NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.8284 8.3544 109.7197 44.9381 0.0000 173.8954 4 D 4.2261 8.3236 121.3187 52.8290 42.4716 175.7860 5 K 3.9665 9.4604 128.7805 59.5728 32.8550 178.5754 6 K 4.1830 8.2268 118.2695 58.8332 32.0157 179.4716 7 V 3.6191 7.5834 117.6861 66.1683 31.4664 177.8781 8 I 3.7521 7.7160 119.5508 64.6029 36.9165 178.3072 9 Q 3.9344 7.8452 118.5429 59.3125 28.5171 178.4286 10 H 4.1056 7.9639 116.8171 59.0076 28.7606 177.7071 11 L 3.9953 8.3452 120.8431 58.1292 41.5559 179.5393 12 N 4.3903 8.4078 116.0342 55.6190 38.0962 177.5264 13 K 3.8968 7.7558 120.7881 59.4621 32.7052 178.2297 14 I 3.8129 7.9121 120.3649 64.6420 37.1305 177.6512 15 L 3.9934 8.6156 121.2051 58.5727 41.2803 179.3569 16 G 3.6706 8.1163 105.1623 47.9854 0.0000 175.3952 17 N 4.4021 8.2737 118.7586 56.1395 38.5238 177.4473 18 E 3.9339 8.0848 119.5877 59.3177 29.5099 179.1544 19 L 4.0656 7.9729 119.0466 57.5514 41.5811 179.8003 20 I 3.7067 7.3111 118.7108 64.2832 37.2024 177.9758 21 A 3.2589 7.8803 121.6705 55.0229 18.1019 179.4864 22 I 3.5452 7.8735 118.4384 64.8055 37.2437 178.4609 23 N 4.3280 7.6386 115.5314 56.1644 38.4241 177.1871 24 Q 3.8677 8.3818 121.2389 59.6501 29.1627 178.1549 25 Y 4.7751 8.2882 119.2189 60.5488 37.8033 178.4968 26 F 3.8953 8.3671 121.4735 61.1424 39.5894 176.9485 27 L 4.0075 8.1511 119.9595 58.4446 41.8173 178.3094 28 H 3.7753 8.1855 116.1300 58.9999 28.7032 177.1525 29 S 4.3261 8.5418 114.8871 62.0448 62.3070 176.7403 30 R 3.9675 8.1150 119.7890 58.5941 29.7636 179.0961 31 M 3.4852 7.5511 119.2261 57.7910 31.9509 178.4555 32 W 4.3984 7.7391 119.2622 59.8637 29.1656 178.1450 33 N 4.3316 8.2357 116.2288 56.6554 37.8648 176.8552 34 D 4.3250 7.5802 117.2056 57.0522 41.2638 177.7001 35 W 4.8759 7.7451 117.0716 57.0396 29.0925 177.2055 36 G 3.9915 8.5582 108.3019 45.7461 0.0000 174.2079 37 L 4.8331 7.9687 121.9633 53.4902 40.3125 177.6687 38 K 4.1432 8.2995 121.0808 58.7829 32.5050 179.1075 39 R 3.9505 7.8926 119.4556 59.1618 30.0289 178.4038 40 L 3.9163 7.7440 118.4977 57.1307 41.5394 179.5852 41 G 3.7121 7.8896 105.3636 47.8135 0.0000 175.7369 42 A 4.0391 8.0538 123.8448 54.9487 18.4285 179.1775 43 H 3.9477 8.2018 116.8212 59.4704 29.6949 177.1781 44 E 4.0941 8.5014 120.8067 59.0903 29.4698 178.0538 45 Y 4.0338 7.9622 119.8025 60.6756 38.7394 177.2501 46 H 3.9684 8.3020 117.2894 58.7134 28.7221 177.2899 47 E 3.8022 8.1335 120.4277 59.5987 29.2203 179.6519 48 S 4.2997 7.8108 112.9199 61.5229 62.5655 176.0244 49 I 3.5680 7.4638 122.4821 64.7308 36.9239 178.1820 50 D 4.3149 8.2798 119.4541 57.1561 40.5399 178.5578 51 E 4.2116 7.9168 119.2750 59.1883 29.3839 178.9613 52 M 4.0688 7.9359 119.0712 58.0184 31.9013 178.9657 53 K 3.9740 8.0901 118.6393 59.7249 32.4326 178.8215 54 H 4.1058 7.8330 116.1716 59.2159 28.6189 177.2254 55 A 4.0023 8.0145 122.1370 55.2622 18.1911 179.1493 56 D 4.2491 7.8800 116.5605 57.4830 41.3041 178.6724 57 K 4.0084 8.0172 119.0150 59.4600 32.0432 179.4183 58 L 4.0560 7.9752 119.3038 57.7643 41.5979 179.3669 59 I 3.8435 8.0202 119.9495 64.4725 36.9700 178.3704 60 E 4.0195 8.1147 119.3363 59.2167 29.3640 179.1562 61 R 4.0159 8.0174 118.7636 59.4781 30.2151 178.5671 62 I 3.7091 8.2648 119.8591 64.5812 37.2699 178.3253 63 L 4.0176 7.9723 119.6987 57.9131 41.1897 179.5031 64 F 4.3438 8.1877 119.6926 60.9469 39.4900 176.9396 65 L 3.7767 8.3016 115.0321 55.0019 41.1833 177.2835 66 E 3.6906 7.6890 118.6549 56.3566 28.7684 174.2066 67 G 3.9423 7.6438 106.6083 44.5671 0.0000 172.8609 68 L 4.6455 8.0107 118.7736 51.9645 43.2074 175.2419 69 P 4.4150 0.0000 0.0000 62.4969 31.8360 175.9977 70 N 4.7370 9.0016 121.6415 52.1920 38.5684 173.9210 71 L 4.4892 8.1690 122.7879 54.4117 