NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6467 8.2227 120.4521 54.2593 44.1037 175.3076 2 Q 4.3515 7.9613 119.2133 55.6465 30.2767 170.0391 3 V 4.8911 9.2953 118.2677 59.3580 35.8761 174.8421 4 D 4.6328 9.1218 123.9916 54.4414 41.4505 176.0204 5 V 4.6992 8.3313 116.1893 59.4353 35.8728 175.1000 6 K 4.5379 8.8892 123.1076 55.0046 33.6919 175.7242 7 D 5.0045 8.6188 124.3841 53.7923 42.8751 174.6459 8 C 5.0023 9.0364 118.6653 54.5063 42.3700 174.0362 9 A 4.6809 9.1510 128.1075 53.2908 19.0267 177.6562 10 N 4.9654 8.9038 116.8775 55.2531 38.2807 173.5059 11 N 4.5696 9.2040 109.6762 53.8457 36.1540 176.0100 12 E 4.0959 8.0431 117.3157 58.2769 31.0675 176.0811 13 I 4.3517 7.1506 122.7724 61.1649 37.0294 176.0465 14 K 4.3821 9.7191 129.1207 58.7371 32.7958 177.6821 15 K 4.7414 7.6940 116.5189 55.8925 35.7896 174.8071 16 V 5.1153 8.2389 120.6880 60.3762 35.0122 173.8387 17 M 5.2548 9.2471 120.6491 53.6807 35.1342 174.5299 18 V 4.6687 7.8652 112.9629 59.1292 36.2997 174.4120 19 D 4.3299 8.5167 124.5501 56.8076 40.9937 176.5567 20 G 3.9905 9.2552 114.5589 45.5054 0.0000 172.5581 21 C 5.1844 7.8006 115.4698 55.3898 43.9795 173.0406 22 H 4.7999 8.7461 119.0883 56.5206 33.7777 173.3331 23 G 3.9004 8.3030 116.3915 47.4887 0.0000 174.3956 24 S 4.6637 8.7558 116.1679 57.5862 62.9794 173.6232 25 D 4.5445 7.8510 120.6508 53.4717 41.1815 174.3009 26 P 4.4190 0.0000 0.0000 63.5369 32.0325 176.6787 27 C 4.6680 9.5233 126.5222 55.4531 44.5801 172.3937 28 I 4.6023 8.3986 128.1748 60.8635 37.9676 175.5448 29 I 4.3383 9.1774 129.6833 59.9829 39.1208 174.5878 30 H 5.1286 8.6665 125.4670 54.2876 29.9416 175.5063 31 R 3.9951 8.5644 123.7501 57.8951 30.3349 177.6750 32 G 3.9395 9.1410 110.3375 45.3701 0.0000 173.4249 33 K 4.6651 7.5489 118.7446 53.3014 34.6750 174.2873 34 P 4.7370 0.0000 0.0000 62.5308 32.3081 175.3559 35 F 4.8944 9.6897 124.9894 57.0555 41.8770 173.9103 36 T 5.0417 8.1843 123.8107 61.7369 70.4357 173.6216 37 L 5.0975 8.6594 126.6166 53.7191 44.2832 175.0403 38 E 5.1555 9.4599 120.5764 54.4831 33.0813 174.1260 39 A 5.2010 9.2304 128.0220 50.0050 22.8381 174.3309 40 L 5.3213 9.2831 124.2022 53.3690 44.1634 175.2813 41 F 5.4823 9.3011 120.9351 55.5490 42.0749 173.0180 42 D 5.2414 8.9114 120.1464 52.2972 42.3024 176.5270 43 A 4.1977 9.0879 126.7878 52.3322 19.3741 177.1334 44 N 5.0850 8.5383 119.7483 52.1930 38.2560 174.2241 45 Q 4.5588 7.2818 116.8995 56.9704 31.6983 171.2718 46 N 5.4575 8.7514 115.9748 51.0856 40.8645 174.5589 47 T 4.7799 8.1492 116.4812 60.8989 70.6194 174.4845 48 K 4.1375 9.6964 127.3722 58.0598 32.3780 177.2314 49 T 4.8283 7.7354 107.7469 59.6860 72.5042 173.2567 50 A 5.0336 8.2972 123.7486 50.4726 22.5422 174.6238 51 K 4.9551 9.3970 124.6089 54.5763 35.1372 174.5849 52 I 4.6943 8.5318 127.2318 59.1845 40.0229 174.2534 53 E 4.7131 9.2639 128.8999 54.5457 32.6701 175.1439 54 I 4.7303 7.9231 122.8300 59.4630 40.7430 174.8165 55 K 4.9327 8.5112 124.1480 54.6073 36.9849 174.9753 56 A 5.2553 8.9664 123.8608 50.2359 22.3129 175.2076 57 S 5.2078 9.2171 116.4394 56.2678 65.5903 172.9266 58 L 4.8985 9.2740 127.4139 54.8159 43.5745 176.2619 59 D 4.3798 9.9746 125.0117 55.2653 38.4309 174.5944 60 G 3.9674 8.5374 105.4152 44.9534 0.0000 173.0653 61 L 4.7708 7.8998 121.4349 52.8352 44.7122 174.2234 62 E 5.2791 8.6566 124.7377 54.3409 32.1962 174.7845 63 I 4.9661 8.9691 119.8119 59.5305 41.3911 173.6887 64 D 5.2126 8.5708 121.1340 52.8408 42.5084 174.6635 65 V 4.2779 8.6317 119.2648 60.2906 32.3942 173.5456 66 P 4.4426 0.0000 0.0000 63.7703 31.9780 176.7840 67 G 3.9704 8.9971 108.3379 45.4172 0.0000 173.4683 68 I 4.2231 7.3220 112.2227 59.2768 39.0465 175.1227 69 D 4.5172 8.8169 121.8502 55.1493 40.9623 175.8084 70 T 4.4230 8.6125 116.0580 61.3329 69.5890 