NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.7777 8.4449 117.8357 56.2436 29.9883 172.9614 1D H 4.5170 8.7008 119.0937 55.9259 29.4424 172.9791 1E H 5.0693 7.5486 115.4715 53.7055 33.6386 171.8763 1F H 4.7016 8.8596 116.8821 55.7795 29.1383 174.3549 1G F 4.9093 8.3881 119.4169 57.8735 39.8722 174.0167 2 N 4.6476 8.5427 116.9865 52.4074 39.2211 174.4957 3 L 4.8185 8.0555 122.9948 51.8761 44.2449 174.6643 4 P 4.5179 0.0000 0.0000 61.8322 32.0626 174.9402 5 P 4.2652 0.0000 0.0000 65.1464 31.6718 176.8649 6 G 3.8509 7.7293 107.5551 45.0954 0.0000 170.5249 7 N 4.4292 8.0484 114.9732 51.8915 40.0236 173.6045 8 Y 5.0365 7.7016 114.4206 58.0586 38.6724 177.6710 9 K 4.2017 8.7745 122.6848 58.6708 32.3556 177.4280 10 K 4.7685 7.6107 115.6798 53.3031 36.0839 173.8270 11 P 4.7018 0.0000 0.0000 63.3934 32.1821 175.6025 12 V 4.7621 9.1127 113.6979 60.1050 36.9610 173.8548 13 L 5.0356 9.1276 121.6272 53.3225 44.3217 176.2758 14 L 5.0294 8.5954 123.0512 53.5332 43.0048 174.6075 15 Y 4.7382 9.2845 127.2962 56.8438 40.3033 173.6701 16 C 3.9802 8.5879 128.7713 58.0342 32.3349 174.2032 17 S 3.9486 8.0835 121.4903 60.2936 62.6583 175.4022 18 N 4.1965 7.9540 119.3994 56.3052 38.7439 175.5060 19 G 3.8781 7.5491 102.0103 44.5441 0.0000 173.2108 20 G 3.3419 7.7366 107.3164 43.6330 0.0000 173.4955 21 H 4.6109 7.2779 116.0632 54.7637 30.8647 174.1128 22 F 5.2893 8.9802 120.4233 55.9058 40.5614 175.2893 23 L 4.5997 9.0588 126.0424 55.4158 43.2459 175.6122 24 R 4.9241 9.4483 126.2452 54.6070 33.5908 174.0436 25 I 4.8199 8.2218 126.6716 59.3490 38.8047 175.6950 26 L 4.0811 8.9045 128.1044 53.4312 42.3046 176.9799 27 P 4.1876 0.0000 0.0000 65.8467 31.2567 177.4572 28 D 4.4950 7.9418 114.3327 53.7651 39.5778 177.0095 29 G 4.1511 8.3858 109.7535 45.3671 0.0000 173.9021 30 T 4.2863 8.3205 117.5444 63.2211 69.1150 173.6047 31 V 4.8980 7.9761 124.5470 61.2384 34.4494 174.5545 32 D 4.5751 8.4643 125.0572 53.1137 42.8323 174.1792 33 G 4.5510 8.5687 104.5147 45.4901 0.0000 172.2263 34 T 4.9936 8.8203 114.7017 60.5561 71.0087 174.7223 35 R 4.2989 8.8499 124.3073 56.8401 31.1350 176.3417 36 D 4.5420 8.2904 118.8742 53.6740 40.2178 176.5501 37 R 3.7737 8.6053 127.6990 58.0424 30.2976 177.1753 38 S 4.3665 8.3431 111.0795 59.0542 63.7425 174.1342 39 D 4.3444 7.6049 121.2587 55.1898 41.1450 176.1277 40 Q 4.3502 8.4451 122.8419 56.4188 29.4261 175.9279 41 H 4.8769 9.1225 116.0103 55.4395 28.9706 175.5436 42 I 4.5771 7.4396 110.8348 59.8870 38.2389 175.2191 43 Q 4.2500 7.8377 122.0386 55.7323 29.7278 174.7749 44 L 4.9978 8.9445 124.3643 52.7741 45.7411 175.3798 45 Q 4.8288 9.2379 124.2529 54.4257 31.0241 174.7070 46 L 5.0436 8.5668 126.6246 54.2646 43.3563 176.2288 47 S 4.6540 8.4451 114.2310 57.0532 66.7163 172.7403 48 A 4.8646 8.6196 122.9429 52.3587 20.6788 175.1939 49 E 4.1169 8.9896 121.1329 56.6646 29.4110 178.4867 50 S 4.5981 5.8100 114.2234 56.7596 65.0773 173.6144 51 V 3.8628 8.2138 121.3864 64.8175 31.5580 176.2895 52 G 3.9338 9.1615 114.2047 45.4283 0.0000 171.8985 53 E 5.1839 8.2322 119.8046 54.5928 32.1544 175.6302 54 V 4.9024 8.9483 116.4365 59.9433 36.8080 173.9346 55 Y 5.2132 8.8146 119.9567 56.5099 41.2408 175.2053 56 I 4.4623 8.5744 122.2646 59.6060 40.3594 174.0873 57 K 4.6509 8.6504 129.0956 54.0380 35.0007 175.0824 58 S 4.5669 8.6948 123.2137 58.5186 62.5790 174.8818 59 T 3.8390 8.5730 118.6785 64.3552 68.7205 175.8194 60 E 4.0950 8.3210 122.7581 58.1654 29.9598 176.9091 61 T 4.3172 8.0413 106.6722 60.7259 70.3991 175.4790 62 G 3.7979 8.2244 109.6384 45.1214 0.0000 173.5806 63 Q 4.4211 7.5507 118.7084 55.9475 30.3552 174.5714 64 Y 4.8163 8.7927 119.3216 55.9554 40.9686 175.1805 65 L 4.3973 9.0435 125.6626 55.2759 43.4459 175.6267 66 A 5.1416 8.7267 126.1774 50.4931 23.1130 174.3116 67 M 5.3118 8.8037 119.9820 53.8997 34.7619 175.6804 68 D 5.2583 9.5061 126.1110 51.7228 41.3502 176.8749 69 T 4.2658 8.5029 107.8862 63.6386 68.8164 174.5259 70 D 4.6423 8.3855 121.0447 54.0400 41.4969 177.0592 71 G 3.1431 8.4129 108.4665 45.1906 0.0000 173.2245 72 L 4.7186 7.8773 119.6765 53.1822 43.1416 175.8990 73 L 5.1863 8.2171 121.7640 54.8249 