NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 I 4.0935 8.0093 118.5539 59.0766 37.3018 175.2198 4 P 4.6307 0.0000 0.0000 60.0383 33.1325 173.2358 5 T 4.9908 8.4823 110.1267 59.9510 72.0678 175.2523 6 V 4.3303 9.0956 125.7927 62.0618 34.0454 174.9311 7 I 4.3477 8.3448 126.0217 58.2604 36.7727 172.1170 *16 A 4.3093 8.2727 126.3627 51.4577 19.0944 175.3605 17 Y 4.6854 8.8059 119.5522 57.2059 41.1739 174.3768 18 D 5.0649 8.4929 119.3695 52.1344 41.9038 177.2671 19 I 3.4741 8.3983 120.2395 65.0567 37.7639 177.8079 20 Y 4.2731 8.2295 117.3911 60.9495 37.7689 178.4431 21 S 4.1664 8.2736 115.9238 61.3997 62.8351 176.2362 22 R 3.3495 7.8841 120.4896 59.5378 30.1129 178.3866 23 L 4.0868 7.7507 117.9591 57.4449 41.5536 179.1940 24 L 4.3354 7.9594 121.8542 57.3033 41.7578 178.7679 25 K 4.1672 7.6905 118.4008 58.2988 32.0333 177.3604 26 D 4.8336 7.7174 117.8966 53.3767 42.0090 176.1188 27 R 3.8943 7.9680 116.7057 57.6985 28.1985 175.7225 28 I 5.0090 7.7574 117.5228 59.7083 40.1724 174.9530 29 I 4.6099 9.2472 128.4608 59.8153 39.6209 174.4461 30 M 4.7754 8.7084 126.3756 53.7387 33.8848 175.5942 31 L 4.5024 9.3170 127.0302 52.2872 43.5850 176.7118 32 G 4.8372 8.0102 119.5684 44.2049 0.0000 169.5816 33 S 4.6721 7.6263 111.1008 56.6417 66.2659 174.6786 34 A 4.2372 8.5698 121.8628 52.4022 19.2301 177.5722 35 I 4.3133 9.8793 122.3621 60.3356 38.2214 174.7713 36 D 5.1386 8.3468 125.8430 50.6510 43.1321 176.3346 37 D 4.4139 8.9706 118.5803 57.9090 40.8092 179.0903 38 N 4.2826 8.1447 116.5633 56.7287 39.0312 176.9542 39 V 3.5771 8.8053 119.7430 65.8467 31.5737 177.8051 40 A 4.0016 8.4476 121.0343 55.2699 18.3436 179.1298 41 N 4.3016 8.6671 115.9825 56.7839 38.9922 177.1279 42 S 4.1135 8.0193 114.2695 61.2191 62.4233 176.2006 43 I 3.6809 7.9176 122.5749 64.4157 36.8291 178.4188 44 V 3.6430 8.1587 119.4442 66.4326 31.3466 178.3099 45 S 4.1987 8.1052 114.3428 61.4864 62.5006 176.7831 46 Q 4.1466 8.0655 121.0630 58.7681 28.4566 178.4093 47 L 4.0376 8.3262 120.3752 57.8214 41.7260 179.5930 48 L 3.9976 8.2941 119.1085 57.7526 41.5438 179.2338 49 F 4.1975 8.3985 120.5184 61.4434 39.2363 177.1723 50 L 3.6328 8.3060 118.3922 57.7102 41.2201 179.4390 51 A 3.8760 8.0114 119.3936 54.7933 18.2825 179.1525 52 A 4.0588 7.6116 118.8299 54.8487 18.6619 179.4423 53 E 4.1179 7.5583 116.4643 58.0796 29.4856 177.7984 54 D 4.3306 8.0723 124.8020 52.6064 42.2064 173.4574 55 P 4.2538 0.0000 0.0000 63.7403 31.6684 177.0086 56 E 4.3104 8.3004 118.9354 58.3160 30.4375 177.1044 57 K 4.3380 7.3119 117.3942 56.1254 32.7223 177.2874 58 E 4.5057 8.6508 121.1343 56.3031 31.2176 175.6401 59 I 4.8252 8.6345 120.3687 59.6579 41.2202 174.7972 60 S 5.1640 8.9791 121.6302 56.7579 65.5058 172.8306 61 L 5.0995 9.3208 128.1353 53.5270 43.8814 174.6600 62 Y 4.7035 9.1542 126.0264 57.4970 39.4871 174.7806 63 I 4.8442 9.2541 125.8980 59.7061 40.1531 174.5720 64 N 5.6058 9.6585 126.5576 52.2182 40.7408 172.2667 65 S 5.0297 9.2525 118.7291 56.1111 66.1933 173.0152 66 P 4.4357 0.0000 0.0000 63.3749 31.7293 175.9827 67 G 4.0487 7.8873 105.0478 44.9097 0.0000 170.9827 68 G 3.9957 8.4565 109.8275 44.9410 0.0000 172.3163 69 S 4.1467 8.7237 119.2368 58.4211 63.1493 175.7812 70 I 3.6418 8.4818 128.8415 64.7249 37.0456 178.6914 71 T 3.8592 7.8260 109.9591 64.5643 68.2541 176.4829 72 A 4.1209 8.1042 123.9423 54.8143 18.3963 179.8890 73 G 3.5968 8.2873 104.4111 48.3223 0.0000 175.9956 74 M 4.4854 8.4558 121.2348 57.8519 31.9024 178.7365 75 A 4.1100 8.0196 121.1155 55.0917 18.4992 179.8248 76 I 3.7316 7.5244 117.6640 64.7171 37.1268 177.4656 77 Y 4.1793 8.6943 120.5983 61.3540 38.5604 178.0452 78 D 4.3368 9.0656 119.5614 57.8744 41.0361 179.2137 79 T 4.1440 8.0037 116.0312 66.8000 68.1754 176.6028 80 M 4.0656 7.9581 119.9321 58.6248 32.0729 178.5484 81 Q 4.0500 7.4784 116.8813 58.5402 28.9645 177.8721 82 F 4.5413 8.6222 121.5265 60.4776 39.6951 175.7884 83 I 3.7118 7.0224 109.9486 