NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 26 Y 4.6581 8.0033 121.6892 57.2532 39.9493 176.0728 27 P 4.5094 0.0000 0.0000 62.8595 31.2499 175.9877 28 D 4.6806 8.5645 121.8756 54.2986 43.4218 175.9386 29 A 4.5610 8.0100 121.7204 49.1283 19.9565 173.9172 30 P 4.2514 0.0000 0.0000 64.0007 31.8718 176.1797 31 V 3.7399 8.3560 122.7113 62.6232 32.6657 174.6632 32 A 4.4733 8.4983 130.4768 51.3063 18.7999 176.2422 33 L 4.3975 7.9247 121.8329 53.3836 44.2481 177.3385 34 K 4.1636 8.1637 120.2520 55.0503 32.9857 176.7169 35 P 4.3110 0.0000 0.0000 65.6917 31.2512 177.4200 36 R 4.2046 7.9412 116.8314 56.7395 30.4794 175.9099 37 F 4.2094 7.9304 119.4444 59.8919 39.6145 174.9794 38 H 4.3056 7.4969 124.3279 54.4143 27.7254 174.5196 39 G 4.4289 7.5139 113.9528 44.3025 0.0000 169.7816 40 R 4.1880 8.5050 121.3989 56.7863 30.9936 177.2192 41 H 4.4102 8.9370 123.2839 56.7293 29.4444 174.7775 42 V 4.7193 8.9338 121.7823 59.8957 34.3195 174.4738 43 L 4.9655 9.6498 124.3030 53.5222 43.2052 176.3712 44 T 4.4000 8.5400 114.9722 60.9072 71.0172 174.1204 45 R 4.6418 8.2373 120.3464 54.4781 33.1497 175.5120 46 H 4.6303 8.5401 117.2224 54.3886 29.8079 175.1090 47 P 4.2396 0.0000 0.0000 66.2029 31.0959 177.9248 48 N 4.1642 8.1919 113.7347 55.5874 38.4633 176.0186 49 G 4.0839 7.8312 103.7094 45.0544 0.0000 174.0136 50 L 4.2092 7.6861 119.7562 54.2998 42.4112 176.4915 51 E 4.4657 8.2798 120.9815 56.3304 29.9769 177.6596 52 K 4.1388 7.9786 120.2616 58.0529 32.6231 177.1900 53 C 4.3663 7.9154 119.8885 58.7385 31.8778 173.1370 54 I 4.9290 7.7454 121.0864 59.9221 37.6879 175.2464 55 G 4.0567 8.2303 106.3397 47.7502 0.0000 174.8801 56 C 4.2117 8.1381 113.7559 57.8255 30.4747 173.8082 57 S 3.8602 8.0047 113.3619 59.3529 60.5033 172.9141 58 L 4.2653 7.4115 122.7265 57.0829 41.9003 177.3010 59 C 4.0963 8.2095 114.0484 61.2397 29.6097 175.4616 60 A 3.9066 8.0830 123.3600 54.5091 17.7016 179.3994 61 A 3.9851 7.4909 118.2354 55.2276 18.6325 179.3281 62 A 4.2448 7.8185 117.1389 52.8161 18.7710 177.2825 63 C 4.0988 7.2732 118.8906 58.3786 31.7508 172.6860 64 P 4.0225 0.0000 0.0000 64.8158 31.0385 176.7711 65 A 4.1389 7.5472 119.3148 51.1993 20.2491 175.6576 66 Y 3.7189 6.6056 111.2701 59.5547 35.7741 170.5216 67 A 4.7654 7.5721 117.8679 51.6096 21.5299 177.1683 68 I 4.8627 7.7169 116.0386 59.3709 40.7024 174.2640 69 Y 4.5183 8.6452 127.3438 55.6348 41.5412 174.2119 70 V 4.8601 7.9938 125.7820 61.2354 34.3668 174.0198 71 E 4.6569 9.0377 127.8380 54.4325 31.3983 173.9853 72 P 5.1322 0.0000 0.0000 61.5163 33.7049 174.4824 73 A 4.5510 7.9675 121.6884 50.3722 23.1938 174.7772 74 E 4.8169 8.6260 120.6116 55.2680 30.3923 176.0950 75 N 4.5615 8.7422 124.5746 53.9114 39.3072 174.0081 76 D 4.7172 8.5136 121.4596 52.2667 42.2992 175.3143 77 P 4.2760 0.0000 0.0000 65.7318 31.6928 177.4182 78 E 4.0693 8.7315 118.4156 58.4928 29.6682 176.3167 79 N 4.8736 7.6615 116.3760 50.7388 38.8364 170.7552 80 P 4.5563 0.0000 0.0000 61.5939 33.2804 177.4940 81 V 3.5965 8.3005 121.2264 65.0402 31.7410 175.6289 82 S 4.8550 7.9143 110.6915 56.3438 66.0941 173.6397 83 A 4.1547 8.5696 122.5453 54.3493 18.7864 179.1382 84 G 3.9556 7.8390 105.7660 45.6548 0.0000 172.9152 85 E 4.5122 8.7721 116.9003 56.4676 31.6154 175.6127 86 R 5.1912 7.9080 121.8779 54.8468 33.4609 173.5801 87 Y 5.3661 8.8005 123.2332 55.2199 42.2313 173.8705 88 A 4.6912 8.6566 121.0190 50.4592 19.3070 177.0263 89 K 4.0541 8.5276 123.6254 59.9337 32.7883 177.1435 90 V 4.5814 7.8013 119.2771 61.0882 34.2756 173.0488 91 Y 5.1641 8.6088 127.5897 55.9400 42.2095 173.6499 92 E 5.1307 8.3497 124.7315 54.1905 34.6042 174.2159 93 I 5.3045 8.2914 124.3757 58.6013 40.4261 174.7944 94 N 4.7152 8.7415 126.8319 52.7318 36.7899 174.9698 95 M 4.3216 