43.1152 175.3936 74 Y 4.9451 8.7488 118.8452 56.1472 41.9528 173.4216 75 G 4.2454 8.9510 108.6806 45.4378 0.0000 173.2529 76 S 5.0806 9.0284 120.9992 56.8396 64.0551 175.3107 77 Q 4.1886 9.0240 124.8710 58.0632 28.9692 176.4374 78 T 4.7285 7.6035 106.3307 59.0690 71.7068 172.7794 79 P 3.9061 0.0000 0.0000 61.0408 29.9630 174.6907 80 N 4.9763 7.4913 124.2369 51.5928 40.3176 175.8761 81 E 3.8662 8.7511 114.9115 59.7162 29.5024 177.5193 82 E 4.1904 8.8755 117.7534 57.2721 29.7399 177.1583 83 C 5.1691 7.9155 115.4198 58.6242 29.2993 173.3896 84 L 4.2676 7.2571 121.2831 53.6194 42.8392 175.6454 85 F 5.1092 8.9152 121.9337 55.5124 43.2986 174.3497 86 L 4.8182 9.2737 123.0422 53.9199 42.7183 175.3805 87 E 4.5597 8.8275 126.6268 55.0453 30.4133 175.5627 88 R 4.8190 8.5145 125.2094 54.0293 34.7847 174.5935 89 L 4.7281 8.6874 124.0282 55.2728 43.0992 175.8230 90 E 4.7200 9.1231 124.8171 55.2465 33.6877 174.7726 91 E 4.0089 9.7235 123.2345 57.9246 27.3302 174.1641 92 N 4.2974 8.3995 110.1993 54.0644 36.6348 174.0968 93 H 4.7704 8.0931 116.6976 57.4299 37.4373 173.3020 94 Y 4.6901 8.0240 116.7504 57.4231 39.9920 173.7704 95 N 5.5030 9.5805 118.4698 52.0354 41.0535 174.6611 96 T 5.2448 8.8518 112.9378 60.1665 72.8060 172.7733 97 Y 4.9720 8.5983 119.0717 56.6153 41.4934 174.1614 98 I 4.5527 8.5484 126.1020 59.1633 39.4803 175.5609 99 S 3.9461 8.7718 122.1141 58.6909 62.3950 174.1791 100 K 3.9869 8.7251 129.1942 59.2894 32.2782 178.8277 101 K 3.8521 7.8693 118.5205 58.9094 32.3773 176.6671 102 H 4.6387 7.9973 115.2538 55.0161 29.4778 176.2462 103 A 3.9265 7.7006 125.6665 55.3395 18.2672 180.5078 104 E 3.7778 7.8819 114.6716 58.1753 29.7934 177.2425 105 K 3.9993 7.5783 116.2387 55.8810 32.7463 175.8555 106 N 3.9620 7.4845 115.6605 53.9745 36.5365 174.5895 107 W 5.0630 7.7302 117.5168 55.7079 31.0660 177.1174 108 F 5.4326 9.1110 123.8718 55.4181 41.1388 175.7518 109 V 3.8945 8.9114 122.0340 63.1185 32.3742 175.2469 110 G 4.4439 8.5983 112.8227 45.2938 0.0000 171.4361 111 L 5.2602 8.4580 121.0650 52.4707 45.3266 177.2004 112 K 4.2186 9.2157 123.1446 55.4185 33.0048 178.3531 113 K 3.9224 8.4233 119.4562 59.5753 31.8992 178.1188 114 N 4.4893 7.9898 113.3800 53.1666 37.8093 175.8355 115 G 3.5356 8.2409 109.2191 45.0997 0.0000 173.7345 116 S 4.7564 8.4291 115.0869 56.8252 64.4852 173.7258 117 V 4.0504 8.0762 121.9149 63.0819 32.1512 175.0921 118 K 4.4871 8.5470 129.8608 54.5775 32.8137 176.3570 119 R 3.9606 8.6576 124.7964 56.2625 30.3820 177.6994 120 G 3.4054 8.9181 111.5908 48.3946 0.0000 174.2585 121 P 4.4124 0.0000 0.0000 64.1765 31.3750 177.2990 122 R 4.4413 7.9382 116.2092 55.9893 30.4931 176.1000 123 T 5.0875 7.5525 108.2489 59.8588 70.8525 173.3130 124 H 4.7688 7.8539 115.1119 54.9503 30.5644 173.0974 125 Y 3.9306 8.7523 118.3670 59.7905 38.1148 177.1413 126 G 4.0456 9.0192 111.1291 45.4562 0.0000 173.9920 127 Q 4.2211 7.3462 118.6207 55.2317 29.8634 176.9672 128 K 3.8705 8.2336 118.4128 58.3849 32.9210 179.4199 129 A 3.9846 7.9926 121.1085 53.8765 18.3655 178.4436 130 I 4.4273 7.1643 106.1589 60.4441 38.5379 175.2880 131 L 4.3743 7.2698 123.2145 53.9554 42.7344 175.8046 132 F 5.4502 9.4246 122.3193 55.5976 43.4614 174.0868 133 L 5.3449 9.3030 120.9549 52.3925 45.2093 174.0487 134 P 5.0791 0.0000 0.0000 62.5859 32.2002 175.3318 135 L 4.9251 9.0990 126.0599 51.7080 44.0789 174.6019 136 P 4.5589 0.0000 0.0000 63.0430 31.9610 176.7148 137 V 3.7455 8.2439 113.9156 61.8447 31.5354 176.1367 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 1C H 8.44 4.78 0.00 3.11 3.44 0.00 5.67 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 1D H 8.70 4.52 0.00 3.20 3.21 0.00 5.64 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.55 5.07 0.00 3.16 3.32 0.00 5.70 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.86 4.70 0.00 3.34 3.41 0.00 5.66 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 1G F 8.39 4.91 0.00 2.89 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 2 N 8.54 4.65 0.00 2.96 2.78 0.00 0.00 6.84 6.74 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 3 L 8.06 4.82 0.00 1.46 1.39 0.56 