NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3230 8.3044 120.3497 54.3968 33.3290 177.1175 2 L 3.9721 7.2424 118.8471 52.8356 43.0445 171.4475 3 Q 4.1329 8.6928 123.3532 52.7182 32.8283 173.0314 4 P 4.3826 0.0000 0.0000 62.4598 31.7313 177.1984 5 K 4.0912 8.5063 123.1952 58.9092 32.5559 176.8539 6 R 4.7225 7.4453 115.2717 55.2316 33.9514 174.4593 7 T 4.5643 8.1336 109.7674 60.3311 71.2195 174.7004 8 K 3.9006 8.7875 127.8450 58.2639 32.4847 176.2888 9 F 5.0416 7.5099 114.4156 56.0207 43.0101 174.9785 10 R 4.2402 8.9838 122.9917 58.4129 30.3198 177.3334 11 K 4.6219 7.8520 114.4422 54.5925 35.5222 175.1766 12 M 4.7251 8.0708 120.4526 53.4028 34.8797 175.7776 13 H 4.4354 8.3820 118.3927 55.5203 29.6282 175.5915 14 K 3.8313 8.8190 123.3377 59.5767 32.4379 178.4582 15 G 3.8157 7.8188 106.7492 47.2212 0.0000 171.6569 16 R 4.2762 7.9297 115.0640 56.1702 31.2814 173.2395 17 N 4.8734 8.5045 116.5357 52.8744 40.0540 176.0458 18 R 4.4335 8.3785 116.1445 55.8387 31.1665 176.3247 19 G 3.5451 9.0482 106.5305 45.9613 0.0000 172.4393 20 L 3.5242 8.3372 117.0651 54.9728 38.8514 174.8053 21 A 4.4608 8.2735 129.6261 51.7310 20.4551 175.8937 22 Q 4.4491 8.6901 111.0659 57.9278 31.1197 177.6179 23 G 3.9106 7.6478 108.2682 45.6490 0.0000 173.6363 24 T 4.2061 7.8217 119.9913 65.0101 69.5358 174.4338 25 D 4.8396 7.4192 121.4977 51.3076 41.6037 176.8214 26 V 3.8387 7.9193 114.0486 62.4109 32.0112 176.9298 27 S 4.3950 8.7062 118.9187 57.3742 64.2262 174.7716 28 F 4.4481 7.9741 117.9598 57.6073 47.6065 175.7683 29 G 3.6441 7.9767 104.6062 44.7797 0.0000 173.2569 30 S 5.0666 5.8100 125.0021 57.9140 67.3217 178.1966 31 F 5.4494 7.7473 117.5272 56.5943 41.0667 177.4180 32 G 4.1326 9.9322 116.1884 46.2150 0.0000 172.1109 33 L 4.7708 7.4624 117.4918 52.8775 44.2726 176.0938 34 K 4.4943 8.3340 122.8870 54.9511 35.0800 175.1943 35 A 4.0884 8.7712 125.7440 49.6378 17.4203 179.3158 36 V 3.6717 8.7828 119.2862 61.8166 32.2718 172.1418 37 G 4.2742 7.6232 105.7121 43.4362 0.0000 171.7119 38 R 4.4961 8.2845 116.8591 54.9176 31.8080 176.5712 39 G 4.2067 8.4818 108.3895 46.6825 0.0000 172.2024 40 R 5.1601 8.6530 117.4797 55.3918 32.4287 174.7469 41 L 4.8703 8.5106 123.8646 52.9989 43.3939 177.9086 42 T 4.0123 9.8741 111.9462 61.9491 68.6233 176.6797 43 A 3.5507 8.0815 129.4262 54.2224 18.1167 180.2685 44 R 4.1641 8.8473 115.8146 58.8342 29.9840 178.6908 45 Q 4.0316 7.7195 117.1894 58.7594 28.8374 178.1585 46 I 4.4504 7.7694 115.0362 63.5134 37.3249 177.7180 47 E 3.9891 7.9601 119.4132 58.8959 29.7505 178.3390 48 A 3.9515 8.0239 120.6315 55.0696 18.3325 179.5060 49 A 4.0393 8.4325 119.6870 54.9433 18.5347 179.5775 50 R 3.6180 7.8305 117.2714 59.7185 30.0476 178.6878 51 R 3.9204 8.1515 117.5375 59.4835 29.9015 178.9471 52 A 3.9385 7.3303 117.6784 55.2762 18.3656 179.0268 53 M 3.9753 8.0857 116.4408 59.3952 32.5622 177.9909 54 T 3.8619 8.8178 116.4633 66.5156 69.8215 174.7863 55 R 4.2265 8.2283 122.2256 54.8182 27.7536 174.3333 56 A 4.2939 7.2760 128.1477 52.6484 23.2514 177.9020 57 V 3.7344 8.1945 113.2089 62.6693 31.8806 176.2669 58 K 4.1971 8.3070 122.3303 56.4492 30.4195 175.3164 59 R 4.3568 7.7705 122.4390 56.7797 33.3213 174.7510 