8.6059 125.0955 57.6279 32.3576 178.7104 96 L 4.0286 7.7225 116.7262 56.0889 42.2132 177.4086 97 R 4.2951 8.1141 118.6354 57.6320 30.9932 176.3635 98 C 4.0345 7.1599 117.0753 59.7971 31.8081 172.8614 99 I 4.4675 7.8969 122.1416 59.7404 39.8318 174.6608 100 F 3.5130 7.8524 116.6103 58.9766 35.3793 174.9448 101 C 4.3518 7.8258 114.7811 57.6992 31.1395 175.6772 102 G 3.9161 8.1335 108.0458 46.1246 0.0000 175.0789 103 L 3.9755 7.4199 119.7294 57.6947 41.8344 178.9761 104 C 4.2368 7.9189 113.8126 61.5283 29.4709 175.5340 105 E 4.2286 8.0481 121.6940 57.6551 29.1426 177.6716 106 E 4.1184 7.6728 117.9821 58.6483 29.8833 177.8439 107 A 4.2008 7.6749 120.0455 53.5170 18.7259 177.6590 108 C 4.1089 7.6021 118.0088 59.1168 31.8622 171.6149 109 P 4.5221 0.0000 0.0000 64.0293 31.5365 176.5866 110 T 4.3285 7.9242 108.0644 61.0037 70.4489 174.6486 111 G 3.6704 8.2527 108.7933 46.1787 0.0000 174.5851 112 A 4.1554 7.0724 120.9307 53.7958 18.9648 177.7715 113 I 4.3666 7.3838 112.6904 60.4788 39.9049 174.8335 114 V 4.4855 8.2234 128.2935 61.3654 35.1310 173.4571 115 L 4.0199 8.6583 128.6912 54.5595 42.0856 177.7264 116 G 3.5308 8.0488 109.2707 46.7173 0.0000 175.0879 117 Y 5.0506 8.3546 117.6920 58.8266 40.3314 176.2195 118 D 5.0071 8.6189 119.5111 55.2595 41.3022 177.0614 119 F 4.9013 8.5900 116.0479 56.8520 39.4830 175.5325 120 E 4.0194 7.0293 121.2415 56.3205 26.9727 177.3544 121 M 4.4702 7.7566 124.1608 53.9110 31.4885 175.8601 122 A 4.1803 7.9520 121.4304 53.4758 19.3639 176.8143 123 D 3.9434 7.8671 117.6933 54.0549 44.2062 174.1537 124 Y 4.6134 8.2907 115.8969 59.6317 39.0566 176.0217 125 E 4.6173 7.9919 119.1106 54.7830 31.3036 175.7746 126 Y 4.1006 9.0829 125.8497 61.1295 38.6908 178.2377 127 S 4.5847 8.3483 109.4171 59.6168 62.9636 173.9918 128 D 4.6764 8.3198 120.6017 54.9424 41.2449 176.7890 129 L 4.5872 8.0228 119.4426 54.2971 42.2620 175.9858 130 V 4.4768 7.5975 119.7176 60.9590 31.8529 175.8106 131 Y 4.4063 9.0245 124.1214 57.6966 39.7124 174.6454 132 G 4.2537 9.2312 107.7462 44.0674 0.0000 173.6474 133 K 4.0434 9.1893 120.2105 59.6164 31.8511 178.2164 134 E 4.2135 8.1990 113.5230 58.2559 29.6759 177.0219 135 D 4.6755 8.5344 119.0715 55.6701 41.2649 176.8975 136 M 4.8931 8.0798 116.6971 54.5026 33.2730 175.3402 137 L 4.4795 7.6734 119.1208 54.1232 42.4556 178.5361 138 V 3.9312 8.2637 113.5645 64.4136 31.6755 177.9442 139 D 4.4411 8.0640 118.3612 55.2088 39.6003 176.5957 140 V 3.8419 7.3019 119.8644 60.7583 32.1225 175.5208 141 V 3.9523 8.3669 124.8730 63.1628 32.0083 175.6156 142 G 4.0151 9.1242 113.2097 45.2690 0.0000 172.3942 143 T 4.7536 7.9599 108.4030 60.1305 72.1396 174.9919 144 K 3.6380 8.7265 119.8016 59.1903 31.8227 177.2617 145 P 4.1911 0.0000 0.0000 66.7104 30.9665 178.1068 146 Q 3.9483 7.7647 117.2288 58.3576 28.4046 179.2257 147 R 4.0808 7.9721 117.6865 58.4403 30.5891 178.6142 148 R 4.0309 8.4050 119.3048 59.3018 29.8600 178.1914 149 E 4.0138 8.3440 118.3953 58.9052 30.1597 177.8423 150 A 4.2517 7.7369 118.6079 53.4189 18.3818 178.5806 151 K 4.2582 7.8713 119.7119 58.3612 32.0583 178.7108 152 R 4.3087 7.5457 112.1881 57.0341 29.3099 177.4568 153 T 4.4025 8.3727 115.6543 62.8981 71.5954 175.4511 154 G 3.8563 7.8254 106.3327 45.8430 0.0000 172.7681 155 K 4.4081 7.3673 119.9088 53.3113 33.2937 174.1293 156 P 4.2945 0.0000 0.0000 62.6412 32.0303 176.3195 157 V 3.7928 8.1497 114.0435 61.0632 32.1651 175.9076 158 K 4.4105 8.3787 123.8505 54.4456 33.5867 176.0553 159 V 3.6802 8.0959 124.2788 62.2696 32.2334 175.9209 160 G 4.0722 8.8966 115.3656 44.9838 0.0000 171.6055 161 Y 5.2347 7.1199 116.0459 56.9095 41.3587 174.3263 162 V 5.4976 8.4514 110.4971 61.4501 36.5918 173.9811 163 V 4.7101 8.0705 114.5967 59.1565 35.8282 174.7917 164 P 4.1513 