NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3657 8.2893 120.3496 54.8554 33.1530 178.3661 2 T 3.5876 9.1987 105.9288 61.8004 68.7832 173.0199 3 H 4.5449 8.7201 129.4554 54.7328 29.2180 174.7749 4 D 4.5699 7.5724 121.8876 54.4066 42.2321 174.2263 5 N 5.0587 7.8148 117.8800 52.7191 45.7800 175.5221 6 K 4.3393 7.2873 113.6183 56.9537 34.6083 173.7736 7 L 4.8291 7.5649 118.8435 53.1326 45.5239 175.2445 8 Q 4.1624 8.5100 118.4444 56.1157 29.0878 176.0585 9 V 4.4690 8.0781 121.7586 60.7685 34.7654 174.1400 10 E 4.4375 8.5816 122.6290 54.8061 31.2084 175.0910 11 A 4.8938 8.1254 123.8776 50.4585 22.6333 175.5110 12 I 4.7384 7.9361 111.7895 60.8541 39.5480 173.7053 13 K 4.7109 8.4315 118.6275 57.2254 34.6392 180.2079 14 R 5.1181 7.6194 132.1574 54.9074 30.1094 174.0059 15 G 4.9073 8.3918 110.5165 43.8956 0.0000 168.4245 16 T 5.1014 8.8079 110.1329 60.9851 70.7221 174.1911 17 V 4.7620 9.0607 123.8726 61.2304 35.1793 174.1163 18 I 5.6160 8.7064 127.4863 58.9189 40.4607 174.3936 19 A 4.8518 8.3864 128.4362 49.9313 23.1584 174.4281 20 H 4.1116 8.2656 111.1390 57.1250 26.4733 175.2866 21 I 4.5486 7.3229 119.5855 58.6580 38.8063 173.8514 22 P 4.3364 0.0000 0.0000 62.8470 31.0329 175.4176 23 A 4.3003 8.5356 125.6356 54.3689 18.4953 177.1453 24 Q 4.1847 9.2337 120.9018 55.9553 28.0048 174.9083 25 I 4.4676 7.7365 117.5801 61.0411 37.4506 177.6557 26 G 3.5761 8.9989 109.2823 47.7958 0.0000 175.8910 27 F 4.1273 8.2494 123.1953 60.8060 39.3712 176.8080 28 K 3.7757 8.2333 117.5646 59.5937 31.8361 178.9582 29 L 3.5023 7.6546 118.6924 57.6083 41.6617 179.2942 30 L 3.8994 8.2966 119.1739 58.7869 41.5631 179.0649 31 S 4.0404 8.9184 116.7327 59.6715 62.1245 177.2942 32 L 3.1406 7.4539 123.1765 57.8109 42.0173 178.9233 33 F 4.5334 7.5889 122.4280 58.0733 40.4607 175.4123 34 K 3.8464 7.8255 117.5160 57.4890 29.1902 175.4456 35 L 4.5360 7.5250 115.2440 54.9596 43.0082 178.8280 36 T 3.9918 7.8136 109.3846 64.4193 68.8871 175.0428 37 E 4.3173 7.8516 120.8082 54.9237 27.8015 175.3373 38 T 4.5793 7.5013 115.5636 61.6575 71.7271 173.9933 39 D 4.7302 8.5306 120.3813 53.2280 39.8773 176.0009 40 Q 4.3486 8.2168 119.7910 54.5230 30.2808 175.3267 41 R 3.9921 8.3693 122.5139 56.9795 30.8198 175.4910 42 I 4.7492 8.3155 127.0099 60.3007 39.9071 175.3788 43 T 4.7785 8.3790 119.8163 62.2597 72.8592 173.2054 44 I 5.0698 8.5186 125.1155 59.7064 41.7125 175.9347 45 G 3.9914 9.1328 111.4728 45.0907 0.0000 172.4304 46 L 4.6560 8.6111 126.7151 53.9584 43.4904 178.3695 47 N 3.9391 8.2126 110.7921 54.8168 34.9540 173.2951 48 L 4.6432 8.2266 124.8907 51.9542 44.1347 175.2907 49 P 4.7601 0.0000 0.0000 63.2844 29.1369 175.8750 50 S 4.4358 9.7166 117.1675 57.2189 62.4672 179.0090 51 G 3.7521 7.6066 105.9967 47.4435 0.0000 174.9416 52 E 4.0834 7.9778 118.5391 58.2749 30.7328 177.9364 53 M 4.3871 8.4008 119.4395 57.0169 33.9644 179.4148 54 G 3.7110 8.3071 108.6795 46.3075 0.0000 175.3224 55 R 5.9676 9.1648 115.3175 53.3729 34.8762 174.8505 56 K 4.8614 8.3731 117.8720 55.9992 36.3799 175.0224 57 D 5.1358 8.4944 121.7308 53.4316 43.4437 175.6433 58 L 4.5453 8.1728 117.8244 54.5912 46.2737 173.5118 59 I 4.6645 8.6027 127.2400 59.6877 39.5006 174.7108 60 K 4.5588 9.4061 128.8697 55.3267 31.9834 175.2720 61 I 4.2012 8.4241 125.2936 60.4155 38.0034 175.2997 62 E 4.2265 8.6528 127.8310 55.8142 31.1281 175.9711 63 N 4.4171 8.4573 117.0253 52.9685 36.6898 174.2447 64 T 4.4354 7.4359 114.9900 61.7182 72.4928 173.0933 65 F 5.3885 8.2598 122.5191 54.6792 42.0793 174.5375 66 L 4.5987 8.4945 124.4021 52.8952 43.0475 176.8628 67 S 4.2423 8.8798 119.1918 58.0111 63.3233 175.1703 68 E 3.9755 8.9374 122.8587 58.9348 29.2940 178.8848 69 D 4.4320 8.2336 120.7236 57.4330 41.0225 177.9866 70 Q 3.8421 7.6928 117.8030 59.5396 28.8618 