173.7150 71 N 4.7312 8.5296 122.4782 52.5062 37.9851 175.2695 72 A 4.3894 9.0911 130.7703 55.0840 18.6440 178.3094 73 C 4.6889 8.0237 110.8914 58.5829 40.2234 173.7848 74 H 4.3269 7.6061 116.4259 55.9776 28.7152 175.6036 75 F 5.0479 7.8364 116.3145 57.1535 41.0128 175.5318 76 V 4.6061 7.4823 111.7265 59.0550 35.3730 175.3769 77 K 4.1665 8.7730 121.5057 56.7689 31.4270 177.5695 78 C 4.8455 8.3362 121.5344 54.1998 42.4258 172.1322 79 P 4.6730 0.0000 0.0000 62.7944 31.9554 175.8851 80 L 4.2401 8.5754 121.0176 54.3959 43.4901 176.0733 81 V 4.3942 8.9565 122.9244 60.7880 33.2807 174.7570 82 K 4.1473 8.4230 129.0087 57.6122 32.0134 175.7244 83 G 4.3020 9.6581 117.2266 45.7859 0.0000 174.2798 84 Q 4.0273 7.8239 120.4439 56.0651 30.2203 175.1223 85 Q 4.8050 8.1528 125.8113 55.0139 30.7219 174.1153 86 Y 4.5519 8.9498 122.8608 56.0654 42.4153 174.2811 87 D 5.2421 8.8355 121.2102 52.7752 43.1479 174.1331 88 I 4.5994 8.8890 126.9878 59.2643 40.1738 174.1269 89 K 5.0318 8.7568 128.3690 54.8566 34.2817 174.9643 90 Y 4.3033 8.9787 125.8048 56.0248 42.4741 173.6874 91 T 4.9279 7.7368 122.9017 61.7433 70.3263 173.4401 92 W 4.9736 9.8583 135.0000 55.8905 32.7662 174.5019 93 N 4.9636 8.5548 124.6905 51.3507 39.7435 173.4835 94 V 3.5238 7.6358 124.9443 61.2935 32.8200 174.0168 95 P 4.6033 0.0000 0.0000 62.1628 32.0429 177.4563 96 K 3.9545 8.4185 118.8257 59.4237 32.0856 178.5398 97 I 3.7286 7.6391 117.2660 62.6868 38.2190 175.8548 98 A 3.9935 7.5547 123.7226 51.8174 18.5498 175.6206 99 P 4.4528 0.0000 0.0000 62.3240 32.2707 176.4140 100 K 4.3709 8.2354 119.3118 56.4842 33.1259 176.5023 101 S 4.5117 8.5317 113.1426 58.0849 65.5774 175.7403 102 E 4.5497 8.8322 124.7526 56.5365 29.9815 176.5272 103 N 5.0239 8.0186 116.0984 51.1805 39.0962 173.2117 104 V 4.7023 8.3827 113.3678 59.3010 35.6232 175.2753 105 V 4.5500 8.7157 125.1784 61.2279 33.8645 174.3989 106 V 4.8589 8.8232 128.2062 61.2645 34.1672 173.9930 107 T 4.9721 8.6335 118.5052 59.8620 71.3039 173.1249 108 V 4.5510 8.6303 126.3346 60.8568 33.9983 174.2301 109 K 4.8826 8.9028 128.5903 54.6214 35.7164 174.5590 110 L 5.0779 8.7688 127.0102 53.0366 44.7348 175.5193 111 I 4.8155 9.0755 122.9936 59.5783 41.5478 174.7044 112 G 4.3406 9.0035 112.6288 43.5791 0.0000 173.3222 113 D 4.4851 8.6693 119.6590 57.5063 40.7109 178.5131 114 N 4.6980 8.5407 112.3647 52.5697 39.0541 173.8617 115 G 3.7151 7.9548 106.2131 43.4824 0.0000 173.3579 116 V 3.8701 8.2508 119.3045 63.7882 31.8216 175.8250 117 L 4.5754 8.7936 129.7428 57.2527 42.6795 176.2436 118 A 4.6608 7.4840 117.8681 51.2263 23.0605 175.7546 119 C 5.0939 8.4378 119.0231 55.6442 45.9580 172.5739 120 A 5.2387 9.0856 127.8385 50.1396 22.7078 174.5396 121 I 4.7702 9.0059 121.6543 59.4404 40.3395 174.9145 122 A 4.8219 9.2488 131.3282 51.1697 19.2267 177.2189 123 T 4.2199 8.5512 111.4862 62.6035 70.0863 174.9917 124 H 4.9803 7.8911 119.6761 55.7593 30.2911 174.5069 125 G 4.1569 7.9517 105.5423 46.3719 0.0000 173.7843 126 K 5.1067 8.8244 120.0466 54.7088 37.1797 175.2108 127 I 4.9192 8.8282 125.7462 59.9296 39.5177 175.1941 128 R 5.0208 8.5231 125.1496 54.7752 35.3044 175.3745 129 D 4.5043 8.6068 118.5726 55.1474 40.9635 176.6004 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 D 8.22 4.65 0.00 2.83 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 2 Q 7.96 4.35 0.00 2.24 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.67 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 3 V 9.30 4.89 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 0.82 0.00 0.00 1.01 0.00 0.00 4 D 9.12 4.63 0.00 2.78 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 5 V 8.33 4.70 2.15 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 0.74 0.00 0.00 0.94 0.00 0.00 6 K 8.89 4.54 0.00 1.70 1.70 