NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 43 S 4.3970 8.3349 116.7670 58.2791 64.3014 173.1443 44 F 3.9945 8.5090 122.5873 54.9139 40.0559 173.8469 45 D 4.8545 8.4686 123.6499 50.6544 44.7512 176.5291 46 K 4.1497 8.5291 119.2032 60.1505 31.9960 179.5972 47 T 3.9249 7.8767 115.3262 67.0560 68.3655 176.6606 48 T 3.9316 9.4563 118.6533 66.4918 68.4103 176.6950 49 F 4.6199 8.0507 119.7748 60.9792 38.9899 178.0379 50 R 4.0590 8.3624 117.5450 58.9893 29.8246 178.7994 51 L 4.0024 8.1767 120.1625 58.2490 42.1806 179.0605 52 L 4.1207 8.3111 119.0094 57.9915 41.6361 179.5984 53 R 4.1598 8.5196 118.8517 59.2761 29.9558 178.7878 54 G 3.6970 8.8098 106.0687 47.9546 0.0000 175.6070 55 E 4.1783 8.6188 121.4160 59.0544 29.4974 179.3192 56 S 4.3427 8.3888 113.2848 61.7580 62.5180 176.1213 57 N 4.6056 8.6062 119.1801 55.9914 38.2544 177.1387 58 L 3.9012 8.1875 122.0061 58.4522 42.1799 179.2555 59 F 3.8967 8.4724 117.4616 60.2753 38.5813 177.2294 60 Y 3.8838 7.9882 118.8412 60.9107 38.5767 177.8448 61 T 3.8938 7.8749 115.8543 66.3970 68.5868 176.5567 62 L 3.9438 7.6168 120.0869 56.6564 41.9953 177.8463 63 A 4.3913 7.1925 119.6105 51.9844 19.2602 177.3330 64 K 4.5742 8.7328 118.3021 55.0826 36.5868 174.6798 65 W 5.3269 8.7596 132.5851 55.6774 32.5986 174.9517 66 E 4.5689 8.7359 124.2674 56.2733 32.3847 174.8346 67 N 4.3934 9.4620 118.7274 54.6976 36.0974 173.5433 68 N 4.2671 8.1741 108.4800 54.0211 38.0330 173.1837 69 K 3.7503 6.3380 112.9503 53.5815 36.3597 175.1344 70 L 4.6789 7.7625 124.2971 55.1218 43.2399 175.5171 71 H 4.6348 9.4395 123.0777 54.0641 31.8706 172.9971 72 V 4.4383 8.0255 123.7831 60.6862 30.9944 173.4728 73 E 4.0001 8.3059 121.1236 55.4870 28.3587 175.8973 74 L 4.4977 8.0884 126.1454 52.2618 42.8120 175.0086 75 P 4.5445 0.0000 0.0000 62.2344 33.4916 176.7017 76 E 4.0348 8.7812 118.5391 59.8910 29.2175 179.1500 77 N 4.4309 8.1450 116.2075 55.1644 37.5685 176.2281 78 I 4.0123 7.6908 120.5009 63.2281 38.1164 176.8109 79 D 4.5423 7.8373 118.1062 56.9468 41.2022 177.4183 80 K 4.3053 7.9257 117.1311 56.8431 32.4950 177.4900 81 Q 4.1332 7.5586 119.2207 58.6236 29.3579 176.2847 82 S 4.9086 7.3647 111.6437 55.3929 65.2268 171.8653 83 P 4.4083 0.0000 0.0000 65.7062 31.4437 176.8722 84 T 4.2795 7.2585 108.5205 62.2072 69.6221 173.2092 85 M 4.8585 9.0178 121.4812 54.1755 35.2987 174.0354 86 T 5.0839 8.8036 122.7535 61.8415 71.3955 173.5187 87 L 5.1306 9.2048 125.3039 52.9235 45.7491 175.4878 88 I 5.1872 9.0084 123.4895 59.8632 40.4232 174.2608 89 Y 5.3390 9.4490 124.6468 56.1964 41.9675 175.7410 90 D 5.2013 8.9607 122.0762 52.0811 41.3974 176.9087 91 E 4.0852 8.6869 116.0675 58.8010 29.5104 177.1325 92 N 4.6515 8.9744 116.4878 52.8602 38.7477 175.6659 93 G 3.9019 8.3817 106.1974 45.8419 0.0000 173.5393 94 Q 4.5233 8.0732 118.8338 53.9443 29.9756 175.0351 95 L 3.8637 8.6301 124.8200 55.2589 42.6275 176.1323 96 L 4.6668 8.6826 125.7167 55.7934 43.8924 176.8115 97 W 4.7997 7.5734 125.4457 56.1911 34.0890 173.0426 98 A 4.3688 7.3082 127.4708 49.6558 20.4772 175.8598 99 Q 3.0420 8.0742 124.4530 58.5077 29.5945 176.5603 100 R 4.3127 7.2213 115.7975 54.7699 33.0173 173.2551 101 D 4.4978 8.3480 122.5751 52.7442 41.7673 176.8663 102 V 4.1795 7.6794 126.2193 59.5076 33.1901 173.1497 103 P 4.1969 0.0000 0.0000 65.2887 31.0901 178.1987 104 W 4.2707 8.0414 113.8331 59.4980 28.3811 177.7336 105 L 2.9727 6.3197 120.5982 57.6274 41.2155 178.5195 106 M 3.9628 7.6446 118.6177 58.4567 31.6392 178.9093 107 K 4.0128 7.7329 116.9649 59.0337 32.2864 177.9738 108 M 4.1025 7.8003 117.2608 56.2201 32.3911 176.5144 109 I 3.9826 7.0358 