NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 T 4.2110 8.1749 110.9391 62.6234 70.1393 172.1086 13 N 3.9611 8.7911 123.8046 52.8184 34.6348 172.2667 14 L 4.4157 8.5140 121.7238 54.6169 43.8339 176.6137 15 L 4.4824 8.3587 121.8905 54.1885 42.8735 176.2770 16 Y 4.2856 8.5120 122.6801 58.1543 39.5738 174.8681 17 T 3.9368 6.6472 117.2402 60.8235 70.1153 173.7495 18 R 3.8535 8.1773 126.5870 57.7553 30.3400 176.4726 19 N 4.2825 7.6938 118.1678 53.8523 39.1488 174.5750 20 D 4.7843 8.3457 128.2047 53.0497 40.1140 176.7761 21 V 3.9122 7.3911 119.3294 62.8125 32.8370 176.0262 22 S 4.1869 8.5973 121.1575 59.2158 64.2716 175.4490 23 D 4.5527 8.7783 123.7699 57.5715 40.5712 178.8196 24 S 4.0714 8.0703 113.2620 61.7187 62.3272 175.9908 25 E 3.9824 8.4198 120.9686 59.1205 29.2437 179.3343 26 K 4.1022 8.5055 118.9592 59.6546 32.2121 179.2515 27 K 3.9059 8.3059 118.3176 59.4530 32.0190 179.3174 28 A 3.9566 8.0602 120.7543 55.4849 18.3789 179.8090 29 T 3.7758 8.6778 115.4059 66.8600 68.5454 176.9541 30 V 3.6378 8.2335 120.4740 66.0729 31.3765 177.7224 31 E 3.9211 8.0551 118.5864 58.9712 29.6036 178.5399 32 L 3.9225 7.9214 120.4160 58.0328 42.1460 178.8997 33 L 3.8959 8.3122 119.2153 58.0828 41.6372 179.3128 34 N 4.3708 8.2510 116.2059 56.2400 38.2215 177.5024 35 R 3.9030 7.8223 119.9576 59.4189 30.1860 178.6615 36 Q 4.0599 7.8564 117.4528 58.8263 28.6796 178.4646 37 V 3.5140 8.0288 119.7345 66.2630 31.4945 178.0301 38 I 3.7171 7.7218 119.2172 64.4289 36.8820 178.2111 39 Q 3.9497 7.8971 120.2560 59.2806 28.8890 178.3189 40 F 3.8557 9.0840 119.0798 60.5660 38.9864 177.6296 41 I 3.7254 8.2771 119.8742 64.5636 36.8551 178.0226 42 D 4.3148 8.1020 118.7286 57.2710 41.0303 178.0338 43 L 3.8185 8.1329 121.3203 57.8784 41.9876 179.1420 44 S 4.0724 8.2656 114.7072 61.2558 63.0410 176.4922 45 L 3.9088 7.9184 122.6409 57.6023 41.3861 179.5675 46 I 3.4805 7.8849 119.8656 64.4919 36.9715 178.5428 47 T 3.8035 7.8466 116.7030 66.6535 68.2017 176.8018 48 K 3.2996 7.5129 119.7701 58.7722 31.7284 179.3333 49 Q 4.0553 7.5098 118.2114 58.9869 28.8455 178.9480 50 A 3.8241 7.5528 121.3527 55.3026 18.2175 178.7465 51 H 3.9892 7.6549 115.3862 59.5935 29.8610 177.0438 52 W 4.6319 8.1252 119.2495 59.1787 28.8947 177.4425 53 N 5.0344 8.0607 115.0648 52.3614 38.5841 174.4373 54 M 4.8477 7.0526 116.8561 54.6328 33.2509 175.6544 55 R 4.3571 9.1355 118.2360 55.8370 34.7134 173.7891 56 G 3.9775 8.9493 104.7850 43.7087 0.0000 172.7394 57 A 3.9071 8.5402 121.3392 53.9663 18.5367 176.9452 58 N 4.1843 8.9818 118.4941 54.7220 37.5866 176.2561 59 F 4.2211 7.8829 118.5210 60.7714 39.3667 175.8964 60 I 2.9324 7.8156 117.1753 64.0118 37.7525 177.5867 61 A 3.7927 7.7194 120.7836 55.1092 18.1856 179.6517 62 V 3.2832 7.2776 116.7701 66.0525 31.0795 177.5050 63 H 3.8100 8.2699 118.3577 59.4273 29.5739 177.0913 64 E 3.8005 8.0687 120.2921 59.3311 29.2775 178.7074 65 M 3.5813 7.9671 118.6626 58.6968 32.1670 178.2435 66 L 3.2055 7.4541 118.8355 57.5644 41.6228 178.9905 67 D 4.1228 7.4064 116.9187 57.0824 41.1585 178.5575 68 G 3.5269 7.5992 106.1423 47.7725 0.0000 175.5708 69 F 3.8368 7.5289 120.3296 60.1312 38.8313 177.5158 70 R 3.8885 7.9729 118.2156 59.8573 29.8352 178.5301 71 T 3.8518 7.7160 114.7200 66.6848 68.5166 176.4259 72 A 4.0877 7.9718 122.0124 55.1423 18.3962 179.3962 73 L 4.2200 8.7758 117.8834 58.4002 41.7490 179.9466 74 I 3.7733 8.0396 119.4503 64.5377 37.0495 178.3053 75 D 4.3762 8.1485 119.6277 57.5763 40.5475 178.5722 76 H 4.1310 8.2960 116.6798 58.6862 28.6766 177.2758 77 L 3.7274 8.1650 122.2999 58.6129 41.8016 178.8963 78 D 4.3307 8.5168 118.8305 57.5682 40.6872 179.0208 79 T 3.8252 7.8604 116.2846 66.8786 68.4803 176.6336 80 M 3.9554 8.2465 120.6432 58.1657 31.9675 178.5772 81 A 3.9614 