NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.6856 8.2649 122.4703 52.3278 19.0632 175.4477 2 T 4.4999 8.7239 117.8716 61.4603 71.5889 171.9988 3 K 5.3614 8.8464 123.8284 54.9961 37.1674 174.6831 4 A 5.3240 8.9278 123.5501 51.0566 23.3937 175.1947 5 V 4.9837 8.7346 117.2691 60.9292 35.4016 173.2110 6 C 4.9093 9.1480 122.0907 58.0006 35.3209 172.6721 7 V 4.5209 8.4447 126.1571 61.5472 32.8416 174.3124 8 L 4.5925 8.8731 129.7850 54.0626 42.9055 176.3367 9 K 4.8478 9.2942 123.0575 55.0749 36.6642 176.4447 10 G 4.5202 8.0421 109.6111 44.7035 0.0000 171.6074 11 D 4.4611 8.9430 118.7508 57.3095 41.6248 178.1250 12 G 3.9208 7.6488 107.5527 44.8034 0.0000 171.2674 13 P 4.4118 0.0000 0.0000 63.6526 31.9829 176.1997 14 V 4.2028 7.5700 120.7681 62.9317 31.9216 174.9250 15 Q 4.7985 8.3960 125.0914 55.4213 32.5576 173.5861 16 G 4.3976 8.1840 106.5254 46.3003 0.0000 171.9239 17 I 5.1598 8.2078 119.6844 59.4419 41.0046 175.0683 18 I 4.6694 8.7691 127.4846 59.5036 40.2074 174.4841 19 N 4.9131 8.5766 124.8352 51.5334 41.1038 174.0355 20 F 5.3338 8.7429 119.4233 55.8922 43.5407 173.7736 21 E 5.2834 9.7682 123.0597 54.9229 33.6567 173.4736 22 Q 4.9883 9.1255 127.7925 54.4171 31.1125 176.1239 23 K 4.1009 9.0351 127.1299 58.6199 32.7395 177.3922 24 E 4.7745 7.7500 116.2590 53.6875 33.0343 175.0138 25 S 4.1494 8.6860 115.4606 60.2220 62.6281 173.5005 26 N 4.0957 9.0020 123.2063 54.1766 37.4974 173.8361 27 G 3.9942 7.9588 106.0380 43.8919 0.0000 171.7423 28 P 4.5712 0.0000 0.0000 63.0033 32.1186 175.9699 29 V 4.6444 8.9497 122.3265 61.2267 33.7652 174.6172 30 K 4.7529 9.4292 128.8110 56.0786 33.6142 176.0402 31 V 4.7463 9.3087 125.8901 60.8183 33.8100 174.2662 32 W 5.9126 8.1806 124.3606 54.5081 32.0921 175.6032 33 G 3.7142 7.6098 106.5236 46.1607 0.0000 170.4946 34 S 5.1381 7.7961 113.2526 56.6267 66.2704 174.2446 35 I 5.1716 8.7418 126.7489 59.3516 40.6499 174.6854 36 K 4.7804 8.9526 125.3135 55.3065 36.4241 176.1331 37 G 3.8811 8.7755 105.3797 46.4570 0.0000 173.0092 38 L 4.7271 7.5109 120.3264 52.3049 44.5399 175.8358 39 T 4.2155 8.2948 114.5636 61.1107 69.1214 173.7856 40 E 4.1128 8.7094 124.7315 57.9723 30.5457 175.0941 41 G 4.2819 8.4028 109.6493 43.9954 0.0000 171.8267 42 L 4.8909 8.2737 119.5021 54.4440 42.9642 176.3715 43 H 5.0660 9.2906 120.1616 53.5621 33.0316 173.2438 44 G 4.0831 9.0909 110.9270 46.9802 0.0000 172.3084 45 F 5.6495 9.3468 126.0560 56.8011 42.7354 173.3671 46 R 4.5546 8.5035 121.6204 55.2501 33.4694 173.7253 47 V 4.6324 8.5524 120.6062 61.6049 32.7092 175.2652 48 Q 4.7138 9.2732 127.5080 55.0164 30.2049 176.5772 49 E 3.7179 8.8834 123.1894 58.8342 29.9248 177.2318 50 F 4.9930 7.8971 116.9705 55.7800 41.0662 175.9517 51 G 4.1436 8.4494 112.6993 44.5576 0.0000 173.9687 52 D 4.7547 8.0512 119.4429 52.7617 41.7252 175.0460 53 N 5.4856 8.6743 124.9915 52.3486 39.3583 176.5286 54 T 3.9774 8.4466 111.3398 63.7615 69.2756 174.2480 55 A 4.6904 7.6136 124.9097 51.3599 19.8287 176.8766 56 G 3.8547 7.9719 111.6631 46.6971 0.0000 175.6463 57 C 4.4391 8.6377 115.2762 59.6432 39.1821 175.9022 58 T 3.7550 8.0146 110.3983 64.5418 68.3204 175.6641 59 S 4.2950 7.9671 113.3282 58.7783 63.5621 174.4777 60 A 4.3134 7.9167 125.0592 53.2497 18.8475 178.6245 61 G 4.1022 7.5299 103.1451 43.7345 0.0000 170.9745 62 P 4.6526 0.0000 0.0000 62.1471 33.4353 175.3447 63 H 4.6540 8.5251 116.9791 55.6739 29.5292 175.2644 64 F 4.1764 9.1397 125.4522 58.4933 40.1594 174.8586 65 N 5.0840 7.9249 126.2133 51.4968 38.7113 173.1145 66 P 4.1770 0.0000 0.0000 64.9086 32.1318 177.8888 67 L 4.3491 7.6130 116.7831 53.6426 42.1695 176.1181 68 S 3.5994 7.3533 