119.7975 59.9282 36.4787 175.5765 110 Q 3.6898 6.7167 125.3086 54.6839 29.3830 175.9030 111 P 4.0522 0.0000 0.0000 65.7800 31.4215 177.8867 112 D 4.5783 7.7844 114.2355 54.5681 39.4268 176.7237 113 W 4.6526 7.9553 119.6546 58.1751 29.4257 176.8789 114 L 4.3783 7.7601 117.2268 54.8340 41.3182 177.5651 115 K 4.2479 7.8874 118.5724 58.2862 32.6746 176.6470 116 S 4.7253 7.5309 111.8646 56.3535 67.2024 173.8494 117 N 4.3174 8.7245 118.8565 54.4150 39.0783 174.8993 118 G 3.7520 7.8183 107.3246 46.2925 0.0000 171.7680 119 F 5.3049 8.1105 116.7625 56.4001 42.9581 174.1450 120 H 4.8763 9.7533 118.2017 54.5781 33.5842 172.1444 121 E 5.2552 8.8091 119.4076 54.7076 32.6643 175.3778 122 I 4.7524 8.7086 124.2711 59.6801 40.1185 174.6676 123 E 5.0946 9.0470 126.3128 55.8638 30.9440 175.4203 124 A 4.6365 8.8249 123.4612 50.7665 23.4241 175.8190 125 D 4.7234 8.2500 119.1397 52.2604 41.0034 177.6411 126 V 3.5148 8.2737 118.5459 66.1687 31.2459 177.4086 127 N 4.2145 7.9413 116.1404 56.8018 39.0059 176.4002 128 D 3.7986 8.2554 120.4293 57.4528 40.6121 178.9198 129 T 4.0998 7.6586 116.4320 66.6657 68.4509 176.8476 130 S 4.3035 8.2001 116.1756 61.2846 62.7434 176.4667 131 L 4.1755 7.6085 121.4174 56.9874 41.4743 178.4432 132 L 4.3088 7.8041 119.3723 58.0696 42.2895 178.0899 133 L 3.9465 8.8160 119.1346 55.7059 42.7695 178.3035 134 S 3.6156 8.1107 113.7506 59.4775 60.2604 171.4203 135 G 3.9942 7.1046 113.2711 45.3529 0.0000 170.8938 136 D 4.9322 7.3223 120.2052 52.8775 42.8928 177.5857 137 H 3.9109 8.8956 121.3762 60.5449 28.8440 177.3164 138 S 3.8269 7.5631 111.6310 61.5961 62.7525 176.2112 139 I 3.7007 7.9235 120.7752 64.5393 36.7908 178.3508 140 Q 4.0118 8.2169 118.3953 59.4308 28.4200 179.3181 141 Q 4.0816 9.2481 119.4286 59.1686 28.7582 179.0081 142 Q 4.2500 7.8071 120.2553 58.2195 28.7260 178.4725 143 L 3.9556 8.4288 121.7746 58.3876 42.1643 179.1613 144 Q 4.0368 8.1611 117.9231 58.8110 28.2599 178.5667 145 E 3.9676 7.9229 119.5801 59.3922 29.1091 179.5269 146 V 3.6405 7.8354 118.2776 65.8091 31.3449 177.9195 147 R 3.9065 7.8144 117.4249 59.5820 29.9972 178.0345 148 Q 4.1851 7.8388 116.2334 59.0892 28.8491 178.0444 149 N 4.7678 7.8148 113.7315 52.5827 39.0198 174.6618 150 N 5.0832 7.1969 115.8991 51.5775 42.9771 174.5897 151 N 4.4739 8.8771 119.4649 56.3457 39.3964 176.4095 152 N 4.9444 7.6060 111.5498 51.6249 40.0965 174.5671 153 A 4.0427 7.7419 121.1519 52.7768 19.5969 177.0332 154 Q 4.6262 8.4368 120.4154 54.7209 30.5674 175.1458 155 M 5.0138 8.8960 123.0775 53.3638 35.2731 175.1038 156 T 5.0187 8.2151 117.5429 62.2590 72.5814 172.5678 157 H 5.1622 9.3012 123.8487 54.0421 31.6356 174.0238 158 S 4.5573 8.5043 118.9197 58.1341 64.4070 173.2808 159 V 5.0763 9.4142 123.6598 61.1492 34.9509 173.7845 160 A 5.1681 9.1433 128.9994 50.0798 22.2089 174.9155 161 V 4.7766 8.3184 121.8087 61.0750 34.5413 174.0985 162 N 5.2609 9.2177 124.8374 51.4278 42.0071 173.2819 163 V 4.6538 9.3854 125.2210 61.5557 33.1890 174.4362 164 Y 4.5023 9.3734 127.2492 55.2645 39.5446 173.7921 165 P 4.6736 0.0000 0.0000 62.3806 32.2087 176.1663 166 A 4.4163 8.6297 123.1906 52.8662 18.8798 176.6318 167 T 4.7227 9.2816 110.5445 59.3397 72.1892 175.0132 168 S 4.1573 8.7822 115.4168 60.5264 62.7470 175.0772 169 R 4.6167 7.7691 114.2363 55.8718 30.3352 175.4367 170 M 4.6572 7.7015 118.2198 53.2881 36.1795 172.7769 171 P 4.5125 0.0000 0.0000 61.4644 33.0551 175.5910 172 K 4.2885 8.3677 121.4353 57.0374 32.5091 175.7778 173 L 5.1734 9.2190 126.1477 53.3660 46.5635 175.3621 174 T 5.1153 9.0903 118.8949 62.0237 71.2368 173.1142 175 I 5.1114 9.2981 128.0615 