NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 S 4.4317 8.3344 115.4175 57.9698 64.3578 173.0407 0 H 4.1046 8.7591 122.6483 55.5774 30.2906 172.6000 1 M 4.8729 8.9883 127.2264 53.8242 35.6281 173.8079 2 D 5.0047 9.1160 124.2014 52.5427 44.8897 174.9900 3 I 4.6769 8.3788 122.9327 60.1244 38.5240 175.0781 4 R 4.6909 8.7882 127.2323 54.1097 32.5253 175.7952 5 Q 4.0319 8.5994 124.8771 55.8154 29.9505 175.1622 6 M 4.1713 8.6153 128.0744 55.5882 32.9874 174.9101 7 N 4.9890 8.5579 122.1890 49.8293 41.2307 174.4146 8 K 3.7725 8.6870 117.7452 60.2947 31.5849 178.2241 9 T 3.9537 8.0162 108.2675 63.9080 68.7967 175.0912 10 H 4.7970 8.1504 118.2857 55.3656 29.1777 175.9007 11 L 4.0390 7.6604 123.0566 58.3016 41.4934 179.3941 12 E 3.9893 8.0960 117.6789 59.5237 29.3378 178.8231 13 H 4.2334 8.0708 115.8653 58.6055 28.8122 177.3219 14 W 3.9742 8.5024 130.1784 60.6686 30.5840 178.1281 15 R 3.3401 8.4317 118.2188 59.0525 29.2556 179.3061 16 G 3.5446 7.7348 104.4787 47.6722 0.0000 175.3708 17 L 4.0932 7.3448 121.0142 57.2399 41.7471 179.2519 18 R 3.3645 7.5089 118.8995 59.1609 29.5766 178.7285 19 K 3.8716 7.3094 116.9897 58.9607 32.0053 178.8707 20 Q 3.9488 7.3461 117.7455 57.9718 28.6979 177.7392 21 L 3.7010 6.8504 120.3995 56.1117 43.5198 176.8837 22 W 5.0203 7.5559 117.6540 53.6667 29.4319 173.1431 23 P 4.4241 0.0000 0.0000 62.9536 31.8108 176.8940 24 G 3.9351 8.6870 105.8138 46.5062 0.0000 172.9154 25 H 4.3901 7.9812 118.9273 54.4183 30.6516 173.4351 26 P 4.2192 0.0000 0.0000 63.0218 32.1153 176.3976 27 D 4.4157 8.9852 121.6949 57.9646 41.1240 178.5611 28 D 4.4109 8.1782 118.2854 57.1762 40.7372 178.7094 29 A 3.9313 7.8850 121.3786 55.4391 18.4211 179.1845 30 H 4.1263 8.1114 114.2912 58.9750 28.7884 177.3810 31 L 3.9925 7.8629 121.1859 58.2280 41.9778 178.8563 32 A 3.9917 7.9682 120.3483 55.3639 18.3270 179.0807 33 D 4.5617 8.8796 117.8630 57.7007 41.0036 179.4473 34 G 3.4571 9.0099 106.3274 47.9217 0.0000 175.6066 35 E 3.9551 7.8893 120.0046 58.8775 29.8298 178.6551 36 E 4.0779 8.7035 119.7274 59.4615 29.7736 178.9837 37 I 3.6500 8.0394 120.1224 64.3718 36.9159 178.4460 38 L 3.9475 7.7275 118.4508 56.8716 41.4645 178.4562 39 Q 4.4508 7.5780 115.1444 54.7360 29.7709 175.6613 40 A 4.4155 7.1865 123.0451 51.7701 19.2775 177.0415 41 D 4.9784 8.6894 117.4678 53.6681 40.9931 176.5187 42 H 5.0293 8.3692 116.2558 55.5487 30.2869 173.5066 43 L 5.5585 8.0774 117.2818 53.2775 45.4077 175.6487 44 A 4.2086 8.3519 122.5097 50.7276 22.6462 175.3743 45 S 5.0765 7.6587 115.0185 56.6659 67.6492 173.0524 46 F 4.9936 9.5433 120.1147 55.8437 43.1168 173.8423 47 I 5.0399 8.9096 123.8299 59.4266 39.9341 174.5354 48 A 4.7263 9.0546 130.1771 51.7310 19.7548 175.9851 49 M 5.2339 9.5580 122.7914 53.6583 35.9931 174.9836 50 A 4.7883 8.7616 123.1405 51.4876 23.2716 176.1119 51 D 4.4089 9.9898 121.0021 55.2127 38.6277 175.1628 52 G 3.9656 8.5553 106.3367 45.3498 0.0000 174.4297 53 V 4.2395 7.6242 112.6077 59.2387 34.1602 174.4830 54 A 4.8524 8.2010 125.2195 51.2076 19.6693 177.2050 55 I 4.1266 8.1784 116.5025 60.3941 39.3245 175.2655 56 G 4.5152 7.7706 109.1752 46.5285 0.0000 171.9571 57 F 5.6673 8.7895 114.4384 55.8967 41.9659 172.9472 58 A 4.8440 9.4461 120.6026 50.4566 22.7391 174.7233 59 D 5.5716 9.5660 121.2481 52.1470 43.5493 175.6219 60 A 5.6367 9.3334 123.7196 50.6384 23.5614 174.6692 61 S 5.4226 9.6042 113.0283 57.3161 67.5830 172.8287 62 I 4.9260 8.9802 121.2532 59.8080 38.8427 175.5857 63 R 4.6484 9.3633 127.2678 55.0162 31.5605 177.1760 64 H 4.5194 8.9446 120.1662 56.8265 29.9042 175.5153 65 