NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3460 8.3001 120.3460 54.6067 34.2553 174.8284 2 A 4.6326 7.7040 119.5080 49.5410 21.4289 174.6242 3 A 4.1328 8.0393 123.4897 51.8587 20.5663 174.8255 4 R 4.9975 7.8371 116.7136 55.7729 33.1593 173.9908 5 T 4.8333 8.9864 114.8794 60.0495 72.3591 172.6745 6 D 5.1293 8.7327 122.6898 53.1479 43.7199 173.8001 7 N 5.1612 9.2713 123.4006 51.5166 42.4392 174.0527 8 S 5.0599 8.3012 116.9367 57.1764 67.3124 173.0282 9 I 4.2643 8.2456 119.9607 60.0868 41.7267 173.0714 10 V 4.6721 8.2361 127.7519 61.2697 33.3080 174.7594 11 V 4.2046 8.7670 128.1141 60.5306 33.3631 176.0954 12 N 4.8627 9.2556 128.2627 51.3508 36.2557 173.7109 13 A 4.3988 7.1121 121.9498 48.9760 23.1451 174.4472 14 P 4.4707 0.0000 0.0000 61.9350 33.4233 177.7901 15 F 4.2271 8.7947 121.2269 61.6530 39.3878 176.6233 16 E 3.6057 8.4201 118.3945 59.3923 29.2697 178.6036 17 L 3.9375 7.7728 119.4341 58.1382 42.3255 178.7266 18 V 3.6384 7.5739 117.7710 65.7475 31.4115 177.8558 19 W 3.5405 8.2794 128.2375 60.5000 30.2754 177.8523 20 D 4.4379 7.9984 117.5176 57.1431 40.5007 178.8092 21 V 3.7716 7.9365 119.1746 66.2983 31.4631 178.2269 22 T 4.1308 7.6511 107.3799 64.7560 68.6471 174.7403 23 N 4.5908 7.8862 116.8603 53.7377 38.9578 175.6425 24 D 4.5292 7.8626 120.1090 52.3124 39.9452 176.0794 25 I 2.3644 7.7514 125.1433 63.7258 37.2571 178.0125 26 E 3.9479 7.9302 116.0079 57.9583 29.3904 177.1587 27 A 5.3054 8.0325 121.0757 51.1886 20.2542 178.7004 28 W 4.7688 8.5473 117.1412 59.5750 28.8180 176.5745 29 P 5.0912 0.0000 0.0000 64.5815 31.1537 177.6344 30 E 4.4029 8.6669 117.6620 58.2206 29.6753 178.4342 31 L 4.0437 8.0055 117.8524 55.6733 42.7428 177.0497 32 F 4.9133 8.6297 118.4091 55.4968 40.5069 177.2030 33 S 4.3685 8.5450 120.4279 60.6362 63.2280 175.2142 34 E 4.1584 8.0850 118.4276 57.5952 30.2661 175.0674 35 Y 5.2147 7.4615 117.2313 56.9236 39.1490 176.2939 36 A 4.5028 9.3923 126.1269 53.3881 20.5423 177.1343 37 E 4.8678 7.9737 112.3814 55.0659 34.5540 175.0588 38 A 4.9335 8.2759 121.7887 51.1555 22.2401 175.6542 39 E 4.5827 8.9610 120.6778 54.6651 33.5365 174.7043 40 I 4.1522 8.1799 124.0678 61.5302 37.1962 175.7888 41 L 4.3958 9.0931 128.6177 57.2477 42.6046 177.1171 42 R 4.6106 7.6450 112.3214 55.5537 32.6226 173.5562 43 Q 5.1736 8.7185 118.6484 53.9642 31.2821 176.1182 44 D 4.9032 8.8231 123.1605 52.1543 40.5848 177.8793 45 G 3.9137 8.7227 116.6016 47.4921 0.0000 173.8429 46 D 4.5198 9.2336 118.5490 50.0290 38.8661 175.3931 47 G 3.8866 7.6824 114.3059 44.4161 0.0000 169.5447 48 F 5.1330 7.8488 112.8974 56.3024 41.4770 172.7122 49 D 5.6640 8.8018 119.6421 52.8059 43.4303 175.6366 50 F 5.3804 8.8408 116.0865 55.2970 42.1148 173.1017 51 R 4.7729 8.9803 121.0013 54.7247 32.3253 174.8415 52 L 4.9859 8.0981 124.9439 52.5917 45.7387 175.3852 53 K 5.0401 8.5507 123.7811 54.8494 35.2287 175.9471 54 T 4.9692 9.0624 118.5226 61.3194 70.3592 174.4109 55 R 4.4907 8.6951 122.1192 54.4683 31.6539 174.9359 56 P 4.3890 0.0000 0.0000 63.3745 31.9729 177.2078 57 D 4.7628 8.6810 123.6498 52.5037 41.5180 176.4541 58 A 4.2147 8.7942 120.7253 55.0568 18.3576 178.1612 59 N 4.8303 9.0540 111.7374 52.7530 39.1985 175.5862 60 G 3.8820 8.6032 106.5691 45.5583 0.0000 173.3981 61 R 4.1523 7.9720 120.4732 54.9922 31.6441 175.0434 62 V 4.4339 7.9209 126.0869 61.4425 32.8153 174.8317 63 W 5.1876 9.3381 127.4654 55.2381 32.7018 174.2191 64 E 5.3339 9.0356 121.8500 55.0347 32.4711 173.7952 65 W 5.2696 8.3545 121.3204 56.8461 32.3367 172.8228 66 V 4.6532 8.5507 119.6774 61.2801 33.8071 174.3360 67 S 5.0367 8.3901 122.2207 56.8090 67.6540 172.1093 68 H 5.1816 8.7674 119.7038 