NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.3076 8.4449 118.7993 55.7888 30.9239 174.9754 4 K 4.1545 8.5119 120.7300 55.9812 33.0370 175.0417 5 T 5.2266 8.7344 122.2779 61.1257 72.3754 173.0699 6 C 4.8911 8.6380 120.3207 58.3550 38.9826 173.0319 7 D 4.9943 9.0641 124.3116 52.3822 42.3082 176.2134 8 L 4.7139 8.5351 123.9354 54.5298 42.5091 177.3891 9 V 3.6933 8.2504 122.5077 64.1643 32.3951 175.4132 10 G 3.7676 9.1087 111.1027 43.8250 0.0000 172.4674 11 E 3.8517 8.8699 116.7853 56.7164 29.6094 178.4124 12 K 3.8428 8.9958 125.3262 58.8338 32.2511 177.2486 13 G 4.1606 8.0637 104.0620 45.0595 0.0000 173.0815 14 K 4.6526 7.7207 119.0036 55.4804 32.9290 176.4595 15 E 4.1176 8.2198 116.2741 55.7633 30.4917 176.9635 16 S 4.1822 8.5850 115.8716 58.6032 63.8295 175.2702 17 E 4.0109 8.8261 127.3649 59.0675 29.6179 179.2752 18 K 3.9201 7.9464 120.5070 59.5154 32.3337 178.5319 19 E 3.9108 8.0933 118.7460 59.1671 29.2670 179.1415 20 L 3.9578 8.0751 118.8845 58.0070 41.7932 179.4547 21 A 3.9897 8.1449 120.4410 55.1850 17.9764 179.7705 22 L 3.9610 7.5308 116.4358 57.8991 42.1219 179.2773 23 L 4.2472 8.1764 119.1485 57.7183 41.7064 179.3835 24 K 3.8877 8.4095 119.8985 59.6422 31.9012 178.7769 25 R 3.9752 7.8842 117.5235 58.4290 30.2823 177.3577 26 L 4.4975 7.5992 117.3382 54.6828 41.9640 177.9287 27 T 2.0000 7.2809 111.6775 63.8686 68.0264 174.2153 28 P 4.1715 0.0000 0.0000 64.4339 31.6708 176.7527 29 L 4.5173 8.1532 117.5080 54.9520 42.4688 178.3972 30 F 4.7317 8.4737 117.8339 60.0237 38.8225 177.0372 31 Q 4.0532 8.0063 115.5331 58.0070 28.8372 176.3299 32 K 4.0779 7.2747 117.8447 56.1666 32.7735 175.8327 33 S 4.2328 7.3162 113.4976 56.6603 65.5737 172.8670 34 F 4.9831 8.7773 124.5317 55.6454 42.1694 173.8031 35 E 5.9800 8.9616 122.2369 53.8657 33.2749 174.5297 36 S 4.8144 8.9769 118.9386 57.4751 66.0896 172.3359 37 T 5.2782 8.7881 123.5799 62.1407 70.4412 174.0220 38 V 4.5137 9.0322 118.2564 60.2377 36.6653 175.7411 39 G 4.2723 9.3867 108.4405 45.0378 0.0000 172.4467 40 Q 4.6511 8.0713 114.5718 53.6023 31.3973 174.8895 41 S 4.3135 8.7127 115.6488 59.2306 63.2103 172.8227 42 P 4.9190 0.0000 0.0000 63.0706 31.6119 175.2020 43 D 5.0036 8.2676 117.2980 55.2724 41.6618 176.6765 44 M 4.7529 7.8967 118.2768 55.6686 33.4918 175.2645 45 Y 5.1728 9.2699 119.1297 56.3309 43.0022 174.3445 46 S 5.1075 9.0813 115.3713 56.9375 66.2854 172.0634 47 Y 5.8006 9.4413 124.6466 55.5988 40.5636 174.6261 48 V 5.0006 8.6498 123.8863 61.0976 34.3712 173.8341 49 F 5.5252 9.5970 129.8349 56.6180 42.4009 173.7327 50 R 4.4491 8.6893 123.3606 54.2503 34.5925 174.9308 51 V 4.0685 7.8613 120.1907 62.2266 32.4713 176.3577 52 C 3.8565 8.6606 125.6920 57.0053 38.1869 173.1175 53 R 4.1030 6.5224 114.8109 53.9669 33.6982 174.7900 54 E 4.2185 8.6405 121.3645 57.2657 29.7844 176.5570 55 A 4.5423 9.1235 127.9034 52.1887 21.0091 177.1519 56 G 3.7697 7.8470 104.8634 44.8907 0.0000 174.8308 57 Q 3.9729 9.1279 122.8586 57.8888 30.3576 176.6685 58 H 4.5422 7.4450 107.7595 55.3560 28.9866 174.2881 59 S 4.5958 9.3361 113.6326 57.2934 64.9347 173.2375 60 S 4.4985 8.2538 114.8814 59.0811 62.4519 173.9135 61 G 3.4292 8.3335 108.1694 46.2250 0.0000 173.9071 62 A 4.2319 8.2439 122.4122 51.7579 19.3618 179.1823 63 G 3.8396 9.1463 109.6803 47.0719 0.0000 173.5263 64 L 5.4327 7.7966 122.0497 53.8770 45.7747 175.1143 65 V 5.0012 9.0570 118.6355 59.5499 36.3064 174.3024 66 Q 4.5396 9.5863 124.9919 54.5718 31.4099 174.1419 67 I 4.8190 8.7793 128.5005 59.6066 39.6811 174.6867 68 Q 3.6832 8.9101 129.8873 55.0157 29.2727 176.7061 69 K 4.0745 8.2898 127.3199 59.2253 32.1925 179.1022 70 S 4.1830 8.0522 114.4845 60.3850 63.1710 174.5338 