D 4.6071 7.9002 118.2272 53.7230 41.2948 175.3314 66 Y 4.1171 8.5617 122.1395 58.0352 39.4520 175.6097 67 V 4.0363 7.4349 125.8632 60.4003 33.3228 174.3665 68 N 4.4103 8.6126 124.2019 55.5204 38.6540 175.2480 69 G 4.1772 8.7710 111.6205 46.5100 0.0000 172.9701 70 C 4.8267 7.4447 116.5780 58.5920 29.8197 173.3657 71 D 4.9348 9.0861 120.4973 54.1242 41.6083 175.8305 72 S 4.8360 8.4161 113.2071 56.7471 66.3173 172.9372 73 S 4.5560 8.0911 113.1435 56.2414 64.8337 171.6740 74 P 4.7317 0.0000 0.0000 62.5039 32.7707 175.1619 75 V 4.7028 8.5641 119.4649 60.9519 34.9716 174.4360 76 V 4.6110 8.5827 127.0915 60.9093 33.2160 174.5559 77 F 5.1643 9.6713 127.4256 56.1440 42.4660 173.7449 78 L 4.6374 8.2957 129.1749 54.5613 41.1275 176.1217 79 E 4.5893 9.5451 127.7004 58.7348 30.2595 177.6426 80 G 4.2907 8.0637 103.8634 46.0035 0.0000 172.3289 81 I 4.6441 8.0040 120.8434 59.4861 41.3921 173.6996 82 F 4.6281 8.4081 129.5086 56.9570 43.2073 172.8172 83 V 4.5692 7.0908 124.7128 60.4296 34.2357 175.1708 84 L 3.9197 8.5056 127.4915 54.3349 42.5053 176.2728 85 P 4.1308 0.0000 0.0000 66.1077 31.2823 178.7743 86 S 4.0773 7.9714 110.9228 60.2159 62.7708 174.7620 87 F 4.6840 7.9897 118.0982 57.0232 39.2175 175.7322 88 R 4.1461 7.6414 120.5102 56.6178 30.5150 176.1278 89 Q 3.6530 8.5368 115.1323 57.7022 25.9901 174.6637 90 R 4.4501 7.5111 110.3945 55.6879 31.6119 176.8254 91 G 3.8910 8.2521 106.2342 46.1725 0.0000 175.9104 92 V 3.4682 7.8043 119.9034 65.8377 31.6087 177.8729 93 A 3.8785 7.8710 120.0181 54.8170 18.2162 179.0215 94 K 3.7396 8.0597 117.6832 60.0947 32.1733 178.8055 95 Q 3.9789 7.9722 117.8365 58.7530 28.6062 178.6638 96 L 3.9092 8.1390 120.3000 58.0062 41.6692 179.6882 97 I 3.6940 8.2602 119.7485 64.2784 36.9474 178.3723 98 A 3.9744 8.0712 121.5034 54.9078 18.1002 179.6078 99 A 3.7305 7.7327 119.4287 55.1204 18.3505 180.0083 100 V 3.1272 7.3183 116.7027 66.0136 31.5967 177.9628 101 Q 3.9559 8.3666 119.7107 59.1520 28.7958 178.2839 102 R 3.8584 8.1108 119.7301 59.0987 30.0259 178.1837 103 W 4.4084 8.4370 128.3594 60.7232 30.7553 178.2455 104 G 3.3518 8.7111 106.0000 47.7841 0.0000 175.8760 105 T 3.8160 8.3517 118.4472 66.6528 68.3153 176.5177 106 N 4.5348 8.2009 116.7325 55.2963 38.5606 176.5288 107 K 4.2652 7.2063 118.5508 55.6790 32.2321 177.1723 108 G 3.8316 8.0554 107.6498 46.0812 0.0000 173.5771 109 C 4.3995 8.3137 117.0174 58.9305 28.8806 174.2101 110 R 4.3633 8.3895 121.1437 56.8900 30.8536 176.2489 111 E 4.7870 7.7276 116.6653 54.5976 34.1686 173.8125 112 M 5.3218 8.6484 121.6444 53.8744 34.9149 174.2948 113 A 5.0337 8.9072 126.3591 50.7703 23.5737 174.0070 114 S 3.5973 7.9244 111.9944 57.7749 65.2273 173.3499 115 D 4.7992 8.2591 120.8678 52.4984 42.1857 174.1492 116 T 4.5168 7.8476 112.3763 60.7682 70.2274 173.1167 117 S 4.2953 8.4762 120.3127 57.6591 62.9922 173.5968 118 P 4.2819 0.0000 0.0000 65.4379 31.2630 177.5475 119 E 4.1024 8.2779 116.9040 58.0878 29.8861 176.8454 120 N 4.6477 8.2062 119.0684 52.6464 37.6956 175.2128 121 T 3.9538 8.2359 115.9932 64.4335 69.2161 176.5463 122 I 3.6919 7.6795 122.2396 64.0504 37.1924 178.0482 123 S 4.0846 8.4940 114.0338 61.4856 62.1575 176.2562 124 Q 3.9974 7.9400 120.1465 58.9699 28.4890 179.0003 125 K 3.9651 8.0623 119.4561 59.3483 32.0813 179.6007 126 V 3.5220 8.3074 118.7649 66.3591 31.4765 177.7223 127 H 4.0064 8.5765 116.2766 59.0829 28.4442 177.9039 128 Q 4.3549 8.6423 120.9386 58.3859 28.3402 178.4622 129 A 4.0480 8.4779 121.2299 54.7178 18.3696 178.5813 130 L 4.5277 7.7727 115.4412 54.6651 41.9385 177.6707 131 G 3.9368 8.3151 