NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.8166 8.4449 117.8388 56.2439 30.0089 172.9545 1D H 4.4668 8.7403 118.7303 55.9211 29.5804 173.1334 1E H 5.1034 7.6148 115.3293 53.4823 33.4568 171.9525 1F H 4.6274 8.9122 116.7783 56.0395 28.8781 174.4156 1G F 4.8093 8.4733 119.4533 57.8253 39.9245 174.2852 2 N 4.6135 8.5507 117.3727 52.3545 38.7963 174.4297 3 L 4.7027 8.0704 123.6372 52.1787 43.6454 174.8343 4 P 4.5121 0.0000 0.0000 61.5513 32.3062 174.3217 5 P 4.3447 0.0000 0.0000 62.7757 32.1718 174.4275 6 G 3.8157 7.8774 104.7703 44.1190 0.0000 171.7917 7 N 4.3282 7.9583 115.8721 52.2497 39.9367 173.7048 8 Y 4.8839 7.8327 112.7610 57.8185 38.5445 176.9614 9 K 4.0295 8.3509 121.6264 59.1340 32.1851 177.0520 10 K 4.6522 7.6097 114.3505 53.5452 34.9301 173.7167 11 P 4.8651 0.0000 0.0000 62.8792 32.6149 175.0383 12 K 4.5479 9.1710 119.4431 56.8141 36.4606 173.9816 13 L 5.0086 9.0813 120.0540 53.0540 44.8329 176.3052 14 L 5.0933 8.6354 121.9204 53.5275 43.4229 174.6658 15 Y 4.8437 9.3647 127.4983 56.3088 40.4735 173.8934 16 C 3.9004 8.4902 128.7222 58.3287 32.1029 174.4769 17 S 3.8303 8.2839 123.5849 61.6359 62.3918 175.2210 18 N 3.9044 7.2874 116.7661 56.3159 38.7230 174.9962 19 G 3.8948 7.4426 103.7736 44.3340 0.0000 172.1310 20 G 3.0497 7.5962 106.8300 44.6371 0.0000 173.3875 21 H 4.7613 7.1700 114.4941 53.5505 32.4806 174.4064 22 F 5.1908 8.6744 120.3517 56.1748 40.4483 175.2287 23 L 4.4987 9.0766 126.3470 55.5058 43.1719 175.5675 24 R 4.9037 10.1337 126.8540 54.6310 33.3827 174.1681 25 I 4.8009 8.1214 126.7523 59.2988 38.3279 175.7114 26 L 4.0951 9.0053 128.3303 53.4700 42.1646 177.2182 27 P 4.2232 0.0000 0.0000 65.5391 31.3125 176.9026 28 D 4.5158 8.0210 116.4643 53.2900 39.6988 177.1057 29 G 4.3200 8.3686 109.1595 45.5538 0.0000 173.5981 30 T 4.3698 8.5384 115.4526 61.4632 68.0678 173.3082 31 V 4.8996 7.9442 126.7172 61.2082 34.0306 174.4861 32 D 4.5763 8.8600 125.5555 53.1322 42.8491 174.1799 33 G 4.1844 8.5006 104.5186 45.5484 0.0000 172.3022 34 T 4.9823 9.1183 115.7198 60.3054 70.9117 174.8211 35 R 4.1619 8.9475 125.0934 57.2117 30.8215 176.3914 36 D 4.6262 8.3220 119.2820 53.0227 40.1245 176.5196 37 R 3.6773 8.6645 128.1212 58.6363 30.1826 177.4001 38 S 4.3291 8.7279 110.8934 58.5502 63.6928 173.9847 39 D 4.2516 8.2327 124.2466 55.8973 41.0405 177.0281 40 Q 4.1494 8.6096 123.3377 56.5487 28.8232 173.0388 41 H 4.9076 9.7833 115.2431 56.5064 28.9605 175.6980 42 I 4.5225 7.0542 110.0747 59.9757 38.2596 175.4884 43 Q 4.2636 7.7798 121.9311 55.7182 29.6283 174.6641 44 L 5.1587 8.8628 124.6304 52.7786 45.4190 175.4784 45 Q 4.8145 9.1639 124.2614 54.5198 30.7984 174.4897 46 L 5.1310 8.5457 126.6361 54.0093 43.6598 176.1763 47 S 4.5822 8.2302 114.0378 57.1843 66.5416 173.4920 48 A 5.3047 8.5132 123.3503 51.9678 20.2594 177.5711 49 E 4.1929 8.9057 119.2643 56.5553 29.9989 178.7782 50 S 4.5734 6.0255 116.3139 56.8136 64.8800 173.4359 51 V 3.8205 8.1677 121.4633 64.8022 31.5995 176.1729 52 G 3.9481 9.2746 114.9075 45.1342 0.0000 171.8218 53 E 5.2476 8.3024 119.9038 54.6392 32.0668 175.6131 54 V 4.9139 8.9064 116.4072 59.8764 36.7547 173.9151 55 Y 5.0341 8.8305 120.2407 56.5143 41.0088 175.2862 56 I 4.3730 8.5982 123.0312 59.6259 40.0488 173.9282 57 K 4.5855 8.7832 129.3253 54.2887 34.8272 175.0999 58 S 4.5750 8.6320 122.7430 58.0702 62.6778 174.8484 59 T 3.8837 8.6835 119.0816 64.9957 68.7484 175.8883 60 E 4.0251 8.4353 122.1653 58.8784 29.7975 177.3715 61 T 4.2278 8.1357 106.5367 61.0754 69.9417 175.7901 62 G 3.8110 8.4709 109.8819 45.1317 0.0000 173.5741 63 Q 4.3925 7.7314 119.1077 55.9528 30.3606 174.5671 64 Y 4.8058 8.9210 120.0387 56.0933 40.3156 175.1311 65 L 4.3597 8.9911 126.3405 55.3965 43.4146 175.6151 66 A 4.9530 8.7963 126.1435 50.6997 23.3028 174.4336 67 M 5.3867 8.5775 119.1502 53.8899 34.9756 175.4955 68 D 5.2409 9.6382 126.3949 51.7477 41.1506 177.1473 69 T 4.3826 8.5069 108.4524 64.2836 68.6637 174.5940 70 D 4.5765 8.3676 120.2941 54.1230 41.4430 176.9700 71 G 3.0820 8.6732 108.6606 45.2271 0.0000 172.8722 72 L 4.7441 7.9642 119.6539 