NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.4981 8.3149 120.1431 56.3875 34.0943 175.3349 3 T 4.2257 8.2107 124.2819 63.1039 67.7756 175.1164 4 Y 3.3933 9.6520 123.7969 59.2484 34.4672 168.2448 5 V 3.8438 7.3184 115.9267 60.0671 32.7088 174.2805 6 P 4.7288 0.0000 0.0000 62.0288 32.8270 179.3349 7 K 4.4771 7.4689 119.5388 56.0462 31.5396 176.6403 8 Q 4.4868 8.6088 117.3397 54.8676 32.6170 173.3708 9 V 3.2674 7.2413 110.7558 60.7155 31.4421 175.9439 10 E 4.7997 8.2376 117.9694 54.9871 30.5892 174.5810 11 P 4.3937 0.0000 0.0000 62.9422 32.7943 174.9420 12 R 5.3375 6.8916 122.5234 56.4890 31.4120 173.1744 13 W 5.8618 8.9731 123.5085 53.8712 32.9068 174.1999 14 V 4.7292 8.6161 124.9448 61.1092 33.7505 174.5542 15 L 4.8146 9.0250 128.6606 54.2578 42.6224 175.5550 16 I 4.4465 8.4899 126.2207 59.7028 38.5697 175.5199 17 D 3.6770 8.8048 126.1610 55.6727 40.2390 177.2641 18 A 4.0258 8.7226 126.5111 50.5919 17.6429 177.0152 19 E 4.7562 7.0896 116.6202 55.8002 31.0913 178.2440 20 G 3.9486 8.6493 110.6333 46.0023 0.0000 173.6443 21 K 4.4860 7.7144 119.2496 54.4877 34.1072 175.7212 22 T 4.5192 8.8425 117.0428 63.1908 69.2983 175.2656 23 L 3.3395 9.1310 121.8009 53.1343 42.9840 178.6877 24 G 3.9627 9.7788 115.5591 48.9578 0.0000 174.7228 25 R 3.9070 7.9356 118.0004 58.7723 29.5653 178.1622 26 L 3.8872 8.1227 121.2404 58.7148 42.0349 177.9093 27 A 3.8678 8.6021 118.8090 55.3986 17.9281 179.8046 28 T 3.7661 8.3953 109.0874 64.9875 68.2282 175.3835 29 K 3.9606 8.7344 120.4903 58.1791 31.6960 178.8697 30 I 3.5964 8.1238 120.6174 65.5456 37.4772 176.9857 31 A 3.7276 8.5437 117.2903 57.1817 18.1247 179.0442 32 T 3.8898 8.2689 114.4987 65.4043 68.8254 176.4450 33 L 3.9173 7.7575 122.0835 57.9321 43.0442 179.9401 34 L 4.3140 8.0597 119.8674 52.7151 39.4701 178.8831 35 R 4.2594 7.5401 115.9143 56.0343 29.6189 177.5263 36 G 4.4350 9.3352 117.6899 46.2882 0.0000 173.6288 37 K 4.7276 7.3119 119.6039 55.5078 32.8463 172.7205 38 H 4.4783 8.6991 128.6772 55.8035 34.1178 174.1192 39 R 4.7148 8.4476 119.2182 53.9701 31.0273 173.0522 40 P 2.0000 0.0000 0.0000 60.1720 33.3203 174.8875 41 D 4.2368 7.4961 116.2949 54.5831 38.3951 174.0835 42 W 4.9823 7.5297 115.5777 57.4497 27.5943 177.4700 43 T 4.4388 7.9402 120.9122 61.7238 71.2480 173.5281 44 P 3.5079 0.0000 0.0000 65.9506 30.5682 176.9483 45 N 4.4141 9.1975 109.1825 54.0465 40.7229 173.7171 46 V 3.6920 8.7918 118.6268 61.5367 31.0614 173.1147 47 A 4.0604 9.0618 121.5757 51.6741 17.3838 180.0022 48 M 2.5637 8.2079 112.0009 53.1873 34.5147 176.4486 49 G 4.0491 8.9916 101.2012 48.3282 0.0000 172.7516 50 D 3.8258 7.0650 115.4852 48.5748 42.0507 175.3899 51 F 4.8986 8.6831 124.7973 57.5379 39.5137 174.3154 52 V 4.8732 8.3971 124.1960 59.8558 33.9199 174.9918 53 V 5.6173 9.2855 123.8463 60.5049 35.2955 174.4325 54 V 5.0123 7.8905 124.4294 61.4843 35.2970 172.1300 55 V 4.3937 8.9320 119.5298 63.0107 35.9065 172.0675 56 N 5.5669 8.6453 115.3277 54.8360 36.0290 177.0706 57 A 4.1347 7.9425 123.3397 54.9544 18.7944 180.4902 58 D 4.8483 7.9110 113.1893 53.5050 38.8473 177.0139 59 K 4.4950 8.4123 116.8534 56.5847 34.7910 175.7959 60 I 4.3258 8.0565 120.3550 61.2127 38.4690 175.3812 61 R 4.4539 8.7324 124.7483 53.8987 31.4642 176.6348 62 V 4.0944 8.4132 121.5218 62.3131 30.5249 176.8069 63 T 4.2277 8.7265 106.5862 61.9086 70.1221 174.1752 64 G 3.9752 8.4806 110.7527 45.3360 0.0000 174.8441 65 K 3.8238 7.5667 119.0444 54.0729 31.8779 174.7165 66 K 3.5176 9.3189 124.6287 57.4436 32.3123 174.6668 67 L 3.7578 8.7255 124.7363 55.1391 41.5707 173.8518 68 E 3.8099 9.1982 116.3985 57.2444 26.6963 175.5709 69 Q 4.4861 7.6789 118.9355 54.8891 31.6941 172.4869 70 K 4.9669 8.2771 122.1300 53.9951 34.9303 176.2352 71 I 3.9454 8.7693 126.8560 61.7415 38.4549 174.4369 72 Y 4.8881 8.7263 127.0839 56.5197 40.0761 175.7162 73 T 3.9705 8.4333 123.5912 61.3517 69.2178 173.2621 74 R 4.5878 6.7481 125.2045 53.9125 28.4473 174.6881 75 Y 3.9341 9.1505 120.6440 60.3353 38.7290 178.8904 76 S 3.4048 8.0424 110.8187 59.3938 60.6524 173.0363 77 G 4.1331 8.5007 118.2343 45.9545 