113.6693 59.6504 60.7153 171.6898 69 R 4.4434 8.0632 118.1651 54.8328 32.2140 176.4253 70 K 4.5034 8.5973 118.1450 55.4833 34.1715 176.3116 71 H 4.0542 8.7315 122.9735 56.7812 30.3535 174.8125 72 G 4.2977 8.1135 111.3950 45.1387 0.0000 172.1802 73 G 4.1117 9.2447 109.2677 43.4416 0.0000 173.2774 74 P 4.2651 0.0000 0.0000 65.3102 31.1356 177.6277 75 K 4.2222 7.8947 116.0596 57.3135 32.5886 176.5589 76 D 4.7449 7.6633 119.0182 53.3729 41.8502 176.5813 77 E 4.0356 8.6431 121.7170 59.3400 29.9976 177.4008 78 E 4.2511 7.9441 119.9372 55.6471 28.1826 175.5394 79 R 5.0505 7.5536 117.5684 54.8626 32.6696 175.1125 80 H 4.6154 8.6065 115.9289 55.3274 29.5839 176.7279 81 V 3.4490 8.3720 122.5171 66.4352 31.3374 177.2083 82 G 3.8893 8.2086 104.6023 47.2001 0.0000 173.3776 83 D 4.9436 8.1307 121.1387 53.9955 40.3671 175.7455 84 L 4.4738 8.3057 122.0479 53.5888 42.4208 179.1043 85 G 3.9344 8.3242 107.2814 46.5252 0.0000 172.9287 86 N 5.6630 8.6766 120.5888 51.5498 41.8382 174.2692 87 V 4.4485 8.6755 113.9872 59.9018 35.5760 174.8228 88 T 5.0000 8.1897 118.7039 61.7812 71.0996 173.3756 89 A 4.5840 8.9947 129.8860 51.5259 20.2693 177.5319 90 D 4.8201 8.9266 121.9934 52.1872 41.7933 176.6337 91 K 4.0882 8.5433 118.3044 59.5217 32.1144 177.7876 92 D 4.5364 8.1692 115.3565 54.4733 41.2450 176.7612 93 G 4.2649 8.5883 108.3268 44.5924 0.0000 172.5659 94 V 4.7495 8.1019 119.7712 60.7077 33.9516 174.3368 95 A 5.1128 9.0969 130.5421 49.9995 20.3681 175.8419 96 D 5.0558 8.5908 123.3726 53.7165 40.7952 176.1219 97 V 3.5970 8.4041 124.3778 62.7634 32.9305 175.1196 98 S 4.6343 8.3912 122.7672 57.7710 63.9881 172.7897 99 I 4.7892 9.3088 128.2536 59.2305 41.3159 174.1791 100 E 5.2035 8.8416 125.5419 54.5308 32.1120 174.4779 101 D 4.9142 9.3062 125.6340 52.9632 44.8653 175.6598 102 S 4.7365 8.9756 119.3259 58.5041 64.2118 175.0565 103 V 4.0025 8.0057 120.3049 64.6986 31.9730 176.5111 104 I 4.0653 7.8246 111.6742 61.0274 38.2408 174.7446 105 S 4.6889 8.5596 114.5913 57.3521 65.5513 174.0992 106 L 4.4457 8.8357 122.6115 54.1555 41.5479 176.4626 107 S 4.5282 7.8954 112.5621 58.3050 66.3973 175.8146 108 G 3.8836 8.5578 107.3043 45.2675 0.0000 174.4068 109 D 4.5088 8.7268 118.1157 57.3533 41.4587 176.7430 110 H 5.1011 8.1359 114.4269 55.5596 28.9894 173.9015 111 C 4.5845 7.7500 120.0056 59.6257 31.8965 173.4426 112 I 3.9227 8.1594 119.1230 60.2836 38.1400 175.6104 113 I 3.7545 7.3226 123.0641 63.0613 37.2952 176.1062 114 G 3.7870 9.7020 113.8240 45.5038 0.0000 172.5263 115 R 4.6773 7.4509 118.1751 54.3979 34.2249 174.5012 116 T 4.9138 7.8441 115.5156 62.1676 70.4295 174.2718 117 L 4.7571 8.4642 129.5415 54.2668 43.9087 175.7570 118 V 5.0697 8.5463 124.5070 60.0156 35.2627 174.2172 119 V 5.1344 8.7071 122.3474 60.4953 34.1223 174.3440 120 H 5.3109 8.8404 119.9268 53.9320 31.2270 174.1310 121 E 4.2736 9.5495 122.4414 59.2255 29.8769 176.2534 122 K 4.7886 8.5587 117.1212 54.7636 36.5146 174.9639 123 A 4.4095 8.4151 122.0429 52.1179 18.8967 176.5724 124 D 4.5811 9.5146 123.2435 54.3408 41.3014 176.0676 125 D 4.5493 9.3724 125.7166 53.2731 39.9015 176.6455 126 L 3.3376 9.5083 119.3131 56.2300 39.4853 175.4052 127 G 4.1387 8.4388 103.9870 46.1063 0.0000 174.9634 128 K 4.5030 8.0518 116.6839 55.9317 32.2364 177.7149 129 G 3.6759 7.9167 109.8475 45.6696 0.0000 175.1640 130 G 3.8630 8.4601 107.2847 46.1512 0.0000 172.4276 131 N 5.0870 7.7449 115.0395 49.5321 40.5343 174.3983 132 E 4.0571 8.7615 118.0063 59.6065 29.5623 178.4945 133 E 4.0475 8.1443 118.0112 59.0718 29.4348 178.9165 134 S 4.0873 8.4548 113.8620 61.3400 62.3634 175.4792 135 T 4.4865 7.5493 108.7931 