NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.6001 8.1849 122.7618 55.1906 43.2995 175.6548 2 Q 4.5888 9.1517 124.0591 54.0019 33.7271 172.3371 3 R 5.2809 8.7650 119.2376 54.9226 33.6506 174.8641 4 T 4.7469 8.9278 116.1559 60.3811 71.9256 171.7859 5 L 5.2384 8.4248 126.7884 53.4456 44.2774 175.1133 6 V 4.9828 9.2648 126.2160 61.1116 34.5481 173.8813 7 L 5.0196 8.8972 127.5353 53.0469 44.5075 175.3232 8 I 4.6640 8.7823 125.3232 60.1161 38.7777 175.8122 9 K 4.6427 9.0264 127.2455 54.8230 33.6931 176.4294 10 P 4.6528 0.0000 0.0000 65.1291 31.1638 178.6947 11 D 4.6059 8.4729 117.3959 56.2163 39.4114 178.3360 12 A 4.1160 8.2890 122.5754 54.9149 18.4411 179.6469 13 F 3.9235 8.2969 115.9057 60.7229 38.9336 177.2910 14 E 4.0897 8.2842 117.6273 58.8820 29.4978 178.0913 15 R 4.3959 7.9399 114.8987 54.8065 30.9402 176.2512 16 S 3.7081 7.7327 113.3365 60.2572 61.0114 172.7749 17 L 4.6030 8.2327 116.7453 54.5608 42.6340 179.1631 18 V 3.3468 7.7447 119.8110 66.1017 31.3608 177.8106 19 A 3.9407 7.8127 119.8242 54.9994 18.1722 178.7672 20 E 3.8469 8.1738 117.3543 59.6070 29.4129 179.1009 21 I 3.6735 7.8037 119.4186 64.8168 37.1694 178.3107 22 M 4.2582 8.3019 119.7254 58.4583 31.7046 179.1196 23 G 3.6121 8.6718 106.2247 47.8569 0.0000 176.0198 24 R 3.9788 7.6077 119.4096 59.0233 30.2180 178.9720 25 I 3.8269 7.4692 119.5652 64.2869 37.0893 178.0532 26 E 4.0022 8.4522 120.4294 59.3369 29.2486 179.0629 27 K 4.0915 8.3219 117.8394 58.6120 32.1226 178.2081 28 K 4.1806 7.4004 118.0262 56.0186 32.0873 176.1385 29 N 4.3169 7.7853 114.5959 54.4722 37.8378 173.8779 30 F 4.7560 7.6579 113.7831 56.4292 40.1884 174.9127 31 K 4.8599 8.7708 122.8940 54.5459 35.0670 175.6163 32 I 4.0023 8.5294 125.2772 61.6138 36.9726 176.0269 33 V 4.2958 8.5809 120.3433 61.9446 33.8930 176.3850 34 S 4.6131 7.4054 114.4305 57.2562 67.4309 172.9336 35 M 5.3699 8.3856 120.7142 54.6892 35.2857 173.8568 36 K 4.6339 9.5000 124.8404 54.5588 36.3991 174.7370 37 F 5.1489 8.7047 126.4592 56.5710 41.1418 174.6807 38 W 4.4589 8.3721 126.4954 54.5845 30.8129 176.6091 39 S 3.7021 8.5006 120.8091 60.7610 62.5640 174.6815 40 K 4.2797 7.5484 120.7537 54.5135 34.5442 174.9201 41 A 3.9930 8.3811 129.9732 51.0709 18.8815 175.7233 42 P 4.2773 0.0000 0.0000 62.4700 33.0539 177.8793 43 R 3.8260 8.5776 121.9163 59.4393 30.0384 178.4468 44 N 4.2422 8.0198 116.4441 55.9095 37.0919 177.0060 45 L 3.4719 7.4829 120.6402 57.3151 41.6262 179.3584 46 I 3.8103 7.1586 119.2393 64.5863 36.8589 178.4249 47 E 4.2053 8.1669 118.2060 59.4233 29.5549 179.1476 48 Q 4.1349 8.1464 118.1237 59.2467 28.5842 178.1738 49 H 3.9908 8.1334 118.0272 59.0409 30.1229 176.1193 50 Y 4.9241 8.1356 117.5238 57.7837 39.1361 177.8365 51 K 3.9214 8.0969 123.4564 60.4480 32.1878 177.7419 52 E 3.9664 8.2796 118.7962 58.4501 29.9243 176.5604 53 H 4.8123 8.4857 114.9322 55.4767 29.0993 176.7646 54 S 2.7900 7.5760 115.0589 59.8707 62.5981 174.8781 55 E 4.3730 7.6630 118.2054 55.9697 30.0996 175.8889 56 Q 4.1728 7.7627 119.7520 54.8695 29.5066 177.3261 57 S 4.1274 8.3909 115.0535 61.2773 63.3155 174.8152 58 Y 4.4413 7.3436 117.0880 57.2158 38.7398 176.5911 59 F 4.0934 7.7759 123.7990 62.0259 39.2802 176.6565 60 N 4.1444 8.1973 115.0453 56.4531 38.5003 177.0773 61 D 4.3727 8.0553 119.7713 57.2880 40.9631 178.2341 62 N 4.3112 8.6096 118.0305 56.8503 38.8340 176.7642 63 C 3.9784 7.9058 118.2114 62.7998 27.9207 175.7278 64 D 4.3199 8.1253 119.8371 57.2959 40.6145 178.3434 65 F 4.3961 8.2224 120.9740 61.7212 39.2560 177.0299 66 M 3.5991 7.7677 116.0125 56.8340 31.7314 177.6587 67 V 4.1023 7.0755 117.7241 62.5961 31.9772 176.5538 68 S 4.3257 7.9186 112.6430 61.0667 63.5561 173.4730 69 G 3.8736 6.8683 109.5637 44.7400 0.0000 171.1299 70 P 4.5987 0.0000 0.0000 61.7545 