59.9463 38.3867 176.0784 84 K 3.9581 8.4064 122.6068 59.0883 32.2438 175.7860 85 P 4.3557 0.0000 0.0000 63.0120 31.9186 176.2667 86 K 4.2551 8.6357 122.4644 56.1263 33.9660 175.9309 87 V 4.6979 8.2613 123.3385 61.2735 33.8990 174.0236 88 S 5.0352 9.2884 124.4584 57.5228 63.5146 172.6727 89 T 5.1306 8.3026 116.2872 60.0010 71.6048 173.1847 90 I 5.0194 8.3680 124.6021 59.6837 41.0128 173.8476 91 C 5.0458 9.2321 129.1007 58.3624 32.6818 172.1863 92 I 4.4899 7.8503 119.9212 60.6730 39.6721 174.7959 93 G 3.7867 9.9320 116.2655 46.1013 0.0000 173.4538 94 M 5.2998 6.2919 116.8520 53.8084 37.3666 173.8901 95 A 5.0289 9.4948 127.4033 50.1073 20.8785 174.5441 96 A 5.0623 8.9170 122.5000 50.2868 22.7346 178.3990 97 S 3.4461 8.6032 114.7691 59.1615 63.2711 176.5530 98 M 4.3059 8.8444 117.2017 57.8740 31.2087 177.9655 99 G 3.6127 8.6291 106.6015 47.6933 0.0000 175.7907 100 A 4.0957 7.8057 122.8149 54.5850 18.2116 179.3457 101 F 4.0242 8.0378 118.6117 61.5339 39.8409 177.0386 102 L 4.2571 8.3376 118.7019 57.6087 41.5274 179.0302 103 L 3.9224 8.0660 120.0754 58.4402 41.8176 179.1466 104 A 4.2832 8.1626 119.6753 54.0096 18.3453 178.5538 105 A 4.3169 7.6375 117.3757 52.2113 18.8154 177.6803 106 G 3.8582 7.1185 104.6967 44.7588 0.0000 173.5584 107 E 4.0152 9.3110 121.8851 56.2171 30.5650 176.1867 108 K 3.8998 8.6766 128.0026 58.5428 32.0557 176.6695 109 G 3.9576 9.6102 115.9617 44.9388 0.0000 173.5634 110 K 4.2457 8.2230 119.3583 56.0287 33.8859 175.8528 111 R 4.6592 8.0664 120.9397 55.1922 31.4945 175.3721 112 Y 5.6387 9.5689 121.8818 55.6811 41.7482 174.7660 113 A 5.1154 8.2450 120.3021 50.8697 22.8661 175.8744 114 L 4.5590 8.6570 120.3749 53.5271 43.2195 176.6039 115 P 4.1763 0.0000 0.0000 65.8903 31.2896 177.4431 116 N 4.9021 7.9318 111.4977 53.0305 38.8250 175.2075 117 S 4.5924 8.1758 115.7736 58.8268 64.3785 172.8995 118 E 5.0232 9.2158 122.2180 54.5919 33.0841 174.5901 119 V 5.0488 8.6456 124.7123 61.5181 35.6746 173.7854 120 M 5.2094 8.8465 125.0491 53.8604 36.1663 173.5958 121 I 4.9913 8.2093 118.3888 59.6378 41.1934 173.8112 122 H 5.2429 8.3943 118.3236 54.6971 31.1470 172.8377 123 Q 4.3014 8.4506 117.6064 54.9098 29.3940 174.5013 124 P 4.2926 0.0000 0.0000 62.8878 31.9906 175.8888 125 L 4.7637 7.6281 119.8856 53.2639 44.7129 176.8825 126 G 3.9798 8.0813 107.2534 46.7395 0.0000 172.4569 127 G 4.1162 8.4090 106.2518 44.9820 0.0000 172.3607 128 A 4.6846 8.0915 121.3086 50.6740 22.1593 175.7550 129 Q 4.4864 8.6766 121.2754 55.0916 32.7178 173.5453 130 G 3.8352 8.7773 109.7865 44.5531 0.0000 174.0414 131 Q 4.1561 9.1795 120.6341 55.4719 30.6807 176.8413 132 A 3.9737 8.6174 124.3055 56.0265 18.4447 180.2922 133 T 3.7972 7.9036 113.3489 67.0594 68.6797 176.5309 134 E 4.0395 8.0094 119.7901 59.3207 29.5466 179.2628 135 I 3.8129 7.9520 120.1939 63.9666 37.0388 178.0947 136 E 3.9280 8.3272 120.6655 59.2183 29.5931 178.7975 137 I 3.6761 7.6916 119.3941 64.3917 37.1566 178.3325 138 A 3.9881 7.9964 121.0851 54.8267 18.1808 179.5240 139 A 3.8780 8.0484 119.3153 55.4548 18.6145 179.9918 140 K 3.8918 8.3577 117.3212 59.6075 31.9774 179.6474 141 R 3.8783 7.8682 118.5622 59.3948 30.0751 178.4149 142 I 3.6910 7.8244 118.3866 63.7369 37.8322 177.7511 143 L 4.0738 7.9542 119.9848 56.9628 41.3320 179.1072 144 L 3.9727 7.6127 120.1958 57.9827 42.0967 178.7148 145 L 3.9057 8.0374 119.1579 57.7367 41.4529 179.4840 146 R 3.7896 7.9714 118.5189 59.5259 30.1550 178.0706 147 D 4.2896 7.7993 117.9245 57.0491 41.0501 178.1131 148 K 3.9022 8.3546 120.5104 59.5772 32.2122 178.8396 149 L 3.8826 8.1616 119.6387 57.8664 41.4863 179.2407 150 N 4.3795 8.5312 116.7998 56.3140 38.4726 177.6524 151 K 4.0461 8.0453 119.7255 59.3533 32.0534 179.6548 152 V 3.8382 7.7247 118.8352 65.7097 31.3618 177.8995 153 L 3.8790 8.3791 120.1780 58.0042 41.8972 178.6901 154 A 4.0191 8.0428 120.7192 55.3321 18.0869 179.5084 155 E 3.8942 7.8672 115.6324 59.7417 29.6626 179.6506 156 