179.6620 71 V 3.4804 7.6154 118.2998 66.2154 31.5652 177.3710 72 D 4.6056 7.8210 119.3718 57.1293 40.5271 178.8391 73 Q 3.8853 7.7969 116.9766 59.2469 28.8875 179.3286 74 L 4.0697 8.3490 119.4174 58.7669 41.5084 181.7680 75 A 3.4750 7.5464 118.4505 54.8355 19.8871 178.2968 76 L 4.0363 7.4892 113.9054 56.8311 42.0194 177.7165 77 Y 4.5482 7.9170 114.8280 59.0538 39.0228 176.2411 78 A 4.7513 7.6526 120.4541 50.5546 20.4156 174.5418 79 P 4.2712 0.0000 0.0000 65.5539 31.6995 178.7404 80 Q 4.1735 7.9650 114.7077 55.9701 29.2007 176.0538 81 A 5.0953 7.3834 119.8588 52.0036 19.1040 177.0781 82 T 4.6012 8.5900 118.4952 62.0469 71.4486 174.2798 83 V 4.6280 9.1690 126.3846 61.5467 33.0931 173.2633 84 N 5.3550 9.4728 126.5576 51.6435 40.7239 174.7327 85 R 4.4756 9.1578 123.9938 55.9768 31.7751 175.5706 86 I 5.3717 9.2063 125.2295 58.9314 39.8748 174.2061 87 D 5.1177 8.6591 126.6623 52.2717 44.1014 175.0337 88 N 3.7381 9.3222 119.2180 55.9810 36.9563 173.0200 89 Y 4.1485 7.8318 108.9569 58.4766 36.7262 170.9913 90 E 4.6854 8.3983 116.5006 54.9622 33.8270 175.3729 91 V 3.9110 8.2103 121.8856 63.2780 30.2932 175.6613 92 V 3.7730 8.5325 128.1483 65.0755 32.4746 176.4674 93 G 4.0197 7.7141 107.7914 44.4430 0.0000 172.0220 94 K 5.4680 8.6908 126.3411 55.5988 32.9329 176.6827 95 S 4.8102 8.8297 121.3928 56.6622 65.6965 173.4495 96 R 4.8482 8.4549 123.0668 53.6520 32.4594 174.2239 97 P 4.3775 0.0000 0.0000 62.6668 31.5261 176.1724 98 S 4.5080 8.6905 119.6773 56.5602 63.8906 172.5000 99 L 4.3216 8.1558 126.1681 53.5730 42.4158 175.1293 100 P 4.6574 0.0000 0.0000 62.4258 33.7954 174.7352 101 E 4.4813 8.8025 116.0352 58.4698 30.5596 176.4208 102 R 5.4737 7.8302 113.9034 53.5942 32.3325 175.0141 103 I 4.6060 8.3926 122.0899 60.0337 39.0743 174.1844 104 D 4.9179 8.8132 127.8499 54.4119 42.7492 177.9114 105 N 4.5024 8.6792 119.3763 54.7646 36.7573 175.2671 106 V 4.3646 7.5001 114.0098 62.0831 34.0206 176.3050 107 L 4.4791 7.8331 118.8523 53.2260 43.0744 176.1421 108 V 4.2324 7.8059 119.5725 60.7725 33.0603 174.7160 109 C 4.3871 9.2012 128.1499 59.7257 31.4060 172.3157 110 P 4.4512 0.0000 0.0000 63.4126 30.9187 175.9830 111 N 4.5733 8.1351 118.3075 53.2805 38.6651 174.8073 112 S 4.3007 8.8135 122.6334 61.9304 63.1830 176.7043 113 N 4.5804 8.0085 117.2158 53.8368 38.3726 173.4965 114 C 4.6149 7.6276 117.9346 57.8680 34.2659 171.6405 115 I 4.2927 7.8787 117.8591 61.3043 39.2421 177.4471 116 S 3.8531 7.9227 113.7107 61.0320 62.9155 175.3123 117 H 4.3589 8.2301 117.6315 58.5063 28.6393 176.1667 118 A 4.2777 7.7219 119.4304 52.8291 18.9604 176.3315 119 E 4.7812 7.5402 113.6199 53.4508 32.7410 175.4476 120 P 4.5922 0.0000 0.0000 62.6386 30.3640 177.0630 121 V 4.4895 7.5117 109.8978 59.5862 34.5206 175.4985 122 S 4.8181 8.5795 119.1731 57.0316 63.9488 174.1951 123 S 4.3882 8.8656 119.2915 59.4631 63.7979 173.5997 124 S 5.3893 8.5455 116.7696 57.0284 66.0163 172.4841 125 F 5.2430 9.1274 123.8725 55.6571 43.8750 173.1335 126 A 4.9183 8.7945 122.8774 50.4384 21.0188 176.3880 127 V 4.3897 9.0758 124.3365 62.2727 31.7416 175.8643 128 R 4.4517 8.6417 130.6898 54.0177 31.1213 174.2888 129 K 4.4530 8.5349 127.9021 56.1488 32.7559 176.1473 130 R 4.3550 8.7444 123.4524 54.9956 31.2114 175.0522 131 A 3.3766 9.1701 126.9841 53.8977 16.6855 176.2631 132 N 4.1320 8.3250 111.4767 54.8187 36.3451 174.8203 133 D 4.5335 7.8858 115.6892 53.1544 45.4246 173.6856 134 I 4.6963 8.1527 126.7459 60.1204 39.6101 174.3247 135 A 5.2385 8.3544 125.9457 50.1389 22.4439 175.2703 136 L 5.2042 9.0207 120.8362 52.9188 45.2496 175.7468 137 K 4.4470 9.3032 127.2246 54.7824 33.3599 175.2593 138 C 3.2936 8.4266 129.7564 58.9751 31.7913 174.5591 139 K 3.4230 8.2047 126.0603 59.9927 32.1985 176.9306 140 Y 3.9270 7.9230 118.6386 