NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2853 8.3031 122.0279 55.9800 33.0497 175.3131 3 G 3.6548 8.4198 115.5394 45.0281 0.0000 170.8010 4 D 4.5202 8.6666 120.4569 53.6878 42.5764 175.5468 5 K 3.9346 8.8427 126.1521 59.6735 32.2300 179.2525 6 K 3.9628 8.0685 118.3332 59.1211 31.9247 179.4086 7 V 3.5648 8.0189 118.7906 66.0161 31.3805 178.1517 8 I 3.6765 7.7865 119.6309 64.3416 36.8970 178.2438 9 Q 3.9114 7.9261 120.3273 59.3662 28.8031 177.8312 10 H 4.0911 8.2764 117.3328 58.9072 28.7871 177.6610 11 L 3.9979 8.2017 120.8822 58.0800 41.4925 179.4503 12 N 4.5366 8.5437 116.6095 56.0184 38.4577 177.4627 13 K 3.9758 8.0446 121.3204 59.4018 32.3279 179.0172 14 I 3.7317 8.1090 120.5432 64.2513 36.9360 178.0916 15 L 4.0695 8.5433 121.7498 58.1283 42.0131 179.2013 16 G 3.6236 8.1419 105.6565 47.9149 0.0000 175.4029 17 N 4.3664 8.0693 118.2529 56.1171 38.4293 177.3125 18 E 3.9717 8.2674 119.9486 59.4943 29.0312 179.4902 19 L 4.0581 8.2092 119.2188 57.6671 41.6387 179.6353 20 I 3.6334 7.6475 119.2810 64.3270 36.9750 178.3904 21 A 3.3444 7.8461 121.5499 54.6882 18.0891 179.4162 22 I 3.5674 7.7868 118.7548 65.0267 37.2749 178.4268 23 N 4.4200 7.7160 115.9299 56.0153 38.3042 177.5298 24 Q 3.8708 7.9897 121.1981 59.4039 29.1152 177.7667 25 Y 4.8378 7.9258 119.3906 60.5628 37.8576 178.1615 26 F 3.9931 8.4572 121.9292 60.9115 39.4166 177.1418 27 L 3.9644 8.1720 120.1165 58.5520 41.9257 178.5311 28 H 3.8497 8.2513 116.2281 58.7706 28.5406 177.5476 29 S 4.3700 8.4125 115.0683 61.8471 62.1864 176.6704 30 R 3.8811 7.8251 120.2703 58.9632 29.6873 179.1167 31 M 3.4670 7.9133 119.1545 57.9350 31.7969 178.6564 32 W 4.5746 7.8951 119.1050 59.9502 29.1545 178.3600 33 N 4.3840 8.4478 116.4645 56.4796 37.8059 177.0154 34 D 4.3248 8.0269 118.2372 56.8094 41.3435 177.5321 35 W 4.8827 7.9073 117.3235 56.9625 29.3657 177.1172 36 G 3.9933 8.2886 107.4028 46.2961 0.0000 175.5599 37 L 4.5876 8.1648 122.4489 53.4458 38.7829 177.1747 38 K 4.1128 8.6698 121.9759 58.6594 32.5427 178.9764 39 R 3.8753 7.7938 119.1529 59.1594 29.9415 178.3052 40 L 3.7806 7.7814 118.4781 57.6576 41.4561 179.5047 41 G 3.7986 8.2730 105.3747 47.9078 0.0000 175.6005 42 A 4.0319 8.3115 123.4970 55.0460 18.4278 179.2317 43 H 3.8972 8.3445 116.8356 59.3946 29.8142 177.1699 44 E 4.0235 8.5951 121.4372 59.2626 29.4789 178.0607 45 Y 4.0376 8.3853 119.9545 60.8933 38.8596 177.4664 46 H 3.9515 8.3766 119.0424 59.3569 29.9350 176.9391 47 E 3.7790 8.1657 120.1028 59.3675 29.2951 178.9005 48 S 4.2558 8.2419 113.3269 61.9810 62.3641 176.4703 49 I 3.5971 7.5848 121.9252 64.4413 36.7689 178.1889 50 D 4.2488 7.8817 119.7048 57.4183 40.5529 178.7274 51 E 4.1211 8.1808 120.3824 59.0428 29.4639 179.2639 52 M 4.0198 8.0736 118.8588 58.3173 32.1029 178.9850 53 K 4.0042 7.9272 118.6883 59.6758 32.2246 179.1254 54 H 4.2671 8.2437 116.3355 58.8190 28.5528 177.5944 55 A 4.0214 8.3020 122.8135 55.2366 18.2066 179.2155 56 D 4.2434 7.9754 116.3510 57.4308 41.3410 178.6575 57 K 4.0159 7.9773 118.5976 59.3868 32.0642 179.3174 58 L 4.0250 8.0233 119.2485 57.9359 41.5875 179.6693 59 I 3.7749 8.0105 119.8255 64.4688 37.0478 178.3885 60 E 4.0217 8.2346 119.4626 59.2187 29.1553 179.5014 61 R 3.9976 8.1763 118.7947 59.5821 30.1761 178.4512 62 I 3.6885 8.2535 120.0493 64.4937 37.1031 178.2040 63 L 4.1322 7.9947 121.0211 58.0213 41.7156 178.7176 64 F 4.3569 8.1292 119.8914 60.9740 39.5645 176.1060 65 L 4.0091 8.0262 117.1774 54.0584 41.0927 176.8903 66 E 3.6208 7.8722 118.1233 57.0423 28.3208 174.1876 67 G 3.9896 8.0903 106.5483 43.3937 0.0000 173.2659 68 L 4.5770 8.0376 118.8917 52.1286 42.7271 175.1594 69 P 4.4163 0.0000 0.0000 62.2549 31.9193 175.7438 70 N 4.6581 9.2440 122.4968 52.5133 