R 4.0601 8.1970 117.2109 58.4874 29.9669 178.2054 157 T 4.9331 7.6913 110.7424 60.9274 69.5788 176.4347 158 G 4.0199 8.2898 108.6271 44.8294 0.0000 173.6492 159 Q 4.0532 7.3825 119.2753 54.5080 29.4767 174.4027 160 P 4.3742 0.0000 0.0000 62.2428 32.4382 176.7264 161 L 3.8596 8.8089 122.8169 58.8413 41.9351 179.0098 162 E 3.8873 8.2699 118.2601 59.4035 29.3210 178.9503 163 V 3.6433 7.9951 118.3923 65.9833 31.2033 178.0462 164 I 3.8174 7.7644 119.1035 64.4403 36.7317 178.1021 165 E 4.0012 8.2383 118.6333 59.6394 29.1874 179.4039 166 R 4.1144 7.9291 117.6710 59.1344 29.9712 178.2518 167 D 4.6947 8.3959 116.8612 55.5281 41.2354 176.9344 168 T 4.4887 7.3292 108.7680 61.1644 69.4458 175.5401 169 D 4.3915 7.8619 121.9801 57.1509 41.2439 176.3540 170 R 4.7269 7.4392 114.2016 53.4784 33.8666 174.5428 171 D 4.1788 8.6470 118.4271 55.5315 41.5061 176.3648 172 N 4.7510 8.4984 121.2936 51.6957 41.0102 172.5705 173 F 5.0580 8.6690 124.3845 56.5789 40.4740 175.5084 174 K 4.9753 9.6007 122.6204 54.4227 36.0940 176.5433 175 S 4.5755 10.1467 119.4128 57.4984 64.3026 175.0162 176 A 4.0012 8.7066 122.8206 55.7124 17.9478 179.9318 177 E 3.9860 8.1393 116.3659 59.5997 29.6056 179.2908 178 E 4.0546 8.2495 118.5238 59.1348 29.4916 179.1770 179 A 4.0534 8.2953 121.4217 54.8809 18.3258 179.4563 180 L 3.8858 7.9356 118.8064 58.5579 42.0669 179.2269 181 E 4.0639 8.0885 116.8250 59.2861 29.4024 178.3345 182 Y 4.2518 7.9977 119.0723 58.6950 39.2490 176.2477 183 G 4.1126 7.7791 106.9290 46.2722 0.0000 175.2176 184 L 4.0962 8.3628 122.1057 56.4957 41.8472 176.6685 185 I 4.6182 7.3949 109.3496 59.3153 40.8769 173.9602 186 D 4.7901 9.0661 119.3522 55.0028 42.9369 177.2534 187 K 4.6198 7.5237 117.3589 54.6966 36.3436 175.2933 188 I 4.6372 8.2902 126.4433 59.5601 38.1489 175.6029 189 L 4.3669 8.5529 128.1698 55.3542 41.8225 177.0862 190 T 4.5406 8.5107 109.3338 63.2317 72.2843 173.8361 191 H 4.9743 7.9697 120.8535 53.6626 31.0749 176.3000 192 L 4.0780 8.6117 123.3926 57.2588 41.1960 179.5379 193 E 4.5946 8.1818 114.0254 58.2572 30.8083 183.2919 *194 H 4.2956 7.7826 113.0896 57.1370 28.0717 179.6372 195 H 4.3889 7.8849 118.2431 55.6879 30.5015 175.7727 196 H 4.3656 8.3176 121.5943 58.3682 28.7012 176.4829 197 H 4.2760 8.7811 122.2557 59.9272 30.0152 175.0758 *198 H 4.5430 7.7972 118.9292 54.6362 27.8423 176.4574 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 3 I 8.01 4.09 1.87 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 1.47 1.21 0.91 0.00 0.00 4 P 0.00 4.63 0.00 2.14 2.16 0.00 3.46 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 1.95 1.94 0.00 5 T 8.48 4.99 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 1.21 0.00 0.00 6 V 9.10 4.33 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 0.96 0.00 0.00 0.91 0.00 0.00 7 I 8.34 4.35 1.87 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 1.35 0.87 0.91 0.00 0.00 *16 A 8.27 4.31 1.20 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 0.00 0.00 17 Y 8.81 4.69 0.00 2.88 2.88 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 18 D 8.49 5.06 0.00 2.83 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 19 I 8.40 3.47 1.65 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.91 0.12 0.00 0.00 20 Y 8.23 4.27 0.00 3.21 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 21 S 8.27 4.17 0.00 4.29 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 22 R 7.88 3.35 0.00 1.71 2.05 0.00 2.88 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 23 L 7.75 4.09 0.00 1.93 1.72 0.84 0.33 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 24 L 7.96 4.34 0.00 1.94 1.90 1.07 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 25 K 7.69 4.17 0.00 1.50 1.73 0.00 1.41 0.00 0.00 1.57 0.00 0.00 3.17 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.46 7.81 26 D 7.72 4.83 0.00 2.79 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 27 R 7.97 3.89 0.00 2.09 2.03 0.00 3.06 