32.6990 175.6590 71 I 4.9235 8.0079 113.4361 59.5026 41.6149 173.8785 72 I 5.2281 8.6115 123.8775 59.7159 39.8850 174.6286 73 S 5.1380 9.0578 121.7211 56.8789 65.4811 173.2626 74 I 4.9936 8.9308 123.3422 59.6722 41.5242 174.1326 75 V 4.5401 8.2607 126.8719 61.7927 32.8793 174.2782 76 Y 5.2359 8.7142 125.5959 56.4769 40.9268 174.3872 77 E 5.1926 10.0342 122.3326 53.8172 33.7111 175.1313 78 G 4.4002 8.4216 112.8045 46.2985 0.0000 171.6896 79 T 4.1974 8.3682 116.9476 64.8985 68.6829 173.8827 80 D 4.5313 9.1171 124.9618 55.1729 39.9404 175.1743 81 A 3.6080 8.2852 121.3510 54.6980 18.1663 180.1362 82 I 3.5446 7.8317 117.7898 64.5669 37.1771 178.5812 83 S 4.0375 7.9110 113.2508 61.4214 62.3890 176.1860 84 K 3.9934 8.0953 121.1512 59.6254 31.7834 179.5191 85 I 3.5815 7.6871 120.2278 63.8158 36.9305 178.3458 86 R 3.8225 7.8008 119.7557 59.6464 29.6855 178.8467 87 R 3.9390 7.9817 116.6757 59.0448 30.3290 178.4807 88 L 4.0724 8.0324 120.2641 58.0005 41.9808 178.7508 89 Q 3.8722 8.3186 119.7314 60.0557 29.2964 176.2743 90 G 3.8572 8.4298 108.7236 46.1025 0.0000 171.6920 91 N 5.0467 8.1367 118.2851 51.0063 40.4501 175.4427 92 I 4.0939 8.2291 111.3792 62.8105 37.6824 176.8712 93 L 4.1439 7.7776 120.2479 56.1270 42.0293 176.6594 94 T 4.3951 7.6905 115.9174 60.7450 68.3435 172.1803 95 P 4.6060 0.0000 0.0000 63.5560 31.9724 176.9856 96 G 3.9959 9.6403 110.4431 45.4417 0.0000 174.4090 97 T 4.5834 7.3779 109.5738 59.8493 72.3376 175.5781 98 I 3.6638 8.5536 122.5823 64.8930 37.1759 179.2069 99 R 4.0715 8.3923 119.1892 59.0367 29.6330 179.3320 100 G 4.1851 7.8724 106.2101 47.4005 0.0000 174.9919 101 D 4.6029 8.3522 120.2816 55.5383 41.2069 177.3046 102 L 4.6474 7.9519 115.8769 53.7790 43.9795 176.0953 103 A 4.8939 7.8258 120.3387 50.6098 21.6986 175.6852 104 N 4.9671 8.1934 117.0831 51.7615 39.0632 173.7663 105 D 4.7054 7.6942 114.1790 52.2789 44.6266 174.5786 106 I 3.7550 8.2659 124.1069 63.0388 38.5137 176.3675 107 R 4.1678 8.0204 117.9077 57.7229 31.2518 176.6377 108 E 3.7950 7.9686 120.0225 54.8101 27.7984 175.6664 109 N 4.9622 7.8572 120.0885 52.1562 38.6038 176.8870 110 L 4.2675 9.5610 123.9496 56.4158 41.3295 174.4520 111 I 5.0796 8.0072 116.2076 59.8700 41.4033 173.5743 112 H 5.2720 9.3839 128.4361 54.3447 32.4036 172.5383 113 A 5.1085 8.7768 126.7160 49.6607 21.6653 175.9823 114 S 4.3570 8.4207 117.7985 59.5470 63.1263 174.7481 115 D 4.6311 8.8573 122.0214 54.2417 40.4135 176.3012 116 S 4.5807 7.4638 113.9871 56.2866 66.8764 174.9130 117 E 3.9819 8.6859 121.2362 59.6530 29.1499 179.3466 118 D 4.3531 8.0469 118.1836 57.5229 40.9766 178.6466 119 S 4.1262 8.0149 115.2688 61.6816 62.8158 176.7165 120 A 4.0133 8.4722 123.4642 55.2279 18.2623 179.7257 121 V 3.5521 7.9032 116.6885 66.1614 31.5992 177.6244 122 D 4.3100 8.1600 117.5249 57.5553 41.1500 178.1172 123 E 4.1031 8.8891 119.3113 59.4814 29.5216 179.2042 124 I 4.0398 8.2497 120.2739 64.8830 36.9641 178.4263 125 S 4.3778 8.1844 113.3790 61.1944 61.9065 176.3730 126 I 3.5666 7.5710 122.0023 64.1150 36.9547 177.9593 127 W 4.3379 8.1337 117.7880 57.5948 30.5239 176.8706 128 F 5.0028 8.6510 116.3477 55.0186 38.7815 173.1098 129 P 4.8461 0.0000 0.0000 62.5349 30.9857 177.1507 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 L 8.18 4.60 0.00 1.70 1.68 0.94 0.39 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 2 Q 9.15 4.59 0.00 2.10 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.60 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 3 R 8.77 5.28 0.00 1.67 1.80 0.00 3.13 0.00 0.00 3.34 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 4 T 8.93 4.75 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 5 L 8.42 5.24 0.00 2.00 1.65 1.28 1.05 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 6 V 9.26 