61.8895 68.6354 175.6212 136 K 4.2822 7.6927 120.3464 58.0374 33.9001 176.9106 137 T 4.1559 8.3602 105.2687 60.1244 70.4265 175.0355 138 G 3.7785 8.0505 109.9328 44.7473 0.0000 172.8352 139 N 4.1149 7.6313 115.5343 54.3072 36.5903 175.0745 140 A 4.5655 7.2678 117.3906 51.0264 19.9452 179.4192 141 G 3.8194 7.4518 104.4027 45.8114 0.0000 174.1118 142 S 4.4103 8.3860 116.5032 58.5602 64.3642 174.1187 143 R 4.0528 8.4249 121.8674 56.3255 29.9790 176.2969 144 L 4.5033 9.0243 124.2173 56.5353 43.8110 176.5850 145 A 4.9690 7.6676 117.5211 51.2750 22.5820 174.2373 146 C 5.4886 8.4407 114.6640 54.8140 43.0081 172.5521 147 G 4.4957 8.1066 104.1751 46.3796 0.0000 172.3810 148 V 4.5213 8.2876 120.4050 61.9689 32.7965 175.3920 149 I 4.1572 8.7902 129.5389 60.9320 38.0110 175.2402 150 G 4.4141 8.8472 114.6747 43.8188 0.0000 172.2893 151 I 4.1798 8.3713 122.1584 61.3648 37.5049 175.4708 152 A 4.7972 8.3978 128.2665 49.8310 21.9782 176.3010 153 Q 4.0764 8.4847 118.8012 56.4126 29.2281 175.8613 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 A 8.26 4.69 1.29 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 0.00 0.00 0.00 0.00 0.00 2 T 8.72 4.50 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 3 K 8.85 5.36 0.00 1.84 1.71 0.00 1.75 0.00 0.00 2.07 0.00 0.00 2.93 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.58 1.51 7.81 4 A 8.93 5.32 1.09 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 0.00 0.00 5 V 8.73 4.98 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 0.69 0.00 0.00 0.94 0.00 0.00 6 C 9.15 4.91 0.00 3.15 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 7 V 8.44 4.52 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 8.87 4.59 0.00 1.84 1.60 1.02 0.61 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 9 K 9.29 4.85 0.00 1.63 1.63 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 G 8.04 4.52 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 0.00 0.00 0.00 11 D 8.94 4.46 0.00 2.68 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 12 G 7.65 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 13 P 0.00 4.41 0.00 2.19 2.17 0.00 3.77 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 2.14 1.95 0.00 14 V 7.57 4.20 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 0.80 0.00 0.00 0.95 0.00 0.00 15 Q 8.40 4.80 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.43 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 16 G 8.18 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 17 I 8.21 5.16 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.63 0.83 0.00 0.00 18 I 8.77 4.67 1.85 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 1.27 1.24 0.47 0.00 0.00 19 N 8.58 4.91 0.00 1.44 1.42 0.00 0.00 6.37 5.97 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 20 F 8.74 5.33 0.00 2.93 2.93 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 21 E 9.77 5.28 0.00 2.52 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 0.00 2.33 2.55 0.00 22 Q 9.13 4.99 0.00 2.23 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.59 0.00 0.00 0.00 0.00 0.00 2.46 2.63 0.00 23 K 9.04 4.10 0.00 1.81 1.87 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.47 1.49 7.81 24 E 7.75 4.77 0.00 1.96 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 2.30 2.21 0.00 25 S 8.69 4.15 0.00 3.83 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 26 N 9.00 4.10 0.00 2.85 2.86 0.00 0.00 7.11 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 27 G 7.96 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 28 P 0.00 4.57 0.00 2.19 2.11 0.00 3.76 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 29 