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 28 I 7.76 5.01 2.10 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 1.48 1.12 1.05 0.00 0.00 29 I 9.25 4.61 1.95 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.87 0.96 0.00 0.00 30 M 8.71 4.78 0.00 1.94 1.97 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.57 0.00 31 L 9.32 4.50 0.00 1.74 1.75 0.94 0.80 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 32 G 8.01 4.84 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 0.00 0.00 0.00 0.00 0.00 0.00 33 S 7.63 4.67 0.00 3.84 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 34 A 8.57 4.24 1.26 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 0.00 0.00 35 I 9.88 4.31 1.95 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 1.31 0.68 0.94 0.00 0.00 36 D 8.35 5.14 0.00 2.69 2.73 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 37 D 8.97 4.41 0.00 2.74 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 38 N 8.14 4.28 0.00 2.75 2.81 0.00 0.00 6.82 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 39 V 8.81 3.58 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 0.96 0.00 0.00 1.06 0.00 0.00 40 A 8.45 4.00 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 41 N 8.67 4.30 0.00 2.88 2.98 0.00 0.00 6.89 7.17 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 42 S 8.02 4.11 0.00 3.96 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 43 I 7.92 3.68 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 1.73 0.85 0.96 0.00 0.00 44 V 8.16 3.64 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 1.18 0.00 0.00 1.05 0.00 0.00 45 S 8.11 4.20 0.00 4.15 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 46 Q 8.07 4.15 0.00 2.37 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 47 L 8.33 4.04 0.00 1.91 1.77 0.97 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.29 4.00 0.00 1.77 1.79 1.01 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 49 F 8.40 4.20 0.00 3.21 3.35 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 50 L 8.31 3.63 0.00 1.88 1.67 1.01 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 51 A 8.01 3.88 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.61 4.06 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 53 E 7.56 4.12 0.00 1.76 1.79 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 1.47 1.54 0.00 54 D 8.07 4.33 0.00 2.54 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 55 P 0.00 4.25 0.00 2.15 2.18 0.00 3.74 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 1.93 1.92 0.00 56 E 8.30 4.31 0.00 2.05 2.00 0.00 0.00 0.00 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 57 K 7.31 4.34 0.00 1.80 1.73 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.37 7.81 58 E 8.65 4.51 0.00 2.11 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 2.29 2.40 0.00 59 I 8.63 4.83 1.90 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 1.23 0.94 1.00 0.00 0.00 60 S 8.98 5.16 0.00 3.84 3.80 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 61 L 9.32 5.10 0.00 1.75 1.66 0.99 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 62 Y 9.15 4.70 0.00 3.05 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 63 I 9.25 4.84 1.92 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 1.17 1.19 0.97 0.00 0.00 64 N 9.66 5.61 0.00 2.92 2.70 0.00 0.00 6.17 7.64 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 65 S 9.25 5.03 0.00 4.15 3.66 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 66 P 0.00 4.44 0.00 2.25 2.19 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 67 G 7.89 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 68 G 8.46 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 0.00 0.00 0.00 69 S 8.72 4.15 0.00 3.80 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 70 I 8.48 3.64 1.79 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.46 0.76 0.00 0.00 71 T 7.83 3.86 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 