107.2290 45.2326 0.0000 174.0089 132 F 4.5187 8.3467 118.6974 56.2515 40.2261 174.6550 133 E 4.7752 8.3934 122.4033 54.0857 32.0844 175.7793 134 E 4.1310 8.7898 123.7080 56.6110 30.5628 175.9386 135 T 4.4476 8.4973 115.1716 62.8331 70.5892 173.7030 136 E 4.7924 7.5436 116.1903 55.1958 31.9808 174.1564 137 R 4.7416 8.3225 117.5469 54.6168 33.4178 175.4689 138 V 4.4924 8.0750 113.2751 59.9806 35.8447 174.2107 139 I 4.3400 7.9888 121.8753 59.6978 38.6930 175.7189 140 F 4.5311 8.4610 123.5300 56.3647 40.4778 174.7379 141 Y 4.8385 8.3145 119.6967 56.3044 41.4764 175.0679 142 R 4.7707 8.4407 120.8046 54.6858 33.4573 174.4310 143 K 4.5576 8.3507 123.7090 54.5281 35.2087 175.8282 144 R 4.0352 8.5741 126.5779 56.6505 30.7947 175.8715 145 C 4.3082 8.5442 120.6089 60.0822 28.2916 173.5670 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 S 8.33 4.43 0.00 4.02 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 H 8.76 4.10 0.00 3.19 3.28 0.00 5.88 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 8.99 4.87 0.00 1.96 1.83 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.46 0.00 2 D 9.12 5.00 0.00 2.53 2.50 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 3 I 8.38 4.68 1.90 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 1.33 0.96 1.00 0.00 0.00 4 R 8.79 4.69 0.00 1.48 1.74 0.00 3.33 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 5 Q 8.60 4.03 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.92 0.00 0.00 0.00 0.00 0.00 1.89 1.41 0.00 6 M 8.62 4.17 0.00 1.61 1.65 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.09 0.00 7 N 8.56 4.99 0.00 2.87 2.83 0.00 0.00 5.86 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 8 K 8.69 3.77 0.00 1.82 1.82 0.00 1.56 0.00 0.00 1.82 0.00 0.00 3.09 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.55 7.81 9 T 8.02 3.95 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 1.14 0.00 0.00 10 H 8.15 4.80 0.00 3.16 3.38 0.00 5.83 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 11 L 7.66 4.04 0.00 1.72 1.80 0.90 0.57 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 12 E 8.10 3.99 0.00 1.98 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 2.37 2.45 0.00 13 H 8.07 4.23 0.00 3.41 3.37 0.00 5.63 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 W 8.50 3.97 0.00 3.20 3.29 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 15 R 8.43 3.34 0.00 1.82 1.79 0.00 3.20 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.10 0.00 16 G 7.73 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.34 4.09 0.00 1.51 1.95 1.11 1.38 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 18 R 7.51 3.36 0.00 0.67 1.04 0.00 2.21 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.37 0.00 19 K 7.31 3.87 0.00 1.57 1.73 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.15 1.18 7.81 20 Q 7.35 3.95 0.00 1.53 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.98 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 21 L 6.85 3.70 0.00 0.91 1.17 0.74 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 22 W 7.56 5.02 0.00 3.36 2.88 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 23 P 0.00 4.42 0.00 2.20 1.98 0.00 3.82 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 24 G 8.69 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 25 H 7.98 4.39 0.00 3.21 3.34 0.00 5.98 0.00 0.00 0.00 0.00 6.88 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 4.22 0.00 2.08 1.91 0.00 3.30 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 2.00 2.01 0.00 27 D 8.99 4.42 0.00 2.78 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 