G 3.3619 8.3510 105.1107 47.7747 0.0000 173.7121 144 P 4.3257 0.0000 0.0000 64.1832 31.3090 178.7352 145 W 4.0319 7.9887 127.5731 60.4200 30.5931 177.9969 146 L 3.7048 8.4243 119.0569 57.6372 40.8727 179.1691 147 A 4.1779 7.5973 119.6873 53.1898 18.2341 178.6661 148 V 3.8596 6.7260 115.2093 64.8079 32.5120 177.7246 149 E 3.4414 7.4617 118.5047 58.9822 29.0687 179.4048 150 I 3.2734 7.0253 119.8273 63.7223 37.0024 176.6162 151 P 3.8768 0.0000 0.0000 65.3882 31.1501 178.0334 152 D 4.1758 7.4574 116.4193 57.5026 41.1892 178.4939 153 L 3.9638 7.8345 119.3936 57.4694 41.5108 179.6675 154 I 3.8188 7.6897 120.0023 64.4836 36.8611 178.0573 155 Q 3.9841 7.9189 119.0827 59.1019 28.9348 177.9396 156 K 4.2752 8.0002 116.6035 56.2099 32.3616 177.8195 157 G 3.9363 7.8628 107.3937 45.9608 0.0000 175.0991 158 V 3.7113 7.9430 121.2057 64.7017 31.6875 176.4869 159 I 4.5664 7.5998 119.6823 59.4656 38.7508 174.7480 160 Q 4.8439 8.5539 123.5694 54.1078 31.6764 174.6172 161 H 4.4233 8.8959 121.4412 55.5332 30.6946 174.8054 162 K 4.2324 8.0785 126.2818 55.4375 32.9295 176.5328 163 E 4.1176 8.7140 122.9728 56.5379 29.5405 176.2669 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 2 A 8.12 4.38 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 D 8.13 4.19 0.00 2.79 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 4 E 8.56 3.92 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 2.39 2.46 0.00 5 A 8.01 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 6 T 8.08 3.85 4.46 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 1.37 0.00 0.00 7 R 8.16 3.92 0.00 2.04 2.08 0.00 3.12 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 8 R 8.13 3.91 0.00 2.05 1.98 0.00 3.38 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 1.67 1.72 0.00 9 V 7.56 3.85 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.02 0.00 0.00 10 V 7.75 4.23 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 0.67 0.00 0.00 1.05 0.00 0.00 11 S 8.05 4.17 0.00 4.03 4.25 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 0.00 0.00 0.00 12 E 8.15 4.58 0.00 2.04 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 2.26 2.35 0.00 13 I 7.57 4.35 1.83 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.49 0.63 0.00 0.00 14 P 0.00 4.34 0.00 2.08 2.03 0.00 3.72 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 15 V 8.21 3.96 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.97 0.00 0.00 16 L 8.55 4.65 0.00 1.98 1.58 1.12 0.69 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 17 K 9.09 4.17 0.00 1.64 1.91 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.36 7.81 18 T 8.11 4.19 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 1.31 0.00 0.00 19 N 8.59 4.61 0.00 2.66 2.76 0.00 0.00 6.90 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 20 A 8.14 4.92 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 21 G 9.21 4.34 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 0.00 22 P 0.00 2.97 0.00 1.71 1.70 0.00 3.51 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.43 0.00 23 R 7.55 4.29 0.00 1.74 1.92 0.00 3.16 0.00 0.00 3.18 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 24 D 8.25 4.90 0.00 2.99 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 25 R 7.86 3.79 0.00 2.06 1.15 0.00 3.36 0.00 0.00 3.43 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.59 0.00 26 E 9.03 4.05 0.00 2.20 2.26 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 2.42 2.39 0.00 27 L 8.09 4.16 0.00 2.03 1.87 0.98 0.81 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 W 8.19 4.53 0.00 3.59 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.10 3.44 2.27 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 0.93 0.00 0.00 1.05 0.00 0.00 30 Q 8.05 3.95 0.00 2.27 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 31 R 8.19 3.91 0.00 2.11 2.12 0.00 3.29 0.00 0.00 3.55 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.82 0.00 32 L 7.85 3.83 0.00 1.57 1.71 0.61 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.88 4.06 0.00 1.99 1.88 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.69 7.81 34 E 8.25 4.03 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 35 E 8.47 3.99 0.00 2.15 1.85 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 2.62 2.54 0.00 36 Y 8.58 4.08 0.00 3.13 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 8.51 4.07 0.00 2.34 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.82 0.00 0.00 0.00 0.00 0.00 2.61 2.43 0.00 38 S 8.37 4.18 0.00 4.01 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.32 4.18 0.00 1.98 1.84 0.65 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 40 I 8.25 3.77 2.07 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 1.46 1.26 1.08 0.00 0.00 41 R 8.06 3.95 0.00 2.06 1.99 0.00 3.42 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 42 Y 8.24 4.34 0.00 3.19 3.26 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 43 V 8.17 3.28 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 0.81 0.00 0.00 0.54 0.00 0.00 44 E 8.29 3.87 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 45 N 8.44 4.36 0.00 3.05 2.96 0.00 0.00 7.09 7.71 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 46 N 8.31 4.38 0.00 2.73 2.98 0.00 0.00 7.06 8.14 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 