NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 G 3.9717 8.3431 109.7564 43.9026 0.0000 172.7594 14 G 3.1674 7.1050 105.1209 45.5914 0.0000 169.2960 15 A 4.6796 6.5886 118.6652 50.6870 23.9178 174.6834 16 V 4.6100 8.4452 121.0326 62.5262 32.7876 175.5058 17 V 4.7578 8.9330 119.8072 60.2236 36.8859 173.9448 18 T 4.9326 8.4025 118.3705 61.9450 70.6778 174.4716 19 V 4.3086 8.4952 126.7749 62.5635 33.0669 174.4265 20 A 4.9164 9.1602 129.9130 50.0984 21.4261 175.2682 21 F 5.5483 8.7988 121.8978 57.9365 40.4393 175.1421 22 T 4.7787 8.9084 111.3952 60.2335 72.6090 174.0699 23 N 5.0735 8.5348 117.5647 52.5338 37.6026 174.3917 24 A 4.0181 7.7271 121.4963 53.3469 19.0883 178.8580 25 R 4.5044 8.1491 120.8852 55.1086 30.0890 175.1872 26 D 4.4562 7.4813 115.1572 53.1912 42.2724 174.6835 27 C 4.4939 8.2378 115.2579 59.6094 28.1576 174.4010 28 F 5.0493 7.6242 119.0086 57.1926 39.9468 174.7017 29 L 4.7297 8.9528 123.3255 54.7034 43.6640 174.9730 30 H 5.4897 9.7736 124.6465 54.7003 30.3663 173.9589 31 L 4.8339 8.9978 124.1894 52.0595 44.7491 175.0482 32 P 4.4840 0.0000 0.0000 61.8162 32.1754 177.7043 33 R 3.9255 8.6886 118.2631 59.5982 28.9501 178.9357 34 R 3.7808 7.8958 118.7304 59.4463 29.9743 178.3653 35 L 3.8409 7.6372 118.2163 57.5039 41.6323 179.5142 36 V 3.0898 7.5208 117.5898 65.6726 31.3272 177.7884 37 A 3.7991 8.0544 120.6118 55.1877 18.1229 179.1617 38 Q 3.6894 8.2507 117.4409 59.2452 29.0967 177.9150 39 L 4.0316 7.9159 115.1125 55.0337 41.9984 176.2030 40 H 4.0541 7.7691 115.2703 56.3175 26.8130 175.2655 41 L 4.1489 7.4181 118.0676 54.9638 42.2033 177.4733 42 L 4.7395 8.8936 123.0172 52.5836 43.7265 175.8565 43 Q 4.1193 8.6823 121.3192 58.0818 29.1074 175.9449 44 N 4.0722 8.6084 120.3915 54.0388 36.3668 173.7529 45 Q 4.2274 8.1843 119.0423 55.7723 29.8750 175.6593 46 A 4.6897 8.5226 126.1760 51.9026 20.4945 175.9822 47 I 4.6847 8.5833 119.8966 59.3968 40.9573 174.4242 48 E 4.3199 9.3979 128.7914 55.3482 31.1927 175.2452 49 V 4.5280 8.4212 127.7004 61.5554 32.4373 173.8804 50 A 4.7195 8.9271 131.1871 50.8573 20.7327 176.4010 51 S 4.3782 7.8748 114.9591 57.9796 64.8508 173.6922 52 D 4.3804 8.7541 118.2523 57.1931 40.9119 175.7529 53 H 4.8490 7.2031 113.6910 53.4169 30.8026 174.3504 54 Q 4.0633 8.4918 118.4363 55.5041 28.8819 175.0446 55 P 4.5904 0.0000 0.0000 63.1300 32.2442 175.2493 56 T 3.7907 7.7618 110.3231 59.7409 72.6625 172.1056 57 Y 4.9590 7.5280 118.7749 56.2845 40.7773 175.0756 58 L 5.0648 8.9966 123.5617 53.0690 46.0497 175.4833 59 S 5.2945 8.7627 114.7294 56.8533 64.9332 172.4247 60 W 5.7703 7.9315 119.5901 55.1064 31.5057 174.3202 61 V 4.1879 8.7886 112.2743 59.6784 36.1850 173.9582 62 E 4.8375 8.9185 124.3247 55.3778 29.9506 176.5033 63 G 4.1879 9.3115 115.6860 47.0434 0.0000 173.3541 64 R 4.5808 8.8212 120.0291 56.4500 31.4414 176.4280 65 H 4.8544 7.6904 114.9394 55.2588 29.0967 172.0611 66 F 5.0498 7.4491 120.1870 58.3397 42.6520 175.0721 67 N 4.0066 9.0310 115.4904 54.2232 33.7603 169.2036 *71 E 4.0364 7.9168 116.9126 56.3170 32.0100 175.5427 72 N 4.1747 8.4390 115.9385 54.4541 36.0937 174.1266 73 V 4.9494 7.4991 115.1705 60.9715 35.1187 174.4785 74 A 4.7784 9.0568 129.0265 50.2634 21.7097 174.7975 75 E 5.7026 8.9792 122.2372 54.8514 32.1291 175.1822 76 I 4.8297 8.2159 120.8323 59.5162 41.8578 173.0490 77 N 4.5937 8.9145 126.0293 54.2691 39.6252 175.1833 78 R 2.6020 8.9365 126.5682 59.6122 30.0522 179.0255 79 Q 3.9291 7.8796 117.0199 58.7282 28.5133 178.8412 80 V 3.6711 8.1066 119.4379 65.9496 31.5655 178.2536 81 G 3.6866 8.0821 105.7937 47.9921 0.0000 175.5882 82 Q 4.3510 7.7399 121.7345 58.2191 28.5560 179.0885 83 K 4.2088 7.7308 117.7687 58.6112 32.1202 178.3141 84 L 4.5904 7.4395 117.4282 54.1844 41.8445 177.0219 85 G 3.8240 8.3181 107.5270 46.1311 0.0000 173.5682 86 L 4.9795 8.0896 118.9434 52.8894 44.0378 175.9802 87 S 4.8252 9.2770 116.4253 56.2176 66.5388 173.9537 88 S 3.4416 8.0563 117.5605 59.8799 62.2714 175.1129 