0.0000 170.6502 78 Y 3.6389 8.3179 122.0293 57.6900 38.5039 167.9717 79 P 4.1887 0.0000 0.0000 63.3053 29.1210 176.7828 80 G 3.9183 8.0423 106.0393 44.0540 0.0000 172.0053 81 G 3.6979 7.4483 112.6524 43.3320 0.0000 173.0878 82 L 4.1505 8.5060 123.5974 55.5442 42.0380 177.2189 83 K 3.4402 7.7356 114.6216 57.5143 29.8273 174.1078 84 K 4.9027 8.4320 123.1398 54.8015 33.6721 176.2935 85 I 4.4834 8.6196 127.0338 58.7201 39.8927 173.9433 86 P 4.8942 0.0000 0.0000 61.8881 32.3873 177.5505 87 L 3.8750 8.6029 123.9729 59.5435 39.9669 179.3379 88 E 3.9175 8.3256 119.1487 59.3382 29.3601 179.5642 89 K 4.0472 8.1227 117.4611 59.9152 33.0116 178.2553 90 M 3.7655 8.2023 119.7512 58.8121 31.6126 178.6575 91 L 4.0200 8.4775 119.9107 59.6654 41.0450 179.2740 92 A 4.0355 7.5701 121.4784 54.0190 18.4652 178.0429 93 T 4.4216 8.1304 112.1807 64.9383 71.4832 174.5790 94 H 5.3716 8.5924 116.2512 51.8996 29.7199 172.2784 95 P 4.2548 0.0000 0.0000 65.8280 31.5000 178.1070 96 E 3.9047 8.2112 117.1874 59.2661 29.2118 179.0670 97 R 3.8474 8.1747 118.9982 59.9126 30.1985 178.8500 98 V 3.2802 8.0505 116.0521 65.9522 31.6396 177.4837 99 L 3.9815 8.5435 119.1337 59.8630 40.2828 178.6100 100 E 3.6523 8.5483 117.4274 59.5609 29.2948 178.7282 101 H 4.0447 8.1979 116.8219 59.8244 30.1363 176.8672 102 A 3.9730 8.0679 122.1668 55.2248 18.1789 179.6205 103 V 3.5929 8.0826 110.4910 64.9519 31.5556 178.6248 104 K 4.9328 8.6784 116.8495 60.5650 32.0485 179.8481 105 G 4.1424 8.0823 105.3335 47.6192 0.0000 175.1020 106 M 4.3459 7.7204 119.8750 55.6137 32.7712 177.1011 107 L 3.7319 7.7623 121.3811 54.9423 42.5976 174.6872 108 P 4.6383 0.0000 0.0000 61.3819 33.8250 174.0812 109 K 4.0044 8.6814 117.7106 55.5001 32.7294 174.4224 110 G 3.8031 8.7395 106.9859 45.0011 0.0000 173.2874 111 P 4.2445 0.0000 0.0000 66.7920 31.5746 177.3202 112 L 4.2171 8.2736 117.9114 55.5667 41.7773 179.3225 113 G 4.5064 7.6034 106.3859 49.3082 0.0000 174.5115 114 R 3.7045 8.3302 118.9036 59.8813 29.9032 177.7271 115 R 3.9041 8.6711 118.7177 59.3614 30.2850 178.9232 116 L 3.6646 7.8565 119.7060 58.1064 42.4398 178.4948 117 F 4.3019 7.8650 117.1441 60.5548 38.5285 177.4979 118 K 4.0460 8.0370 117.3124 59.6759 32.2210 178.7127 119 R 4.0186 7.9632 114.6797 56.9798 29.6702 175.4985 120 L 5.2824 8.2778 121.1294 53.2106 44.3926 175.9664 121 K 4.8056 9.2983 125.1955 55.1501 36.8804 175.5085 122 V 4.0442 7.5908 122.3965 59.8419 34.8001 173.8930 123 Y 4.7596 8.1474 117.3217 63.7214 37.8457 178.4335 124 A 3.5196 7.4314 122.3287 54.5989 21.3625 179.3332 125 G 3.8552 9.2698 104.0272 45.7438 0.0000 172.3674 126 P 3.4772 0.0000 0.0000 61.4796 33.4930 176.3369 127 D 5.4106 8.5756 132.0405 53.6258 39.0710 179.1152 128 H 4.0486 8.0103 118.4771 58.5876 28.5714 175.1377 129 P 3.9520 0.0000 0.0000 66.4446 30.3854 177.6076 130 H 4.2690 8.6238 115.4864 58.9219 28.5996 176.9752 131 Q 4.0602 8.2919 119.3875 59.2854 28.4247 179.3829 132 A 4.1329 7.9258 119.5223 54.6891 19.1278 178.1852 133 Q 4.0910 7.7600 117.5116 55.0118 27.0876 175.8737 134 R 3.9754 8.0910 121.9199 57.9835 30.5953 174.9340 135 P 4.1766 0.0000 0.0000 61.6669 31.2789 174.3473 136 E 4.0542 8.2319 116.7425 57.6812 29.5527 178.0844 137 K 4.6814 8.0872 114.6373 54.9217 34.1707 175.0604 138 L 4.2710 9.1111 123.7932 55.5597 43.7085 176.9216 139 E 5.0860 8.3595 118.2901 55.4796 33.7086 175.8284 140 V 4.0395 8.8262 123.8684 63.5094 32.1504 172.9508 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 8.31 4.50 0.00 1.90 1.77 0.00 1.76 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.52 7.81 3 T 8.21 4.23 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 4 Y 9.65 3.39 0.00 3.07 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 5 V 7.32 3.84 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.86 0.00 0.00 6 P 0.00 4.73 0.00 2.15 2.05 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 7 K 7.47 4.48 0.00 1.88 1.47 0.00 1.46 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.38 7.81 8 Q 8.61 4.49 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.64 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 