0.0000 0.0000 65.7311 31.3771 176.1742 165 Y 4.8529 6.8131 113.1916 55.5867 40.2490 173.7725 166 V 4.4638 8.5170 115.0582 60.1887 32.8594 176.4017 167 R 4.1353 8.3449 122.8427 55.6695 30.9569 175.6019 168 P 4.2637 0.0000 0.0000 65.9780 31.4896 177.9515 169 E 4.1027 8.1840 115.9315 59.1440 29.7459 176.9691 170 L 4.4137 7.5073 118.5150 54.1223 42.1697 176.2090 171 E 4.1143 8.2169 118.6108 58.3913 29.9812 174.6979 172 G 4.1433 9.2827 113.7099 45.8237 0.0000 172.6617 173 F 3.8875 7.8875 122.0651 58.2864 39.0661 174.9966 174 K 4.2424 8.1331 128.6192 55.3409 31.6427 176.3691 175 A 4.7816 8.2031 126.1527 49.1729 22.4082 174.2693 176 P 4.5539 0.0000 0.0000 63.1932 30.1410 176.7428 177 T 5.3519 7.8447 120.1193 59.7327 69.1097 176.0510 178 E 3.8155 8.5310 122.5572 58.7986 30.0340 177.9420 179 G 4.1045 7.6463 111.9765 45.8370 0.0000 173.2761 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 26 Y 8.00 4.66 0.00 3.00 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 27 P 0.00 4.51 0.00 2.21 2.10 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.23 0.00 28 D 8.56 4.68 0.00 2.82 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 29 A 8.01 4.56 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.25 0.00 2.08 2.12 0.00 3.80 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 31 V 8.36 3.74 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 0.60 0.00 0.00 0.92 0.00 0.00 32 A 8.50 4.47 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.92 4.40 0.00 1.07 0.92 0.38 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.16 4.16 0.00 1.78 1.66 0.00 1.61 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.32 7.81 35 P 0.00 4.31 0.00 2.37 1.86 0.00 3.64 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.76 0.00 36 R 7.94 4.20 0.00 1.84 2.05 0.00 3.38 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 37 F 7.93 4.21 0.00 3.01 3.14 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 0.00 0.00 0.00 38 H 7.50 4.31 0.00 2.74 3.09 0.00 5.73 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 39 G 7.51 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 0.00 0.00 0.00 0.00 40 R 8.50 4.19 0.00 1.97 1.93 0.00 3.27 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.45 0.00 41 H 8.94 4.41 0.00 2.99 3.23 0.00 5.89 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.93 4.72 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 0.42 0.00 0.00 1.01 0.00 0.00 43 L 9.65 4.97 0.00 1.56 1.51 0.68 0.08 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 44 T 8.54 4.40 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 1.21 0.00 0.00 45 R 8.24 4.64 0.00 1.79 1.99 0.00 3.21 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 46 H 8.54 4.63 0.00 3.19 3.22 0.00 5.64 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.24 0.00 2.05 2.14 0.00 3.79 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 48 N 8.19 4.16 0.00 2.68 2.92 0.00 0.00 7.13 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 G 7.83 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 0.00 0.00 0.00 0.00 50 L 7.69 4.21 0.00 1.74 1.62 0.90 0.96 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 51 E 8.28 4.47 0.00 1.99 1.86 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 2.33 2.40 0.00 52 K 7.98 4.14 0.00 1.61 1.77 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.67 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.86 1.32 7.81 53 C 7.92 4.37 0.00 2.81 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 I 7.75 4.93 1.95 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 1.31 1.98 0.95 0.00 0.00 55 G 8.23 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 C 8.14 4.21 0.00 3.12 3.19 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 57 