42.4147 177.6434 72 Q 4.0694 8.0485 120.8619 58.0274 29.3164 175.6490 73 D 4.5768 8.1437 117.9645 52.9563 41.4133 175.2011 74 L 4.5966 8.3089 126.4314 52.7513 44.0068 177.1779 75 G 3.8380 8.3641 117.3060 45.1155 0.0000 171.1510 76 K 4.2247 8.4040 121.6226 55.3021 32.9484 177.5990 77 L 4.1832 8.4057 126.6767 54.8054 42.2817 177.6679 78 L 4.4124 8.5479 124.6606 53.2450 40.3511 174.2386 79 I 4.1857 7.7058 120.4451 59.3131 37.3569 176.2567 80 G 3.9339 8.6613 114.8461 45.4823 0.0000 171.8736 81 E 4.7239 8.5640 116.4109 55.9993 31.1288 176.0008 82 N 5.0680 7.7531 115.8920 50.4828 41.6533 174.9794 83 T 4.4595 8.8469 117.1492 67.3160 68.6203 176.2501 84 Q 3.9560 8.1712 120.4013 59.2684 29.0652 177.9122 85 E 3.9841 8.3488 119.2296 59.7826 29.5348 179.1872 86 M 3.9658 8.3095 118.7672 58.5144 31.9112 178.8170 87 L 4.1351 8.1400 118.9712 57.9432 41.7072 179.4745 88 Q 3.9653 8.0313 119.2175 59.3012 29.0361 177.8171 89 C 4.1606 8.9374 118.7932 63.0766 28.0999 175.9797 90 D 4.6170 8.3231 120.3870 57.2551 40.4599 178.3888 91 L 3.9533 8.2879 121.2200 58.3880 42.0162 178.8237 92 N 4.3642 8.5223 116.6114 56.3807 38.4942 177.2205 93 L 4.0937 7.9461 121.1763 57.9631 42.0777 178.8387 94 E 4.1041 8.7014 119.2376 59.3274 29.5468 179.2132 95 L 4.0367 8.1535 119.0605 57.4603 41.6057 179.4518 96 K 4.0191 8.0549 119.3385 59.1448 32.1356 178.7893 97 A 4.0162 8.2351 121.2653 55.4726 18.4410 179.7251 98 T 3.8428 8.3184 114.6621 66.4776 68.3525 176.8174 99 K 3.9225 7.9537 121.0014 59.8249 32.2228 178.6325 100 D 4.4061 8.0643 118.9987 57.2228 40.6394 178.7159 101 L 4.0330 7.8438 120.9672 58.0102 42.2823 179.0817 102 R 3.9852 7.9422 117.7409 59.1189 29.9275 178.9875 103 E 3.9595 8.0412 118.4474 59.3721 29.5546 179.2089 104 A 3.6332 7.7744 120.6889 54.8993 18.3386 179.7772 105 I 3.6467 7.7862 118.6197 64.4048 37.1602 178.4326 106 V 3.5056 7.6096 118.6644 66.3676 31.2834 177.2037 107 H 3.9595 8.1289 117.5909 59.7458 29.5944 176.6249 108 C 3.9019 8.0642 118.1289 62.9633 27.7837 175.8375 109 E 3.7289 8.0804 120.5868 59.2000 28.9746 178.7001 110 Q 3.9127 7.5563 118.2812 59.0614 29.3159 177.8541 111 V 3.7952 7.3906 109.6915 60.9635 31.9132 175.7630 112 H 3.1799 7.3134 114.8524 57.2382 26.1033 175.9901 113 D 4.6219 7.5612 120.7731 53.5218 39.8388 174.8644 114 Y 4.3278 7.9926 122.1904 59.2309 38.5142 177.2627 115 V 3.6544 7.7979 119.4541 66.1768 31.9365 177.8977 116 S 4.1922 8.3410 114.9035 61.6363 62.6089 176.8581 117 R 3.9169 7.7236 121.5665 59.4363 29.8846 178.0974 118 D 4.3721 8.1227 117.5629 56.9096 41.0772 177.8060 119 L 3.9030 7.9338 121.0648 58.3906 42.0722 179.1283 120 L 3.9638 7.7982 118.2550 57.5986 41.4981 179.5215 121 K 3.9732 8.2254 119.7435 59.2456 32.1335 178.8338 122 D 4.2725 7.9969 119.3035 57.5787 40.8926 178.4569 123 I 3.4985 7.9105 120.5023 64.5063 36.9425 178.2577 124 L 3.9426 8.1600 121.2312 58.1501 42.1410 178.5847 125 E 3.9228 8.2169 119.2542 59.2641 29.5879 178.7190 126 S 4.2352 8.0255 113.2437 61.1563 62.5080 175.9408 127 E 4.1726 8.2548 121.4863 59.3338 29.0897 179.1116 128 E 4.1044 8.6766 119.1523 59.2328 29.4777 179.0912 129 E 4.0136 8.2171 118.5765 59.6457 29.4823 178.8586 130 H 4.4290 8.2042 118.0370 59.2694 29.8957 177.4796 131 I 3.7404 8.0122 121.8204 64.1572 36.9120 177.6525 132 D 4.3378 8.3921 119.2082 57.6008 41.0560 177.5479 133 Y 4.1802 8.1810 119.7582 61.0318 38.7939 178.3018 134 L 3.6615 7.9758 119.5160 57.6707 41.6243 179.4968 135 E 3.8906 8.5183 118.8607 59.7569 29.3551 179.3797 136 T 3.8128 7.7653 115.7229 66.8459 68.4717 176.6820 137 Q 3.8433 7.8299 119.7395 58.8268 28.7899 178.5710 138 L 3.8999 7.8008 120.1537 57.7473 41.7141 179.9266 139 G 3.6463 8.2534 106.0141 47.5910 0.0000 175.9228 140 L 4.0420 8.0536 