0.00 1.54 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.41 7.81 7 D 8.62 5.00 0.00 2.73 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 8 C 9.04 5.00 0.00 2.87 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 9 A 9.15 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 N 8.90 4.97 0.00 2.53 2.96 0.00 0.00 7.25 7.67 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 11 N 9.20 4.57 0.00 2.98 2.93 0.00 0.00 7.38 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 12 E 8.04 4.10 0.00 2.28 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 0.00 2.34 2.67 0.00 13 I 7.15 4.35 1.89 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.78 0.93 0.00 0.00 14 K 9.72 4.38 0.00 1.74 1.88 0.00 1.78 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.50 1.72 7.81 15 K 7.69 4.74 0.00 1.79 1.87 0.00 1.45 0.00 0.00 1.88 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.43 7.81 16 V 8.24 5.12 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 0.97 0.00 0.00 0.97 0.00 0.00 17 M 9.25 5.25 0.00 2.05 2.16 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 2.45 2.65 0.00 18 V 7.87 4.67 1.61 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 0.75 0.00 0.00 0.87 0.00 0.00 19 D 8.52 4.33 0.00 2.64 2.56 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 0.00 20 G 9.26 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 21 C 7.80 5.18 0.00 2.98 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 22 H 8.75 4.80 0.00 3.19 3.09 0.00 6.01 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 23 G 8.30 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 S 8.76 4.66 0.00 3.74 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 D 7.85 4.54 0.00 2.81 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 26 P 0.00 4.42 0.00 1.95 2.04 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 27 C 9.52 4.67 0.00 3.06 3.09 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 0.00 0.00 0.00 28 I 8.40 4.60 1.84 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 1.37 0.95 0.69 0.00 0.00 29 I 9.18 4.34 1.80 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.68 0.62 0.00 0.00 30 H 8.67 5.13 0.00 3.12 3.36 0.00 5.64 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 31 R 8.56 4.00 0.00 1.76 1.96 0.00 3.41 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 1.60 1.82 0.00 32 G 9.14 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 0.00 0.00 0.00 33 K 7.55 4.67 0.00 1.98 1.75 0.00 1.59 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.38 7.81 34 P 0.00 4.74 0.00 2.09 2.21 0.00 3.33 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.81 0.00 35 F 9.69 4.89 0.00 3.14 3.37 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 36 T 8.18 5.04 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 1.14 0.00 0.00 37 L 8.66 5.10 0.00 1.65 1.51 0.90 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 38 E 9.46 5.16 0.00 1.95 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 2.27 2.38 0.00 39 A 9.23 5.20 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.28 5.32 0.00 1.75 1.58 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 41 F 9.30 5.48 0.00 3.26 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 42 D 8.91 5.24 0.00 2.60 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 43 A 9.09 4.20 1.40 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 44 N 8.54 5.09 0.00 2.76 2.95 0.00 0.00 6.10 7.39 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 45 Q 7.28 4.56 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.11 6.90 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 46 N 8.75 5.46 0.00 2.58 2.76 0.00 0.00 6.98 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 8.15 4.78 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 