4.98 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.08 0.00 0.00 7 L 8.90 5.02 0.00 1.54 1.34 0.42 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.78 4.66 2.02 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 1.30 1.06 0.83 0.00 0.00 9 K 9.03 4.64 0.00 2.10 1.82 0.00 1.97 0.00 0.00 1.99 0.00 0.00 3.04 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.49 1.51 7.81 10 P 0.00 4.65 0.00 1.80 2.01 0.00 3.10 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.96 0.00 11 D 8.47 4.61 0.00 3.00 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 12 A 8.29 4.12 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 13 F 8.30 3.92 0.00 3.39 3.22 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 14 E 8.28 4.09 0.00 2.07 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 0.00 2.40 2.46 0.00 15 R 7.94 4.40 0.00 1.94 1.95 0.00 3.39 0.00 0.00 3.26 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 16 S 7.73 3.71 0.00 4.04 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 17 L 8.23 4.60 0.00 1.60 1.60 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.74 3.35 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 0.93 0.00 0.00 -0.03 0.00 0.00 19 A 7.81 3.94 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 20 E 8.17 3.85 0.00 2.07 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 2.37 2.47 0.00 21 I 7.80 3.67 1.99 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 1.52 0.63 0.92 0.00 0.00 22 M 8.30 4.26 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.71 0.00 23 G 8.67 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 R 7.61 3.98 0.00 1.90 1.99 0.00 3.16 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 25 I 7.47 3.83 1.73 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.04 -0.11 0.00 0.00 26 E 8.45 4.00 0.00 2.19 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 2.33 2.40 0.00 27 K 8.32 4.09 0.00 1.92 1.85 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.62 1.58 7.81 28 K 7.40 4.18 0.00 1.74 1.93 0.00 1.92 0.00 0.00 1.88 0.00 0.00 3.09 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.33 1.41 7.81 29 N 7.79 4.32 0.00 2.75 2.64 0.00 0.00 7.11 6.39 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 30 F 7.66 4.76 0.00 2.93 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 31 K 8.77 4.86 0.00 1.75 1.73 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.56 7.81 32 I 8.53 4.00 1.84 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 1.05 0.54 0.80 0.00 0.00 33 V 8.58 4.30 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 0.67 0.00 0.00 0.88 0.00 0.00 34 S 7.41 4.61 0.00 2.72 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 35 M 8.39 5.37 0.00 2.01 1.84 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.65 0.00 36 K 9.50 4.63 0.00 1.56 0.90 0.00 1.43 0.00 0.00 1.05 0.00 0.00 2.75 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.24 1.50 7.81 37 F 8.70 5.15 0.00 3.01 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 38 W 8.37 4.46 0.00 2.95 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 39 S 8.50 3.70 0.00 4.00 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 0.00 40 K 7.55 4.28 0.00 1.62 1.66 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.49 7.81 41 A 8.38 3.99 1.04 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 42 P 0.00 4.28 0.00 2.07 1.92 0.00 2.97 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.22 0.00 43 R 8.58 3.83 0.00 1.81 1.88 0.00 3.14 0.00 0.00 3.36 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 44 N 8.02 4.24 0.00 2.87 3.00 0.00 0.00 6.28 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.48 3.47 0.00 1.32 0.46 0.56 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.16 3.81 1.97 