121.6486 57.5174 41.6545 179.2632 141 I 3.5310 7.4518 119.8300 64.8130 36.8023 178.4379 142 Q 4.0047 7.3431 115.9679 58.5566 28.5960 178.2841 143 K 4.2544 7.7251 117.6876 57.5929 32.4676 177.9201 144 V 4.2653 8.0856 109.8456 59.9943 34.0343 176.4774 145 G 4.0668 8.1741 107.4297 44.7760 0.0000 174.4479 146 L 3.9549 8.6912 122.3294 58.0920 41.9854 179.5252 147 E 3.9762 8.0730 117.7969 59.3822 29.6667 178.3342 148 N 4.3672 8.2573 116.1125 56.7994 38.3986 176.2627 149 Y 4.0475 7.8240 118.8892 61.0246 39.1308 178.1338 150 L 4.1308 8.3013 119.8606 57.5221 41.7697 179.0962 151 Q 3.8873 8.7922 120.4916 59.4562 28.8732 178.6438 152 S 4.2749 8.2260 113.6861 60.3700 63.0466 174.5798 153 H 4.6342 7.5680 118.3040 55.6319 29.5048 175.8586 154 M 4.2192 8.0556 121.4852 57.5618 31.9513 176.2247 155 H 5.1064 7.6488 113.2446 53.8890 31.4166 174.3575 156 E 4.1546 8.6061 120.1518 56.7752 29.4334 176.7197 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 G 8.35 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 0.00 0.00 0.00 4 D 8.32 4.23 0.00 2.86 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 9.46 3.97 0.00 1.84 1.77 0.00 1.75 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.51 7.81 6 K 8.23 4.18 0.00 1.86 1.61 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.46 7.81 7 V 7.58 3.62 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 1.10 0.00 0.00 1.05 0.00 0.00 8 I 7.72 3.75 2.01 0.00 0.00 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 1.52 0.63 0.90 0.00 0.00 9 Q 7.85 3.93 0.00 2.22 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 10 H 7.96 4.11 0.00 3.38 3.33 0.00 5.63 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 11 L 8.35 4.00 0.00 1.80 1.74 0.95 0.68 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 12 N 8.41 4.39 0.00 2.95 2.86 0.00 0.00 6.73 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 13 K 7.76 3.90 0.00 1.82 1.98 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.32 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.47 7.81 14 I 7.91 3.81 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 1.69 0.72 0.92 0.00 0.00 15 L 8.62 3.99 0.00 1.78 1.81 0.92 1.28 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 16 G 8.12 3.67 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 0.00 0.00 0.00 17 N 8.27 4.40 0.00 2.92 2.87 0.00 0.00 7.02 7.20 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 18 E 8.08 3.93 0.00 1.97 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 2.58 2.37 0.00 19 L 7.97 4.07 0.00 1.81 1.67 0.90 0.72 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 20 I 7.31 3.71 1.94 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 1.41 0.68 0.91 0.00 0.00 21 A 7.88 3.26 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 22 I 7.87 3.55 1.93 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.03 0.85 0.00 0.00 23 N 7.64 4.33 0.00 2.79 2.82 0.00 0.00 6.73 7.45 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 24 Q 8.38 3.87 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.60 2.29 0.00 25 Y 8.29 4.78 0.00 3.05 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 26 F 8.37 3.90 0.00 3.38 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 27 L 8.15 4.01 0.00 1.86 1.86 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.19 3.78 0.00 3.49 3.01 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 29 S 8.54 4.33 0.00 3.94 3.87 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 30 R 8.11 3.97 0.00 1.88 1.90 0.00 3.00 0.00 0.00 2.78 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 31 M 7.55 3.49 0.00 0.80 1.54 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.18 0.00 32 W 7.74 4.40 0.00 3.60 3.32 