38.3825 174.2950 71 L 4.5713 8.1875 124.4159 54.4917 42.6678 177.7578 72 Q 4.0185 8.1651 120.9086 58.6809 29.2751 175.8299 73 D 4.5784 8.2742 118.1085 53.0604 41.4172 175.4580 74 L 4.5453 8.3425 126.0959 52.8576 43.8656 176.4794 75 G 3.8305 8.3724 116.0596 44.6229 0.0000 171.3181 76 K 4.1731 8.3255 120.7564 55.3151 32.5929 176.8235 77 L 4.0404 8.4240 127.0243 54.5854 42.0732 176.8350 78 L 4.3978 8.6671 124.7507 53.4980 40.8890 175.5145 79 I 4.3611 8.1323 124.6106 59.4320 38.4671 176.5477 80 G 4.0378 8.6898 114.6866 44.5448 0.0000 172.8330 81 E 4.6991 8.7577 115.6325 55.8473 30.4455 175.4745 82 N 5.0199 7.5998 117.2093 51.1091 41.7029 174.9197 83 T 4.3543 8.5271 110.3790 64.9718 68.9806 176.3880 84 Q 3.9514 8.1797 122.0135 59.1307 29.1148 177.9518 85 E 4.0206 8.8017 119.7801 59.5591 29.5003 179.1737 86 M 3.8673 8.3586 119.0233 58.4682 32.0016 178.8970 87 L 4.1841 8.4400 119.4128 57.7809 41.6965 179.3757 88 Q 4.0071 8.2455 119.7027 59.1720 28.9906 177.7858 89 C 4.1472 8.7714 118.3543 63.0833 28.2096 175.8847 90 D 4.6343 8.3683 120.3060 57.3048 40.3281 178.5921 91 L 4.0069 8.1052 120.7760 58.3094 42.1251 178.6205 92 N 4.3285 8.4411 116.6129 56.4192 38.4069 177.1283 93 L 4.0282 8.0461 121.5375 58.2507 42.1291 178.9216 94 E 4.0812 8.5534 118.6455 59.2413 29.3815 179.2128 95 L 3.9922 8.3153 119.4620 57.6947 41.8592 179.3415 96 K 3.8672 8.1256 119.2364 59.6650 32.1091 178.6008 97 A 4.0637 8.2892 121.1544 55.3873 18.2704 179.7997 98 T 3.8109 8.2311 114.5195 66.5709 68.6882 176.6996 99 K 3.9120 8.0113 121.5177 59.7970 32.2433 178.4387 100 D 4.4229 7.9964 118.5580 57.3461 40.7026 178.8288 101 L 3.9997 7.9723 119.4373 57.8126 41.6627 179.6402 102 R 3.9307 8.0480 117.8852 59.5513 30.1628 179.0384 103 E 3.9840 8.1212 117.5402 59.3168 29.4093 179.3409 104 A 3.5764 8.1230 120.8992 54.9366 18.3913 179.7942 105 I 3.6679 7.9074 118.5574 64.2826 37.1346 178.5325 106 V 3.5689 7.8045 119.2384 66.5663 31.4247 177.6832 107 H 4.0859 7.9632 117.1870 59.2560 29.6012 177.0676 108 C 4.1120 8.0922 118.7613 62.5590 27.8959 175.5216 109 E 3.9009 8.1502 120.9001 59.5198 29.0596 178.6416 110 Q 3.9524 7.7909 117.9420 58.5943 29.0429 177.7726 111 V 4.0237 7.1720 110.1012 60.5909 31.9190 175.5737 112 H 3.1381 7.6133 114.0078 57.0469 26.9896 176.3690 113 D 4.5117 7.4698 120.7579 53.3368 37.9717 175.8838 114 Y 4.3280 7.2980 121.1707 60.4130 38.4239 178.0072 115 V 3.6399 7.8114 119.1339 66.1381 31.7258 178.0663 116 S 4.1630 8.2383 114.5298 61.4817 62.5493 176.5867 117 R 3.8953 7.9461 121.1597 59.6772 29.7895 178.3703 118 D 4.3431 8.0961 118.6260 57.0933 40.7874 178.2573 119 L 3.9342 7.8722 120.8811 58.4963 42.0238 179.2641 120 L 4.0313 8.2386 118.8928 57.3170 41.4441 179.3806 121 K 3.9056 8.3016 119.9458 59.6720 32.3157 178.4998 122 D 4.3584 8.2345 119.1600 57.5413 40.6522 179.0334 123 I 3.5564 7.7058 120.2208 64.1614 37.0702 178.2197 124 L 3.9150 8.2987 121.6888 58.0284 41.8706 178.5848 125 E 3.9203 8.3517 119.3950 59.3790 29.5832 178.8159 126 S 4.0577 7.9471 112.7057 61.4362 62.3844 175.9324 127 E 4.1080 8.4438 121.5298 59.4821 29.1685 179.2173 128 E 3.9955 8.6322 119.1355 59.3113 29.5026 179.1176 129 E 4.0290 8.3660 118.7247 59.8053 29.5631 179.1125 130 H 4.3893 8.2643 116.1006 59.0631 28.7557 177.8802 131 I 3.7654 8.1408 121.7828 64.3905 36.8493 177.9309 132 D 4.3173 8.3074 118.8413 57.5748 41.0126 177.5812 133 Y 4.1301 8.1812 119.9496 60.6862 38.7511 178.3034 134 L 3.5690 7.8957 119.6319 57.7449 41.8001 179.1573 135 E 3.8997 8.1929 118.4887 59.7685 29.3422 179.5794 136 T 3.7992 8.0754 115.8947 66.8450 68.5547 176.6747 137 Q 3.7742 7.9798 120.1456 58.8004 28.3226 178.9047 138 L 3.8835 7.8364 120.1465 57.5724 41.6021 179.7262 139 G 3.5804 