54.4406 32.6410 172.0203 69 A 4.8235 8.4661 126.6531 50.1845 22.9285 175.1438 70 V 4.5725 8.6992 119.4956 60.4577 32.5684 172.2460 71 P 4.8001 0.0000 0.0000 62.3018 33.0421 176.2707 72 D 4.7588 9.8144 121.7283 51.8526 41.3806 175.3775 73 K 2.4800 8.6619 124.8775 58.3832 32.6051 178.8521 74 G 3.5984 8.0459 106.1567 48.2970 0.0000 173.9722 75 S 4.5081 7.8975 112.6877 57.1039 63.8581 174.4212 76 R 3.8715 7.8710 119.4741 56.8553 28.0718 174.9487 77 T 5.7698 7.6607 110.3266 61.3194 71.9062 173.2182 78 V 5.1067 9.2319 124.7343 60.4196 35.1146 173.9760 79 R 5.1519 8.5455 122.2827 54.7076 33.5265 174.5819 80 A 4.9703 8.4365 122.4861 51.8320 23.4590 174.6090 81 H 5.0872 8.3922 112.3855 54.7034 32.0571 173.7793 82 R 4.2729 8.6110 119.8452 56.7058 30.1575 176.8043 83 V 3.9139 8.8899 123.0800 64.5574 32.2039 176.2835 84 E 4.5059 7.8382 123.3603 54.6522 28.8436 176.5954 85 T 3.8725 8.4059 115.4311 62.3403 70.3257 176.3221 86 G 3.7411 6.9819 110.6959 46.4590 0.0000 174.2916 87 P 4.2862 0.0000 0.0000 63.2276 31.6723 175.3468 88 F 4.8421 7.5459 118.1627 56.8200 39.4173 176.0255 89 A 4.3700 9.4694 125.3208 55.1747 18.8890 177.4966 90 Y 4.7464 7.2753 109.8556 56.6423 41.3125 173.7751 91 M 4.8302 8.4727 120.5098 54.4974 35.3010 173.1991 92 N 5.5739 9.7400 124.3518 51.5440 42.0957 173.9113 93 L 5.2665 8.9569 123.1723 53.7168 46.0988 174.7552 94 H 5.3817 9.8155 125.3888 54.6090 33.2821 171.7437 95 W 5.7561 9.4229 126.0810 55.2600 32.3535 174.9682 96 T 5.5487 8.8364 112.5736 60.3880 72.2380 172.1982 97 Y 5.4933 9.1077 119.7156 56.4592 41.4790 175.0069 98 R 4.7758 9.0457 123.4729 54.1872 33.6808 174.0770 99 A 4.7076 8.7779 128.1961 52.1659 19.2064 176.8685 100 V 4.3513 8.6599 114.5593 58.7683 35.7294 174.6849 101 A 4.1279 8.3911 123.5231 55.7545 18.0093 176.3408 102 G 4.2760 9.8339 111.7787 46.5995 0.0000 172.0050 103 G 4.2003 7.2664 109.8573 46.3359 0.0000 174.4430 104 T 5.3060 9.5198 121.9468 61.6166 72.7195 172.1040 105 E 4.7755 9.4961 128.1258 55.4271 31.2844 174.4317 106 M 4.9007 9.0159 127.5019 53.7029 34.5510 175.0478 107 R 4.8638 8.7169 123.3003 54.3198 33.4724 173.7901 108 W 5.4424 9.4013 126.8894 55.0260 31.8185 174.8954 109 V 5.1104 9.4154 125.4122 61.1888 33.9091 174.0798 110 Q 5.3228 9.1588 126.3804 54.2061 32.0680 174.2958 111 E 5.2835 9.2118 123.1065 54.6739 33.0901 175.0962 112 F 4.5994 8.2602 117.9926 57.0495 42.2121 172.3491 113 D 4.5104 7.6058 117.0659 53.0857 44.2871 174.1572 114 M 4.5806 8.6923 125.6451 55.0250 33.1650 176.2912 115 K 4.2945 8.6633 122.6199 55.2165 33.6509 174.9327 116 P 4.3607 0.0000 0.0000 64.7793 31.1986 176.0855 117 G 3.9645 9.0329 110.2025 45.1010 0.0000 173.6010 118 A 4.1874 8.2273 123.6129 51.1156 18.9420 176.9879 119 P 4.0601 0.0000 0.0000 64.5747 31.6962 176.9028 120 F 4.7643 7.6269 115.5814 55.2325 41.9541 174.8042 121 D 4.9531 8.2803 123.0564 51.6429 42.9523 176.8948 122 N 4.3320 8.7509 116.3291 56.8521 38.4695 176.9468 123 A 4.0274 8.1369 120.9354 56.0349 18.4681 179.3499 124 H 4.2039 8.5687 114.2084 59.1309 28.6804 177.8425 125 M 4.1794 8.6028 120.2240 58.8223 32.0938 178.2935 126 T 4.1394 8.8300 116.1539 66.7445 68.7158 176.3219 127 A 4.0232 8.0566 122.4157 55.4000 18.4727 178.9322 128 H 4.1475 8.3510 116.7212 59.7176 29.9333 177.4282 129 L 4.0048 8.2170 122.2626 57.1231 41.3769 179.2073 130 N 4.3331 8.3574 116.4917 56.6470 38.6473 177.3812 131 T 3.8657 7.9611 117.1223 67.0465 68.1330 176.8401 132 T 3.9216 7.9118 111.4965 65.0120 68.7275 176.7399 133 T 4.0186 8.4357 119.0112 66.5023 68.5478 176.8047 134 R 3.7626 8.1060 119.7701 59.1832 30.0887 179.0251 135 A 3.9238 7.8159 120.0015 55.2204 18.3906 179.5076 136 N 4.1693 8.1875 