71 N 4.6747 7.9066 114.6887 51.3844 37.9649 175.4142 72 G 3.8333 8.1358 106.9885 45.3663 0.0000 173.8911 73 K 3.9174 7.8662 122.0153 56.7998 33.2544 174.9206 74 E 4.9897 8.8466 128.2457 54.9492 31.3494 174.6837 75 T 4.6957 9.1039 125.0556 61.6602 71.1774 174.2234 76 V 4.1508 8.3354 127.2444 61.3886 32.0177 177.2015 77 V 3.4651 8.8699 127.2010 65.0154 32.2297 176.1566 78 G 4.3429 7.7680 104.7089 45.2649 0.0000 172.3103 79 R 5.1127 8.8035 121.0923 53.0119 32.8894 176.6692 80 F 4.3563 8.2783 116.9141 56.7275 38.8607 175.9722 81 N 4.7379 7.4907 116.0298 53.3968 38.1989 175.1342 82 E 4.7838 7.8219 118.0882 55.5337 29.3180 174.5570 83 T 5.2715 8.9132 118.5853 62.4874 71.7280 175.6785 84 Q 4.7426 9.0647 122.8154 54.3322 33.3366 174.1095 85 I 5.0060 7.7497 121.7877 59.6254 41.4006 174.0992 86 F 5.0551 9.4132 126.6067 55.8221 43.7101 173.1310 87 Q 4.6917 8.9003 122.3658 54.5709 30.7327 175.2026 88 G 2.5204 7.0964 117.4959 43.3443 0.0000 171.8995 89 S 3.8943 7.6236 111.6427 61.1670 63.5190 174.6174 90 N 5.2633 7.5249 117.1966 50.5346 39.3125 172.8026 91 W 5.5960 7.1811 113.7859 55.9074 32.3558 173.8403 92 I 5.2120 9.2875 120.9627 59.8912 40.8069 174.1062 93 M 5.1388 9.9207 127.2926 53.9097 34.3418 173.9580 94 L 5.0194 8.8703 128.9668 53.4671 44.5484 174.9389 95 I 5.0440 9.0345 126.7357 59.6829 40.9476 173.9704 96 Y 5.3526 9.0217 124.0903 56.6422 40.9852 175.5494 97 K 4.5136 9.0994 125.4531 54.9280 35.7274 176.5117 98 G 3.9603 8.6779 106.7620 47.1990 0.0000 174.1164 99 G 3.9595 8.0679 107.8714 44.5242 0.0000 174.0961 100 D 4.6439 8.5367 119.2823 54.3976 41.8538 176.7400 101 E 4.5467 8.6071 121.3159 56.6532 30.4532 176.2186 102 Y 4.4091 8.9083 121.6856 57.2435 39.2747 175.8465 103 D 5.3628 8.6530 122.6044 52.1440 42.7629 173.8047 104 N 4.8173 7.6605 121.3873 52.0075 38.8823 175.8675 105 H 4.2313 9.0206 111.0409 58.4542 28.7209 176.9481 106 C 4.1876 12.0000 116.0842 56.9452 40.0285 174.6378 107 G 3.7048 8.3461 108.4045 44.2938 0.0000 174.7610 108 R 5.9358 8.5034 119.7742 55.1568 30.4673 176.0843 109 E 4.2913 8.3452 117.8495 56.9702 30.7823 176.3189 110 Q 4.4611 8.6253 120.2532 55.8465 29.7967 176.3109 111 R 4.1534 8.5357 121.2085 56.5393 31.5110 175.8850 112 R 5.1361 8.5010 118.1415 54.6390 34.5500 174.4256 113 A 4.7831 9.3767 124.9171 50.3023 21.4557 175.5729 114 V 4.5676 8.4236 122.8765 61.2752 34.0274 174.4666 115 V 4.6036 8.7466 128.8895 61.3164 34.0113 174.0433 116 M 4.5014 9.2903 129.4488 54.5317 33.0590 174.9313 117 I 4.6114 9.0178 129.4581 60.2979 38.6509 175.4044 118 S 5.2154 8.9240 124.4473 56.9971 64.9016 173.3804 119 C 4.8862 8.8336 124.2598 57.2604 42.6587 172.9693 120 N 4.6687 8.4311 123.1156 53.2547 40.9610 174.7395 121 R 4.2977 8.7694 125.1940 57.5754 30.4969 177.0087 122 H 4.7615 8.8649 115.1288 56.5039 29.7222 175.0802 123 T 4.7320 7.4916 113.1252 60.0583 70.4014 174.0518 124 L 4.0242 8.6797 128.2713 57.3051 42.5706 177.0647 125 A 4.9943 7.5285 116.2736 52.3097 22.7690 174.7204 126 D 4.4364 8.3575 121.0599 54.6578 44.7411 174.1582 127 N 4.2236 8.4252 114.2414 54.1700 35.5749 174.9270 128 F 5.0757 8.1447 119.1008 57.6941 40.3734 173.8907 129 N 4.9339 8.5822 124.9382 50.8576 43.3177 172.1671 130 P 4.1764 0.0000 0.0000 62.6004 31.9163 175.8569 131 V 4.1382 8.5482 122.4063 63.5105 33.9678 175.7146 132 S 4.5559 7.1768 113.5873 56.8693 66.1663 172.6710 133 E 4.1886 8.5858 124.1783 55.9210 34.7992 173.8120 134 E 4.9549 7.4583 121.9257 54.1773 30.1650 173.6575 135 R 4.1324 9.3220 123.9592 54.3316 33.6379 177.5054 136 G 4.0553 9.0158 117.2444 46.6381 0.0000 174.2679 137 K 3.9654 9.2219 122.0453 58.6870 32.7444 176.9823 138 V 3.7916 8.0696 119.7607 62.6480 30.9060 174.6521 139 