NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.7114 8.2348 114.6797 58.0174 63.7567 173.2861 3 L 4.6627 7.3953 121.5135 52.7367 44.3752 175.7555 4 R 5.0355 9.2972 123.6663 54.7812 32.8452 174.2046 5 I 4.7362 8.5015 126.0994 58.9882 41.0614 173.7706 6 L 4.8413 9.1104 131.3277 53.5816 44.0351 174.8691 7 I 4.7786 8.4429 128.5412 59.7734 39.0275 175.1064 8 V 4.7173 8.5790 127.5156 60.8560 34.2455 173.8627 9 D 4.7500 8.3460 124.1483 53.9977 45.1222 176.4110 10 D 5.2557 9.1748 123.5544 53.7273 39.5691 176.1133 11 E 4.4607 7.7382 121.4309 53.4318 29.8245 175.6096 12 K 3.9935 8.6360 125.9077 59.5922 32.2959 177.2834 13 L 3.9629 8.1092 118.2565 58.2504 41.4269 179.5472 14 T 4.0669 9.1148 115.5580 66.1741 68.8554 177.2880 15 R 3.9974 7.9479 119.4365 59.3980 30.0170 178.6634 16 D 4.4724 8.3378 118.6631 57.2782 40.6329 178.9446 17 G 3.6710 7.8294 104.8477 47.7477 0.0000 174.8387 18 L 4.1484 8.4170 123.5023 58.1562 42.1930 179.2540 19 I 4.3487 8.4495 119.6173 64.5797 36.8771 178.3502 20 A 4.1696 8.2922 120.7240 54.5000 18.2564 177.8216 21 N 4.6737 7.7219 111.6760 53.1744 39.3273 174.8479 22 I 3.9853 7.1502 119.2740 59.3250 39.1285 175.5117 23 N 4.5115 7.7042 122.6331 51.6572 37.7858 175.3477 24 W 4.4754 8.0528 125.2216 58.6515 29.5356 178.0730 25 K 4.3746 8.0010 116.1899 56.9651 31.6262 177.0351 26 A 4.5761 7.7449 120.2790 51.7697 20.3870 176.6620 27 L 4.4621 7.3669 115.8577 54.1292 42.8860 176.6030 28 S 4.6272 7.9434 112.1163 58.4520 62.9659 174.7592 29 F 4.9180 7.7442 119.0049 57.8637 39.0239 174.7312 30 D 4.9708 9.4758 120.1343 53.9964 43.9730 175.6711 31 Q 4.5281 8.0994 116.1938 53.9496 33.4221 174.2860 32 I 4.4862 8.1421 122.5931 59.7686 39.7607 174.6101 33 D 5.0462 8.7769 127.6211 52.8950 43.4700 175.6392 34 Q 5.2890 8.5220 116.9244 54.5987 32.4175 173.7122 35 A 4.6019 8.2077 120.1307 50.6489 22.3213 177.1606 36 D 4.2978 9.0256 122.7560 57.1379 41.3763 175.7455 37 D 4.9205 7.6214 116.2536 51.0188 42.4258 175.9027 38 G 3.6493 8.8776 104.9417 48.1090 0.0000 175.2877 39 I 3.6496 7.7481 121.2455 63.7459 37.9001 176.9816 40 N 4.2376 8.3047 117.0220 56.9416 38.6554 176.4247 41 A 4.0381 8.2829 122.1902 55.0375 18.4650 179.6463 42 I 3.6932 8.0435 118.6496 64.4968 36.6310 178.3030 43 Q 3.9697 8.0773 120.3736 59.2528 28.7951 178.5999 44 I 3.6841 7.5859 120.4181 64.2843 36.9839 177.9740 45 A 4.2875 8.1964 121.7658 54.8018 18.3208 179.4829 46 L 4.3155 7.7328 116.8685 57.2422 41.6643 179.6496 47 K 4.3978 7.4927 116.9550 58.1916 32.3389 176.8488 48 H 4.7015 8.4758 117.1840 53.2295 30.5178 170.0974 49 P 4.0092 0.0000 0.0000 61.6894 31.5441 174.9240 50 P 4.4302 0.0000 0.0000 62.6520 32.4557 176.0792 51 N 4.6347 8.6997 118.4537 55.4281 40.0184 175.3157 52 V 4.9615 7.7157 116.9414 60.9873 35.7352 173.7593 53 L 5.1440 9.0379 128.3953 53.0950 45.4765 174.6970 54 L 5.1690 8.9623 127.4987 53.5869 45.0681 174.9483 55 T 5.3509 8.5876 119.2475 60.8087 71.2908 172.2691 56 D 4.9264 8.7293 125.6883 54.6381 42.4326 177.0850 57 V 3.9014 8.6426 124.4296 66.0173 32.2422 176.0738 58 R 5.0361 7.7834 117.7916 55.1795 31.7078 176.1130 59 M 4.3645 8.3507 117.3555 53.8597 35.8381 173.1433 60 P 4.2242 0.0000 0.0000 63.8128 31.6438 176.1743 61 R 3.6145 8.5090 115.7599 57.1727 29.1588 175.8620 62 M 4.3535 8.5023 109.4184 54.2629 34.5228 174.0049 63 D 4.7149 8.2771 125.8782 53.3048 43.6337 177.8473 64 G 3.9199 9.2055 109.8315 47.3002 0.0000 176.4414 65 I 3.8170 7.8540 121.7652 64.4667 36.7601 177.7123 66 E 3.9889 8.3639 118.8158 59.6185 29.3223 179.1966 67 L 3.9967 8.1526 119.8727 58.4964 42.1536 179.4985 68 V 3.6775 8.2827 112.6129 64.2305 31.5142 177.7656 69 D 4.4883 8.5137 118.4060 57.8539 40.8582 178.3865 70 N 4.5236 7.9358 115.0315 55.3492 38.7931 177.6731 71 I 3.7619 7.7202 