115.0133 56.5687 38.6078 177.6313 137 M 3.4312 8.0460 120.5152 58.1630 32.0283 178.7162 138 E 3.8208 7.8538 118.6516 59.0834 29.5695 179.3528 139 R 3.7581 7.8240 118.6793 59.6427 30.1678 178.6560 140 I 3.5889 7.9336 119.8804 63.9675 36.9532 178.2741 141 K 3.7748 7.8226 120.5066 59.5251 31.9478 178.9542 142 K 3.9298 7.8016 118.2446 59.4273 31.9655 179.3352 143 I 3.6694 7.6420 119.9985 64.6328 37.0403 178.6079 144 I 3.7661 7.9367 120.6424 64.4481 36.8422 178.4444 145 E 4.0388 8.2911 119.4854 59.1096 29.1334 179.1717 146 D 4.3142 8.2594 119.3590 57.4221 40.9743 178.6761 147 R 4.1762 7.8842 119.8376 58.9422 30.1510 178.4659 148 H 4.1649 8.3804 117.7536 59.3830 29.6329 177.1024 149 R 3.8323 7.9420 119.1670 59.6522 29.6943 178.1175 150 E 4.1981 8.6031 118.6722 59.0134 29.1681 179.3326 151 G 3.7350 7.8908 105.0680 47.0738 0.0000 174.2224 152 Q 4.2737 7.8092 123.9667 56.1244 28.9167 175.7735 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 1 M 8.30 4.35 0.00 1.97 2.16 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 2 A 7.70 4.63 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 3 A 8.04 4.13 0.25 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 4 R 7.84 5.00 0.00 1.78 1.74 0.00 3.22 0.00 0.00 3.30 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.75 0.00 5 T 8.99 4.83 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 1.40 0.00 0.00 6 D 8.73 5.13 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 N 9.27 5.16 0.00 2.61 2.50 0.00 0.00 6.45 7.12 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 8 S 8.30 5.06 0.00 3.61 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 I 8.25 4.26 1.57 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.68 0.54 0.00 0.00 10 V 8.24 4.67 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 0.81 0.00 0.00 0.90 0.00 0.00 11 V 8.77 4.20 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 0.89 0.00 0.00 0.85 0.00 0.00 12 N 9.26 4.86 0.00 2.83 2.78 0.00 0.00 6.69 7.08 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 13 A 7.11 4.40 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.47 0.00 2.20 2.04 0.00 3.51 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 15 F 8.79 4.23 0.00 3.19 3.11 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 16 E 8.42 3.61 0.00 2.17 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 2.40 2.56 0.00 17 L 7.77 3.94 0.00 1.81 1.64 0.95 0.95 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 18 V 7.57 3.64 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.06 0.00 0.00 19 W 8.28 3.54 0.00 2.15 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.00 4.44 0.00 2.74 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 21 V 7.94 3.77 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 1.10 0.00 0.00 0.99 0.00 0.00 22 T 7.65 4.13 4.59 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 1.43 0.00 0.00 23 N 7.89 4.59 0.00 2.42 2.66 0.00 0.00 6.98 8.22 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 24 D 7.86 4.53 0.00 2.94 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.75 2.36 1.29 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 -0.16 0.09 0.00 0.00 26 E 7.93 3.95 0.00 1.88 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 2.18 2.12 0.00 27 A 8.03 5.31 1.50 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 0.00 0.00 0.00 28 W 8.55 4.77 0.00 3.44 3.38 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 29 P 0.00 5.09 0.00 2.13 2.40 0.00 3.93 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 30 E 8.67 4.40 0.00 2.31 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 0.00 2.33 2.44 0.00 31 L 8.01 4.04 0.00 1.69 