8.1414 121.1228 55.3949 18.5193 179.5695 82 E 3.9217 8.4056 117.2408 59.4251 29.5599 179.6306 83 R 3.9658 7.9724 118.6321 59.1992 30.1630 178.3176 84 A 3.9393 7.9892 120.5599 55.3905 18.4535 179.8359 85 V 3.7389 7.8236 116.5657 66.2602 31.3045 178.2200 86 Q 4.0496 8.0190 117.2677 58.4703 28.5502 177.6858 87 L 4.4173 7.4800 117.1898 54.5036 41.9628 177.6914 88 G 3.8783 8.2757 108.5307 45.1830 0.0000 174.4778 89 G 4.1110 7.5355 108.6672 44.1320 0.0000 172.7718 90 V 4.2167 8.0173 118.4621 60.5144 33.4303 175.7335 91 A 4.2428 8.6507 130.8666 52.0179 18.8346 176.1377 92 L 4.6649 9.5425 124.0611 53.2402 42.9180 176.8923 93 G 4.2108 8.4611 110.7510 44.6039 0.0000 172.6651 94 T 4.1840 7.7789 110.6254 61.0535 71.0625 174.9096 95 T 3.8379 8.5478 117.2200 65.5445 67.3212 176.1597 96 Q 3.9921 8.0632 118.8706 59.4684 28.6055 178.7361 97 V 3.6026 7.4353 119.0425 65.4394 31.5549 178.0138 98 I 3.6882 7.9484 119.6204 64.5204 36.8105 177.8047 99 N 4.3160 8.4017 116.9919 56.8095 38.8216 176.5602 100 S 4.4072 8.1063 114.3016 59.8740 63.4931 174.9576 101 K 4.4937 7.7299 118.8738 55.9058 32.8173 176.0161 102 T 4.0376 7.9641 115.2220 61.5442 67.6134 172.2473 103 P 4.6421 0.0000 0.0000 62.7109 31.9492 175.1779 104 L 4.5213 7.5794 120.1139 52.9156 42.7569 176.4524 105 K 3.9652 8.6607 125.0646 56.1086 32.6805 176.0732 106 S 4.0519 8.7550 119.6512 59.0412 62.7653 173.0353 107 Y 4.2064 8.6435 128.3144 55.9213 39.4227 172.7011 108 P 4.2294 0.0000 0.0000 63.4059 31.5574 175.8177 109 L 4.7416 8.5490 122.1293 54.5163 41.7085 176.3922 110 D 4.8154 7.8878 115.0975 52.5417 40.5051 175.3179 111 I 4.3139 7.4079 112.9862 60.5291 39.5238 174.8199 112 H 5.1650 8.3249 113.7206 55.3983 33.3353 173.8277 113 N 4.6705 8.2570 116.7311 53.8974 40.1841 175.1469 114 V 3.6688 8.3457 127.0068 66.6063 31.7395 178.4387 115 Q 4.0563 8.1635 116.9964 59.0376 28.4975 178.6295 116 D 4.3405 8.0326 119.3125 57.7970 41.0180 178.3587 117 H 4.4920 8.0962 117.9196 58.3087 28.6315 177.7729 118 L 4.0257 8.4056 121.2054 57.8827 41.5513 179.8756 119 K 4.0297 8.2074 118.2190 59.5478 31.9451 179.3351 120 E 4.0326 8.4023 118.9138 59.3307 29.3521 179.5326 121 L 4.2087 8.7679 119.2085 57.8029 41.6749 179.0472 122 A 4.0775 8.3917 121.1563 55.4960 18.2403 179.4095 123 D 4.3494 8.1227 116.8075 57.7724 40.9736 179.3435 124 R 4.0050 7.9671 118.1529 59.5295 29.9843 178.8171 125 Y 3.7584 8.9207 116.7432 60.7738 37.8557 178.3149 126 A 4.0891 8.5135 122.1075 55.2352 18.5293 179.6024 127 I 3.5984 7.7575 118.1788 64.6767 37.1622 178.8897 128 V 3.5132 7.7009 118.6280 65.7325 31.3021 177.7290 129 A 3.9097 8.7105 121.6379 55.4584 18.1604 179.3936 130 N 4.2781 8.6817 115.1288 56.3356 38.5798 177.2249 131 D 4.3406 8.2185 119.6143 57.4526 41.1209 178.7201 132 V 3.8269 8.1295 119.9382 64.8643 31.0287 178.2022 133 R 3.9547 7.7929 118.6932 59.1284 30.0380 178.3058 134 K 4.1266 7.8606 118.3742 59.0201 31.9011 179.0486 135 A 4.0443 7.9041 120.3370 54.8750 18.5131 179.4307 136 I 3.8679 7.4277 117.5396 64.7267 37.0534 178.8601 137 G 3.6353 7.9357 106.3017 47.9785 0.0000 174.0844 138 E 3.9937 7.7144 119.0816 57.3729 29.9322 176.1579 139 A 4.3032 7.4291 121.9337 51.7786 19.1149 177.4582 140 K 4.0151 8.7396 123.3863 59.4400 32.6704 177.9899 141 D 4.3616 7.9480 119.4220 54.0239 41.8421 175.6970 142 D 4.3659 8.8233 127.5652 57.9237 40.9263 178.4906 143 D 4.3587 8.1253 118.3591 58.0155 40.8092 179.1649 144 T 3.8248 7.9132 115.6923 66.4368 68.3002 176.6311 145 A 3.9496 8.1391 122.9720 54.9827 18.3551 179.1539 146 D 4.2024 8.2488 116.5934 57.5786 41.3604 178.3281 147 I 3.6661 7.7893 120.2926 64.6971 37.1693 178.4877 148 L 3.9763 8.0534 119.5109 57.8540 41.3709 179.7932 149 T 3.8008 8.1034 115.9196 66.4977 68.2637 176.5419 150 A 3.9691 8.1249 122.4938 55.0986 