59.5758 40.0543 174.6891 176 V 4.8597 9.2478 127.5819 61.1009 34.0986 174.3111 177 V 4.8857 8.8304 127.5504 61.1528 34.2705 174.0224 178 V 4.8746 8.9561 128.3389 61.2133 33.8807 173.8398 179 D 5.0481 8.9686 128.7872 53.6172 41.0902 176.4664 180 T 4.1312 8.8311 116.3764 63.1976 69.4705 174.4145 181 I 4.2256 7.6889 124.1111 58.9594 37.4236 173.9271 182 P 4.3427 0.0000 0.0000 62.5813 31.8377 177.9434 183 V 3.5272 8.4990 113.7954 64.3987 31.6710 178.5344 184 E 4.0687 8.1530 118.5864 58.2214 29.4776 177.8306 185 L 4.7261 7.7040 117.4734 53.8395 42.2904 176.8124 186 K 4.1000 7.5001 118.6402 56.7539 32.9622 177.1294 187 S 4.4104 8.3245 116.9092 58.4620 63.8008 174.4224 188 S 4.3155 8.3608 114.9553 58.5381 62.2767 173.5769 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 43 S 8.33 4.40 0.00 3.80 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 44 F 8.51 3.99 0.00 2.62 1.72 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 45 D 8.47 4.85 0.00 2.77 2.62 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 46 K 8.53 4.15 0.00 1.86 2.00 0.00 1.71 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.67 1.61 7.81 47 T 7.88 3.92 4.36 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 1.23 0.00 0.00 48 T 9.46 3.93 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 1.23 0.00 0.00 49 F 8.05 4.62 0.00 3.33 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 50 R 8.36 4.06 0.00 2.08 2.05 0.00 3.19 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.94 0.00 51 L 8.18 4.00 0.00 1.83 1.89 1.00 0.60 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 52 L 8.31 4.12 0.00 2.02 1.93 1.32 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.52 4.16 0.00 2.09 2.09 0.00 3.12 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 54 G 8.81 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 55 E 8.62 4.18 0.00 2.30 2.28 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 2.60 2.61 0.00 56 S 8.39 4.34 0.00 4.19 4.22 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 57 N 8.61 4.61 0.00 3.03 2.98 0.00 0.00 6.70 6.35 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 58 L 8.19 3.90 0.00 1.74 1.98 0.72 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.47 3.90 0.00 3.30 3.10 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 60 Y 7.99 3.88 0.00 2.42 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 61 T 7.87 3.89 4.33 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 1.16 0.00 0.00 62 L 7.62 3.94 0.00 1.51 1.49 0.31 0.47 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 63 A 7.19 4.39 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 64 K 8.73 4.57 0.00 1.76 1.77 0.00 1.20 0.00 0.00 1.49 0.00 0.00 2.75 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.31 7.81 65 W 8.76 5.33 0.00 3.36 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 66 E 8.74 4.57 0.00 2.05 1.88 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 1.80 2.07 0.00 67 N 9.46 4.39 0.00 2.75 2.83 0.00 0.00 6.96 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 N 8.17 4.27 0.00 2.84 2.79 0.00 0.00 7.04 6.68 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 69 K 6.34 3.75 0.00 1.50 1.26 0.00 1.58 0.00 0.00 1.43 0.00 0.00 2.82 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.12 1.30 7.81 70 L 7.76 4.68 0.00 1.90 1.59 1.11 1.05 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 71 H 9.44 4.63 0.00 2.97 3.08 0.00 5.80 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 72 V 8.03 4.44 0.83 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 -0.10 0.00 0.00 0.07 0.00 0.00 73 E 8.31 4.00 0.00 1.94 1.90 