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 33 N 8.24 4.33 0.00 2.73 2.85 0.00 0.00 6.68 7.36 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 34 D 7.58 4.32 0.00 2.63 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 W 7.75 4.88 0.00 3.74 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 36 G 8.56 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 37 L 7.97 4.83 0.00 2.20 1.64 1.28 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.30 4.14 0.00 1.95 1.86 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.48 7.81 39 R 7.89 3.95 0.00 2.02 1.98 0.00 3.18 0.00 0.00 3.05 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 40 L 7.74 3.92 0.00 1.18 0.16 0.29 0.16 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 41 G 7.89 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 8.05 4.04 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 43 H 8.20 3.95 0.00 3.24 3.26 0.00 5.79 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 44 E 8.50 4.09 0.00 2.62 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.74 0.00 45 Y 7.96 4.03 0.00 3.04 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 46 H 8.30 3.97 0.00 3.35 3.24 0.00 5.89 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 47 E 8.13 3.80 0.00 2.05 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 2.28 2.29 0.00 48 S 7.81 4.30 0.00 4.05 4.07 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 0.00 0.00 0.00 0.00 49 I 7.46 3.57 1.76 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 0.90 0.09 0.82 0.00 0.00 50 D 8.28 4.31 0.00 2.86 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 51 E 7.92 4.21 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.58 0.00 52 M 7.94 4.07 0.00 2.03 2.21 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 53 K 8.09 3.97 0.00 1.88 1.82 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.55 7.81 54 H 7.83 4.11 0.00 3.46 3.38 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.01 4.00 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 56 D 7.88 4.25 0.00 2.75 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.02 4.01 0.00 2.04 1.86 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.65 7.81 58 L 7.98 4.06 0.00 1.73 1.72 0.96 0.94 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 59 I 8.02 3.84 2.03 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 1.52 1.04 0.92 0.00 0.00 60 E 8.11 4.02 0.00 2.22 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 2.42 0.00 61 R 8.02 4.02 0.00 1.98 2.11 0.00 3.37 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 62 I 8.26 3.71 1.98 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 1.54 0.86 0.94 0.00 0.00 63 L 7.97 4.02 0.00 2.08 1.79 0.93 1.00 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 64 F 8.19 4.34 0.00 2.99 3.31 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 65 L 8.30 3.78 0.00 1.81 1.64 0.97 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.69 3.69 0.00 1.99 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 2.14 2.24 0.00 67 G 7.64 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.01 4.65 0.00 1.61 1.58 0.91 0.99 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 69 P 0.00 4.41 0.00 2.04 1.98 0.00 3.63 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 2.03 2.08 0.00 70 N 9.00 4.74 0.00 2.62 2.87 0.00 0.00 7.12 8.26 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 71 L 8.17 4.49 0.00 1.63 1.65 0.91 0.95 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 72 Q 8.05 4.07 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 73 D 8.14 4.58 0.00 2.69 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.31 4.60 0.00 1.51 1.51 0.88 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.36 