59.1436 37.0794 175.7892 141 C 4.1089 8.3751 120.4582 59.8529 30.4446 175.2265 142 E 3.9521 7.6262 118.4008 57.1778 27.3246 173.8632 143 K 4.4257 7.0898 117.9837 54.8705 34.4336 175.1372 144 E 4.7907 8.2720 123.7946 54.6052 31.9887 174.7395 145 F 5.5171 8.4968 125.9802 55.9867 43.2465 174.2098 146 S 5.1442 8.5798 114.3478 57.8711 65.3251 175.2968 147 H 4.2001 9.2419 116.7752 58.8741 28.5599 176.8239 148 N 4.1939 7.6504 119.8798 55.4881 36.6857 176.9918 149 V 3.4827 7.7881 120.2333 65.7014 31.9203 177.6414 150 V 3.9094 7.4971 115.6709 63.7858 31.1922 176.6534 151 L 4.4781 7.4011 116.0888 56.1605 42.1927 177.4249 152 A 4.3532 7.5911 119.5631 52.9119 18.8000 176.9066 153 N 4.3800 7.5119 119.1265 53.1498 37.4093 174.3614 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 8.29 4.37 0.00 2.00 1.35 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 2 T 9.20 3.59 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 1.17 0.00 0.00 3 H 8.72 4.54 0.00 3.11 3.27 0.00 5.75 0.00 0.00 0.00 0.00 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 7.57 4.57 0.00 2.62 2.53 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 5 N 7.81 5.06 0.00 2.57 2.69 0.00 0.00 6.78 7.61 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 6 K 7.29 4.34 0.00 1.78 1.81 0.00 1.51 0.00 0.00 1.69 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.18 1.33 7.81 7 L 7.56 4.83 0.00 1.57 1.59 0.91 0.94 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 8 Q 8.51 4.16 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 9 V 8.08 4.47 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 0.83 0.00 0.00 0.99 0.00 0.00 10 E 8.58 4.44 0.00 2.08 1.90 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 2.19 2.22 0.00 11 A 8.13 4.89 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 I 7.94 4.74 1.90 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 1.45 0.80 0.96 0.00 0.00 13 K 8.43 4.71 0.00 1.69 0.98 0.00 1.74 0.00 0.00 1.96 0.00 0.00 3.08 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.36 1.59 7.81 14 R 7.62 5.12 0.00 1.76 2.09 0.00 3.08 0.00 0.00 3.26 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.42 0.00 15 G 8.39 4.91 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 16 T 8.81 5.10 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 1.43 0.00 0.00 17 V 9.06 4.76 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 1.00 0.00 0.00 0.98 0.00 0.00 18 I 8.71 5.62 1.92 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 1.16 1.35 0.98 0.00 0.00 19 A 8.39 4.85 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 H 8.27 4.11 0.00 3.30 3.29 0.00 5.61 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.32 4.55 2.06 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 1.53 0.77 0.98 0.00 0.00 22 P 0.00 4.34 0.00 2.25 2.27 0.00 3.78 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.04 0.00 23 A 8.54 4.30 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 24 Q 9.23 4.18 0.00 2.16 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.80 0.00 0.00 0.00 0.00 0.00 2.25 2.42 0.00 25 I 7.74 4.47 2.02 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.10 1.04 0.00 0.00 26 G 9.00 3.58 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 0.00 0.00 0.00 27 F 8.25 4.13 0.00 3.10 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 28 K 8.23 3.78 0.00 1.95 1.64 0.00 1.76 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.61 7.81 29 L 7.65 3.50 0.00 1.89 1.93 1.04 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.30 3.90 0.00 1.58 1.53 1.03 1.03 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 31 S 8.92 4.04 0.00 3.45 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 32 L 7.45 3.14 0.00 1.17 0.27 -0.11 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.59 