1.18 0.00 0.00 72 A 8.10 4.12 1.46 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 0.00 0.00 73 G 8.29 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 M 8.46 4.49 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.81 0.00 75 A 8.02 4.11 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 76 I 7.52 3.73 2.15 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 1.46 0.78 0.99 0.00 0.00 77 Y 8.69 4.18 0.00 3.23 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 78 D 9.07 4.34 0.00 2.90 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 79 T 8.00 4.14 4.43 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 1.34 0.00 0.00 80 M 7.96 4.07 0.00 1.92 2.20 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.60 0.00 81 Q 7.48 4.05 0.00 1.89 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.91 0.00 0.00 0.00 0.00 0.00 2.10 1.96 0.00 82 F 8.62 4.54 0.00 2.98 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 83 I 7.02 3.71 1.77 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 1.45 0.80 0.88 0.00 0.00 84 K 8.41 3.96 0.00 1.61 1.78 0.00 1.62 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.44 7.81 85 P 0.00 4.36 0.00 1.95 2.19 0.00 3.60 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.08 0.00 86 K 8.64 4.26 0.00 1.70 1.70 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.78 1.40 7.81 87 V 8.26 4.70 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 1.00 0.00 0.00 0.98 0.00 0.00 88 S 9.29 5.04 0.00 4.05 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 89 T 8.30 5.13 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 1.22 0.00 0.00 90 I 8.37 5.02 1.02 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.71 0.77 0.00 0.00 91 C 9.23 5.05 0.00 2.99 2.84 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 0.00 0.00 0.00 92 I 7.85 4.49 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.37 1.13 0.00 0.00 93 G 9.93 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 0.00 0.00 0.00 94 M 6.29 5.30 0.00 2.14 1.90 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.62 0.00 95 A 9.49 5.03 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 96 A 8.92 5.06 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 97 S 8.60 3.45 0.00 3.97 3.24 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 98 M 8.84 4.31 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.48 0.00 99 G 8.63 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.81 4.10 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 101 F 8.04 4.02 0.00 3.01 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 0.00 102 L 8.34 4.26 0.00 1.98 1.80 1.02 0.65 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 0.00 103 L 8.07 3.92 0.00 1.90 1.85 0.97 1.11 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 0.00 104 A 8.16 4.28 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 0.00 105 A 7.64 4.32 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 G 7.12 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 0.00 107 E 9.31 4.02 0.00 2.05 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 2.29 2.29 0.00 108 K 8.68 3.90 0.00 1.74 1.69 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.48 7.81 109 G 9.61 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 0.00 0.00 0.00 110 K 8.22 4.25 0.00 1.77 1.92 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.78 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.47 1.36 7.81 111 R 8.07 4.66 0.00 1.75 1.78 0.00 3.16 0.00 0.00 3.36 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 112 Y 9.57 5.64 0.00 2.79 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 A 8.25 5.12 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 0.00 114 L 8.66 4.56 0.00 1.71 1.63 1.