1.48 1.12 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 32 F 8.63 4.91 0.00 3.44 3.06 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 33 S 8.54 4.37 0.00 3.99 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 34 E 8.09 4.16 0.00 2.01 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 1.47 1.47 0.00 35 Y 7.46 5.21 0.00 3.20 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 36 A 9.39 4.50 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 37 E 7.97 4.87 0.00 1.86 1.76 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 2.29 2.32 0.00 38 A 8.28 4.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.96 4.58 0.00 1.94 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 2.12 2.24 0.00 40 I 8.18 4.15 1.66 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.19 0.67 0.00 0.00 41 L 9.09 4.40 0.00 1.53 1.72 0.89 0.74 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 42 R 7.64 4.61 0.00 1.86 1.99 0.00 3.05 0.00 0.00 3.36 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 43 Q 8.72 5.17 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.32 0.00 0.00 0.00 0.00 0.00 2.22 2.22 0.00 44 D 8.82 4.90 0.00 2.73 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 45 G 8.72 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 0.00 0.00 0.00 46 D 9.23 4.52 0.00 2.83 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 47 G 7.68 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 48 F 7.85 5.13 0.00 3.29 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 49 D 8.80 5.66 0.00 2.71 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 50 F 8.84 5.38 0.00 2.97 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 51 R 8.98 4.77 0.00 1.77 1.71 0.00 3.23 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.47 0.00 52 L 8.10 4.99 0.00 0.27 0.64 0.58 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 53 K 8.55 5.04 0.00 1.75 1.58 0.00 1.62 0.00 0.00 1.99 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.37 7.81 54 T 9.06 4.97 4.53 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 1.60 0.00 0.00 55 R 8.70 4.49 0.00 1.76 1.96 0.00 3.42 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 56 P 0.00 4.39 0.00 1.96 2.15 0.00 3.70 0.00 0.00 3.74 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 57 D 8.68 4.76 0.00 3.11 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 58 A 8.79 4.21 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 59 N 9.05 4.83 0.00 2.84 2.87 0.00 0.00 7.03 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 60 G 8.60 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 61 R 7.97 4.15 0.00 1.82 1.96 0.00 2.87 0.00 0.00 2.90 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 62 V 7.92 4.43 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 0.90 0.00 0.00 0.90 0.00 0.00 63 W 9.34 5.19 0.00 3.69 3.41 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 64 E 9.04 5.33 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 2.17 2.43 0.00 65 W 8.35 5.27 0.00 3.55 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 66 V 8.55 4.65 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.94 0.00 0.00 67 S 8.39 5.04 0.00 2.72 3.43 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 68 H 8.77 5.18 0.00 3.14 2.75 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 69 A 8.47 4.82 0.55 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 0.00 0.00 70 V 8.70 4.57 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 0.99 0.00 0.00 0.87 0.00 0.00 71 P 0.00 4.80 0.00 2.52 2.09 0.00 3.70 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 72 D 9.81 4.76 0.00 2.83 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 