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 2.30 2.26 0.00 74 L 8.09 4.50 0.00 1.90 1.77 1.39 1.14 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 75 P 0.00 4.54 0.00 2.46 2.16 0.00 3.74 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 2.06 2.00 0.00 76 E 8.78 4.03 0.00 2.22 2.29 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 2.39 2.34 0.00 77 N 8.14 4.43 0.00 2.91 3.02 0.00 0.00 5.93 7.81 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 78 I 7.69 4.01 1.84 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.29 0.97 0.00 0.00 79 D 7.84 4.54 0.00 2.89 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 80 K 7.93 4.31 0.00 1.85 1.84 0.00 1.91 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.47 7.81 81 Q 7.56 4.13 0.00 2.24 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.41 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 82 S 7.36 4.91 0.00 3.97 3.82 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 83 P 0.00 4.41 0.00 2.26 2.21 0.00 3.92 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 2.04 1.99 0.00 84 T 7.26 4.28 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 1.30 0.00 0.00 85 M 9.02 4.86 0.00 2.00 1.85 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 86 T 8.80 5.08 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 87 L 9.20 5.13 0.00 1.64 1.30 0.96 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 88 I 9.01 5.19 2.08 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 1.40 1.10 1.05 0.00 0.00 89 Y 9.45 5.34 0.00 2.90 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.96 5.20 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 91 E 8.69 4.09 0.00 2.10 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 2.28 2.34 0.00 92 N 8.97 4.65 0.00 2.83 2.90 0.00 0.00 7.02 7.69 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 93 G 8.38 3.90 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 0.00 0.00 0.00 94 Q 8.07 4.52 0.00 2.57 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.04 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 95 L 8.63 3.86 0.00 1.41 1.50 0.18 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 96 L 8.68 4.67 0.00 1.74 1.82 1.19 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 97 W 7.57 4.80 0.00 3.33 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 98 A 7.31 4.37 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.07 3.04 0.00 1.75 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 100 R 7.22 4.31 0.00 1.63 1.58 0.00 3.23 0.00 0.00 3.11 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.53 0.00 101 D 8.35 4.50 0.00 2.49 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 0.00 102 V 7.68 4.18 1.78 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 0.78 0.00 0.00 0.83 0.00 0.00 103 P 0.00 4.20 0.00 2.23 2.11 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 104 W 8.04 4.27 0.00 3.55 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 0.00 105 L 6.32 2.97 0.00 0.27 1.08 0.71 0.60 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 0.00 106 M 7.64 3.96 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.81 0.00 107 K 7.73 4.01 0.00 1.97 1.89 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.73 7.81 108 M 7.80 4.10 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.01 3.15 0.00 109 I 7.04 3.98 1.86 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.82 0.92 0.00 0.00 110 Q 6.72 3.69 0.00 0.93 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.41 6.84 0.00 0.00 0.00 0.00 0.00 1.78 1.16 0.00 111 P 0.00 4.05 0.00 2.07 2.03 0.00 3.39 