4.53 0.00 3.15 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 34 K 7.83 3.85 0.00 1.89 2.27 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.33 1.68 7.81 35 L 7.53 4.54 0.00 1.75 1.72 1.03 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.81 3.99 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 1.16 0.00 0.00 37 E 7.85 4.32 0.00 2.09 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 2.27 2.29 0.00 38 T 7.50 4.58 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 1.23 0.00 0.00 39 D 8.53 4.73 0.00 2.79 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 40 Q 8.22 4.35 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.93 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 41 R 8.37 3.99 0.00 1.92 2.04 0.00 3.07 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 42 I 8.32 4.75 1.88 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 1.38 0.83 0.92 0.00 0.00 43 T 8.38 4.78 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 44 I 8.52 5.07 1.91 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 1.31 0.64 0.99 0.00 0.00 45 G 9.13 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 46 L 8.61 4.66 0.00 1.55 1.63 0.90 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.21 3.94 0.00 2.78 3.08 0.00 0.00 6.79 7.85 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 48 L 8.23 4.64 0.00 1.65 1.40 0.97 0.82 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 49 P 0.00 4.76 0.00 2.03 2.02 0.00 3.35 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 50 S 9.72 4.44 0.00 3.91 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 51 G 7.61 3.75 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 0.00 0.00 0.00 52 E 7.98 4.08 0.00 2.10 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 2.25 0.00 53 M 8.40 4.39 0.00 2.04 2.10 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 2.47 2.60 0.00 54 G 8.31 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 55 R 9.16 5.97 0.00 1.64 1.80 0.00 3.29 0.00 0.00 3.94 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 56 K 8.37 4.86 0.00 1.88 1.90 0.00 1.51 0.00 0.00 1.75 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.45 7.81 57 D 8.49 5.14 0.00 2.63 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 58 L 8.17 4.55 0.00 1.73 1.61 0.93 0.90 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 59 I 8.60 4.66 1.91 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 1.27 0.99 0.94 0.00 0.00 60 K 9.41 4.56 0.00 1.78 1.79 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.43 7.81 61 I 8.42 4.20 2.03 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 1.12 0.71 0.93 0.00 0.00 62 E 8.65 4.23 0.00 2.15 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 0.00 2.27 2.39 0.00 63 N 8.46 4.42 0.00 2.73 2.81 0.00 0.00 7.04 7.54 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 64 T 7.44 4.44 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 1.17 0.00 0.00 65 F 8.26 5.39 0.00 3.03 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 66 L 8.49 4.60 0.00 1.66 1.61 0.95 0.92 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 67 S 8.88 4.24 0.00 4.15 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 68 E 8.94 3.98 0.00 2.13 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 2.28 2.37 0.00 69 D 8.23 4.43 0.00 2.70 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 70 Q 7.69 3.84 0.00 2.27 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.59 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 71 V 7.62 3.48 2.22 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 1.06 0.00 0.00 0.97 0.00 0.00 72 D 7.82 4.61 0.00 2.98 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 73 Q 7.80 3.89 0.00 1.85 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 