121.6067 64.3833 37.0354 178.2543 72 L 4.0445 8.8416 119.3477 58.6415 41.5557 179.9752 73 K 4.3963 7.3115 116.4201 58.3581 31.9901 177.5711 74 L 4.5112 7.2316 117.4015 55.1571 41.9809 177.0389 75 Y 5.1136 7.7454 116.6825 56.2444 39.7413 173.6868 76 P 4.2507 0.0000 0.0000 65.7776 31.6390 177.5759 77 D 4.4773 8.0589 115.7444 55.1061 41.5262 174.8572 78 C 4.7532 7.9005 119.6456 59.4478 32.4512 173.3359 79 S 4.6802 8.7113 122.0492 58.0912 64.3359 173.2143 80 V 4.7555 8.2671 121.3721 61.1441 34.3496 174.5895 81 I 4.7507 8.7028 128.1245 59.6289 40.2861 174.4343 82 F 5.1682 9.4435 126.3897 56.4408 41.0140 174.9530 83 M 5.0242 9.5940 123.9597 54.2697 33.2755 175.3055 84 S 4.7819 9.2321 119.2070 56.1379 66.0183 174.0376 85 G 4.2291 9.1827 111.7085 45.4287 0.0000 173.0777 86 Y 4.3716 8.1976 122.4616 58.6149 39.7574 176.6606 87 S 4.6398 7.4893 117.7232 57.1793 62.9545 174.2775 88 D 4.7380 7.5534 121.0919 54.9301 41.9391 178.4257 89 K 3.6243 7.7695 120.3318 59.5447 32.4444 178.0324 90 E 3.8641 8.1984 118.3060 59.8821 29.1907 178.9895 91 Y 4.1980 7.7395 118.5341 60.6331 39.0384 177.4469 92 L 3.4384 7.8989 120.2251 57.9132 41.5311 179.9145 93 K 3.8940 7.6411 116.3248 59.2804 31.9854 179.0835 94 A 4.0176 7.7172 119.7124 54.3624 18.3019 178.6537 95 A 4.2721 7.1506 117.7976 54.5033 19.8181 178.2146 96 I 3.7256 7.5632 118.4508 59.6028 37.0627 176.9603 97 K 4.1902 8.4996 130.8308 55.1068 30.2049 177.0443 98 F 4.8244 6.8979 122.6186 54.8417 38.3104 174.6390 99 R 4.5596 7.7554 128.0536 56.7166 33.4151 174.6218 100 A 4.3983 8.7215 123.6119 54.6339 17.6215 179.7538 101 I 3.7162 6.5119 123.3083 59.2880 35.7905 174.4031 102 R 4.8282 8.5877 124.2346 54.4970 32.2931 174.8022 103 Y 5.7849 7.9533 120.4867 54.8596 42.2727 174.6018 104 V 4.3945 8.3716 118.2923 61.6738 34.9183 173.0010 105 E 4.8756 9.0187 128.2189 55.7808 30.0953 176.9915 106 K 4.3061 8.8018 124.6656 55.6533 33.1189 175.3429 107 P 4.2484 0.0000 0.0000 62.5004 31.3551 176.5877 108 I 3.7676 8.4024 124.4188 62.1030 37.7182 175.3786 109 D 4.8686 8.5355 123.6835 52.0727 42.9032 174.9290 110 P 4.4567 0.0000 0.0000 63.9303 31.7938 177.6206 111 S 4.3850 8.9317 116.8225 61.1673 63.2923 176.2195 112 E 3.9013 7.9465 120.6664 59.6108 29.0825 179.3104 113 I 3.7599 7.7041 119.3841 64.0584 37.0845 177.5347 114 M 4.0883 7.8916 118.4925 57.1492 32.1522 177.9039 115 D 4.2177 7.9299 118.7431 57.4238 41.2948 177.8950 116 A 4.0162 7.8957 121.2156 55.4825 18.2360 179.7382 117 L 4.1114 7.6987 116.8312 57.9501 41.5927 179.8817 118 K 3.9577 8.0288 118.3975 59.1876 31.7935 179.3821 119 Q 4.0074 8.5179 118.6547 58.7707 28.9254 177.9752 120 S 4.1001 8.4364 116.3272 62.0762 62.8612 176.7679 121 I 3.6060 8.0355 121.9819 64.6504 36.8598 178.0849 122 Q 3.8860 7.6941 119.7309 59.5577 28.8744 178.1448 123 T 3.7847 7.9847 116.8876 66.8509 68.4727 176.2455 124 V 3.5033 7.8448 119.5657 66.1769 31.3315 177.6570 125 L 3.8922 7.7124 117.2291 58.0678 41.7295 178.9966 126 Q 4.0953 8.3069 119.3375 59.7682 28.8186 178.1604 127 H 4.2244 8.4817 117.2405 59.1971 28.6868 177.4547 128 Q 4.1995 8.6586 117.1208 57.6033 28.5769 177.7562 129 A 4.3583 8.4672 121.9238 53.2348 19.0643 177.2770 130 Q 4.0800 7.8056 120.9274 56.1277 29.8616 174.9551 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 S 8.23 4.71 0.00 3.83 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 3 L 7.40 4.66 0.00 1.58 1.57 0.67 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 4 R 9.30 5.04 0.00 1.88 1.75 0.00 3.08 0.00 0.00 3.06 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.51 0.00 5 I 8.50 4.74 0.64 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 0.88 1.52 0.39 0.00 0.00 6 L 9.11 4.84 0.00 1.69 1.59 0.90 1.09 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 