9 V 7.24 3.27 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 0.74 0.00 0.00 0.95 0.00 0.00 10 E 8.24 4.80 0.00 2.02 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 2.02 2.06 0.00 11 P 0.00 4.39 0.00 2.53 2.37 0.00 3.96 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 2.12 0.00 12 R 6.89 5.34 0.00 2.05 2.11 0.00 2.94 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.38 0.00 13 W 8.97 5.86 0.00 3.78 2.99 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 14 V 8.62 4.73 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 1.12 0.00 0.00 1.03 0.00 0.00 15 L 9.03 4.81 0.00 1.60 1.57 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 16 I 8.49 4.45 1.90 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 1.13 0.61 0.93 0.00 0.00 17 D 8.80 3.68 0.00 2.72 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 18 A 8.72 4.03 1.51 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 0.00 0.00 19 E 7.09 4.76 0.00 2.08 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 2.36 2.29 0.00 20 G 8.65 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.71 4.49 0.00 2.01 1.72 0.00 1.78 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.64 7.81 22 T 8.84 4.52 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 23 L 9.13 3.34 0.00 1.80 1.12 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 24 G 9.78 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 25 R 7.94 3.91 0.00 2.10 2.20 0.00 3.05 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.91 0.00 26 L 8.12 3.89 0.00 1.82 2.02 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.60 3.87 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 28 T 8.40 3.77 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 29 K 8.73 3.96 0.00 2.14 1.69 0.00 1.76 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.73 7.81 30 I 8.12 3.60 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 1.47 0.55 0.93 0.00 0.00 31 A 8.54 3.73 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 32 T 8.27 3.89 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 33 L 7.76 3.92 0.00 1.59 1.88 0.95 1.26 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 34 L 8.06 4.31 0.00 1.79 1.47 0.91 1.17 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 35 R 7.54 4.26 0.00 1.91 1.90 0.00 3.23 0.00 0.00 2.25 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.84 0.00 36 G 9.34 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 K 7.31 4.73 0.00 1.84 1.71 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.25 1.49 7.81 38 H 8.70 4.48 0.00 3.14 3.27 0.00 5.77 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 R 8.45 4.71 0.00 1.86 1.83 0.00 3.27 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 1.44 1.58 0.00 40 P 0.00 2.00 0.00 1.72 1.32 0.00 3.68 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 41 D 7.50 4.24 0.00 2.67 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 42 W 7.53 4.98 0.00 3.23 3.42 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 43 T 7.94 4.44 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 1.23 0.00 0.00 44 P 0.00 3.51 0.00 2.25 2.09 0.00 3.76 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 2.10 2.07 0.00 45 N 9.20 4.41 0.00 2.71 2.90 0.00 0.00 6.96 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 46 V 8.79 3.69 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 0.79 0.00 0.00 0.88 0.00 0.00 47 A 9.06 4.06 1.55 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 48 M 8.21 2.56 0.00 2.09 1.93 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.62 0.00 49 G 8.99 4.05 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 0.00 50 D 7.06 3.83 0.00 2.62 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 51 F 8.68 4.90 0.00 1.51 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.40 4.87 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 0.80 0.00 0.00 0.97 0.00 0.00 53 V 9.29 5.62 2.33 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 1.40 0.00 0.00 1.31 0.00 0.00 54 V 7.89 5.01 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 