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.52 0.00 2.18 2.18 0.00 3.70 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 2.00 1.99 0.00 5 P 0.00 4.27 0.00 2.18 2.20 0.00 3.75 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 1.96 1.94 0.00 6 G 7.73 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 7 N 8.05 4.43 0.00 2.52 2.60 0.00 0.00 5.75 7.55 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 8 Y 7.70 5.04 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 9 K 8.77 4.20 0.00 1.81 1.89 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.51 7.81 10 K 7.61 4.77 0.00 1.70 1.68 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.41 7.81 11 P 0.00 4.70 0.00 2.06 2.04 0.00 3.72 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 1.98 1.99 0.00 12 V 9.11 4.76 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 0.80 0.00 0.00 1.03 0.00 0.00 13 L 9.13 5.04 0.00 1.66 1.66 0.33 0.62 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 14 L 8.60 5.03 0.00 1.57 1.63 0.35 0.89 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 15 Y 9.28 4.74 0.00 3.26 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 16 C 8.59 3.98 0.00 2.49 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.08 3.95 0.00 3.87 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 18 N 7.95 4.20 0.00 2.52 2.64 0.00 0.00 6.75 7.98 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 19 G 7.55 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 20 G 7.74 3.34 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 0.00 21 H 7.28 4.61 0.00 3.03 3.27 0.00 5.80 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 22 F 8.98 5.29 0.00 3.04 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 23 L 9.06 4.60 0.00 1.83 1.53 0.95 0.22 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 24 R 9.45 4.92 0.00 1.90 2.05 0.00 3.21 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 25 I 8.22 4.82 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.73 0.88 0.00 0.00 26 L 8.90 4.08 0.00 1.85 1.51 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.19 0.00 1.99 2.10 0.00 3.53 0.00 0.00 3.21 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 28 D 7.94 4.49 0.00 2.78 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 29 G 8.39 4.15 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 0.00 0.00 0.00 30 T 8.32 4.29 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 1.22 0.00 0.00 31 V 7.98 4.90 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 0.83 0.00 0.00 0.93 0.00 0.00 32 D 8.46 4.58 0.00 2.71 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.57 4.55 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 0.00 34 T 8.82 4.99 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 1.36 0.00 0.00 35 R 8.85 4.30 0.00 1.88 1.99 0.00 3.21 0.00 0.00 3.09 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.51 0.00 36 D 8.29 4.54 0.00 2.83 2.66 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 37 R 8.61 3.77 0.00 1.89 1.91 0.00 3.29 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.02 0.00 38 S 8.34 4.37 0.00 3.98 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 39 D 7.60 4.34 0.00 2.83 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 40 Q 8.45 4.35 0.00 1.86 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.12 0.00 0.00 0.00 0.00 0.00 2.28 2.21 0.00 41 H 9.12 4.88 0.00 3.32 3.45 0.00 5.77 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.44 4.58 1.89 0.00 0.00 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 1.57 1.06 1.04 0.00 0.00 43 Q 7.84 4.25 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.87 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 44 L 8.94 5.00 0.00 1.48 1.42 0.81 0.81 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 45 Q 9.24 4.83 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 46 L 8.57 5.04 0.00 1.54 1.07 0.85 0.98 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 47 S 8.45 4.65 0.00 3.97 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 48 A 8.62 4.86 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.99 4.12 0.00 1.76 1.70 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 