18.3615 179.6089 151 A 3.3080 7.9249 119.2790 54.9814 18.3535 179.6983 152 S 3.9320 8.4265 112.0022 61.5417 62.3359 176.0297 153 R 3.7617 8.2618 121.6900 59.8249 29.6499 178.1108 154 D 3.7752 7.5198 118.1725 57.1370 40.8061 178.6806 155 L 3.6576 7.5433 119.4501 57.8396 41.5718 179.4103 156 D 4.4198 8.1834 119.0641 57.0651 40.6094 178.7691 157 K 4.0862 7.4477 120.3206 59.4997 32.1907 179.0087 158 F 3.8995 7.8987 118.5505 60.1620 38.6616 177.2543 159 L 3.9637 8.4607 120.4428 58.0676 41.8081 178.7831 160 W 4.4369 8.3387 128.0934 60.7538 30.4028 177.9127 161 F 4.0155 8.2639 116.7038 60.4727 38.6206 177.5083 162 I 3.8463 8.4138 119.7857 64.5264 36.9132 178.1356 163 E 4.0141 8.6260 119.6844 59.7847 29.2112 179.5508 164 S 4.2691 8.2557 113.0737 60.3143 62.9045 175.1746 165 N 4.7105 7.7883 117.8693 52.0941 39.2114 174.8552 166 I 4.1855 7.2595 122.9428 60.5026 37.9503 175.8559 167 E 4.1450 9.5106 124.5192 56.7361 29.1700 176.7447 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 12 T 8.17 4.21 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 13 N 8.79 3.96 0.00 3.00 2.97 0.00 0.00 7.09 6.97 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 14 L 8.51 4.42 0.00 1.54 1.60 1.02 1.12 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 15 L 8.36 4.48 0.00 1.50 1.62 0.97 1.12 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 16 Y 8.51 4.29 0.00 3.01 2.91 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 17 T 6.65 3.94 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 1.03 0.00 0.00 18 R 8.18 3.85 0.00 1.77 1.95 0.00 3.28 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.61 0.00 19 N 7.69 4.28 0.00 2.62 2.64 0.00 0.00 7.10 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 20 D 8.35 4.78 0.00 2.81 2.71 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 21 V 7.39 3.91 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 0.78 0.00 0.00 0.94 0.00 0.00 22 S 8.60 4.19 0.00 4.08 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 23 D 8.78 4.55 0.00 2.79 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 24 S 8.07 4.07 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 25 E 8.42 3.98 0.00 2.04 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 2.32 2.34 0.00 26 K 8.51 4.10 0.00 1.89 1.95 0.00 1.65 0.00 0.00 1.84 0.00 0.00 2.88 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.43 1.79 7.81 27 K 8.31 3.91 0.00 2.00 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.65 7.81 28 A 8.06 3.96 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 29 T 8.68 3.78 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 1.18 0.00 0.00 30 V 8.23 3.64 2.23 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 0.98 0.00 0.00 1.05 0.00 0.00 31 E 8.06 3.92 0.00 2.21 2.06 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 2.30 2.31 0.00 32 L 7.92 3.92 0.00 1.79 1.79 0.98 0.43 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 33 L 8.31 3.90 0.00 1.63 1.63 0.89 0.63 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 34 N 8.25 4.37 0.00 2.84 2.87 0.00 0.00 6.74 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 7.82 3.90 0.00 2.04 2.10 0.00 3.10 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 36 Q 7.86 4.06 0.00 2.14 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.52 0.00 0.00 0.00 0.00 0.00 2.54 2.42 0.00 37 V 8.03 3.51 2.21 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 1.12 0.00 0.00 0.91 0.00 0.00 38 I 7.72 3.72 2.04 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 1.42 0.82 0.93 0.00 0.00 39 Q 7.90 3.95 0.00 2.31 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 40 F 9.08 3.86 0.00 3.22 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 41 I 8.28 3.73 1.91 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 