89 G 3.9203 8.7186 114.7361 45.4986 0.0000 173.6691 90 D 4.5015 7.8148 120.1977 54.6617 42.2235 175.4115 91 Q 5.0203 8.5368 120.6995 54.8133 29.9785 175.4095 92 V 4.5806 8.7491 116.9620 59.4015 36.4996 174.4147 93 F 5.1698 8.9744 125.0517 56.7106 41.3501 174.5848 94 L 4.5776 8.3818 128.0269 53.8761 42.8418 175.9788 95 R 4.3073 8.7704 125.9359 53.4819 32.1334 173.2877 96 P 4.6726 0.0000 0.0000 62.9632 32.2839 175.8529 97 C 4.5103 8.6556 122.0473 58.4924 28.3503 173.8688 98 S 4.2142 9.0523 121.1953 61.6986 62.6795 174.5343 99 H 5.1310 7.8442 113.7764 54.3566 32.6606 172.9131 100 V 4.6112 8.0418 119.7102 60.3913 34.2564 174.8155 101 V 3.9764 8.1677 116.7765 61.1952 33.0244 175.3130 102 S 4.7946 8.5000 120.4038 58.2301 63.7868 173.7225 103 C 4.4231 9.0271 123.5874 60.0785 27.8857 173.8894 104 Q 4.2964 9.5607 123.8971 58.2293 29.9400 175.8259 105 Q 5.1703 7.7893 118.4627 54.6768 32.8974 173.7389 106 V 4.9310 9.0749 124.5294 60.0189 35.2723 173.8924 107 E 5.1967 9.2055 122.9718 54.7986 32.6022 175.5245 108 V 5.0992 8.8044 116.5891 59.6875 36.7932 174.1721 109 E 5.0414 8.9234 118.9038 53.9103 33.0896 173.2159 110 P 4.7617 0.0000 0.0000 63.0291 31.6109 176.3435 111 L 4.2863 8.9596 125.7568 57.7729 42.8949 176.6754 112 S 4.6956 8.2141 111.4644 55.3038 66.5821 174.6132 113 A 4.1484 8.6323 121.6002 55.3374 17.9223 179.4756 114 D 4.3071 8.0908 116.9018 57.6902 40.9570 178.4319 115 D 4.3843 8.0753 119.2570 57.1819 40.7662 178.7868 116 W 4.4844 8.3716 128.6585 60.6317 30.5204 177.5868 117 E 4.0167 8.2187 119.5873 58.6951 29.4147 178.5758 118 I 3.7818 8.1130 120.2581 64.0900 37.1001 177.8872 119 L 3.8535 8.0972 121.5801 58.5126 41.7618 178.7517 120 E 3.5827 7.6223 118.2847 58.8471 29.0843 178.5044 121 L 4.5756 7.2852 115.0608 54.6730 42.1976 176.3751 122 H 4.8034 8.2045 116.1835 55.5966 30.6530 174.5038 123 A 4.2662 8.0830 124.7250 51.4683 17.1210 178.6226 124 I 4.2272 7.3943 119.7102 58.5121 38.0862 178.3055 125 S 3.8387 8.6824 125.8480 57.8794 59.5568 170.6948 126 L 4.0778 7.8451 125.5089 58.7427 42.1714 177.2957 127 E 3.9679 8.2022 118.6628 59.3236 29.5280 178.7385 128 Q 3.9910 7.9146 118.3439 59.2834 28.8481 178.3697 129 H 4.1897 8.1671 116.8012 58.5111 28.7146 177.3218 130 L 4.0581 8.3119 122.5684 58.4242 41.7656 179.2140 131 L 4.2712 7.8111 118.5231 57.2497 41.5899 178.8723 132 D 4.6543 7.8414 117.1541 56.0245 41.0997 176.8725 133 Q 4.1803 7.5604 115.3357 55.4422 31.3725 175.0187 134 I 4.6592 7.8902 117.1394 59.8775 41.3694 174.6091 135 R 4.7648 8.9771 123.5021 55.7801 33.5304 174.9293 136 I 5.1072 8.0602 119.0767 59.5862 39.2818 175.5767 137 V 4.8166 9.0236 119.7093 59.7208 36.0321 174.5056 138 F 5.3613 7.9452 115.5262 54.7395 41.4035 172.0135 139 P 4.3765 0.0000 0.0000 64.6520 31.4971 176.9038 140 K 4.0195 9.0774 121.0401 56.2066 30.5672 176.3612 141 A 3.8875 7.4598 122.2091 51.7406 19.3802 177.0816 142 V 4.8298 8.2911 121.1527 61.2917 33.8039 175.0721 143 V 4.7976 8.7544 120.5854 59.0618 36.4355 172.6225 144 P 4.3528 0.0000 0.0000 61.7141 32.6992 175.1237 145 I 4.4835 8.3776 123.8193 59.0272 40.5271 174.9937 146 W 4.4873 8.9712 127.6838 56.7956 29.4586 176.6432 147 V 3.8894 8.6825 116.9034 61.9472 31.0555 174.9894 148 D 4.5207 7.6172 117.7014 52.5964 41.4593 176.1160 149 Q 4.2162 8.9705 117.7748 58.9117 28.5830 178.3146 150 Q 4.6019 7.8033 114.9959 56.5247 30.0214 175.7256 151 T 4.7067 8.8455 115.0007 61.6129 72.2163 172.7439 152 Y 5.1014 7.4302 121.8258 55.0688 41.4601 174.3510 153 I 4.7011 8.4066 113.0146 59.2508 41.6081 173.9655 154 F 5.0636 9.5208 123.7047 56.6530 40.5776 174.9530 155 I 5.1083 8.9055 116.2517 59.1041 41.5399 173.7702 156 Q 5.1272 8.9676 124.7694 54.3063 31.8161 174.4488 157 I 4.1923 8.7059 128.1815 61.6223 37.6775 176.4226 158 V 3.8993 8.9063 128.1716 64.9295 32.2316 176.1836 159 T 4.8460 7.6686 115.2075 61.7925 73.0625 172.5816 160 L 5.0645 8.5494 123.3072 53.1706 45.2307 175.6250 161 M 4.8225 8.8883 121.9553 52.8977 