2.20 2.30 0.00 50 S 5.81 4.60 0.00 4.12 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 51 V 8.21 3.86 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 0.94 0.00 0.00 1.03 0.00 0.00 52 G 9.16 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 0.00 0.00 0.00 53 E 8.23 5.18 0.00 2.11 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 2.20 2.29 0.00 54 V 8.95 4.90 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 0.62 0.00 0.00 1.16 0.00 0.00 55 Y 8.81 5.21 0.00 2.98 3.04 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 56 I 8.57 4.46 1.72 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.57 0.67 0.00 0.00 57 K 8.65 4.65 0.00 1.43 1.50 0.00 1.20 0.00 0.00 1.19 0.00 0.00 2.67 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.89 0.21 7.81 58 S 8.69 4.57 0.00 3.85 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 59 T 8.57 3.84 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 1.16 0.00 0.00 60 E 8.32 4.10 0.00 1.98 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 2.19 2.36 0.00 61 T 8.04 4.32 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 1.24 0.00 0.00 62 G 8.22 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 63 Q 7.55 4.42 0.00 1.94 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.71 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 64 Y 8.79 4.82 0.00 2.91 2.89 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 65 L 9.04 4.40 0.00 1.60 1.49 0.79 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.73 5.14 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.80 5.31 0.00 2.22 2.27 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.64 0.00 68 D 9.51 5.26 0.00 3.00 2.95 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 69 T 8.50 4.27 4.38 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 1.35 0.00 0.00 70 D 8.39 4.64 0.00 2.79 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 71 G 8.41 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 0.00 0.00 0.00 72 L 7.88 4.72 0.00 2.07 1.60 0.82 0.52 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 73 L 8.22 5.19 0.00 1.56 1.60 0.88 0.88 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 74 Y 8.75 4.95 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 75 G 8.95 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 S 9.03 5.08 0.00 3.68 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 77 Q 9.02 4.19 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.54 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 78 T 7.60 4.73 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 79 P 0.00 3.91 0.00 0.65 0.49 0.00 3.48 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.27 0.00 80 N 7.49 4.98 0.00 2.95 2.98 0.00 0.00 5.85 7.66 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 81 E 8.75 3.87 0.00 2.04 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 2.28 2.33 0.00 82 E 8.88 4.19 0.00 2.19 2.29 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 2.37 2.46 0.00 83 C 7.92 5.17 0.00 3.23 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 84 L 7.26 4.27 0.00 1.32 1.28 0.77 0.07 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 85 F 8.92 5.11 0.00 3.13 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 9.27 4.82 0.00 1.52 1.59 0.89 0.75 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 87 E 8.83 4.56 0.00 2.11 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 2.17 1.89 0.00 88 R 8.51 4.82 0.00 1.77 1.79 0.00 3.13 0.00 0.00 2.88 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.62 0.00 89 L 8.69 4.73 0.00 1.74 1.61 1.02 1.10 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 90 E 9.12 4.72 0.00 2.23 1.87 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 2.30 2.44 0.00 91 E 9.72 4.01 0.00 2.40 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 2.30 2.40 0.00 92 N 8.40 4.30 0.00 2.83 2.88 0.00 0.00 6.89 8.16 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 93 H 8.09 4.77 0.00 2.85 3.01 0.00 5.91 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.02 4.69 0.00 3.01 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 