73 K 8.66 2.48 0.00 1.22 1.49 0.00 1.27 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.10 0.22 7.81 74 G 8.05 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 S 7.90 4.51 0.00 4.03 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 76 R 7.87 3.87 0.00 2.00 2.17 0.00 2.74 0.00 0.00 2.29 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.19 0.00 77 T 7.66 5.77 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 78 V 9.23 5.11 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 0.86 0.00 0.00 0.68 0.00 0.00 79 R 8.55 5.15 0.00 1.71 1.80 0.00 3.27 0.00 0.00 3.08 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 80 A 8.44 4.97 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 81 H 8.39 5.09 0.00 3.32 3.36 0.00 5.46 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 82 R 8.61 4.27 0.00 1.67 1.97 0.00 2.81 0.00 0.00 2.87 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.25 0.00 83 V 8.89 3.91 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 0.79 0.00 0.00 0.90 0.00 0.00 84 E 7.84 4.51 0.00 2.21 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 2.37 2.33 0.00 85 T 8.41 3.87 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 1.27 0.00 0.00 86 G 6.98 3.74 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 0.00 0.00 0.00 87 P 0.00 4.29 0.00 1.69 1.92 0.00 3.42 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.12 0.00 88 F 7.55 4.84 0.00 2.99 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 89 A 9.47 4.37 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 7.28 4.75 0.00 3.00 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 91 M 8.47 4.83 0.00 1.74 1.05 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 1.95 0.00 92 N 9.74 5.57 0.00 2.89 2.74 0.00 0.00 6.01 6.90 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 93 L 8.96 5.27 0.00 1.60 1.49 0.58 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 94 H 9.82 5.38 0.00 3.20 3.19 0.00 5.60 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 W 9.42 5.76 0.00 3.24 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.84 5.55 4.39 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 1.24 0.00 0.00 97 Y 9.11 5.49 0.00 3.25 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 R 9.05 4.78 0.00 1.92 1.78 0.00 3.11 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 99 A 8.78 4.71 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 8.66 4.35 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 0.77 0.00 0.00 0.98 0.00 0.00 101 A 8.39 4.13 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 G 9.83 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 0.00 103 G 7.27 4.20 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 0.00 104 T 9.52 5.31 4.39 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 1.56 0.00 0.00 105 E 9.50 4.78 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 2.23 2.23 0.00 106 M 9.02 4.90 0.00 1.55 1.59 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.26 0.00 107 R 8.72 4.86 0.00 1.83 1.76 0.00 3.06 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 108 W 9.40 5.44 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 0.00 109 V 9.42 5.11 2.35 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 1.05 0.00 0.00 1.04 0.00 0.00 110 Q 9.16 5.32 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.53 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 111 E 9.21 5.28 0.00 2.03 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 2.30 2.33 0.00 112 F 8.26 4.60 0.00 2.89 2.86 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 0.00 113 D 7.61 4.51 0.00 2.45 