Q 5.0167 8.2032 127.3269 54.2834 28.5329 175.2536 140 D 4.5521 8.7125 117.2553 53.6493 41.9592 176.0868 141 C 4.0636 8.3096 116.2622 56.8797 36.9447 172.9536 142 F 4.9712 7.4076 116.5002 57.7114 42.9881 171.8306 143 Y 4.4934 8.1916 123.6856 56.0727 40.2078 174.2668 144 L 4.7821 8.0394 126.8206 53.0648 45.2331 175.3124 145 F 5.0821 9.5697 124.7140 55.5108 43.1122 173.8849 146 E 5.3446 8.9190 117.6663 55.4671 33.3399 174.0329 147 M 5.7678 8.5523 116.6364 56.0214 35.2214 172.8326 148 D 5.5136 8.6559 119.2399 52.9673 44.5986 175.6129 149 S 5.0877 8.4530 111.8741 57.7997 66.1732 177.3923 150 S 4.4007 8.6450 121.3280 60.5159 63.0553 176.4648 151 L 3.9975 7.7862 120.2357 57.0420 41.3437 177.5559 152 A 4.4483 7.6567 119.6174 52.2470 19.1508 176.6038 153 C 4.4501 7.7672 114.5973 57.7975 41.0946 174.1146 154 S 4.4331 8.2710 117.5999 58.8348 62.8291 168.8319 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 3 E 8.44 4.31 0.00 2.09 2.03 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 2.19 2.35 0.00 4 K 8.51 4.15 0.00 1.97 1.96 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.49 7.81 5 T 8.73 5.23 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 0.92 0.00 0.00 6 C 8.64 4.89 0.00 2.89 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 7 D 9.06 4.99 0.00 2.62 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 8 L 8.54 4.71 0.00 1.53 1.61 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.25 3.69 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 0.76 0.00 0.00 1.04 0.00 0.00 10 G 9.11 3.77 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 0.00 0.00 0.00 11 E 8.87 3.85 0.00 2.02 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 0.00 2.43 2.29 0.00 12 K 9.00 3.84 0.00 1.71 1.87 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.47 7.81 13 G 8.06 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 14 K 7.72 4.65 0.00 1.75 1.79 0.00 1.72 0.00 0.00 1.92 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.34 7.81 15 E 8.22 4.12 0.00 2.08 1.97 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 2.29 2.25 0.00 16 S 8.59 4.18 0.00 3.93 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 17 E 8.83 4.01 0.00 2.28 2.20 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 2.37 2.43 0.00 18 K 7.95 3.92 0.00 1.86 1.85 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.51 1.53 7.81 19 E 8.09 3.91 0.00 2.16 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 2.26 2.25 0.00 20 L 8.08 3.96 0.00 1.82 1.74 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.14 3.99 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 22 L 7.53 3.96 0.00 1.83 1.74 0.92 0.79 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 23 L 8.18 4.25 0.00 1.91 1.88 1.02 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.41 3.89 0.00 1.86 2.02 0.00 1.48 0.00 0.00 1.57 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.46 7.81 25 R 7.88 3.98 0.00 1.99 2.05 0.00 3.39 0.00 0.00 3.25 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 26 L 7.60 4.50 0.00 2.11 1.84 1.01 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.28 2.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 28 P 0.00 4.17 0.00 2.01 2.11 0.00 3.62 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 29 L 8.15 4.52 0.00 1.92 1.90 1.01 1.21 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 30 F 8.47 4.73 0.00 2.92 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 31 Q 8.01 4.05 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 7.05 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 32 K 7.27 4.08 0.00 1.69 1.19 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.32 7.81 33 S 7.32 