8.3378 106.1190 47.8716 0.0000 175.7856 140 L 4.0352 7.9703 121.5082 57.3893 41.5064 179.5714 141 I 3.5772 7.4239 119.9249 64.3191 36.7144 178.5069 142 Q 3.9470 7.4373 117.6677 58.9849 28.6536 178.6403 143 K 4.1695 7.9994 118.3407 58.4192 32.2511 178.2947 144 V 4.1815 8.3531 109.8915 60.4904 33.1100 176.7888 145 G 4.0779 7.9339 106.4951 45.7876 0.0000 174.5272 146 L 3.9585 8.4959 122.4040 58.1193 42.1188 179.4418 147 E 3.9789 8.1243 118.0025 59.4342 29.4001 178.8696 148 N 4.3089 8.1380 116.0654 56.4460 38.4527 176.6497 149 Y 3.9721 7.8162 119.6749 60.6550 39.1267 177.7667 150 L 4.0816 8.2506 120.0182 57.8227 41.6277 179.0694 151 Q 3.8993 8.2153 119.5951 59.4662 28.7615 178.4353 152 S 4.2969 8.1321 113.7181 60.0982 63.0387 174.4395 153 H 4.6304 7.8182 118.8954 55.5791 29.4571 175.5313 154 M 4.0824 7.7322 120.9124 58.1273 32.3757 175.2732 155 H 5.1960 7.5491 115.1381 53.9093 30.7077 175.1220 156 E 4.1276 8.7036 121.7611 56.7731 29.2815 176.8241 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 2 K 8.30 4.29 0.00 1.70 1.76 0.00 1.57 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.28 1.46 7.81 3 G 8.42 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.67 4.52 0.00 2.79 2.52 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 0.00 5 K 8.84 3.93 0.00 1.83 1.76 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.51 7.81 6 K 8.07 3.96 0.00 1.75 1.59 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.47 7.81 7 V 8.02 3.56 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 1.17 0.00 0.00 0.95 0.00 0.00 8 I 7.79 3.68 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 1.39 0.51 0.89 0.00 0.00 9 Q 7.93 3.91 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 10 H 8.28 4.09 0.00 3.35 3.32 0.00 5.68 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.20 4.00 0.00 1.86 1.73 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.54 4.54 0.00 2.90 2.85 0.00 0.00 6.71 6.79 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 13 K 8.04 3.98 0.00 1.92 1.95 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 I 8.11 3.73 2.00 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 1.69 1.04 0.92 0.00 0.00 15 L 8.54 4.07 0.00 1.70 1.81 0.95 1.14 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 16 G 8.14 3.62 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 0.00 0.00 0.00 17 N 8.07 4.37 0.00 3.02 2.89 0.00 0.00 7.02 7.52 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 18 E 8.27 3.97 0.00 2.16 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 2.56 2.54 0.00 19 L 8.21 4.06 0.00 1.76 1.67 0.90 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.65 3.63 1.96 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 1.42 0.99 0.85 0.00 0.00 21 A 7.85 3.34 1.03 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 0.00 0.00 22 I 7.79 3.57 1.95 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 1.53 0.64 0.85 0.00 0.00 23 N 7.72 4.42 0.00 2.78 2.82 0.00 0.00 6.76 7.41 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 24 Q 7.99 3.87 0.00 2.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.32 0.00 25 Y 7.93 4.84 0.00 3.01 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.46 3.99 0.00 3.33 3.07 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 27 L 8.17 3.96 0.00 1.92 1.68 0.88 1.03 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 28 H 8.25 3.85 0.00 3.48 2.84 0.00 5.70 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.41 4.37 0.00 3.94 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 30 R 7.83 3.88 0.00 2.01 1.89 0.00 2.98 0.00 0.00 2.66 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 31 M 7.91 3.47 0.00 0.92 1.63 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.18 