S 8.00 3.86 0.00 3.95 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 58 L 7.41 4.27 0.00 1.97 1.64 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 59 C 8.21 4.10 0.00 3.23 3.19 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 60 A 8.08 3.91 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 61 A 7.49 3.99 1.33 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 0.00 0.00 0.00 62 A 7.82 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 63 C 7.27 4.10 0.00 3.04 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 64 P 0.00 4.02 0.00 2.08 2.06 0.00 3.69 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 1.87 1.88 0.00 65 A 7.55 4.14 1.19 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 0.00 0.00 66 Y 6.61 3.72 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 67 A 7.57 4.77 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 68 I 7.72 4.86 1.77 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 1.09 0.63 0.51 0.00 0.00 69 Y 8.65 4.52 0.00 2.92 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 V 7.99 4.86 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 1.08 0.00 0.00 0.83 0.00 0.00 71 E 9.04 4.66 0.00 2.12 1.86 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 2.37 2.60 0.00 72 P 0.00 5.13 0.00 1.85 1.89 0.00 3.60 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.02 0.00 73 A 7.97 4.55 0.59 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 0.00 0.00 74 E 8.63 4.82 0.00 2.02 1.93 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 2.31 2.49 0.00 75 N 8.74 4.56 0.00 2.77 2.78 0.00 0.00 6.96 7.43 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 76 D 8.51 4.72 0.00 2.68 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 77 P 0.00 4.28 0.00 2.08 2.11 0.00 3.74 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 2.04 2.10 0.00 78 E 8.73 4.07 0.00 1.97 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 2.32 2.28 0.00 79 N 7.66 4.87 0.00 2.65 2.62 0.00 0.00 7.29 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 80 P 0.00 4.56 0.00 2.18 2.00 0.00 3.77 0.00 0.00 3.55 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 81 V 8.30 3.60 1.66 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 0.85 0.00 0.00 -0.38 0.00 0.00 82 S 7.91 4.85 0.00 4.02 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 83 A 8.57 4.15 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 84 G 7.84 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 85 E 8.77 4.51 0.00 2.08 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 0.00 2.31 2.31 0.00 86 R 7.91 5.19 0.00 1.88 1.80 0.00 3.11 0.00 0.00 3.52 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 87 Y 8.80 5.37 0.00 3.10 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 88 A 8.66 4.69 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 89 K 8.53 4.05 0.00 1.50 1.92 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.41 7.81 90 V 7.80 4.58 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 1.00 0.00 0.00 0.97 0.00 0.00 91 Y 8.61 5.16 0.00 3.15 2.81 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 92 E 8.35 5.13 0.00 1.91 1.74 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 2.40 2.15 0.00 93 I 8.29 5.30 1.77 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.38 0.64 0.00 0.00 94 N 8.74 4.72 0.00 2.77 2.73 0.00 0.00 7.16 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 M 8.61 4.32 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.68 0.00 96 L 7.72 4.03 0.00 1.25 1.53 0.36 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 97 R 8.11 4.30 0.00 1.94 1.93 0.00 3.41 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 98 C 7.16 4.03 0.00 2.97 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 99 