28 D 8.18 4.41 0.00 2.70 2.70 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 29 A 7.88 3.93 1.13 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 0.00 0.00 0.00 30 H 8.11 4.13 0.00 3.31 3.25 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.86 3.99 0.00 1.80 1.89 0.96 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.97 3.99 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 33 D 8.88 4.56 0.00 3.22 3.15 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 0.00 0.00 0.00 0.00 34 G 9.01 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.89 3.96 0.00 2.13 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 2.65 2.47 0.00 36 E 8.70 4.08 0.00 2.07 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 0.00 2.33 2.38 0.00 37 I 8.04 3.65 1.61 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 1.48 0.85 0.59 0.00 0.00 38 L 7.73 3.95 0.00 1.69 1.65 0.82 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 39 Q 7.58 4.45 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.94 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 40 A 7.19 4.42 1.38 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 0.00 0.00 0.00 41 D 8.69 4.98 0.00 2.79 2.83 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 42 H 8.37 5.03 0.00 3.25 3.62 0.00 5.75 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 43 L 8.08 5.56 0.00 1.52 1.53 0.98 0.93 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 44 A 8.35 4.21 -0.44 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 45 S 7.66 5.08 0.00 3.18 3.69 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 0.00 0.00 0.00 46 F 9.54 4.99 0.00 2.95 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 47 I 8.91 5.04 1.82 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.11 0.96 0.00 0.00 48 A 9.05 4.73 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 49 M 9.56 5.23 0.00 1.83 1.90 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 2.49 2.71 0.00 50 A 8.76 4.79 1.11 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 51 D 9.99 4.41 0.00 2.80 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 52 G 8.56 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 53 V 7.62 4.24 2.00 0.00 0.00 0.00 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 0.84 0.00 0.00 54 A 8.20 4.85 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 55 I 8.18 4.13 1.10 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.60 0.01 0.00 0.00 56 G 7.77 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 57 F 8.79 5.67 0.00 3.41 3.26 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 58 A 9.45 4.84 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 59 D 9.57 5.57 0.00 3.01 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 60 A 9.33 5.64 1.49 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 0.00 0.00 61 S 9.60 5.42 0.00 4.12 4.15 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 0.00 0.00 0.00 0.00 62 I 8.98 4.93 1.88 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.43 0.79 0.00 0.00 63 R 9.36 4.65 0.00 1.74 1.82 0.00 2.80 0.00 0.00 2.94 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 64 H 8.94 4.52 0.00 3.15 3.36 0.00 5.71 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 D 7.90 4.61 0.00 2.68 2.67 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 66 Y 8.56 4.12 0.00 2.95 2.97 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 67 V 7.43 4.04 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 1.15 0.00 0.00 0.97 0.00 0.00 68 N 8.61 4.41 0.00 2.85 3.09 0.00 0.00 7.35 