35.1616 173.3865 162 P 4.5709 0.0000 0.0000 62.0452 32.2740 175.8125 163 A 4.1129 8.3492 122.2457 52.5314 18.3815 176.9577 164 A 4.3827 7.9665 123.0116 50.4958 21.7754 175.5399 165 P 4.4460 0.0000 0.0000 65.5828 31.6272 175.8350 166 Y 5.0071 6.5366 115.0498 56.5341 40.9878 173.6404 167 G 4.2782 9.4822 107.4269 45.5583 0.0000 171.3244 168 R 5.2400 8.8368 120.5698 54.2486 32.1396 175.1920 169 L 4.5695 9.2889 127.8137 54.7720 42.6251 176.2447 170 E 4.8282 9.3597 121.5331 54.3843 33.2738 177.2491 171 T 3.9287 8.5615 116.5827 66.1211 68.5023 175.1518 172 N 4.7904 7.9089 116.0325 52.5439 38.0145 175.0124 173 T 4.1001 7.6089 116.9892 63.9467 69.2736 173.7438 174 K 4.1982 9.1156 128.5047 55.8821 33.4788 175.0461 175 L 4.9773 8.5712 130.0603 53.6467 43.4558 175.0800 176 L 4.8175 8.9423 127.2041 53.0331 44.1880 175.5263 177 I 5.1030 8.4673 124.1097 59.4415 39.5538 174.8519 178 Q 4.5660 8.2571 124.3334 53.2374 31.3667 174.0712 179 P 2.9700 0.0000 0.0000 62.2402 31.1910 176.4474 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 13 G 8.34 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 14 G 7.10 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 0.00 0.00 0.00 15 A 6.59 4.68 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 16 V 8.45 4.61 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 0.86 0.00 0.00 1.12 0.00 0.00 17 V 8.93 4.76 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 0.57 0.00 0.00 0.89 0.00 0.00 18 T 8.40 4.93 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 19 V 8.50 4.31 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 0.96 0.00 0.00 0.98 0.00 0.00 20 A 9.16 4.92 1.28 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 0.00 0.00 0.00 21 F 8.80 5.55 0.00 2.92 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.91 4.78 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 1.29 0.00 0.00 23 N 8.53 5.07 0.00 2.81 2.90 0.00 0.00 5.87 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 24 A 7.73 4.02 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 R 8.15 4.50 0.00 1.57 1.50 0.00 2.60 0.00 0.00 2.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.27 0.00 26 D 7.48 4.46 0.00 2.11 2.45 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 27 C 8.24 4.49 0.00 2.85 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 28 F 7.62 5.05 0.00 3.03 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 29 L 8.95 4.73 0.00 2.14 1.76 1.04 1.02 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 30 H 9.77 5.49 0.00 3.36 3.54 0.00 5.82 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 9.00 4.83 0.00 1.53 1.38 0.69 1.06 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 32 P 0.00 4.48 0.00 1.85 1.54 0.00 3.21 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.44 0.00 33 R 8.69 3.93 0.00 2.03 2.59 0.00 2.99 0.00 0.00 3.30 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 34 R 7.90 3.78 0.00 1.83 1.87 0.00 3.13 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 35 L 7.64 3.84 0.00 1.69 1.47 0.74 0.48 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 36 V 7.52 3.09 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 0.82 0.00 0.00 0.75 0.00 0.00 37 A 8.05 3.80 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 38 Q 8.25 3.69 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.89 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 39 L 7.92 4.03 0.00 1.44 1.47 0.64 0.80 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 40 H 7.77 4.05 0.00 3.22 3.31 0.00 5.66 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 7.42 4.15 0.00 0.95 1.05 -0.67 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.89 4.74 0.00 1.79 1.64 0.95 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 43 Q 8.68 4.12 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 44 N 8.61 4.07 0.00 2.90 2.85 0.00 0.00 7.06 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 45 Q 8.18 4.23 0.00 2.22 