1.45 1.09 0.94 0.00 0.00 42 D 8.10 4.31 0.00 2.93 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 43 L 8.13 3.82 0.00 1.59 1.43 0.56 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.27 4.07 0.00 4.06 4.19 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 0.00 0.00 0.00 0.00 45 L 7.92 3.91 0.00 1.88 1.75 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.88 3.48 1.91 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 1.49 0.87 0.53 0.00 0.00 47 T 7.85 3.80 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 48 K 7.51 3.30 0.00 1.28 0.74 0.00 0.89 0.00 0.00 0.78 0.00 0.00 2.67 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.03 1.25 7.81 49 Q 7.51 4.06 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.61 0.00 50 A 7.55 3.82 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 51 H 7.65 3.99 0.00 2.89 3.07 0.00 5.96 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.13 4.63 0.00 3.49 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 53 N 8.06 5.03 0.00 2.84 2.99 0.00 0.00 6.72 7.60 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 54 M 7.05 4.85 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.92 0.00 55 R 9.14 4.36 0.00 1.82 1.70 0.00 3.01 0.00 0.00 3.07 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.49 0.00 56 G 8.95 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 57 A 8.54 3.91 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 N 8.98 4.18 0.00 2.95 2.83 0.00 0.00 6.83 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 59 F 7.88 4.22 0.00 3.15 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 60 I 7.82 2.93 1.91 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.19 0.88 0.00 0.00 61 A 7.72 3.79 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 62 V 7.28 3.28 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 0.93 0.00 0.00 0.83 0.00 0.00 63 H 8.27 3.81 0.00 2.21 2.81 0.00 5.83 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 64 E 8.07 3.80 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 2.24 2.39 0.00 65 M 7.97 3.58 0.00 1.74 1.79 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.28 0.00 66 L 7.45 3.21 0.00 1.58 1.43 0.78 0.70 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 67 D 7.41 4.12 0.00 2.39 2.61 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 68 G 7.60 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 F 7.53 3.84 0.00 3.03 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 70 R 7.97 3.89 0.00 1.74 2.02 0.00 3.22 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 71 T 7.72 3.85 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 1.24 0.00 0.00 72 A 7.97 4.09 1.71 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 73 L 8.78 4.22 0.00 2.10 1.85 1.01 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.04 3.77 2.15 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 1.56 0.76 0.94 0.00 0.00 75 D 8.15 4.38 0.00 2.80 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 H 8.30 4.13 0.00 3.50 3.25 0.00 5.64 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 77 L 8.16 3.73 0.00 1.95 1.94 1.04 1.55 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 78 D 8.52 4.33 0.00 2.81 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 7.86 3.83 4.37 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 1.18 0.00 0.00 80 M 8.25 3.96 0.00 1.89 2.04 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.37 0.00 81 A 8.14 3.