0.67 0.00 0.00 1.01 0.00 0.00 55 V 8.93 4.39 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 0.88 0.00 0.00 1.16 0.00 0.00 56 N 8.65 5.57 0.00 3.02 3.08 0.00 0.00 6.84 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 57 A 7.94 4.13 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 D 7.91 4.85 0.00 2.81 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 K 8.41 4.50 0.00 1.65 1.78 0.00 1.85 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.39 7.81 60 I 8.06 4.33 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 1.24 0.58 1.03 0.00 0.00 61 R 8.73 4.45 0.00 2.01 1.78 0.00 3.12 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 62 V 8.41 4.09 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 0.88 0.00 0.00 0.94 0.00 0.00 63 T 8.73 4.23 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 1.22 0.00 0.00 64 G 8.48 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.57 3.82 0.00 1.75 1.87 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.53 7.81 66 K 9.32 3.52 0.00 1.88 1.81 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.44 7.81 67 L 8.73 3.76 0.00 1.85 1.71 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.00 0.00 68 E 9.20 3.81 0.00 2.13 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 2.21 2.32 0.00 69 Q 7.68 4.49 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.87 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 70 K 8.28 4.97 0.00 1.63 1.73 0.00 1.89 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.39 7.81 71 I 8.77 3.95 1.89 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.97 0.92 0.00 0.00 72 Y 8.73 4.89 0.00 2.99 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.43 3.97 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 1.30 0.00 0.00 74 R 6.75 4.59 0.00 1.74 1.62 0.00 3.17 0.00 0.00 3.31 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.48 0.00 75 Y 9.15 3.93 0.00 2.77 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 76 S 8.04 3.40 0.00 3.92 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 G 8.50 4.13 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 0.00 78 Y 8.32 3.64 0.00 3.17 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 79 P 0.00 4.19 0.00 2.20 2.12 0.00 4.58 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 80 G 8.04 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 81 G 7.45 3.70 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 0.00 0.00 0.00 82 L 8.51 4.15 0.00 1.76 1.73 1.17 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 83 K 7.74 3.44 0.00 1.96 1.73 0.00 1.46 0.00 0.00 1.82 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.31 7.81 84 K 8.43 4.90 0.00 1.64 1.78 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.47 7.81 85 I 8.62 4.48 1.87 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 1.20 0.59 0.91 0.00 0.00 86 P 0.00 4.89 0.00 2.11 1.97 0.00 3.64 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 87 L 8.60 3.88 0.00 1.90 1.99 1.03 1.10 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 88 E 8.33 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 2.42 2.48 0.00 89 K 8.12 4.05 0.00 1.93 2.05 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 90 M 8.20 3.77 0.00 2.09 2.33 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.61 0.00 91 L 8.48 4.02 0.00 1.80 1.81 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 92 A 7.57 4.04 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 93 T 8.13 4.42 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 1.17 0.00 0.00 94 H 8.59 5.37 0.00 3.11 3.14 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.25 0.00 2.27 2.32 0.00 3.75 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.05 0.00 96 E 8.21 3.90 0.00 2.14 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 97 R 8.17 3.85 0.00 2.00 1.99 0.00 3.25 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 98 V 8.05 3.28 2.31 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 1.06 0.00 0.00 1.05 0.00 0.00 99 L 8.54 3.98 0.00 1.98 1.94 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 