0.00 32 W 7.90 4.57 0.00 3.61 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 33 N 8.45 4.38 0.00 2.88 2.86 0.00 0.00 6.67 7.59 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 34 D 8.03 4.32 0.00 2.56 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 35 W 7.91 4.88 0.00 3.79 3.18 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 36 G 8.29 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.16 4.59 0.00 2.08 1.64 1.27 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.67 4.11 0.00 1.92 1.86 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.48 7.81 39 R 7.79 3.88 0.00 1.83 1.91 0.00 3.22 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 40 L 7.78 3.78 0.00 1.39 0.34 0.46 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.27 3.80 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 0.00 0.00 0.00 42 A 8.31 4.03 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 43 H 8.34 3.90 0.00 3.34 3.20 0.00 5.79 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.60 4.02 0.00 2.53 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.76 0.00 45 Y 8.39 4.04 0.00 3.06 3.18 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 46 H 8.38 3.95 0.00 3.25 3.38 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.17 3.78 0.00 2.05 1.79 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 2.42 2.22 0.00 48 S 8.24 4.26 0.00 4.15 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.58 3.60 1.75 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.14 0.81 0.00 0.00 50 D 7.88 4.25 0.00 2.90 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 51 E 8.18 4.12 0.00 2.08 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 0.00 2.69 2.34 0.00 52 M 8.07 4.02 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.54 0.00 53 K 7.93 4.00 0.00 1.96 1.84 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.58 7.81 54 H 8.24 4.27 0.00 3.47 3.34 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.30 4.02 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 56 D 7.98 4.24 0.00 2.94 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 57 K 7.98 4.02 0.00 2.01 1.85 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.71 7.81 58 L 8.02 4.03 0.00 1.88 1.73 0.98 0.73 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 59 I 8.01 3.77 2.02 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.96 0.92 0.00 0.00 60 E 8.23 4.02 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 61 R 8.18 4.00 0.00 2.06 2.12 0.00 3.32 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 62 I 8.25 3.69 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.62 0.93 0.00 0.00 63 L 7.99 4.13 0.00 2.05 1.71 0.93 0.95 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 64 F 8.13 4.36 0.00 2.98 3.24 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 65 L 8.03 4.01 0.00 1.81 1.64 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.87 3.62 0.00 1.96 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 2.14 2.23 0.00 67 G 8.09 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 68 L 8.04 4.58 0.00 1.61 1.60 0.91 0.99 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 69 P 0.00 4.42 0.00 2.04 1.98 0.00 3.66 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 2.03 2.07 0.00 70 N 9.24 4.66 0.00 2.62 2.84 0.00 0.00 7.10 7.38 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 71 L 8.19 4.57 0.00 1.62 1.64 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.17 4.02 0.00 1.98 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.88 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 73 D 8.27 4.58 0.00 2.70 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.34 4.55 0.00 1.50 1.50 0.88 1.06 