52.9182 43.1466 176.1237 73 L 5.1654 8.2904 122.5531 55.2276 42.9393 175.3802 74 Y 4.9294 8.9555 118.9597 56.3037 41.9727 173.3338 75 G 4.2306 8.9596 108.7044 45.2383 0.0000 173.2870 76 S 5.0664 9.0910 121.2683 56.8187 64.0204 175.3476 77 Q 4.3619 9.0071 124.8692 58.2506 28.9372 176.4511 78 T 4.6369 7.6466 106.2166 58.8110 71.7827 171.5816 79 P 4.0182 0.0000 0.0000 61.5445 31.8891 174.6872 80 N 4.9653 8.0907 120.4383 51.1289 40.3439 173.9930 81 E 3.9894 8.9709 115.8940 60.2087 29.4483 178.8931 82 E 4.2250 9.0027 116.8154 57.8614 29.6642 177.5242 83 C 4.9846 8.2081 115.3287 58.7510 29.1417 173.3691 84 L 4.3525 7.1496 120.3913 53.7305 42.6885 175.8675 85 F 5.1260 9.0116 121.8152 55.5799 43.3038 174.6015 86 L 4.8368 9.2310 122.9119 53.6097 42.5500 175.5993 87 E 4.3374 8.7257 126.9179 55.4388 30.0580 175.8767 88 R 4.8198 8.5680 125.7229 53.9960 34.6005 174.7624 89 L 4.7481 8.6849 123.9329 55.1278 43.1386 175.8170 90 E 4.6892 9.0970 125.2623 55.1962 33.4889 175.0308 91 E 3.9944 9.7842 124.0342 57.5756 27.2777 174.1961 92 N 4.3152 8.5445 111.0452 54.1961 36.4038 174.0276 93 H 4.8001 8.4387 117.2044 57.6167 37.7495 173.5439 94 Y 4.6306 7.7106 116.0079 57.4981 40.1686 173.3275 95 N 5.6263 9.7488 117.7840 51.9464 41.3479 174.5675 96 T 5.2608 8.9218 112.9933 60.1515 72.6821 172.6938 97 Y 4.9599 8.7371 119.8239 56.6387 41.2664 174.1774 98 I 4.5828 8.5265 125.9848 59.1056 39.6423 175.5474 99 S 3.8701 8.7803 122.2466 58.5537 62.3444 173.9900 100 K 3.9472 8.7752 129.4048 59.4298 32.2983 178.6316 101 K 3.7267 7.9294 118.0622 59.2583 32.2312 176.8311 102 H 4.5943 8.1548 114.4641 55.1640 29.3287 176.4223 103 A 3.8920 7.9269 128.0842 56.1430 18.1541 181.6200 104 E 3.6377 7.8960 109.6000 58.3219 29.7190 179.5098 105 K 4.0793 7.8528 114.7536 56.1113 32.5350 176.0410 106 N 4.0138 7.7690 115.6442 53.9978 36.4569 174.4316 107 W 5.0861 7.8110 117.6218 55.8684 30.8881 176.7767 108 F 5.4683 9.1751 123.3857 55.1745 42.0448 174.9247 109 L 4.3036 9.1713 123.6643 55.2914 42.9620 176.0328 110 G 4.5373 8.5693 111.2430 45.3678 0.0000 171.4183 111 L 5.3278 8.2381 120.3324 52.5387 45.1418 177.2726 112 K 4.2586 9.3744 123.4901 55.4057 33.0005 178.4118 113 K 4.0224 8.4437 119.7924 59.5662 31.9374 178.0636 114 N 4.5018 8.0146 113.3881 53.0313 37.7475 175.9266 115 G 3.4547 8.4666 109.4489 45.0870 0.0000 173.6502 116 S 4.7932 9.1306 116.3981 57.7200 64.6735 173.8408 117 C 4.7293 8.4797 116.3402 58.1925 30.6141 173.0611 118 K 4.4419 8.6333 120.1428 55.6453 33.4208 176.6151 119 R 4.4258 8.2739 120.7773 54.6089 31.8281 177.7185 120 G 3.3099 8.6654 112.5008 48.2253 0.0000 174.1879 121 P 4.3303 0.0000 0.0000 64.6633 31.3964 177.3502 122 R 4.4184 7.8827 115.6354 56.0548 30.1814 176.0568 123 T 5.1344 7.5501 108.3171 59.7250 70.9352 173.2225 124 H 4.6891 7.7778 115.1887 54.9989 30.4950 173.1248 125 Y 3.8567 8.6700 118.4590 59.7832 38.1043 177.0163 126 G 4.0985 9.0191 111.1872 45.5281 0.0000 174.0018 127 Q 4.2523 7.4332 118.7191 55.1253 29.9583 177.0642 128 K 3.8614 8.2890 118.8453 58.6835 32.8699 179.4839 129 A 3.9180 7.8002 121.8766 54.7155 18.3551 178.6900 130 I 4.4038 7.1918 106.0726 61.0770 38.5066 175.5101 131 L 4.3177 7.3708 123.2134 54.2140 42.5482 175.9034 132 F 5.3471 9.4535 122.5626 55.4844 43.2428 174.0847 133 L 5.2942 9.1900 123.5381 52.7044 44.7365 173.8134 134 P 5.2366 0.0000 0.0000 62.8311 32.5264 175.5482 135 L 5.1202 9.3582 121.9991 52.1091 46.1795 174.1050 136 P 4.7023 0.0000 0.0000 62.3673 32.4691 176.7674 137 V 3.7181 8.2588 114.0924 61.8797 31.4617 176.1245 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 1C H 8.44 4.82 0.00 3.11 3.47 0.00 5.67 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 1D H 8.74 4.47 0.00 3.22 3.25 0.00 5.64 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 1E H 7.61 5.10 0.00 3.16 3.32 0.00 5.71 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.91 4.63 0.00 3.33 3.39 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.47 4.81 0.00 2.97 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 2 N 8.55 4.61 0.00 2.95 2.79 0.00 0.00 6.92 6.74 