I 7.90 4.47 1.88 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 1.00 0.93 0.00 0.00 100 F 7.85 3.51 0.00 3.13 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 C 7.83 4.35 0.00 3.09 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 0.00 102 G 8.13 3.92 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 0.00 0.00 0.00 103 L 7.42 3.98 0.00 1.63 1.72 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 104 C 7.92 4.24 0.00 3.15 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 0.00 105 E 8.05 4.23 0.00 2.01 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 2.23 2.17 0.00 106 E 7.67 4.12 0.00 2.08 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 0.00 2.29 2.30 0.00 107 A 7.67 4.20 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 0.00 108 C 7.60 4.11 0.00 2.93 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 0.00 109 P 0.00 4.52 0.00 2.22 2.15 0.00 3.78 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 1.98 1.95 0.00 110 T 7.92 4.33 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 111 G 8.25 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 0.00 112 A 7.07 4.16 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 0.00 113 I 7.38 4.37 1.82 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 1.31 1.22 0.91 0.00 0.00 114 V 8.22 4.49 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 0.65 0.00 0.00 0.91 0.00 0.00 115 L 8.66 4.02 0.00 1.30 1.49 0.64 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 116 G 8.05 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 0.00 117 Y 8.35 5.05 0.00 2.97 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 0.00 0.00 0.00 0.00 118 D 8.62 5.01 0.00 3.00 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 0.00 119 F 8.59 4.90 0.00 3.21 3.36 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 0.00 120 E 7.03 4.02 0.00 1.71 1.73 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 2.02 1.47 0.00 121 M 7.76 4.47 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.67 0.00 122 A 7.95 4.18 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 0.00 123 D 7.87 3.94 0.00 2.50 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 0.00 124 Y 8.29 4.61 0.00 3.06 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 0.00 125 E 7.99 4.62 0.00 2.11 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 2.42 2.39 0.00 126 Y 9.08 4.10 0.00 3.00 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 0.00 127 S 8.35 4.58 0.00 4.10 4.10 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 0.00 128 D 8.32 4.68 0.00 2.96 2.75 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 0.00 129 L 8.02 4.59 0.00 1.74 1.63 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.60 4.48 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 0.79 0.00 0.00 0.96 0.00 0.00 131 Y 9.02 4.41 0.00 2.97 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 0.00 132 G 9.23 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 0.00 0.00 0.00 0.00 133 K 9.19 4.04 0.00 1.94 1.94 0.00 1.81 0.00 0.00 2.00 0.00 0.00 3.27 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.58 1.50 7.81 134 E 8.20 4.21 0.00 2.14 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 2.29 2.29 0.00 135 D 8.53 4.68 0.00 3.05 2.81 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 0.00 136 M 8.08 4.89 0.00 2.39 2.09 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.72 0.00 137 L 7.67 4.48 0.00 1.79 1.84 0.97 1.16 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 0.00 138 V 8.26 3.93 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 0.84 0.00 0.00 0.96 0.00 0.00 139 D 8.06 4.44 0.00 2.78 2.81 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 0.00 140 V 7.30 3.84 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 