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 0.00 0.00 0.00 114 M 8.69 4.58 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.70 0.00 115 K 8.66 4.29 0.00 1.79 1.70 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.46 1.47 7.81 116 P 0.00 4.36 0.00 2.17 2.09 0.00 3.74 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 117 G 9.03 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 0.00 118 A 8.23 4.19 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 0.00 119 P 0.00 4.06 0.00 2.31 2.21 0.00 3.60 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 2.14 2.18 0.00 120 F 7.63 4.76 0.00 2.74 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 0.00 121 D 8.28 4.95 0.00 2.89 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 N 8.75 4.33 0.00 2.78 2.88 0.00 0.00 6.65 7.28 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 0.00 123 A 8.14 4.03 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 0.00 124 H 8.57 4.20 0.00 3.54 3.51 0.00 5.82 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 M 8.60 4.18 0.00 2.59 2.18 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.60 0.00 126 T 8.83 4.14 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 127 A 8.06 4.02 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 0.00 0.00 128 H 8.35 4.15 0.00 3.41 3.54 0.00 5.79 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 0.00 129 L 8.22 4.00 0.00 1.71 1.67 0.33 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 130 N 8.36 4.33 0.00 3.05 2.89 0.00 0.00 7.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 T 7.96 3.87 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 1.22 0.00 0.00 132 T 7.91 3.92 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 1.07 0.00 0.00 133 T 8.44 4.02 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 1.34 0.00 0.00 134 R 8.11 3.76 0.00 1.94 1.90 0.00 3.09 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 135 A 7.82 3.92 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 0.00 136 N 8.19 4.17 0.00 2.94 2.67 0.00 0.00 7.05 6.95 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 0.00 137 M 8.05 3.43 0.00 1.37 1.64 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.81 0.00 138 E 7.85 3.82 0.00 2.06 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 2.20 2.34 0.00 139 R 7.82 3.76 0.00 1.94 1.94 0.00 3.06 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 140 I 7.93 3.59 1.67 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.19 0.83 0.00 0.00 141 K 7.82 3.77 0.00 1.78 1.87 0.00 1.53 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.41 7.81 142 K 7.80 3.93 0.00 1.96 1.81 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.64 7.81 143 I 7.64 3.67 1.98 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 1.50 0.85 0.91 0.00 0.00 144 I 7.94 3.77 1.85 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 1.53 0.77 0.92 0.00 0.00 145 E 8.29 4.04 0.00 2.14 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 2.32 2.54 0.00 146 D 8.26 4.31 0.00 2.86 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 0.00 147 R 7.88 4.18 0.00 2.04 2.02 0.00 3.32 0.00 0.00 3.21 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.68 0.00 148 H 8.38 4.16 0.00 3.34 3.49 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 0.00 149 R 7.94 3.83 0.00 1.93 2.16 0.00 3.31 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 150 E 8.60 4.20 0.00 2.22 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 2.33 2.38 0.00 151 G 7.89 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 7.81 4.27 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.49 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00