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 3 L 8.07 4.70 0.00 1.49 1.42 0.66 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.51 0.00 2.17 2.13 0.00 3.69 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 1.98 1.89 0.00 5 P 0.00 4.34 0.00 2.17 2.06 0.00 3.72 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 1.94 0.00 6 G 7.88 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 7 N 7.96 4.33 0.00 2.60 2.62 0.00 0.00 5.83 7.55 0.00 0.00 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 Y 7.83 4.88 0.00 3.08 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 9 K 8.35 4.03 0.00 1.84 1.93 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.51 7.81 10 K 7.61 4.65 0.00 1.73 1.71 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.43 7.81 11 P 0.00 4.87 0.00 1.93 2.04 0.00 3.72 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 12 K 9.17 4.55 0.00 2.05 1.94 0.00 1.37 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.47 7.81 13 L 9.08 5.01 0.00 1.77 1.71 0.47 0.67 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 14 L 8.64 5.09 0.00 1.56 1.64 0.37 0.84 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 15 Y 9.36 4.84 0.00 3.19 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 16 C 8.49 3.90 0.00 2.26 2.42 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 17 S 8.28 3.83 0.00 3.47 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 18 N 7.29 3.90 0.00 2.52 2.71 0.00 0.00 6.68 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 19 G 7.44 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 20 G 7.60 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 H 7.17 4.76 0.00 2.99 3.15 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.67 5.19 0.00 3.15 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 9.08 4.50 0.00 1.89 1.57 0.97 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 24 R 10.13 4.90 0.00 1.97 2.05 0.00 3.20 0.00 0.00 3.41 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 25 I 8.12 4.80 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.72 0.87 0.00 0.00 26 L 9.01 4.10 0.00 1.84 1.52 0.92 0.84 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 27 P 0.00 4.22 0.00 2.12 2.14 0.00 3.37 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.90 0.00 28 D 8.02 4.52 0.00 2.81 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 29 G 8.37 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 0.00 0.00 0.00 0.00 30 T 8.54 4.37 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 1.26 0.00 0.00 31 V 7.94 4.90 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 0.89 0.00 0.00 0.90 0.00 0.00 32 D 8.86 4.58 0.00 2.81 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 33 G 8.50 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 34 T 9.12 4.98 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 1.37 0.00 0.00 35 R 8.95 4.16 0.00 1.89 2.02 0.00 3.23 0.00 0.00 3.12 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.47 0.00 36 D 8.32 4.63 0.00 2.83 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.66 3.68 0.00 1.84 1.88 0.00 3.28 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.65 0.00 38 S 8.73 4.33 0.00 3.93 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 39 D 8.23 4.25 0.00 2.71 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 40 Q 8.61 4.15 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.28 1.95 0.00 41 H 9.78 4.91 0.00 3.23 3.50 0.00 5.75 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.05 4.52 1.90 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 1.48 0.90 1.04 0.00 0.00 43 Q 7.78 4.26 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 44 L 8.86 5.16 0.00 1.58 1.43 0.82 0.52 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 45 Q 9.16 4.81 0.00 2.07 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 46 L 8.55 5.13 0.00 1.64 1.11 0.88 1.03 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 47 S 8.23 4.58 0.00 3.96 3.95 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 48 A 8.51 5.30 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 