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 69 G 8.77 4.18 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 0.00 70 C 7.44 4.83 0.00 2.99 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 71 D 9.09 4.93 0.00 2.66 2.70 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 72 S 8.42 4.84 0.00 3.91 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 73 S 8.09 4.56 0.00 3.84 3.75 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 74 P 0.00 4.73 0.00 1.95 1.67 0.00 3.73 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.86 0.00 75 V 8.56 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 1.15 0.00 0.00 0.96 0.00 0.00 76 V 8.58 4.61 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 0.88 0.00 0.00 1.30 0.00 0.00 77 F 9.67 5.16 0.00 3.14 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 78 L 8.30 4.64 0.00 1.60 1.36 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 79 E 9.55 4.59 0.00 2.33 2.28 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 2.85 2.65 0.00 80 G 8.06 4.29 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 0.00 81 I 8.00 4.64 1.72 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.73 0.76 0.00 0.00 82 F 8.41 4.63 0.00 2.79 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 0.00 0.00 0.00 0.00 83 V 7.09 4.57 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 0.87 0.00 0.00 0.78 0.00 0.00 84 L 8.51 3.92 0.00 2.03 1.79 1.11 1.09 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 85 P 0.00 4.13 0.00 2.15 2.09 0.00 3.67 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.14 0.00 86 S 7.97 4.08 0.00 3.20 3.28 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 87 F 7.99 4.68 0.00 2.95 2.98 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 0.00 0.00 0.00 88 R 7.64 4.15 0.00 1.86 1.76 0.00 3.16 0.00 0.00 3.04 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.70 0.00 89 Q 8.54 3.65 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.00 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 90 R 7.51 4.45 0.00 2.01 1.92 0.00 3.17 0.00 0.00 3.30 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.52 0.00 91 G 8.25 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 92 V 7.80 3.47 2.04 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 1.08 0.00 0.00 0.93 0.00 0.00 93 A 7.87 3.88 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 94 K 8.06 3.74 0.00 1.81 2.00 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.54 7.81 95 Q 7.97 3.98 0.00 2.26 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 96 L 8.14 3.91 0.00 1.77 1.68 0.92 1.24 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 97 I 8.26 3.69 2.10 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.60 1.05 0.00 0.00 98 A 8.07 3.97 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 99 A 7.73 3.73 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 0.00 100 V 7.32 3.13 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 1.22 0.00 0.00 0.79 0.00 0.00 101 Q 8.37 3.96 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 102 R 8.11 3.86 0.00 2.00 2.13 0.00 3.20 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 103 W 8.44 4.41 0.00 3.55 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 G 8.71 3.35 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 0.00 0.00 0.00 0.00 105 T 8.35 3.82 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 1.18 0.00 0.00 106 N 8.20 4.53 0.00 2.68 2.87 0.00 0.00 7.08 8.09 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 0.00 107 K 7.21 4.27 0.00 1.43 1.48 0.00 1.44 0.00 0.00 1.33 