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.18 0.00 2.06 2.16 0.00 3.69 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.30 0.00 116 N 7.93 4.90 0.00 2.69 2.82 0.00 0.00 6.92 7.57 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 0.00 117 S 8.18 4.59 0.00 3.94 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 0.00 118 E 9.22 5.02 0.00 2.03 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 2.34 2.30 0.00 119 V 8.65 5.05 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 0.94 0.00 0.00 0.96 0.00 0.00 120 M 8.85 5.21 0.00 1.79 1.52 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.76 0.00 121 I 8.21 4.99 1.86 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.45 0.90 0.00 0.00 122 H 8.39 5.24 0.00 3.03 3.14 0.00 5.54 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 0.00 123 Q 8.45 4.30 0.00 2.06 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.90 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 124 P 0.00 4.29 0.00 1.99 1.95 0.00 3.56 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.02 0.00 125 L 7.63 4.76 0.00 1.54 1.49 0.89 0.77 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 0.00 126 G 8.08 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 0.00 127 G 8.41 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 0.00 0.00 0.00 128 A 8.09 4.68 1.18 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 0.00 0.00 129 Q 8.68 4.49 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.45 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 130 G 8.78 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 9.18 4.16 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 132 A 8.62 3.97 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 T 7.90 3.80 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 1.21 0.00 0.00 134 E 8.01 4.04 0.00 2.13 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 2.39 2.39 0.00 135 I 7.95 3.81 2.02 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 1.40 0.70 0.90 0.00 0.00 136 E 8.33 3.93 0.00 2.11 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 2.30 2.34 0.00 137 I 7.69 3.68 2.02 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 1.45 0.92 0.90 0.00 0.00 138 A 8.00 3.99 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 0.00 139 A 8.05 3.88 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 0.00 140 K 8.36 3.89 0.00 1.77 1.87 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.57 7.81 141 R 7.87 3.88 0.00 1.99 2.02 0.00 3.07 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 142 I 7.82 3.69 1.84 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 1.48 1.14 0.97 0.00 0.00 143 L 7.95 4.07 0.00 1.92 1.68 0.91 0.50 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 0.00 144 L 7.61 3.97 0.00 1.97 1.75 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 145 L 8.04 3.91 0.00 1.81 1.61 0.86 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 0.00 146 R 7.97 3.79 0.00 1.91 2.07 0.00 3.07 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 147 D 7.80 4.29 0.00 2.88 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 0.00 148 K 8.35 3.90 0.00 1.89 1.90 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.46 7.81 149 L 8.16 3.88 0.00 1.69 1.43 0.64 -0.25 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 0.00 150 N 8.53 4.38 0.00 2.93 2.89 0.00 0.00 7.05 6.92 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 0.00 151 K 8.05 4.05 0.00 2.00 1.87 0.00 1.67 0.00 0.00 1.58 0.00 0.00 3.16 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.69 7.81 152 V 7.72 3.84 2.43 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 0.95 0.00 0.00 1.00 0.00 0.00 153 L 8.38 3.88 0.00 2.03 1.72 1.06 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 154 A 8.04 4.02 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 0.00 155 E 7.87 3.89 0.00 2.16 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 2.35 2.48 0.00 156 R 8.20 4.06 0.00 1.80 2.04 0.00 3.44 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.64 0.00 157 T 7.69 4.93 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 