48 K 9.70 4.14 0.00 1.72 1.83 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.36 7.81 49 T 7.74 4.83 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 50 A 8.30 5.03 1.18 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 0.00 0.00 51 K 9.40 4.96 0.00 1.74 1.58 0.00 1.55 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.27 1.46 7.81 52 I 8.53 4.69 1.64 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.71 0.61 0.00 0.00 53 E 9.26 4.71 0.00 1.74 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 0.00 2.14 2.15 0.00 54 I 7.92 4.73 0.88 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.08 -0.50 0.00 0.00 55 K 8.51 4.93 0.00 1.61 1.62 0.00 1.57 0.00 0.00 1.81 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.32 7.81 56 A 8.97 5.26 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 57 S 9.22 5.21 0.00 3.83 3.68 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 0.00 0.00 0.00 0.00 58 L 9.27 4.90 0.00 1.64 1.70 0.91 0.95 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 D 9.97 4.38 0.00 2.78 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 60 G 8.54 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.90 4.77 0.00 1.69 1.61 0.92 0.61 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 62 E 8.66 5.28 0.00 1.98 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.27 0.00 63 I 8.97 4.97 1.90 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 1.55 0.87 0.92 0.00 0.00 64 D 8.57 5.21 0.00 2.81 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 65 V 8.63 4.28 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 0.88 0.00 0.00 0.78 0.00 0.00 66 P 0.00 4.44 0.00 2.25 2.07 0.00 3.86 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 67 G 9.00 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 68 I 7.32 4.22 2.11 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.90 1.10 0.00 0.00 69 D 8.82 4.52 0.00 2.84 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 70 T 8.61 4.42 4.35 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 1.31 0.00 0.00 71 N 8.53 4.73 0.00 2.78 2.84 0.00 0.00 7.06 8.75 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 72 A 9.09 4.39 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 73 C 8.02 4.69 0.00 2.85 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 74 H 7.61 4.33 0.00 2.13 2.67 0.00 5.59 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 75 F 7.84 5.05 0.00 3.28 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 76 V 7.48 4.61 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 0.98 0.00 0.00 1.04 0.00 0.00 77 K 8.77 4.17 0.00 1.88 1.88 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.45 7.81 78 C 8.34 4.85 0.00 2.92 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 79 P 0.00 4.67 0.00 2.08 2.04 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 80 L 8.58 4.24 0.00 1.51 1.31 0.81 -0.07 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 81 V 8.96 4.39 2.32 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 0.96 0.00 0.00 1.00 0.00 0.00 82 K 8.42 4.15 0.00 1.94 1.78 0.00 1.72 0.00 0.00 0.95 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.34 7.81 83 G 9.66 4.30 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 0.00 84 Q 7.82 4.03 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.76 0.00 0.00 0.00 0.00 0.00 1.76 2.09 0.00 85 Q 8.15 4.81 0.00 2.09 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.54 0.00 0.00 0.00 0.00 0.00 2.12 2.47 0.00 86 Y 8.95 4.55 0.00 1.99 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 87 D 8.84 5.24 0.00 2.64 2.59 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 0.00 0.00 0.00 0.00 88 I 8.89 4.60 2.14 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 1.29 1.72 1.04 0.00 0.00 89 K 