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 112 D 7.78 4.58 0.00 2.81 2.78 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 0.00 0.00 0.00 0.00 113 W 7.96 4.65 0.00 3.33 3.02 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 0.00 114 L 7.76 4.38 0.00 1.59 1.52 0.28 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 115 K 7.89 4.25 0.00 1.75 1.85 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.44 7.81 116 S 7.53 4.73 0.00 3.65 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 0.00 117 N 8.72 4.32 0.00 2.43 2.50 0.00 0.00 6.75 7.65 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 0.00 118 G 7.82 3.75 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 0.00 0.00 0.00 119 F 8.11 5.30 0.00 2.47 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 0.00 0.00 0.00 120 H 9.75 4.88 0.00 2.54 2.19 0.00 5.75 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.81 5.26 0.00 1.87 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 1.97 2.41 0.00 122 I 8.71 4.75 2.11 0.00 0.00 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 1.65 1.17 1.22 0.00 0.00 123 E 9.05 5.09 0.00 1.91 1.90 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 2.31 2.37 0.00 124 A 8.82 4.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.25 4.72 0.00 2.82 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 0.00 126 V 8.27 3.51 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 0.99 0.00 0.00 0.95 0.00 0.00 127 N 7.94 4.21 0.00 2.72 2.79 0.00 0.00 7.22 8.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.26 3.80 0.00 2.00 1.54 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 0.00 129 T 7.66 4.10 4.40 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 1.32 0.00 0.00 130 S 8.20 4.30 0.00 4.05 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 0.00 131 L 7.61 4.18 0.00 2.09 1.98 0.96 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 132 L 7.80 4.31 0.00 2.04 2.09 0.80 0.72 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 0.00 133 L 8.82 3.95 0.00 1.77 1.67 0.96 0.90 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 0.00 134 S 8.11 3.62 0.00 4.18 4.20 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 0.00 135 G 7.10 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 0.00 0.00 0.00 136 D 7.32 4.93 0.00 2.75 2.62 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 0.00 137 H 8.90 3.91 0.00 3.26 3.34 0.00 6.12 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 S 7.56 3.83 0.00 3.92 3.79 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 0.00 0.00 0.00 0.00 139 I 7.92 3.70 1.89 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 0.34 0.93 0.00 0.00 140 Q 8.22 4.01 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.90 0.00 0.00 0.00 0.00 0.00 2.46 2.64 0.00 141 Q 9.25 4.08 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 142 Q 7.81 4.25 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 143 L 8.43 3.96 0.00 1.70 1.83 0.92 0.77 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 0.00 144 Q 8.16 4.04 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 145 E 7.92 3.97 0.00 2.22 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 2.45 0.00 146 V 7.84 3.64 2.24 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 0.98 0.00 0.00 0.97 0.00 0.00 147 R 7.81 3.91 0.00 1.84 2.12 0.00 3.31 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 148 Q 7.84 4.19 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.63 2.55 0.00 149 N 7.81 4.77 0.00 2.70 2.83 0.00 0.00 6.87 7.54 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 0.00 150 N 7.20 5.08 0.00 2.75 2.63 0.00 0.00 