7 I 8.44 4.78 1.82 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 1.09 1.13 0.92 0.00 0.00 8 V 8.58 4.72 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 9 D 8.35 4.75 0.00 2.80 2.46 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 10 D 9.17 5.26 0.00 2.84 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 11 E 7.74 4.46 0.00 2.08 1.86 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 2.20 2.25 0.00 12 K 8.64 3.99 0.00 1.86 1.84 0.00 1.81 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.58 7.81 13 L 8.11 3.96 0.00 1.78 1.75 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 14 T 9.11 4.07 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 1.29 0.00 0.00 15 R 7.95 4.00 0.00 1.86 2.00 0.00 3.13 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 16 D 8.34 4.47 0.00 2.86 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 17 G 7.83 3.67 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 0.00 0.00 0.00 18 L 8.42 4.15 0.00 1.93 1.95 1.06 1.00 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 19 I 8.45 4.35 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.21 1.10 0.00 0.00 20 A 8.29 4.17 1.44 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 21 N 7.72 4.67 0.00 2.83 2.81 0.00 0.00 6.91 6.91 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 22 I 7.15 3.99 0.56 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.53 -0.60 0.00 0.00 23 N 7.70 4.51 0.00 2.58 2.58 0.00 0.00 7.12 7.95 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 24 W 8.05 4.48 0.00 3.53 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 25 K 8.00 4.37 0.00 1.95 1.89 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.47 7.81 26 A 7.74 4.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 7.37 4.46 0.00 1.93 1.92 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 28 S 7.94 4.63 0.00 3.62 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 F 7.74 4.92 0.00 3.23 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 30 D 9.48 4.97 0.00 2.55 2.63 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 0.00 0.00 0.00 0.00 31 Q 8.10 4.53 0.00 1.95 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.84 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 32 I 8.14 4.49 1.50 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.01 0.37 0.00 0.00 33 D 8.78 5.05 0.00 2.52 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 34 Q 8.52 5.29 0.00 2.10 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.67 0.00 0.00 0.00 0.00 0.00 2.17 2.17 0.00 35 A 8.21 4.60 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 9.03 4.30 0.00 2.72 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 37 D 7.62 4.92 0.00 2.82 2.76 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 0.00 0.00 0.00 0.00 38 G 8.88 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.75 3.65 1.88 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 1.53 1.60 0.94 0.00 0.00 40 N 8.30 4.24 0.00 2.85 3.14 0.00 0.00 7.02 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 41 A 8.28 4.04 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 42 I 8.04 3.69 2.05 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 1.65 0.90 0.92 0.00 0.00 43 Q 8.08 3.97 0.00 2.14 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 44 I 7.59 3.68 2.03 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 1.46 0.66 0.93 0.00 0.00 45 A 8.20 4.29 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 46 L 7.73 4.32 0.00 1.68 1.79 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 47 K 7.49 4.40 0.00 1.81 1.45 0.00 1.56 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.55 7.81 48 H 8.48 4.70 0.00 3.08 3.11 0.00 5.63 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.01 