74 L 8.35 4.07 0.00 1.76 1.86 0.97 0.91 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 75 A 7.55 3.47 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 76 L 7.49 4.04 0.00 0.57 1.37 0.73 0.67 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 77 Y 7.92 4.55 0.00 3.06 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 78 A 7.65 4.75 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 79 P 0.00 4.27 0.00 2.18 2.42 0.00 3.80 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 2.01 2.00 0.00 80 Q 7.96 4.17 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 81 A 7.38 5.10 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 82 T 8.59 4.60 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 1.36 0.00 0.00 83 V 9.17 4.63 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 1.07 0.00 0.00 0.95 0.00 0.00 84 N 9.47 5.35 0.00 2.67 2.74 0.00 0.00 6.84 6.23 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 85 R 9.16 4.48 0.00 1.70 1.52 0.00 2.82 0.00 0.00 2.89 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.47 0.00 86 I 9.21 5.37 2.12 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 1.17 1.89 1.06 0.00 0.00 87 D 8.66 5.12 0.00 2.80 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.32 3.74 0.00 2.73 2.78 0.00 0.00 7.17 7.54 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 89 Y 7.83 4.15 0.00 3.09 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 90 E 8.40 4.69 0.00 2.11 1.82 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 2.31 2.43 0.00 91 V 8.21 3.91 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 0.96 0.00 0.00 92 V 8.53 3.77 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 0.71 0.00 0.00 0.97 0.00 0.00 93 G 7.71 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 94 K 8.69 5.47 0.00 1.65 1.78 0.00 1.75 0.00 0.00 2.37 0.00 0.00 2.72 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.62 1.31 7.81 95 S 8.83 4.81 0.00 3.95 3.72 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 96 R 8.45 4.85 0.00 1.67 1.82 0.00 3.21 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 97 P 0.00 4.38 0.00 2.15 2.18 0.00 3.64 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.09 0.00 98 S 8.69 4.51 0.00 3.84 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 99 L 8.16 4.32 0.00 1.60 1.54 0.90 0.92 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 0.00 100 P 0.00 4.66 0.00 2.23 2.08 0.00 3.80 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 101 E 8.80 4.48 0.00 1.95 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 2.34 2.29 0.00 102 R 7.83 5.47 0.00 1.82 1.90 0.00 2.60 0.00 0.00 3.89 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.49 0.00 103 I 8.39 4.61 2.01 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.14 1.06 0.00 0.00 104 D 8.81 4.92 0.00 2.69 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 0.00 105 N 8.68 4.50 0.00 2.94 3.39 0.00 0.00 6.72 7.75 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 0.00 106 V 7.50 4.36 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 1.11 0.00 0.00 1.28 0.00 0.00 107 L 7.83 4.48 0.00 1.59 1.27 0.56 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.81 4.23 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 0.78 0.00 0.00 0.93 0.00 0.00 109 C 9.20 4.39 0.00 3.66 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 0.00 110 P 0.00 4.45 0.00 1.48 1.88 0.00 4.09 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.07 0.00 111 N 8.14 4.57 0.00 3.10 2.93 0.00 0.00 7.14 8.97 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 0.00 112 S 8.81 4.30 0.00 3.91 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 0.00 113 N 8.01 4.58 0.00 2.68 2.82 0.00 0.00 6.81 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 0.00 114 C 7.63 