6.93 7.88 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 0.00 151 N 8.88 4.47 0.00 2.70 2.86 0.00 0.00 6.76 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 N 7.61 4.94 0.00 2.64 2.68 0.00 0.00 6.84 7.35 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 0.00 153 A 7.74 4.04 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 0.00 154 Q 8.44 4.63 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 155 M 8.90 5.01 0.00 1.84 2.06 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 156 T 8.22 5.02 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 157 H 9.30 5.16 0.00 3.25 3.28 0.00 5.80 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 S 8.50 4.56 0.00 3.68 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 V 9.41 5.08 2.33 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 1.16 0.00 0.00 1.08 0.00 0.00 160 A 9.14 5.17 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 0.00 161 V 8.32 4.78 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 1.05 0.00 0.00 1.02 0.00 0.00 162 N 9.22 5.26 0.00 2.78 2.24 0.00 0.00 6.16 8.54 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 0.00 163 V 9.39 4.65 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 0.74 0.00 0.00 0.93 0.00 0.00 164 Y 9.37 4.50 0.00 2.75 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 0.00 165 P 0.00 4.67 0.00 2.06 2.03 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 166 A 8.63 4.42 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 0.00 167 T 9.28 4.72 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 1.40 0.00 0.00 168 S 8.78 4.16 0.00 4.00 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 0.00 169 R 7.77 4.62 0.00 1.94 2.03 0.00 2.99 0.00 0.00 3.20 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.52 0.00 170 M 7.70 4.66 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.56 0.00 171 P 0.00 4.51 0.00 1.54 1.22 0.00 3.38 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.44 0.00 172 K 8.37 4.29 0.00 1.76 1.74 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.61 7.81 173 L 9.22 5.17 0.00 1.80 1.67 0.98 0.66 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 0.00 174 T 9.09 5.12 4.38 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 1.27 0.00 0.00 175 I 9.30 5.11 2.20 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 1.29 1.00 1.14 0.00 0.00 176 V 9.25 4.86 2.33 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 0.97 0.00 0.00 1.09 0.00 0.00 177 V 8.83 4.89 2.22 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 1.00 0.00 0.00 1.13 0.00 0.00 178 V 8.96 4.87 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 0.96 0.00 0.00 0.95 0.00 0.00 179 D 8.97 5.05 0.00 2.77 2.60 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 0.00 180 T 8.83 4.13 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 1.29 0.00 0.00 181 I 7.69 4.23 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 1.38 0.62 0.91 0.00 0.00 182 P 0.00 4.34 0.00 2.29 1.95 0.00 3.71 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.98 0.00 183 V 8.50 3.53 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 0.66 0.00 0.00 0.90 0.00 0.00 184 E 8.15 4.07 0.00 2.03 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 2.37 2.36 0.00 185 L 7.70 4.73 0.00 1.71 1.65 0.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 186 K 7.50 4.10 0.00 1.85 1.76 0.00 1.55 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.61 1.38 7.81 187 S 8.32 4.41 0.00 3.88 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 0.00 188 S 8.36 4.32 0.00 3.78 3.68 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