49 E 8.91 4.19 0.00 1.61 1.60 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 2.11 2.42 0.00 50 S 6.03 4.57 0.00 4.19 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 51 V 8.17 3.82 2.30 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 0.97 0.00 0.00 1.03 0.00 0.00 52 G 9.27 3.95 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 0.00 0.00 0.00 53 E 8.30 5.25 0.00 2.07 1.70 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 2.20 2.28 0.00 54 V 8.91 4.91 1.94 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 0.52 0.00 0.00 1.16 0.00 0.00 55 Y 8.83 5.03 0.00 2.98 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.60 4.37 1.71 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 0.98 0.61 0.66 0.00 0.00 57 K 8.78 4.59 0.00 1.28 1.52 0.00 1.01 0.00 0.00 0.92 0.00 0.00 2.66 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.00 0.77 7.81 58 S 8.63 4.58 0.00 3.85 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 59 T 8.68 3.88 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 1.19 0.00 0.00 60 E 8.44 4.03 0.00 2.01 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 0.00 2.24 2.39 0.00 61 T 8.14 4.23 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 62 G 8.47 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 0.00 0.00 0.00 63 Q 7.73 4.39 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.74 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 64 Y 8.92 4.81 0.00 2.94 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 65 L 8.99 4.36 0.00 1.60 1.46 0.80 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.80 4.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.58 5.39 0.00 2.17 2.19 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 2.63 2.61 0.00 68 D 9.64 5.24 0.00 2.98 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 69 T 8.51 4.38 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 1.34 0.00 0.00 70 D 8.37 4.58 0.00 2.77 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 71 G 8.67 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 0.00 0.00 0.00 72 L 7.96 4.74 0.00 2.01 1.59 0.88 0.36 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 73 L 8.29 5.17 0.00 1.57 1.62 0.91 0.89 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 74 Y 8.96 4.93 0.00 3.00 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 75 G 8.96 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 76 S 9.09 5.07 0.00 3.72 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 77 Q 9.01 4.36 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 78 T 7.65 4.64 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 79 P 0.00 4.02 0.00 1.06 0.49 0.00 3.42 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.05 0.00 80 N 8.09 4.97 0.00 2.89 2.91 0.00 0.00 6.20 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 81 E 8.97 3.99 0.00 2.03 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 2.38 2.35 0.00 82 E 9.00 4.23 0.00 2.17 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 0.00 2.38 2.36 0.00 83 C 8.21 4.98 0.00 3.23 3.23 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 84 L 7.15 4.35 0.00 1.41 1.32 0.80 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 85 F 9.01 5.13 0.00 3.11 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 9.23 4.84 0.00 1.50 1.58 0.87 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.73 4.34 0.00 2.07 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 2.15 1.75 0.00 88 R 8.57 4.82 0.00 1.76 1.78 0.00 3.07 0.00 0.00 2.83 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.58 0.00 89 L 8.68 4.75 0.00 1.61 1.69 1.01 0.95 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 90 E 9.10 4.69 0.00 2.22 1.87 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 2.30 2.44 0.00 91 E 9.78 3.99 0.00 2.38 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 92 N 8.54 4.32 0.00 2.86 2.90 0.00 0.00 6.86 8.16 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 93 H 8.44 4.80 0.00 2.87 2.99 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.71 4.63 0.00 3.06 