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.41 3.92 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 2.31 2.50 0.00 83 R 7.97 3.97 0.00 1.98 2.04 0.00 3.12 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 84 A 7.99 3.94 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 85 V 7.82 3.74 2.18 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 1.01 0.00 0.00 0.92 0.00 0.00 86 Q 8.02 4.05 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 87 L 7.48 4.42 0.00 1.74 1.65 0.89 0.87 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 88 G 8.28 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 0.00 0.00 0.00 89 G 7.54 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 90 V 8.02 4.22 2.08 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 0.86 0.00 0.00 0.93 0.00 0.00 91 A 8.65 4.24 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 92 L 9.54 4.66 0.00 1.58 1.61 0.92 0.97 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 93 G 8.46 4.21 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 0.00 94 T 7.78 4.18 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 95 T 8.55 3.84 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 96 Q 8.06 3.99 0.00 2.29 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 97 V 7.44 3.60 2.23 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 1.03 0.00 0.00 0.94 0.00 0.00 98 I 7.95 3.69 2.02 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 1.72 0.88 0.93 0.00 0.00 99 N 8.40 4.32 0.00 2.69 3.08 0.00 0.00 7.37 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 0.00 100 S 8.11 4.41 0.00 4.09 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 0.00 101 K 7.73 4.49 0.00 1.85 1.84 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.34 7.81 102 T 7.96 4.04 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 1.34 0.00 0.00 103 P 0.00 4.64 0.00 2.22 2.14 0.00 3.82 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.99 0.00 104 L 7.58 4.52 0.00 1.89 1.68 0.87 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.66 3.97 0.00 1.73 1.75 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.44 7.81 106 S 8.75 4.05 0.00 3.90 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 0.00 107 Y 8.64 4.21 0.00 3.13 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 P 0.00 4.23 0.00 2.01 1.86 0.00 2.49 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.50 0.00 109 L 8.55 4.74 0.00 1.70 1.79 0.98 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 110 D 7.89 4.82 0.00 2.72 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 0.00 111 I 7.41 4.31 1.72 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 1.25 0.27 0.79 0.00 0.00 112 H 8.32 5.17 0.00 3.18 3.32 0.00 5.92 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.26 4.67 0.00 2.85 2.91 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 0.00 114 V 8.35 3.67 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 1.07 0.00 0.00 1.15 0.00 0.00 115 Q 8.16 4.06 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.69 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 116 D 8.03 4.34 0.00 2.87 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 0.00 117 H 8.10 4.49 0.00 3.44 3.46 0.00 5.64 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 0.00 118 L 8.41 4.03 0.00 2.03 1.74 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.21 4.03 0.00 1.98 1.87 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.61 7.81 120 E 8.40 4.03 0.00 2.25 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 2.43 2.15 0.00 121 L 8.77 4.21 0.00 1.89 1.71 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.39 4.08 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 0.00 123 D 8.12 4.35 0.00 3.02 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 0.00 124 R 7.97 4.00 0.00 1.95 2.03 0.00 3.40 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.05 0.00 125 Y 8.92 3.76 0.00 3.15 3.05 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 0.00 126 A 8.51 4.09 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 I 7.76 3.60 2.04 