V 8.95 4.64 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 1.07 0.00 0.00 30 K 9.43 4.75 0.00 2.05 1.98 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.83 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.30 1.44 7.81 31 V 9.31 4.75 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 0.72 0.00 0.00 1.10 0.00 0.00 32 W 8.18 5.91 0.00 3.45 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 33 G 7.61 3.71 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 0.00 0.00 0.00 34 S 7.80 5.14 0.00 3.87 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 35 I 8.74 5.17 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 1.29 0.66 0.90 0.00 0.00 36 K 8.95 4.78 0.00 1.76 1.88 0.00 1.36 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.34 7.81 37 G 8.78 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 38 L 7.51 4.73 0.00 1.83 1.48 0.78 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.29 4.22 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 40 E 8.71 4.11 0.00 2.03 1.89 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 2.39 2.36 0.00 41 G 8.40 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.27 4.89 0.00 1.52 1.60 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.29 5.07 0.00 3.03 3.32 0.00 5.63 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 44 G 9.09 4.08 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 0.00 0.00 0.00 45 F 9.35 5.65 0.00 3.07 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 46 R 8.50 4.55 0.00 1.89 1.89 0.00 3.00 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.35 0.00 47 V 8.55 4.63 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.87 0.00 0.00 48 Q 9.27 4.71 0.00 1.98 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 49 E 8.88 3.72 0.00 1.65 1.12 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 1.47 2.13 0.00 50 F 7.90 4.99 0.00 3.18 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.45 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.05 4.75 0.00 2.64 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 53 N 8.67 5.49 0.00 2.71 2.77 0.00 0.00 7.30 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 54 T 8.45 3.98 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 1.22 0.00 0.00 55 A 7.61 4.69 1.25 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 56 G 7.97 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 57 C 8.64 4.44 0.00 2.99 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 58 T 8.01 3.75 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 1.22 0.00 0.00 59 S 7.97 4.30 0.00 4.00 4.02 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 60 A 7.92 4.31 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 7.53 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.65 0.00 2.06 2.20 0.00 3.75 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 63 H 8.53 4.65 0.00 2.93 3.29 0.00 5.74 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 64 F 9.14 4.18 0.00 2.89 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 65 N 7.92 5.08 0.00 2.59 2.44 0.00 0.00 6.91 7.71 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 66 P 0.00 4.18 0.00 2.07 1.93 0.00 2.96 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.11 0.00 67 L 7.61 4.35 0.00 1.56 1.68 0.93 0.93 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 68 S 7.35 3.60 0.00 3.93 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 69 R 8.06 4.44 0.00 1.90 2.14 0.00 3.29 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.78 0.00 70 K 8.60 4.50 0.00 1.80 1.69 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.37 7.81 71 H 8.73 4.05 0.00 