4.23 0.00 3.58 3.42 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 34 F 8.78 4.98 0.00 2.55 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 35 E 8.96 5.98 0.00 2.01 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 2.50 2.16 0.00 36 S 8.98 4.81 0.00 4.19 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.79 5.28 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 38 V 9.03 4.51 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.22 0.00 0.00 39 G 9.39 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 0.00 0.00 0.00 0.00 40 Q 8.07 4.65 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.91 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 41 S 8.71 4.31 0.00 3.89 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 42 P 0.00 4.92 0.00 2.15 2.11 0.00 3.74 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 1.91 1.96 0.00 43 D 8.27 5.00 0.00 2.82 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 44 M 7.90 4.75 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.73 0.00 45 Y 9.27 5.17 0.00 2.78 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 46 S 9.08 5.11 0.00 3.86 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 Y 9.44 5.80 0.00 3.23 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 48 V 8.65 5.00 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 0.98 0.00 0.00 0.99 0.00 0.00 49 F 9.60 5.53 0.00 2.74 2.02 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 50 R 8.69 4.45 0.00 1.60 1.47 0.00 3.04 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.39 0.00 51 V 7.86 4.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.83 0.00 0.00 52 C 8.66 3.86 0.00 1.72 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 53 R 6.52 4.10 0.00 1.39 1.49 0.00 3.23 0.00 0.00 2.80 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.35 0.00 54 E 8.64 4.22 0.00 2.02 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 2.31 2.56 0.00 55 A 9.12 4.54 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 56 G 7.85 3.77 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 0.00 0.00 0.00 57 Q 9.13 3.97 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 58 H 7.44 4.54 0.00 3.30 3.12 0.00 5.75 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 9.34 4.60 0.00 3.80 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 60 S 8.25 4.50 0.00 3.86 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 61 G 8.33 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.24 4.23 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 63 G 9.15 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 7.80 5.43 0.00 2.00 1.56 0.03 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 65 V 9.06 5.00 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 0.71 0.00 0.00 1.02 0.00 0.00 66 Q 9.59 4.54 0.00 2.23 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.36 1.88 0.00 67 I 8.78 4.82 1.92 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 1.17 0.64 0.87 0.00 0.00 68 Q 8.91 3.68 0.00 1.90 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.81 0.00 0.00 0.00 0.00 0.00 1.94 1.25 0.00 69 K 8.29 4.07 0.00 1.65 1.79 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.40 7.81 70 S 8.05 4.18 0.00 3.92 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 71 N 7.91 4.67 0.00 2.80 2.90 0.00 0.00 6.03 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.14 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 0.00 0.00 0.00 73 K 7.87 3.92 0.00 1.96 1.71 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.41 7.81 74 E 8.85 4.99 0.00 1.99 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.29 0.00 75 T 9.10 4.70 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 