0.00 0.00 3.14 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.64 1.14 7.81 108 G 8.06 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 0.00 109 C 8.31 4.40 0.00 2.92 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 R 8.39 4.36 0.00 1.78 1.95 0.00 3.14 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 111 E 7.73 4.79 0.00 1.86 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 2.27 0.00 112 M 8.65 5.32 0.00 1.81 1.87 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.74 0.00 113 A 8.91 5.03 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 0.00 114 S 7.92 3.60 0.00 3.38 3.11 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 0.00 115 D 8.26 4.80 0.00 2.89 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 T 7.85 4.52 4.18 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 1.16 0.00 0.00 117 S 8.48 4.30 0.00 3.93 3.74 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 0.00 118 P 0.00 4.28 0.00 2.09 2.12 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 119 E 8.28 4.10 0.00 1.96 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 2.35 2.26 0.00 120 N 8.21 4.65 0.00 2.73 2.74 0.00 0.00 6.77 7.37 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 0.00 121 T 8.24 3.95 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 0.00 122 I 7.68 3.69 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 1.51 0.52 0.87 0.00 0.00 123 S 8.49 4.08 0.00 3.94 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 0.00 124 Q 7.94 4.00 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 125 K 8.06 3.97 0.00 1.96 1.85 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.57 7.81 126 V 8.31 3.52 2.13 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 0.92 0.00 0.00 0.90 0.00 0.00 127 H 8.58 4.01 0.00 3.10 3.15 0.00 5.87 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 8.64 4.35 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.58 2.38 0.00 129 A 8.48 4.05 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 130 L 7.77 4.53 0.00 1.84 1.78 0.92 0.87 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 0.00 131 G 8.32 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 0.00 132 F 8.35 4.52 0.00 3.22 2.98 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 0.00 0.00 0.00 133 E 8.39 4.78 0.00 1.95 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 2.23 2.27 0.00 134 E 8.79 4.13 0.00 1.94 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 2.32 2.32 0.00 135 T 8.50 4.45 4.29 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 1.31 0.00 0.00 136 E 7.54 4.79 0.00 2.09 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 2.24 2.37 0.00 137 R 8.32 4.74 0.00 1.78 1.84 0.00 3.19 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 138 V 8.08 4.49 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 0.72 0.00 0.00 0.66 0.00 0.00 139 I 7.99 4.34 1.77 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.54 0.50 0.00 0.00 140 F 8.46 4.53 0.00 2.94 2.95 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 0.00 0.00 0.00 141 Y 8.31 4.84 0.00 2.97 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 0.00 142 R 8.44 4.77 0.00 1.75 1.78 0.00 3.22 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 143 K 8.35 4.56 0.00 1.73 1.64 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.75 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.43 7.81 144 R 8.57 4.04 0.00 1.82 1.82 0.00 3.28 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 1.61 1.66 0.00 145 C 8.54 4.31 0.00 3.00 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