0.00 158 G 8.29 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 0.00 0.00 0.00 159 Q 7.38 4.05 0.00 1.90 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.81 0.00 0.00 0.00 0.00 0.00 1.96 1.44 0.00 160 P 0.00 4.37 0.00 2.20 2.15 0.00 3.64 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 2.04 1.92 0.00 161 L 8.81 3.86 0.00 1.77 1.74 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 162 E 8.27 3.89 0.00 2.07 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 2.39 2.39 0.00 163 V 8.00 3.64 2.20 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 1.22 0.00 0.00 0.93 0.00 0.00 164 I 7.76 3.82 2.06 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.08 1.01 0.00 0.00 165 E 8.24 4.00 0.00 2.08 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 2.36 2.61 0.00 166 R 7.93 4.11 0.00 1.92 1.99 0.00 3.13 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 167 D 8.40 4.69 0.00 2.81 2.85 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 0.00 168 T 7.33 4.49 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 1.26 0.00 0.00 169 D 7.86 4.39 0.00 2.78 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 0.00 170 R 7.44 4.73 0.00 1.76 1.78 0.00 3.34 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 171 D 8.65 4.18 0.00 2.56 2.31 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 0.00 172 N 8.50 4.75 0.00 2.78 2.61 0.00 0.00 6.81 7.23 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 0.00 173 F 8.67 5.06 0.00 2.95 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 0.00 174 K 9.60 4.98 0.00 1.57 1.61 0.00 1.38 0.00 0.00 1.49 0.00 0.00 2.23 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 1.19 7.81 175 S 10.15 4.58 0.00 3.94 4.03 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 0.00 176 A 8.71 4.00 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 0.00 177 E 8.14 3.99 0.00 2.04 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 2.42 2.42 0.00 178 E 8.25 4.05 0.00 2.27 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 2.35 2.34 0.00 179 A 8.30 4.05 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 0.00 180 L 7.94 3.89 0.00 1.91 1.90 1.00 0.81 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 0.00 181 E 8.09 4.06 0.00 2.06 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 2.37 2.60 0.00 182 Y 8.00 4.25 0.00 3.13 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 0.00 183 G 7.78 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 0.00 184 L 8.36 4.10 0.00 1.93 1.76 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 185 I 7.39 4.62 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 1.43 0.65 0.91 0.00 0.00 186 D 9.07 4.79 0.00 2.24 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 0.00 187 K 7.52 4.62 0.00 1.67 1.56 0.00 2.04 0.00 0.00 1.90 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.49 7.81 188 I 8.29 4.64 1.90 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 0.77 0.95 0.00 0.00 189 L 8.55 4.37 0.00 1.58 1.60 0.68 0.71 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 0.00 190 T 8.51 4.54 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 1.23 0.00 0.00 191 H 7.97 4.97 0.00 3.19 3.22 0.00 5.64 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 L 8.61 4.08 0.00 1.66 1.59 0.92 0.76 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 0.00 193 E 8.18 4.59 0.00 1.88 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 2.24 1.85 0.00 *194 H 7.78 4.30 0.00 2.87 3.03 0.00 7.16 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 H 7.88 4.39 0.00 2.96 3.03 0.00 5.56 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 H 8.32 4.37 0.00 3.33 3.57 0.00 5.81 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 H 8.78 4.28 0.00 3.19 3.29 0.00 5.72 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 *198 H 7.80 4.54 0.00 2.97 2.81 0.00 7.29 0.00 0.00 0.00 0.00 6.91 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.