1.24 0.00 0.00 76 V 8.34 4.15 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 0.76 0.00 0.00 0.94 0.00 0.00 77 V 8.87 3.47 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 0.18 0.00 0.00 0.75 0.00 0.00 78 G 7.77 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 79 R 8.80 5.11 0.00 1.65 1.67 0.00 3.11 0.00 0.00 3.17 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.38 0.00 80 F 8.28 4.36 0.00 2.86 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 0.00 0.00 0.00 81 N 7.49 4.74 0.00 2.68 2.53 0.00 0.00 5.88 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 82 E 7.82 4.78 0.00 1.99 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 2.20 2.22 0.00 83 T 8.91 5.27 4.37 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 1.39 0.00 0.00 84 Q 9.06 4.74 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 85 I 7.75 5.01 1.82 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 1.21 0.95 0.79 0.00 0.00 86 F 9.41 5.06 0.00 3.21 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 87 Q 8.90 4.69 0.00 1.97 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.71 0.00 0.00 0.00 0.00 0.00 2.00 2.27 0.00 88 G 7.10 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 0.00 0.00 0.00 89 S 7.62 3.89 0.00 3.97 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 90 N 7.52 5.26 0.00 2.71 2.85 0.00 0.00 6.43 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 91 W 7.18 5.60 0.00 3.51 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 92 I 9.29 5.21 1.98 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 1.13 0.67 1.05 0.00 0.00 93 M 9.92 5.14 0.00 2.45 2.18 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.61 0.00 94 L 8.87 5.02 0.00 1.78 1.37 0.98 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 95 I 9.03 5.04 2.09 0.00 0.00 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 1.35 0.72 1.04 0.00 0.00 96 Y 9.02 5.35 0.00 2.91 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 97 K 9.10 4.51 0.00 1.91 1.83 0.00 1.89 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.47 7.81 98 G 8.68 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 0.00 0.00 0.00 99 G 8.07 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 0.00 0.00 0.00 100 D 8.54 4.64 0.00 2.54 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 0.00 101 E 8.61 4.55 0.00 1.87 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 2.48 2.36 0.00 102 Y 8.91 4.41 0.00 3.04 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 0.00 103 D 8.65 5.36 0.00 2.66 2.62 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 0.00 104 N 7.66 4.82 0.00 2.95 2.85 0.00 0.00 5.85 7.90 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 0.00 105 H 9.02 4.23 0.00 3.24 3.49 0.00 5.71 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 C 12.00 4.19 0.00 2.68 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.35 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 R 8.50 5.94 0.00 2.00 2.34 0.00 2.68 0.00 0.00 3.96 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.46 0.00 109 E 8.35 4.29 0.00 2.18 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 0.00 2.60 2.69 0.00 110 Q 8.63 4.46 0.00 2.