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 76 K 8.40 4.22 0.00 1.70 1.72 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.51 7.81 77 L 8.41 4.18 0.00 1.64 1.56 0.88 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.55 4.41 0.00 1.85 1.66 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 79 I 7.71 4.19 1.89 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 1.34 0.78 0.92 0.00 0.00 80 G 8.66 3.93 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 0.00 0.00 0.00 81 E 8.56 4.72 0.00 1.97 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 2.24 2.49 0.00 82 N 7.75 5.07 0.00 2.91 2.79 0.00 0.00 6.21 7.22 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 83 T 8.85 4.46 4.48 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 1.48 0.00 0.00 84 Q 8.17 3.96 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.89 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 85 E 8.35 3.98 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 86 M 8.31 3.97 0.00 1.41 2.22 0.00 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.05 0.00 87 L 8.14 4.14 0.00 1.74 1.71 0.81 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 8.03 3.97 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 89 C 8.94 4.16 0.00 3.29 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 90 D 8.32 4.62 0.00 2.90 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 91 L 8.29 3.95 0.00 1.80 1.86 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.52 4.36 0.00 2.96 2.88 0.00 0.00 6.72 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 93 L 7.95 4.09 0.00 1.83 1.92 0.93 1.16 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 94 E 8.70 4.10 0.00 2.20 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 2.67 2.50 0.00 95 L 8.15 4.04 0.00 1.86 1.74 0.97 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.05 4.02 0.00 1.87 1.96 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.51 7.81 97 A 8.24 4.02 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 8.32 3.84 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 1.23 0.00 0.00 99 K 7.95 3.92 0.00 1.87 1.96 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.49 7.81 100 D 8.06 4.41 0.00 2.98 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 0.00 101 L 7.84 4.03 0.00 2.12 1.73 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.94 3.99 0.00 2.11 1.97 0.00 3.19 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 103 E 8.04 3.96 0.00 1.98 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 2.35 2.33 0.00 104 A 7.77 3.63 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 0.00 105 I 7.79 3.65 2.00 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 1.41 0.61 0.92 0.00 0.00 106 V 7.61 3.51 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 0.99 0.00 0.00 0.98 0.00 0.00 107 H 8.13 3.96 0.00 3.23 3.21 0.00 5.85 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 0.00 108 C 8.06 3.90 0.00 3.16 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 0.00 109 E 8.08 3.73 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 110 Q 7.56 3.91 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.69 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 111 V 7.39 3.80 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 0.71 0.00 0.00 0.94 0.00 0.00 112 H 7.31 3.18 0.00 3.20 3.43 0.00 5.65 0.00 0.00 0.00 0.00 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.56 4.62 0.00 2.62 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 Y 7.99 4.33 0.00 3.05 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 0.00 115 V 7.80 3.65 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 1.10 0.00 0.00 1.00 0.00 0.00 116 S 8.34 4.19 0.00 4.24 3.93 