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 75 G 8.37 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.33 4.17 0.00 1.70 1.73 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.52 7.81 77 L 8.42 4.04 0.00 1.63 1.56 0.96 0.99 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 78 L 8.67 4.40 0.00 1.77 1.69 1.02 0.73 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 79 I 8.13 4.36 1.88 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 1.33 0.79 0.91 0.00 0.00 80 G 8.69 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.76 4.70 0.00 2.17 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 2.49 2.23 0.00 82 N 7.60 5.02 0.00 2.89 2.87 0.00 0.00 5.98 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.53 4.35 5.45 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 1.68 0.00 0.00 84 Q 8.18 3.95 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 85 E 8.80 4.02 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.65 0.00 86 M 8.36 3.87 0.00 1.30 2.07 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.06 0.00 87 L 8.44 4.18 0.00 1.86 1.71 0.84 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 8.25 4.01 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 89 C 8.77 4.15 0.00 3.32 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.37 4.63 0.00 2.96 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 91 L 8.11 4.01 0.00 1.88 1.86 0.95 0.44 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 92 N 8.44 4.33 0.00 2.94 2.90 0.00 0.00 6.71 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 93 L 8.05 4.03 0.00 1.87 1.98 0.93 1.02 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 94 E 8.55 4.08 0.00 2.12 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 0.00 2.71 2.63 0.00 95 L 8.32 3.99 0.00 1.70 1.75 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.13 3.87 0.00 1.91 1.99 0.00 1.54 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.53 7.81 97 A 8.29 4.06 1.42 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 0.00 0.00 0.00 98 T 8.23 3.81 4.61 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 1.27 0.00 0.00 99 K 8.01 3.91 0.00 1.86 1.97 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.51 7.81 100 D 8.00 4.42 0.00 2.93 2.73 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 0.00 101 L 7.97 4.00 0.00 1.98 1.72 0.92 1.03 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 0.00 102 R 8.05 3.93 0.00 2.04 1.99 0.00 3.14 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 103 E 8.12 3.98 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 104 A 8.12 3.58 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 0.00 105 I 7.91 3.67 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.75 0.93 0.00 0.00 106 V 7.80 3.57 2.24 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 0.97 0.00 0.00 0.93 0.00 0.00 107 H 7.96 4.09 0.00 3.24 3.22 0.00 5.84 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 0.00 108 C 8.09 4.11 0.00 3.15 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.15 3.90 0.00 2.15 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 0.00 2.37 2.46 0.00 110 Q 7.79 3.95 0.00 2.05 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.94 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 111 V 7.17 4.02 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 0.79 0.00 0.00 0.98 0.00 0.00 112 H 7.61 3.14 0.00 3.17 3.23 0.00 5.64 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.47 4.51 0.00 2.61 2.47 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 0.00 114 Y 7.30 4.33 0.00 3.10 2.96 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 0.00 115 V 7.81 3.64 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 1.09 0.00 