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.95 0.98 0.00 0.00 47 E 8.17 4.21 0.00 2.00 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 2.35 2.42 0.00 48 Q 8.15 4.13 0.00 2.19 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 49 H 8.13 3.99 0.00 3.22 3.43 0.00 5.93 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 50 Y 8.14 4.92 0.00 3.34 3.21 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 51 K 8.10 3.92 0.00 2.00 2.33 0.00 1.44 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.46 7.81 52 E 8.28 3.97 0.00 1.93 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 2.26 2.33 0.00 53 H 8.49 4.81 0.00 3.73 3.45 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 54 S 7.58 2.79 0.00 3.30 3.46 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 55 E 7.66 4.37 0.00 1.82 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 2.13 2.24 0.00 56 Q 7.76 4.17 0.00 1.19 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 57 S 8.39 4.13 0.00 4.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Y 7.34 4.44 0.00 3.17 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 59 F 7.78 4.09 0.00 3.03 3.05 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 60 N 8.20 4.14 0.00 2.80 2.85 0.00 0.00 6.99 8.08 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 61 D 8.06 4.37 0.00 2.73 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 62 N 8.61 4.31 0.00 2.76 2.86 0.00 0.00 7.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 C 7.91 3.98 0.00 2.84 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 64 D 8.13 4.32 0.00 2.79 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 65 F 8.22 4.40 0.00 3.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 M 7.77 3.60 0.00 1.99 2.14 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.79 0.00 67 V 7.08 4.10 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 1.02 0.00 0.00 0.90 0.00 0.00 68 S 7.92 4.33 0.00 4.06 4.12 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 69 G 6.87 3.87 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 0.00 0.00 0.00 70 P 0.00 4.60 0.00 0.49 1.25 0.00 3.52 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 71 I 8.01 4.92 1.81 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.21 0.76 0.00 0.00 72 I 8.61 5.23 2.09 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.36 1.10 0.00 0.00 73 S 9.06 5.14 0.00 3.80 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.93 4.99 1.66 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 1.05 0.89 -0.07 0.00 0.00 75 V 8.26 4.54 1.69 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 1.01 0.00 0.00 0.43 0.00 0.00 76 Y 8.71 5.24 0.00 2.96 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 77 E 10.03 5.19 0.00 2.03 1.80 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 2.26 2.42 0.00 78 G 8.42 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.37 4.20 4.26 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 1.24 0.00 0.00 80 D 9.12 4.53 0.00 2.93 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 81 A 8.29 3.61 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 82 I 7.83 3.54 1.96 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 1.40 0.77 0.87 0.00 0.00 83 S 7.91 4.04 0.00 3.89 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 K 8.10 3.99 0.00 1.95 2.06 0.00 1.85 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.74 1.84 7.81 85 I 7.69 3.58 1.66 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 0.72 -0.36 0.69 0.00 0.00 86 R 7.80 3.82 0.00 2.14 1.94 0.00 3.26 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.81 0.00 87 R 7.98 3.94 0.00 1.98 1.98 0.00 3.23 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 88 L 8.03 4.07 0.00 1.95 1.74 0.93 0.58 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 