0.00 1.73 0.95 0.00 3.64 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 1.96 2.04 0.00 50 P 0.00 4.43 0.00 2.14 2.00 0.00 3.32 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 1.98 1.98 0.00 51 N 8.70 4.63 0.00 3.07 2.95 0.00 0.00 6.22 7.04 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 52 V 7.72 4.96 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 1.03 0.00 0.00 1.15 0.00 0.00 53 L 9.04 5.14 0.00 1.66 1.34 0.81 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.96 5.17 0.00 1.63 1.42 0.95 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 55 T 8.59 5.35 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 0.92 0.00 0.00 56 D 8.73 4.93 0.00 2.91 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 57 V 8.64 3.90 2.36 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 1.08 0.00 0.00 0.96 0.00 0.00 58 R 7.78 5.04 0.00 1.86 1.84 0.00 3.34 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 59 M 8.35 4.36 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 60 P 0.00 4.22 0.00 2.22 2.21 0.00 3.86 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 1.99 0.00 61 R 8.51 3.61 0.00 1.92 2.02 0.00 3.29 0.00 0.00 3.16 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 62 M 8.50 4.35 0.00 1.93 1.94 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 2.41 2.40 0.00 63 D 8.28 4.71 0.00 3.05 2.85 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 64 G 9.21 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 65 I 7.85 3.82 1.88 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.11 0.80 0.00 0.00 66 E 8.36 3.99 0.00 2.17 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 0.00 2.47 2.48 0.00 67 L 8.15 4.00 0.00 1.94 1.85 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 68 V 8.28 3.68 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 1.01 0.00 0.00 1.16 0.00 0.00 69 D 8.51 4.49 0.00 3.02 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 N 7.94 4.52 0.00 2.81 2.83 0.00 0.00 7.09 7.20 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 71 I 7.72 3.76 2.17 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 1.61 1.04 1.04 0.00 0.00 72 L 8.84 4.04 0.00 1.64 1.78 1.00 0.99 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 73 K 7.31 4.40 0.00 1.95 1.77 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.68 1.64 7.81 74 L 7.23 4.51 0.00 1.24 1.50 -0.23 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 75 Y 7.75 5.11 0.00 3.16 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 76 P 0.00 4.25 0.00 2.17 2.23 0.00 3.84 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 2.04 2.00 0.00 77 D 8.06 4.48 0.00 2.72 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 78 C 7.90 4.75 0.00 3.15 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 79 S 8.71 4.68 0.00 3.90 3.79 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 80 V 8.27 4.76 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 0.07 0.00 0.00 0.85 0.00 0.00 81 I 8.70 4.75 1.85 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.56 0.94 0.00 0.00 82 F 9.44 5.17 0.00 3.06 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 83 M 9.59 5.02 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 84 S 9.23 4.78 0.00 3.84 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 85 G 9.18 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 0.00 0.00 0.00 0.00 86 Y 8.20 4.37 0.00 2.88 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 87 S 7.49 4.64 0.00 3.38 3.56 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 88 D 7.55 4.74 0.00 2.72 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 89 K 7.77 3.62 0.00 1.53 1.67 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.34 7.81 90 E 8.20 3.86 0.00 2.03 