4.61 0.00 3.05 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 0.00 115 I 7.88 4.29 1.85 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 1.44 1.09 0.81 0.00 0.00 116 S 7.92 3.85 0.00 4.00 3.77 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 0.00 117 H 8.23 4.36 0.00 3.14 3.39 0.00 5.71 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 0.00 118 A 7.72 4.28 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 E 7.54 4.78 0.00 1.82 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 120 P 0.00 4.59 0.00 2.04 2.08 0.00 3.60 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 121 V 7.51 4.49 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 0.73 0.00 0.00 0.32 0.00 0.00 122 S 8.58 4.82 0.00 3.82 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 0.00 123 S 8.87 4.39 0.00 4.36 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 0.00 124 S 8.55 5.39 0.00 4.05 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 0.00 125 F 9.13 5.24 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 0.00 126 A 8.79 4.92 1.22 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 0.00 0.00 0.00 127 V 9.08 4.39 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 0.74 0.00 0.00 1.01 0.00 0.00 128 R 8.64 4.45 0.00 1.93 1.80 0.00 3.15 0.00 0.00 3.09 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 129 K 8.53 4.45 0.00 1.80 1.71 0.00 1.78 0.00 0.00 1.86 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.42 7.81 130 R 8.74 4.36 0.00 1.98 2.00 0.00 2.99 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 131 A 9.17 3.38 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 0.00 132 N 8.33 4.13 0.00 2.82 2.82 0.00 0.00 6.88 8.06 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 0.00 133 D 7.89 4.53 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.15 4.70 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.32 0.92 0.00 0.00 135 A 8.35 5.24 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 0.00 136 L 9.02 5.20 0.00 1.64 1.68 0.85 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 137 K 9.30 4.45 0.00 2.03 1.69 0.00 1.58 0.00 0.00 1.51 0.00 0.00 2.85 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.30 1.31 7.81 138 C 8.43 3.29 0.00 2.86 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 0.00 139 K 8.20 3.42 0.00 1.55 1.77 0.00 1.39 0.00 0.00 1.53 0.00 0.00 2.13 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.06 0.55 7.81 140 Y 7.92 3.93 0.00 2.96 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 0.00 141 C 8.38 4.11 0.00 3.13 3.25 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 0.00 142 E 7.63 3.95 0.00 2.06 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 2.15 2.37 0.00 143 K 7.09 4.43 0.00 1.47 1.10 0.00 1.67 0.00 0.00 1.52 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.60 7.81 144 E 8.27 4.79 0.00 1.83 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 2.16 2.42 0.00 145 F 8.50 5.52 0.00 3.09 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 0.00 146 S 8.58 5.14 0.00 4.05 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 0.00 147 H 9.24 4.20 0.00 3.23 3.48 0.00 5.77 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 N 7.65 4.19 0.00 2.84 2.98 0.00 0.00 5.82 7.68 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 0.00 149 V 7.79 3.48 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 0.82 0.00 0.00 0.96 0.00 0.00 150 V 7.50 3.91 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 0.75 0.00 0.00 1.03 0.00 0.00 151 L 7.40 4.48 0.00 1.79 1.71 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 152 A 7.59 4.35 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 0.00 153 N 7.51 4.38 0.00 2.88 2.71 0.00 0.00 6.76 7.44 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