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 46 A 8.52 4.69 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 47 I 8.58 4.68 1.93 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.81 0.82 0.00 0.00 48 E 9.40 4.32 0.00 2.04 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 1.96 1.73 0.00 49 V 8.42 4.53 1.95 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 0.86 0.00 0.00 0.90 0.00 0.00 50 A 8.93 4.72 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 51 S 7.87 4.38 0.00 3.80 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 52 D 8.75 4.38 0.00 2.73 2.79 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 53 H 7.20 4.85 0.00 3.22 3.34 0.00 5.76 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 54 Q 8.49 4.06 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.05 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 55 P 0.00 4.59 0.00 1.57 1.98 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.96 0.00 56 T 7.76 3.79 4.08 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 1.16 0.00 0.00 57 Y 7.53 4.96 0.00 2.90 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 58 L 9.00 5.06 0.00 1.68 1.71 1.03 0.70 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 59 S 8.76 5.29 0.00 4.17 4.09 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 60 W 7.93 5.77 0.00 3.51 3.01 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.79 4.19 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.81 0.00 0.00 62 E 8.92 4.84 0.00 2.26 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.56 0.00 63 G 9.31 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 7.67 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 92 V 8.75 4.58 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 0.75 0.00 0.00 0.93 0.00 0.00 93 F 8.97 5.17 0.00 2.95 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 94 L 8.38 4.58 0.00 1.29 1.36 0.79 0.36 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 95 R 8.77 4.31 0.00 1.78 1.75 0.00 3.43 0.00 0.00 3.26 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.81 0.00 96 P 0.00 4.67 0.00 1.92 1.88 0.00 3.71 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.93 0.00 97 C 8.66 4.51 0.00 2.96 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 98 S 9.05 4.21 0.00 3.86 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 99 H 7.84 5.13 0.00 3.14 3.16 0.00 5.69 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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5.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.95 0.00 0.00 109 E 8.92 5.04 0.00 1.95 1.89 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 2.14 2.24 0.00 110 P 0.00 4.76 0.00 2.10 2.27 0.00 3.60 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.35 0.00 111 L 8.96 4.29 0.00 1.78 1.99 0.88 0.65 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 0.00 112 S 8.21 4.70 0.00 3.98 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 A 8.63 4.15 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 0.00 114 D 8.09 4.31 0.00 2.71 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 0.00 115 D 8.08 4.38 0.00 3.01 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 0.00 116 W 8.37 4.48 0.00 3.36 3.30 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 1.27 0.87 0.91 0.00 0.00 125 S 8.68 3.84 0.00 3.78 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 0.00 126 L 7.85 4.08 0.00 1.78 1.74 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 127 E 8.20 3.97 0.00 2.10 1.95 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 2.40 2.43 0.00 128 Q 7.91 3.99 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 129 H 8.17 4.19 0.00 3.37 3.66 0.00 5.63 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.31 4.06 0.00 1.91 1.92 0.92 0.61 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 0.00 131 L 7.81 4.27 0.00 1.82 1.76 0.94 0.93 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 0.00 132 D 7.84 4.65 0.00 