3.16 3.17 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 72 G 8.11 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 73 G 9.24 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.27 0.00 2.22 2.26 0.00 3.77 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 75 K 7.89 4.22 0.00 1.77 1.90 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 7.66 4.74 0.00 2.83 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 77 E 8.64 4.04 0.00 1.95 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 2.31 2.27 0.00 78 E 7.94 4.25 0.00 1.97 1.88 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 2.38 2.22 0.00 79 R 7.55 5.05 0.00 1.92 1.90 0.00 2.81 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 80 H 8.61 4.62 0.00 3.52 3.39 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 81 V 8.37 3.45 1.50 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 0.82 0.00 0.00 0.42 0.00 0.00 82 G 8.21 3.89 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 0.00 0.00 0.00 83 D 8.13 4.94 0.00 2.69 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 84 L 8.31 4.47 0.00 1.90 1.95 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.32 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 86 N 8.68 5.66 0.00 2.61 2.73 0.00 0.00 6.56 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 87 V 8.68 4.45 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 -0.03 0.00 0.00 0.84 0.00 0.00 88 T 8.19 5.00 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 1.21 0.00 0.00 89 A 8.99 4.58 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.93 4.82 0.00 2.86 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 91 K 8.54 4.09 0.00 1.74 1.88 0.00 1.59 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.43 7.81 92 D 8.17 4.54 0.00 2.81 2.68 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 93 G 8.59 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 0.00 0.00 0.00 0.00 94 V 8.10 4.75 2.18 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 0.74 0.00 0.00 0.97 0.00 0.00 95 A 9.10 5.11 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 96 D 8.59 5.06 0.00 2.56 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 97 V 8.40 3.60 1.91 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 0.52 0.00 0.00 0.63 0.00 0.00 98 S 8.39 4.63 0.00 3.89 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 99 I 9.31 4.79 1.97 0.00 0.00 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 1.14 0.48 1.01 0.00 0.00 100 E 8.84 5.20 0.00 1.96 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 101 D 9.31 4.91 0.00 2.87 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 0.00 102 S 8.98 4.74 0.00 3.91 3.89 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 0.00 103 V 8.01 4.00 2.23 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 0.82 0.00 0.00 0.95 0.00 0.00 104 I 7.82 4.07 1.95 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.82 1.04 0.00 0.00 105 S 8.56 4.69 0.00 3.91 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 0.00 106 L 8.84 4.45 0.00 1.78 1.63 1.04 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.90 4.53 0.00 3.88 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 0.00 108 G 8.56 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 0.00 109 D 8.73 4.51 0.00 2.68 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 0.00 110 H 8.14 5.10 0.00 3.24 3.45 0.00 5.64 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.75 4.58 0.00 3.17 2.86 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 0.00 112 I 8.16 3.92 1.62 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.14 0.91 0.00 0.00 113 I 7.32 