95 N 9.58 5.50 0.00 3.00 2.52 0.00 0.00 6.95 7.06 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 96 T 8.85 5.24 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 97 Y 8.60 4.97 0.00 2.74 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 98 I 8.55 4.55 1.65 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.50 0.63 0.00 0.00 99 S 8.77 3.95 0.00 4.09 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 0.00 100 K 8.73 3.99 0.00 1.69 1.64 0.00 1.60 0.00 0.00 1.46 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.30 7.81 101 K 7.87 3.85 0.00 1.74 1.63 0.00 1.82 0.00 0.00 1.66 0.00 0.00 3.15 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.01 1.31 7.81 102 H 8.00 4.64 0.00 3.25 2.62 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.70 3.93 1.38 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 0.00 0.00 104 E 7.88 3.78 0.00 1.56 1.77 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 2.11 2.05 0.00 105 K 7.58 4.00 0.00 0.79 0.90 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.49 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.97 0.85 7.81 106 N 7.48 3.96 0.00 3.01 3.06 0.00 0.00 6.89 7.73 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 0.00 107 W 7.73 5.06 0.00 3.26 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 0.00 108 F 9.11 5.43 0.00 2.86 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 0.00 109 V 8.91 3.89 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 0.62 0.00 0.00 0.42 0.00 0.00 110 G 8.60 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 0.00 111 L 8.46 5.26 0.00 1.47 1.44 1.00 0.93 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 0.00 112 K 9.22 4.22 0.00 1.94 1.68 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.47 7.81 113 K 8.42 3.92 0.00 1.70 1.84 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.36 7.81 114 N 7.99 4.49 0.00 2.78 2.90 0.00 0.00 6.23 7.00 0.00 0.00 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 G 8.24 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.43 4.76 0.00 3.93 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 0.00 117 V 8.08 4.05 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 0.79 0.00 0.00 0.97 0.00 0.00 118 K 8.55 4.49 0.00 1.74 1.68 0.00 1.79 0.00 0.00 1.68 0.00 0.00 3.20 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.34 1.32 7.81 119 R 8.66 3.96 0.00 1.70 1.94 0.00 2.98 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.48 0.00 120 G 8.92 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 0.00 0.00 0.00 121 P 0.00 4.41 0.00 1.96 2.21 0.00 3.08 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 122 R 7.94 4.44 0.00 1.85 1.93 0.00 3.31 0.00 0.00 3.28 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 123 T 7.55 5.09 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 1.40 0.00 0.00 124 H 7.85 4.77 0.00 3.46 3.53 0.00 5.67 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.75 3.93 0.00 3.14 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 0.00 126 G 9.02 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 0.00 127 Q 7.35 4.22 0.00 1.82 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.70 0.00 0.00 0.00 0.00 0.00 2.14 1.98 0.00 128 K 8.23 3.87 0.00 1.73 1.63 0.00 1.54 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.27 7.81 129 A 7.99 3.98 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 7.16 4.43 1.63 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.83 0.49 0.00 0.00 131 L 7.27 4.37 0.00 0.97 0.52 0.42 0.84 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 0.00 132 F 9.42 5.45 0.00 3.40 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 0.00 133 L 9.30 5.34 0.00 1.89 1.70 1.07 1.06 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 0.00 134 P 0.00 5.08 0.00 2.19 2.25 0.00 3.84 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 135 L 9.10 4.93 0.00 1.69 1.65 0.95 0.72 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 0.00 136 P 0.00 4.56 0.00 2.07 2.08 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 137 V 8.24 3.75 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 0.68 0.00 0.00 0.94 0.00 0.00