47 K 8.26 3.95 0.00 1.92 1.82 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.58 7.81 48 N 8.19 4.47 0.00 2.87 2.90 0.00 0.00 6.96 6.77 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 49 A 7.43 4.54 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 50 D 8.01 4.35 0.00 2.78 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 51 N 8.47 5.09 0.00 2.65 2.80 0.00 0.00 6.98 8.48 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 52 D 8.13 4.58 0.00 2.60 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 W 8.41 5.38 0.00 3.98 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 54 F 7.39 5.38 0.00 2.82 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 0.00 0.00 0.00 55 R 9.14 4.66 0.00 1.80 1.86 0.00 3.23 0.00 0.00 3.05 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.98 0.00 56 L 8.63 5.48 0.00 1.75 1.84 1.00 1.01 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 57 E 9.11 4.79 0.00 1.58 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 0.00 1.72 1.47 0.00 58 S 7.60 4.43 0.00 2.72 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 59 N 8.40 4.58 0.00 2.90 3.07 0.00 0.00 7.01 5.97 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 60 K 8.55 3.86 0.00 1.73 1.89 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.46 7.81 61 E 8.19 4.25 0.00 2.09 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 0.00 2.40 2.36 0.00 62 G 7.98 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 63 T 8.46 4.70 4.28 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 0.00 0.00 0.00 1.29 0.00 0.00 64 R 8.11 5.04 0.00 1.93 1.78 0.00 3.25 0.00 0.00 3.38 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.79 0.00 65 W 8.99 4.96 0.00 1.78 2.44 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 66 F 7.83 5.12 0.00 3.11 3.03 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 0.00 0.00 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 K 8.18 5.13 0.00 1.09 0.74 0.00 1.69 0.00 0.00 1.78 0.00 0.00 3.22 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.35 1.31 7.81 69 C 8.85 5.29 0.00 3.56 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 70 W 9.83 5.65 0.00 3.50 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 71 Y 9.69 4.94 0.00 3.42 3.23 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 72 I 7.79 4.90 1.75 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 1.24 0.67 0.93 0.00 0.00 73 H 9.32 4.73 0.00 3.43 3.36 0.00 5.93 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 D 9.56 4.12 0.00 2.85 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 75 L 8.06 3.79 0.00 1.80 1.82 0.91 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.68 4.32 0.00 1.81 1.00 0.88 0.76 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 77 K 8.45 5.02 0.00 1.78 1.74 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.61 1.60 7.81 78 Y 9.60 4.69 0.00 3.22 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 79 E 8.49 4.91 0.00 2.13 1.74 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 1.96 1.65 0.00 80 F 8.80 5.17 0.00 3.02 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 81 D 9.59 5.10 0.00 2.59 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 8.65 5.12 1.96 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 1.39 1.06 0.98 0.00 0.00 83 E 9.02 5.38 0.00 2.18 2.12 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 2.24 2.30 0.00 84 F 8.76 5.16 0.00 3.11 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 85 D 8.82 5.40 0.00 2.63 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 86 I 8.51 4.19 1.91 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.33 0.66 0.00 0.00 87 P 0.00 4.39 0.00 2.27 2.00 0.00 3.63 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.12 0.00 88 I 8.42 3.64 1.85 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 1.44 0.70 0.87 0.00 0.00 89 T 7.77 4.45 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 1.22 0.00 0.00 90 Y 8.12 4.62 0.00 3.21 2.98 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 91 P 0.00 3.57 0.00 1.85 1.38 0.00 3.79 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.87 0.00 92 T 7.78 4.08 4.42 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 1.24 0.00 0.00 93 T 7.83 4.48 4.32 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 1.20 0.00 0.00 94 A 7.90 3.87 0.17 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 95 P 0.00 4.22 0.00 1.42 2.07 0.00 3.25 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 96 E 8.26 4.26 0.00 1.87 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 2.11 2.19 0.00 97 I 7.80 4.19 1.55 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 0.76 0.13 0.81 0.00 0.00 98 A 9.08 5.01 1.25 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 0.00 0.00 0.00 0.00 0.00 99 V 8.52 4.93 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 0.98 0.00 0.00 0.69 0.00 0.00 100 P 0.00 4.30 0.00 2.24 2.10 0.00 3.84 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 101 E 8.31 4.07 0.00 2.14 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 2.39 2.41 0.00 102 L 8.14 4.53 0.00 1.86 1.73 0.73 0.83 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 0.00 103 D 7.68 4.40 0.00 2.75 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 0.00 104 G 8.92 