3.75 1.76 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.35 0.88 0.00 0.00 114 G 9.70 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 0.00 0.00 0.00 115 R 7.45 4.68 0.00 1.62 1.80 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.29 0.00 116 T 7.84 4.91 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 117 L 8.46 4.76 0.00 1.79 1.51 0.32 0.86 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 0.00 118 V 8.55 5.07 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 0.80 0.00 0.00 0.94 0.00 0.00 119 V 8.71 5.13 2.34 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 1.03 0.00 0.00 1.09 0.00 0.00 120 H 8.84 5.31 0.00 3.22 3.54 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.55 4.27 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 122 K 8.56 4.79 0.00 1.75 1.88 0.00 1.37 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.37 7.81 123 A 8.42 4.41 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 0.00 124 D 9.51 4.58 0.00 2.66 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 0.00 125 D 9.37 4.55 0.00 2.90 2.90 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 0.00 126 L 9.51 3.34 0.00 1.78 1.80 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.44 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 8.05 4.50 0.00 1.89 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.50 7.81 129 G 7.92 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 0.00 0.00 0.00 130 G 8.46 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 0.00 131 N 7.74 5.09 0.00 2.75 2.76 0.00 0.00 6.17 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 0.00 132 E 8.76 4.06 0.00 2.05 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 2.37 2.40 0.00 133 E 8.14 4.05 0.00 2.09 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 0.00 2.39 2.30 0.00 134 S 8.45 4.09 0.00 4.02 4.02 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 0.00 135 T 7.55 4.49 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 0.00 136 K 7.69 4.28 0.00 1.82 1.84 0.00 1.68 0.00 0.00 1.95 0.00 0.00 3.10 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.51 7.81 137 T 8.36 4.16 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 1.13 0.00 0.00 138 G 8.05 3.78 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 0.00 0.00 0.00 139 N 7.63 4.11 0.00 2.98 2.87 0.00 0.00 6.85 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 0.00 140 A 7.27 4.57 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 0.00 141 G 7.45 3.82 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 0.00 0.00 0.00 142 S 8.39 4.41 0.00 3.85 3.81 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 0.00 143 R 8.42 4.05 0.00 1.66 1.79 0.00 3.19 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.63 0.00 144 L 9.02 4.50 0.00 1.70 1.70 1.00 0.54 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 0.00 145 A 7.67 4.97 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 C 8.44 5.49 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 0.00 147 G 8.11 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 0.00 0.00 0.00 0.00 148 V 8.29 4.52 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 0.82 0.00 0.00 0.91 0.00 0.00 149 I 8.79 4.16 1.79 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 1.07 0.75 0.41 0.00 0.00 150 G 8.85 4.41 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 0.00 151 I 8.37 4.18 1.85 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 1.25 0.54 0.91 0.00 0.00 152 A 8.40 4.80 1.21 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 0.00 0.00 153 Q 8.48 4.08 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00