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 9.75 5.63 0.00 3.05 2.59 0.00 0.00 6.97 6.93 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 96 T 8.92 5.26 4.57 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 1.38 0.00 0.00 97 Y 8.74 4.96 0.00 2.78 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 98 I 8.53 4.58 1.65 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 -0.30 0.65 0.52 0.00 0.00 99 S 8.78 3.87 0.00 3.99 4.01 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 0.00 100 K 8.78 3.95 0.00 1.66 1.65 0.00 1.69 0.00 0.00 1.46 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.30 7.81 101 K 7.93 3.73 0.00 1.60 1.64 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.97 1.29 7.81 102 H 8.15 4.59 0.00 3.24 2.50 0.00 5.70 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 0.00 103 A 7.93 3.89 1.35 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 0.00 104 E 7.90 3.64 0.00 2.00 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 2.23 1.91 0.00 105 K 7.85 4.08 0.00 0.79 1.15 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.38 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.94 0.83 7.81 106 N 7.77 4.01 0.00 3.01 3.13 0.00 0.00 6.90 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 0.00 107 W 7.81 5.09 0.00 3.24 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 0.00 108 F 9.18 5.47 0.00 2.83 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 0.00 109 L 9.17 4.30 0.00 1.51 1.66 0.82 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 110 G 8.57 4.54 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 0.00 111 L 8.24 5.33 0.00 1.37 1.43 0.99 0.96 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 0.00 112 K 9.37 4.26 0.00 1.94 1.67 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.47 7.81 113 K 8.44 4.02 0.00 1.70 1.84 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.46 7.81 114 N 8.01 4.50 0.00 2.78 2.90 0.00 0.00 6.17 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 0.00 115 G 8.47 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.13 4.79 0.00 3.75 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 0.00 117 C 8.48 4.73 0.00 3.12 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 0.00 118 K 8.63 4.44 0.00 1.62 1.73 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.37 7.81 119 R 8.27 4.43 0.00 1.72 1.59 0.00 3.06 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 120 G 8.67 3.31 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 0.00 121 P 0.00 4.33 0.00 1.98 2.20 0.00 2.93 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 1.75 1.76 0.00 122 R 7.88 4.42 0.00 1.84 1.93 0.00 3.30 0.00 0.00 3.29 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 123 T 7.55 5.13 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 1.38 0.00 0.00 124 H 7.78 4.69 0.00 3.45 3.53 0.00 5.66 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.67 3.86 0.00 3.14 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 0.00 126 G 9.02 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 0.00 127 Q 7.43 4.25 0.00 1.93 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.74 0.00 0.00 0.00 0.00 0.00 2.17 1.97 0.00 128 K 8.29 3.86 0.00 1.78 1.65 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.28 7.81 129 A 7.80 3.92 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 0.00 130 I 7.19 4.40 1.68 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.85 0.55 0.00 0.00 131 L 7.37 4.32 0.00 1.00 0.64 0.49 0.81 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 0.00 132 F 9.45 5.35 0.00 3.41 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 0.00 133 L 9.19 5.29 0.00 2.09 1.78 0.86 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.24 0.00 2.23 2.19 0.00 3.86 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 135 L 9.36 5.12 0.00 1.65 1.60 1.00 0.91 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 0.00 136 P 0.00 4.70 0.00 2.07 2.05 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 137 V 8.26 3.72 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 0.64 0.00 0.00 0.91 0.00 0.00