1.99 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 2.35 2.42 0.00 91 Y 7.74 4.20 0.00 2.85 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 92 L 7.90 3.44 0.00 1.59 1.40 0.58 -0.12 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 93 K 7.64 3.89 0.00 1.66 1.80 0.00 1.63 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.58 7.81 94 A 7.72 4.02 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 95 A 7.15 4.27 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.56 3.73 1.78 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.67 0.93 0.00 0.00 97 K 8.50 4.19 0.00 1.01 1.22 0.00 1.38 0.00 0.00 1.44 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.98 1.09 7.81 98 F 6.90 4.82 0.00 2.99 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 R 7.76 4.56 0.00 1.94 2.00 0.00 3.34 0.00 0.00 3.55 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.46 0.00 100 A 8.72 4.40 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 0.00 101 I 6.51 3.72 1.96 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.58 1.04 0.00 0.00 102 R 8.59 4.83 0.00 1.93 1.87 0.00 3.07 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 103 Y 7.95 5.78 0.00 3.05 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 0.00 104 V 8.37 4.39 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 0.92 0.00 0.00 105 E 9.02 4.88 0.00 2.00 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 2.70 2.49 0.00 106 K 8.80 4.31 0.00 1.69 1.78 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.57 7.81 107 P 0.00 4.25 0.00 2.04 2.03 0.00 3.71 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 2.02 2.10 0.00 108 I 8.40 3.77 1.89 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 1.34 0.38 0.92 0.00 0.00 109 D 8.54 4.87 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 0.00 110 P 0.00 4.46 0.00 2.19 2.09 0.00 3.52 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 2.15 0.00 111 S 8.93 4.38 0.00 4.01 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 0.00 112 E 7.95 3.90 0.00 2.18 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 2.37 2.38 0.00 113 I 7.70 3.76 1.84 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 0.83 0.83 0.00 0.00 114 M 7.89 4.09 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.53 0.00 115 D 7.93 4.22 0.00 2.87 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 0.00 116 A 7.90 4.02 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 0.00 117 L 7.70 4.11 0.00 1.77 1.95 0.83 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.03 3.96 0.00 1.94 1.84 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.59 7.81 119 Q 8.52 4.01 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.65 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 120 S 8.44 4.10 0.00 4.07 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 I 8.04 3.61 1.93 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.37 0.77 0.00 0.00 122 Q 7.69 3.89 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 123 T 7.98 3.78 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 1.06 0.00 0.00 124 V 7.84 3.50 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.99 0.00 0.00 125 L 7.71 3.89 0.00 1.79 1.72 0.87 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 8.31 4.10 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 127 H 8.48 4.22 0.00 3.37 3.61 0.00 5.70 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 0.00 128 Q 8.66 4.20 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.93 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 129 A 8.47 4.36 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 0.00 130 Q 7.81 4.08 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.49 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00