100 E 8.55 3.65 0.00 2.08 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.42 0.00 101 H 8.20 4.04 0.00 3.16 3.33 0.00 5.70 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 0.00 102 A 8.07 3.97 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 0.00 103 V 8.08 3.59 2.28 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 0.97 0.00 0.00 1.19 0.00 0.00 104 K 8.68 4.93 0.00 1.81 1.87 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.98 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.60 1.47 7.81 105 G 8.08 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 0.00 106 M 7.72 4.35 0.00 2.02 2.14 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 2.60 2.53 0.00 107 L 7.76 3.73 0.00 1.14 1.66 -0.58 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 108 P 0.00 4.64 0.00 2.21 2.16 0.00 3.66 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.88 0.00 109 K 8.68 4.00 0.00 1.82 2.12 0.00 1.59 0.00 0.00 1.69 0.00 0.00 3.21 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.54 7.81 110 G 8.74 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 0.00 111 P 0.00 4.24 0.00 2.27 2.35 0.00 3.70 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 2.08 2.08 0.00 112 L 8.27 4.22 0.00 1.60 1.60 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 113 G 7.60 4.51 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 0.00 0.00 0.00 114 R 8.33 3.70 0.00 2.12 2.04 0.00 3.17 0.00 0.00 3.22 8.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 115 R 8.67 3.90 0.00 2.02 1.95 0.00 3.19 0.00 0.00 3.11 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 116 L 7.86 3.66 0.00 1.33 1.37 0.73 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 117 F 7.87 4.30 0.00 3.30 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 0.00 118 K 8.04 4.05 0.00 1.98 2.02 0.00 1.75 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.57 1.80 7.81 119 R 7.96 4.02 0.00 1.57 1.40 0.00 2.51 0.00 0.00 2.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.66 0.00 120 L 8.28 5.28 0.00 1.54 1.73 1.00 0.69 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 0.00 121 K 9.30 4.81 0.00 1.90 1.73 0.00 2.00 0.00 0.00 1.95 0.00 0.00 3.10 0.00 0.00 3.50 0.00 0.00 0.00 0.00 1.53 1.57 7.81 122 V 7.59 4.04 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 0.59 0.00 0.00 0.89 0.00 0.00 123 Y 8.15 4.76 0.00 2.90 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 0.00 124 A 7.43 3.52 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 0.00 125 G 9.27 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 0.00 126 P 0.00 3.48 0.00 2.36 1.94 0.00 3.92 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 1.95 1.94 0.00 127 D 8.58 5.41 0.00 3.13 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 0.00 128 H 8.01 4.05 0.00 3.21 3.42 0.00 5.84 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 0.00 129 P 0.00 3.95 0.00 1.99 2.26 0.00 3.76 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.35 0.00 130 H 8.62 4.27 0.00 3.31 3.42 0.00 5.71 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.29 4.06 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.66 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 132 A 7.93 4.13 1.14 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 0.00 133 Q 7.76 4.09 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.90 0.00 0.00 0.00 0.00 0.00 2.33 2.59 0.00 134 R 8.09 3.98 0.00 1.65 1.85 0.00 3.08 0.00 0.00 3.83 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 135 P 0.00 4.18 0.00 1.59 1.64 0.00 3.45 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.83 0.00 136 E 8.23 4.05 0.00 2.14 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 2.42 2.42 0.00 137 K 8.09 4.68 0.00 1.74 1.76 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.43 1.48 7.81 138 L 9.11 4.27 0.00 1.76 1.69 1.05 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 139 E 8.36 5.09 0.00 1.82 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 2.23 2.27 0.00 140 V 8.83 4.04 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 0.81 0.00 0.00 0.94 0.00 0.00