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 0.00 117 R 7.72 3.92 0.00 1.95 2.16 0.00 3.19 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 118 D 8.12 4.37 0.00 3.10 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 0.00 119 L 7.93 3.90 0.00 1.96 1.79 0.94 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 120 L 7.80 3.96 0.00 1.90 1.70 0.94 1.02 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 0.00 121 K 8.23 3.97 0.00 2.02 2.02 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 1.35 7.81 122 D 8.00 4.27 0.00 2.92 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 0.00 123 I 7.91 3.50 1.97 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 1.12 0.61 0.76 0.00 0.00 124 L 8.16 3.94 0.00 1.83 1.91 0.98 1.05 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 0.00 125 E 8.22 3.92 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.34 0.00 126 S 8.03 4.24 0.00 4.04 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 0.00 127 E 8.25 4.17 0.00 2.10 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.55 0.00 128 E 8.68 4.10 0.00 2.03 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 2.36 2.57 0.00 129 E 8.22 4.01 0.00 2.25 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 2.36 0.00 130 H 8.20 4.43 0.00 3.32 3.55 0.00 5.61 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.01 3.74 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.49 0.93 0.00 0.00 132 D 8.39 4.34 0.00 2.92 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Y 8.18 4.18 0.00 3.14 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 0.00 134 L 7.98 3.66 0.00 2.02 1.64 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.52 3.89 0.00 2.01 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 2.30 2.46 0.00 136 T 7.77 3.81 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 1.20 0.00 0.00 137 Q 7.83 3.84 0.00 1.73 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 1.50 1.77 0.00 138 L 7.80 3.90 0.00 1.91 1.63 0.82 0.86 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 0.00 139 G 8.25 3.65 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 0.00 0.00 0.00 140 L 8.05 4.04 0.00 1.85 1.90 1.04 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.45 3.53 1.79 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.09 0.84 0.00 0.00 142 Q 7.34 4.00 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.95 0.00 0.00 0.00 0.00 0.00 2.55 2.50 0.00 143 K 7.73 4.25 0.00 1.76 1.86 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.68 7.81 144 V 8.09 4.27 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 0.72 0.00 0.00 1.09 0.00 0.00 145 G 8.17 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.69 3.95 0.00 1.76 1.69 0.95 0.94 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 0.00 147 E 8.07 3.98 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 148 N 8.26 4.37 0.00 2.91 2.93 0.00 0.00 6.69 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Y 7.82 4.05 0.00 2.99 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 0.00 150 L 8.30 4.13 0.00 1.90 1.76 0.98 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.79 3.89 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.84 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 152 S 8.23 4.27 0.00 3.77 3.67 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 0.00 153 H 7.57 4.63 0.00 3.04 3.03 0.00 5.81 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 M 8.06 4.22 0.00 1.92 1.98 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.45 0.00 155 H 7.65 5.11 0.00 3.08 3.14 0.00 5.71 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 E 8.61 4.15 0.00 1.94 1.83 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 2.27 2.28 0.00