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 0.00 105 K 8.20 4.34 0.00 1.93 1.88 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.38 7.81 106 T 7.51 4.60 4.13 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 1.33 0.00 0.00 107 A 8.50 4.05 1.24 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 0.00 0.00 0.00 108 K 7.76 4.06 0.00 1.74 1.79 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.85 1.42 7.81 *110 Y 7.27 4.66 0.00 3.07 2.87 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 0.00 111 R 8.51 4.09 0.00 1.84 1.91 0.00 3.21 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 112 G 8.72 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 G 8.28 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 0.00 114 K 7.84 4.64 0.00 1.76 1.83 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.43 7.81 115 I 8.29 3.42 0.56 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 -0.02 -0.54 0.00 0.00 116 C 8.32 4.58 0.00 2.34 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 0.00 117 L 8.38 4.52 0.00 1.59 1.52 -0.17 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 118 T 8.12 4.27 4.31 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 1.26 0.00 0.00 119 D 8.65 4.48 0.00 2.77 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 0.00 120 H 7.98 4.20 0.00 3.33 3.41 0.00 5.78 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 F 8.19 4.09 0.00 3.22 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 0.00 122 K 7.85 4.02 0.00 2.05 1.89 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.67 7.81 123 P 0.00 4.25 0.00 2.14 2.09 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 124 L 7.38 3.80 0.00 1.49 1.71 0.98 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 125 W 8.12 4.01 0.00 2.96 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 0.00 126 A 8.38 4.03 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 0.00 127 R 8.01 3.84 0.00 1.84 1.80 0.00 3.16 0.00 0.00 3.16 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 128 N 7.38 4.25 0.00 1.61 1.42 0.00 0.00 6.43 7.03 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 0.00 129 V 6.35 3.39 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 0.66 0.00 0.00 0.92 0.00 0.00 130 P 0.00 4.61 0.00 2.10 1.99 0.00 3.67 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.89 0.00 131 K 7.89 4.46 0.00 1.53 1.74 0.00 1.54 0.00 0.00 1.63 0.00 0.00 2.66 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.33 1.23 7.81 132 F 7.17 4.55 0.00 1.53 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 0.00 0.00 0.00 0.00 133 G 8.20 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.31 3.93 0.00 1.31 1.46 -0.57 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.03 4.06 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 0.00 136 H 8.03 3.97 0.00 3.22 2.58 0.00 5.83 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 8.30 4.35 0.00 1.90 1.77 0.56 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 *139 A 7.93 4.61 1.05 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 0.00 140 L 8.56 4.72 0.00 1.98 2.00 0.68 0.90 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 0.00 141 G 8.17 3.57 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 0.00 0.00 0.00 142 L 7.59 4.03 0.00 1.73 1.93 0.89 1.12 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 0.00 143 G 8.35 3.36 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 0.00 144 P 0.00 4.33 0.00 2.21 2.13 0.00 3.73 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.17 0.00 145 W 7.99 4.03 0.00 3.34 3.25 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 0.00 0.00 0.00 146 L 8.42 3.70 0.00 1.86 1.46 1.26 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 147 A 7.60 4.18 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 6.73 3.86 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.81 0.00 0.00 149 E 7.46 3.44 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 1.47 1.47 0.00 150 I 7.03 3.27 0.73 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.50 0.75 0.00 0.00 151 P 0.00 3.88 0.00 2.01 2.03 0.00 3.30 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 152 D 7.46 4.18 0.00 2.69 2.59 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 0.00 153 L 7.83 3.96 0.00 1.56 1.62 0.80 0.74 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 0.00 154 I 7.69 3.82 1.83 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.56 0.96 0.00 0.00 155 Q 7.92 3.98 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 156 K 8.00 4.28 0.00 1.74 1.81 0.00 1.87 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.51 7.81 157 G 7.86 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 0.00 158 V 7.94 3.71 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 0.80 0.00 0.00 0.91 0.00 0.00 159 I 7.60 4.57 1.85 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 1.56 0.77 1.09 0.00 0.00 160 Q 8.55 4.84 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.94 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 161 H 8.90 4.42 0.00 3.11 3.20 0.00 5.72 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 K 8.08 4.23 0.00 1.68 1.67 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.40 7.81 163 E 8.71 4.12 0.00 1.92 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.