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 1.42 1.12 0.91 0.00 0.00 128 V 7.70 3.51 1.75 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 0.65 0.00 0.00 0.77 0.00 0.00 129 A 8.71 3.91 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 0.00 130 N 8.68 4.28 0.00 2.75 2.88 0.00 0.00 6.75 7.95 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 0.00 131 D 8.22 4.34 0.00 2.83 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 0.00 132 V 8.13 3.83 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.00 0.00 0.00 133 R 7.79 3.95 0.00 1.95 2.13 0.00 3.22 0.00 0.00 3.35 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 134 K 7.86 4.13 0.00 1.94 1.83 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.44 7.81 135 A 7.90 4.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 I 7.43 3.87 1.97 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 1.43 1.16 0.89 0.00 0.00 137 G 7.94 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 0.00 0.00 0.00 138 E 7.71 3.99 0.00 1.89 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 2.31 2.24 0.00 139 A 7.43 4.30 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 0.00 140 K 8.74 4.02 0.00 1.88 1.88 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.41 7.81 141 D 7.95 4.36 0.00 2.72 2.54 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 0.00 142 D 8.82 4.37 0.00 2.70 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 0.00 143 D 8.13 4.36 0.00 2.84 2.71 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 0.00 144 T 7.91 3.82 4.35 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 1.17 0.00 0.00 145 A 8.14 3.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 D 8.25 4.20 0.00 2.87 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 0.00 147 I 7.79 3.67 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 1.49 0.55 0.83 0.00 0.00 148 L 8.05 3.98 0.00 1.78 1.67 0.88 0.48 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 0.00 149 T 8.10 3.80 4.35 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 1.18 0.00 0.00 150 A 8.12 3.97 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 0.00 151 A 7.92 3.31 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 0.00 152 S 8.43 3.93 0.00 3.88 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 0.00 153 R 8.26 3.76 0.00 2.04 1.97 0.00 3.14 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 154 D 7.52 3.78 0.00 2.54 1.77 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 0.00 155 L 7.54 3.66 0.00 1.56 1.58 0.66 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 156 D 8.18 4.42 0.00 2.59 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 K 7.45 4.09 0.00 1.63 1.63 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.55 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.97 1.44 7.81 158 F 7.90 3.90 0.00 2.86 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 0.00 0.00 0.00 159 L 8.46 3.96 0.00 1.88 1.93 1.10 1.05 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 0.00 160 W 8.34 4.44 0.00 3.42 3.54 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 0.00 161 F 8.26 4.02 0.00 3.27 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 0.00 162 I 8.41 3.85 2.00 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.96 0.88 0.00 0.00 163 E 8.63 4.01 0.00 2.15 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 2.40 2.57 0.00 164 S 8.26 4.27 0.00 3.54 3.78 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 0.00 165 N 7.79 4.71 0.00 2.78 2.77 0.00 0.00 6.99 7.07 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 0.00 166 I 7.26 4.19 2.03 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 1.31 0.65 0.93 0.00 0.00 167 E 9.51 4.15 0.00 1.91 1.87 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 2.34 2.25 0.00