0.00 1.00 0.00 0.00 116 S 8.24 4.16 0.00 3.99 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 0.00 117 R 7.95 3.90 0.00 1.96 2.12 0.00 3.17 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 118 D 8.10 4.34 0.00 2.97 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 0.00 119 L 7.87 3.93 0.00 1.87 1.89 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 120 L 8.24 4.03 0.00 1.85 1.70 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 121 K 8.30 3.91 0.00 2.16 1.94 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.36 7.81 122 D 8.23 4.36 0.00 2.92 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 I 7.71 3.56 1.95 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 1.12 0.66 0.75 0.00 0.00 124 L 8.30 3.91 0.00 1.81 1.89 0.93 0.75 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 0.00 125 E 8.35 3.92 0.00 2.07 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 2.31 2.33 0.00 126 S 7.95 4.06 0.00 3.99 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 0.00 127 E 8.44 4.11 0.00 2.13 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 0.00 2.60 2.53 0.00 128 E 8.63 4.00 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 129 E 8.37 4.03 0.00 2.21 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 2.36 2.53 0.00 130 H 8.26 4.39 0.00 3.56 3.42 0.00 5.64 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 0.00 131 I 8.14 3.77 2.09 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 1.47 0.76 0.94 0.00 0.00 132 D 8.31 4.32 0.00 2.94 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 0.00 133 Y 8.18 4.13 0.00 3.16 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 0.00 134 L 7.90 3.57 0.00 2.10 1.65 0.94 1.04 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 0.00 135 E 8.19 3.90 0.00 2.07 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 2.31 2.34 0.00 136 T 8.08 3.80 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 137 Q 7.98 3.77 0.00 1.62 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 1.46 1.84 0.00 138 L 7.84 3.88 0.00 1.90 1.61 0.82 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.34 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 0.00 140 L 7.97 4.04 0.00 1.77 1.86 1.05 1.06 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 0.00 141 I 7.42 3.58 1.74 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.18 0.81 0.00 0.00 142 Q 7.44 3.95 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 143 K 8.00 4.17 0.00 1.72 1.87 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.61 7.81 144 V 8.35 4.18 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 0.76 0.00 0.00 1.09 0.00 0.00 145 G 7.93 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 0.00 146 L 8.50 3.96 0.00 1.76 1.68 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.12 3.98 0.00 2.06 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 2.39 2.40 0.00 148 N 8.14 4.31 0.00 2.93 2.89 0.00 0.00 6.75 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Y 7.82 3.97 0.00 3.03 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 0.00 150 L 8.25 4.08 0.00 1.75 1.72 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.22 3.90 0.00 2.14 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 152 S 8.13 4.30 0.00 3.72 3.66 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 0.00 0.00 0.00 0.00 153 H 7.82 4.63 0.00 2.94 3.00 0.00 5.81 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 M 7.73 4.08 0.00 1.73 2.06 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.39 0.00 155 H 7.55 5.20 0.00 3.14 3.15 0.00 5.77 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 0.00 156 E 8.70 4.13 0.00 1.95 1.85 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 2.30 2.30 0.00