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.08 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 111 R 8.54 4.15 0.00 1.56 1.68 0.00 2.79 0.00 0.00 2.64 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 1.03 0.00 112 R 8.50 5.14 0.00 1.79 1.88 0.00 3.31 0.00 0.00 3.36 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 113 A 9.38 4.78 1.26 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 0.00 114 V 8.42 4.57 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 0.94 0.00 0.00 0.95 0.00 0.00 115 V 8.75 4.60 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 0.74 0.00 0.00 0.21 0.00 0.00 116 M 9.29 4.50 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 117 I 9.02 4.61 2.08 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.65 0.96 0.00 0.00 118 S 8.92 5.22 0.00 3.99 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 0.00 119 C 8.83 4.89 0.00 3.17 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 N 8.43 4.67 0.00 2.80 2.65 0.00 0.00 7.23 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 0.00 121 R 8.77 4.30 0.00 1.70 1.90 0.00 3.21 0.00 0.00 3.20 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 122 H 8.86 4.76 0.00 3.26 3.34 0.00 5.61 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.49 4.73 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 1.27 0.00 0.00 124 L 8.68 4.02 0.00 1.69 1.74 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 125 A 7.53 4.99 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.36 4.44 0.00 2.80 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 0.00 127 N 8.43 4.22 0.00 3.12 2.88 0.00 0.00 6.45 8.13 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 0.00 128 F 8.14 5.08 0.00 2.95 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 N 8.58 4.93 0.00 2.58 2.52 0.00 0.00 6.34 7.56 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 0.00 130 P 0.00 4.18 0.00 1.63 1.46 0.00 3.57 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.93 0.00 131 V 8.55 4.14 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 0.65 0.00 0.00 0.78 0.00 0.00 132 S 7.18 4.56 0.00 3.85 3.44 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 0.00 133 E 8.59 4.19 0.00 1.69 1.63 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 1.81 1.82 0.00 134 E 7.46 4.95 0.00 1.78 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 2.63 2.52 0.00 135 R 9.32 4.13 0.00 1.65 1.53 0.00 3.07 0.00 0.00 3.39 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 136 G 9.02 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 137 K 9.22 3.97 0.00 1.75 1.88 0.00 1.77 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.38 7.81 138 V 8.07 3.79 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 0.87 0.00 0.00 0.88 0.00 0.00 139 Q 8.20 5.02 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.67 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 140 D 8.71 4.55 0.00 2.70 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 0.00 141 C 8.31 4.06 0.00 2.87 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 0.00 142 F 7.41 4.97 0.00 2.93 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 0.00 143 Y 8.19 4.49 0.00 3.16 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 0.00 144 L 8.04 4.78 0.00 1.19 1.14 0.89 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 145 F 9.57 5.08 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 0.00 146 E 8.92 5.34 0.00 1.92 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 2.29 2.20 0.00 147 M 8.55 5.77 0.00 2.24 2.25 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 148 D 8.66 5.51 0.00 2.60 2.61 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 0.00 149 S 8.45 5.09 0.00 3.91 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 0.00 150 S 8.65 4.40 0.00 4.07 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 0.00 151 L 7.79 4.00 0.00 1.69 1.80 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 152 A 7.66 4.45 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 0.00 153 C 7.77 4.45 0.00 3.08 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 0.00 154 S 8.27 4.43 0.00 4.02 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