8.76 5.03 0.00 1.70 1.70 0.00 1.77 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.44 7.81 90 Y 8.98 4.30 0.00 2.65 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.74 4.93 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 1.18 0.00 0.00 92 W 9.86 4.97 0.00 3.49 3.39 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 93 N 8.55 4.96 0.00 2.58 2.65 0.00 0.00 6.79 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 94 V 7.64 3.52 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 -0.05 0.00 0.00 95 P 0.00 4.60 0.00 2.18 2.07 0.00 3.46 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.88 0.00 96 K 8.42 3.95 0.00 1.73 1.89 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.39 7.81 97 I 7.64 3.73 1.84 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 1.33 0.60 0.87 0.00 0.00 98 A 7.55 3.99 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 99 P 0.00 4.45 0.00 2.17 2.05 0.00 3.73 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 100 K 8.24 4.37 0.00 1.76 1.83 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.40 7.81 101 S 8.53 4.51 0.00 3.78 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 0.00 102 E 8.83 4.55 0.00 1.99 1.96 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 2.25 2.26 0.00 103 N 8.02 5.02 0.00 2.66 2.70 0.00 0.00 6.70 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.38 4.70 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 0.96 0.00 0.00 0.92 0.00 0.00 105 V 8.72 4.55 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 0.95 0.00 0.00 0.91 0.00 0.00 106 V 8.82 4.86 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 0.70 0.00 0.00 0.91 0.00 0.00 107 T 8.63 4.97 4.16 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 1.16 0.00 0.00 108 V 8.63 4.55 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 0.69 0.00 0.00 0.82 0.00 0.00 109 K 8.90 4.88 0.00 1.68 1.44 0.00 1.56 0.00 0.00 1.58 0.00 0.00 2.75 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.21 1.30 7.81 110 L 8.77 5.08 0.00 1.31 1.25 0.73 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 111 I 9.08 4.82 1.81 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 1.11 0.57 0.87 0.00 0.00 112 G 9.00 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 0.00 0.00 0.00 0.00 113 D 8.67 4.49 0.00 2.66 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 N 8.54 4.70 0.00 2.82 2.82 0.00 0.00 6.99 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 7.95 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.25 3.87 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 0.77 0.00 0.00 0.90 0.00 0.00 117 L 8.79 4.58 0.00 1.60 1.52 1.01 0.88 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 0.00 118 A 7.48 4.66 0.96 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 0.00 119 C 8.44 5.09 0.00 2.91 2.92 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 0.00 120 A 9.09 5.24 1.16 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 0.00 0.00 121 I 9.01 4.77 1.94 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 0.70 0.88 0.00 0.00 122 A 9.25 4.82 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 8.55 4.22 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 1.22 0.00 0.00 124 H 7.89 4.98 0.00 3.12 3.32 0.00 5.61 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 0.00 125 G 7.95 4.16 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 0.00 0.00 0.00 126 K 8.82 5.11 0.00 1.68 1.64 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.43 7.81 127 I 8.83 4.92 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.62 0.90 0.00 0.00 128 R 8.52 5.02 0.00 1.72 1.80 0.00 3.12 0.00 0.00 3.53 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 129 D 8.61 4.50 0.00 2.68 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