2.85 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 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3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 V 8.29 4.83 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 0.91 0.00 0.00 1.00 0.00 0.00 143 V 8.75 4.80 2.01 0.00 0.00 0.00 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 0.88 0.00 0.00 144 P 0.00 4.35 0.00 1.07 0.49 0.00 3.56 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 1.59 1.59 0.00 145 I 8.38 4.48 1.81 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 1.14 0.97 0.92 0.00 0.00 146 W 8.97 4.49 0.00 3.26 3.34 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 0.00 147 V 8.68 3.89 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 0.65 0.00 0.00 0.89 0.00 0.00 148 D 7.62 4.52 0.00 2.88 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 0.00 149 Q 8.97 4.22 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.95 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 150 Q 7.80 4.60 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.61 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 151 T 8.85 4.71 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 152 Y 7.43 5.10 0.00 2.00 1.43 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 0.00 153 I 8.41 4.70 1.86 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 1.15 1.21 0.79 0.00 0.00 154 F 9.52 5.06 0.00 3.24 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 0.00 155 I 8.91 5.11 1.90 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 1.25 0.89 0.95 0.00 0.00 156 Q 8.97 5.13 0.00 2.09 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.04 0.00 0.00 0.00 0.00 0.00 2.22 2.40 0.00 157 I 8.71 4.19 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.66 0.88 0.00 0.00 158 V 8.91 3.90 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 0.74 0.00 0.00 0.95 0.00 0.00 159 T 7.67 4.85 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 0.00 160 L 8.55 5.06 0.00 1.49 1.54 1.03 0.84 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 0.00 161 M 8.89 4.82 0.00 2.03 1.86 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 162 P 0.00 4.57 0.00 2.19 2.03 0.00 3.92 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 163 A 8.35 4.11 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 0.00 164 A 7.97 4.38 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 0.00 165 P 0.00 4.45 0.00 2.10 2.14 0.00 3.44 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 1.08 1.67 0.00 166 Y 6.54 5.01 0.00 3.14 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 G 9.48 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 0.00 0.00 0.00 0.00 168 R 8.84 5.24 0.00 1.96 1.83 0.00 3.10 0.00 0.00 3.37 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 169 L 9.29 4.57 0.00 1.58 1.61 1.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 170 E 9.36 4.83 0.00 2.02 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 2.39 2.39 0.00 171 T 8.56 3.93 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 0.00 172 N 7.91 4.79 0.00 2.82 2.91 0.00 0.00 6.06 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 0.00 173 T 7.61 4.10 4.49 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 1.26 0.00 0.00 174 K 9.12 4.20 0.00 1.83 1.69 0.00 1.61 0.00 0.00 1.83 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.39 7.81 175 L 8.57 4.98 0.00 1.68 1.58 0.94 1.03 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 0.00 176 L 8.94 4.82 0.00 1.60 1.54 0.97 0.54 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 0.00 177 I 8.47 5.10 1.99 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 1.47 0.66 1.09 0.00 0.00 178 Q 8.26 4.57 0.00 1.89 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.97 0.00 0.00 0.00 0.00 0.00 2.29 2.13 0.00 179 P 0.00 2.97 0.00 1.54 0.85 0.00 3.39 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.33 0.00 * Residues marked with a * may have inaccurate shift predictions.