0.84 0.00 0.00 0.98 0.00 0.00 141 V 8.37 3.95 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 0.76 0.00 0.00 0.85 0.00 0.00 142 G 9.12 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 0.00 143 T 7.96 4.75 4.50 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 144 K 8.73 3.64 0.00 1.68 1.73 0.00 1.32 0.00 0.00 1.46 0.00 0.00 2.72 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.09 0.29 7.81 145 P 0.00 4.19 0.00 2.22 2.37 0.00 3.77 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.23 0.00 146 Q 7.76 3.95 0.00 2.38 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 147 R 7.97 4.08 0.00 1.78 1.98 0.00 3.17 0.00 0.00 3.33 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 148 R 8.41 4.03 0.00 1.84 2.13 0.00 3.12 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 149 E 8.34 4.01 0.00 2.03 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 2.33 2.34 0.00 150 A 7.74 4.25 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 0.00 151 K 7.87 4.26 0.00 2.05 1.72 0.00 1.53 0.00 0.00 1.84 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.48 7.81 152 R 7.55 4.31 0.00 1.96 2.01 0.00 3.04 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 153 T 8.37 4.40 4.42 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 1.25 0.00 0.00 154 G 7.83 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 0.00 155 K 7.37 4.41 0.00 1.81 1.70 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.40 7.81 156 P 0.00 4.29 0.00 2.06 2.00 0.00 3.72 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 2.03 2.14 0.00 157 V 8.15 3.79 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 0.70 0.00 0.00 0.91 0.00 0.00 158 K 8.38 4.41 0.00 1.67 1.66 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.36 7.81 159 V 8.10 3.68 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 0.30 0.00 0.00 0.74 0.00 0.00 160 G 8.90 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 0.00 161 Y 7.12 5.23 0.00 2.99 3.19 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 0.00 162 V 8.45 5.50 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 0.80 0.00 0.00 0.95 0.00 0.00 163 V 8.07 4.71 1.64 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 0.22 0.00 0.00 0.82 0.00 0.00 164 P 0.00 4.15 0.00 1.68 1.95 0.00 3.59 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.57 0.00 165 Y 6.81 4.85 0.00 2.99 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 V 8.52 4.46 2.36 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 1.17 0.00 0.00 1.11 0.00 0.00 167 R 8.34 4.14 0.00 1.94 2.11 0.00 3.46 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.93 0.00 168 P 0.00 4.26 0.00 2.02 2.11 0.00 3.71 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 2.00 2.05 0.00 169 E 8.18 4.10 0.00 1.89 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 2.29 2.38 0.00 170 L 7.51 4.41 0.00 1.64 1.66 0.04 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 171 E 8.22 4.11 0.00 1.91 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 0.00 2.32 2.43 0.00 172 G 9.28 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 173 F 7.89 3.89 0.00 3.04 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 0.00 174 K 8.13 4.24 0.00 1.65 1.71 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.48 1.44 7.81 175 A 8.20 4.78 1.67 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 0.00 176 P 0.00 4.55 0.00 2.25 2.24 0.00 3.89 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.79 0.00 177 T 7.84 5.35 4.47 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 1.34 0.00 0.00 178 E 8.53 3.82 0.00 1.98 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 0.00 2.33 2.28 0.00 179 G 7.65 4.10 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 0.00