89 Q 8.32 3.87 0.00 2.19 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.61 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 90 G 8.43 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 91 N 8.14 5.05 0.00 2.89 2.88 0.00 0.00 5.74 7.83 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 92 I 8.23 4.09 1.85 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 1.39 0.58 0.94 0.00 0.00 93 L 7.78 4.14 0.00 1.84 1.76 0.92 1.08 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 T 7.69 4.40 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 1.21 0.00 0.00 95 P 0.00 4.61 0.00 2.03 1.98 0.00 3.64 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 2.02 2.08 0.00 96 G 9.64 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 T 7.38 4.58 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 98 I 8.55 3.66 1.86 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 1.51 0.94 0.91 0.00 0.00 99 R 8.39 4.07 0.00 1.86 1.97 0.00 3.35 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.75 0.00 100 G 7.87 4.19 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 0.00 101 D 8.35 4.60 0.00 2.70 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 0.00 102 L 7.95 4.65 0.00 1.70 1.66 0.91 0.73 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 0.00 103 A 7.83 4.89 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 N 8.19 4.97 0.00 2.60 2.70 0.00 0.00 6.72 8.47 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 0.00 105 D 7.69 4.71 0.00 2.52 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 0.00 106 I 8.27 3.76 1.78 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.81 0.78 0.00 0.00 107 R 8.02 4.17 0.00 1.55 1.74 0.00 3.03 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.41 0.00 108 E 7.97 3.79 0.00 1.75 1.67 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 1.47 1.92 0.00 109 N 7.86 4.96 0.00 2.89 3.11 0.00 0.00 6.21 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.56 4.27 0.00 1.99 1.94 0.98 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.01 5.08 1.90 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 1.13 0.85 0.97 0.00 0.00 112 H 9.38 5.27 0.00 3.40 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 0.00 113 A 8.78 5.11 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 0.00 114 S 8.42 4.36 0.00 3.79 3.94 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 0.00 115 D 8.86 4.63 0.00 2.78 2.82 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 0.00 0.00 0.00 116 S 7.46 4.58 0.00 4.04 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 0.00 117 E 8.69 3.98 0.00 2.04 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 0.00 2.41 2.42 0.00 118 D 8.05 4.35 0.00 2.69 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 S 8.01 4.13 0.00 4.17 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 0.00 120 A 8.47 4.01 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 0.00 121 V 7.90 3.55 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 1.01 0.00 0.00 1.02 0.00 0.00 122 D 8.16 4.31 0.00 2.96 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.89 4.10 0.00 2.19 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 0.00 2.24 2.47 0.00 124 I 8.25 4.04 2.03 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 1.52 0.80 1.03 0.00 0.00 125 S 8.18 4.38 0.00 3.97 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 0.00 126 I 7.57 3.57 1.79 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 1.34 0.68 0.07 0.00 0.00 127 W 8.13 4.34 0.00 3.38 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 F 8.65 5.00 0.00 3.17 3.05 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 0.00 129 P 0.00 4.85 0.00 2.20 2.05 0.00 3.54 0.00 0.00 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.94 0.00