60 Q 3.7688 8.2167 114.2529 57.9211 28.5075 177.6503 61 G 4.0627 8.8426 106.5276 46.0466 0.0000 171.5421 62 K 4.5690 8.1825 118.0100 54.4556 35.7972 174.5343 63 I 5.6574 7.3695 122.4454 58.3624 41.3886 174.6243 64 W 5.0963 8.8896 121.8869 55.4355 34.3210 174.5610 65 I 5.1009 8.3074 121.6062 59.7123 38.4354 175.8221 66 R 4.2735 8.8996 123.3908 56.8841 30.3825 176.7828 67 V 4.4533 7.1173 111.8884 59.5649 33.7725 175.0285 68 F 4.7200 8.2809 123.6960 55.6655 41.9381 171.6648 69 P 4.5926 0.0000 0.0000 60.2806 31.6090 178.0470 70 D 4.3848 7.9170 120.5708 53.2284 40.3622 173.6336 71 K 4.5525 8.7502 122.1215 53.9917 32.6041 173.7409 72 P 2.9700 0.0000 0.0000 61.1429 31.4652 171.9527 73 I 3.0367 7.5096 135.0000 61.2456 34.5238 173.3987 74 T 4.4826 7.6867 115.7536 60.7631 71.1790 173.5480 75 E 4.7138 8.4268 118.5250 55.0746 34.4061 174.4224 76 K 4.5878 8.4587 124.4076 53.9869 33.7582 174.2958 77 P 4.3898 0.0000 0.0000 62.0865 33.5993 177.4803 78 L 4.0904 8.7998 124.0967 56.0652 40.4942 179.9873 79 A 4.4129 9.0206 116.5792 51.8885 16.2890 177.2442 80 V 4.3780 7.4689 118.3840 59.4261 34.5768 175.6833 81 R 3.9695 8.5667 123.9577 56.9666 30.3504 175.0060 82 M 4.3756 8.3571 119.8131 54.0291 33.6247 176.6441 83 G 4.0291 8.5143 105.0720 46.6124 0.0000 173.9041 84 K 4.4794 8.0208 125.7117 56.1299 33.8262 177.0635 85 G 4.0250 8.4126 104.8716 44.6365 0.0000 174.3989 86 K 4.0004 8.2900 121.5650 55.8030 32.9626 178.1810 87 G 4.0072 8.3412 111.0680 46.5787 0.0000 171.4645 88 N 5.0806 8.0919 116.1905 50.9790 41.6583 174.7213 89 V 3.3288 8.3203 115.8207 62.2235 31.3624 175.7079 90 E 4.1383 8.0480 127.2256 58.1658 30.0849 175.3442 91 Y 4.8391 6.5262 113.2006 55.5218 40.5615 173.0285 92 W 5.4659 9.2753 118.7717 54.5676 32.5027 175.5124 93 V 4.6635 9.1207 124.9795 60.5426 34.0846 175.1096 94 A 5.0010 9.0862 123.9010 49.4324 20.2665 174.4361 95 L 4.5910 8.5964 119.8989 56.0985 42.3949 176.7169 96 I 4.9304 8.8527 116.7332 59.2750 41.7027 173.9844 97 Q 4.8524 8.3121 119.4675 53.6705 32.8811 172.0433 98 P 4.3442 0.0000 0.0000 64.7190 31.5150 177.7100 99 G 3.9763 9.0538 110.6557 44.8349 0.0000 173.0914 100 K 4.1152 7.9877 122.2249 56.7473 33.4188 176.0853 101 V 4.2030 7.7101 126.4119 60.6097 31.7683 175.6709 102 L 3.8405 8.8601 127.6921 56.3141 41.8456 178.5048 103 Y 5.8836 6.9994 115.2945 56.6505 42.8718 173.2766 104 E 5.3802 8.8864 115.2678 56.6499 34.1869 174.8720 105 M 5.6764 9.3831 122.0926 53.5518 36.2276 174.1277 106 D 5.3208 8.6716 117.7985 55.2207 46.5457 177.2752 107 G 4.1184 8.0105 107.9725 44.1705 0.0000 173.2875 108 V 4.4287 7.5647 115.0854 58.3437 34.5118 172.4425 109 P 4.3230 0.0000 0.0000 63.1406 32.8574 177.4799 110 E 3.3602 8.9314 119.8729 59.3438 29.2335 179.1398 111 E 3.7526 8.0320 119.8834 58.6117 29.4584 177.9609 112 L 3.9126 7.4916 119.1705 57.2693 42.7717 177.7015 113 A 3.6585 7.8934 121.0499 55.3360 17.7988 179.2074 114 R 3.3227 7.7380 116.9309 59.0068 31.1525 176.4730 115 E 4.4802 7.4276 119.8886 53.5769 26.6907 173.7455 116 A 4.4281 7.0498 128.0309 52.9991 26.0903 179.1000 117 F 4.6482 7.8097 114.5544 59.9813 39.7154 178.1046 118 K 3.9881 8.0983 121.2985 59.6085 32.0245 178.6513 119 L 4.1313 7.4886 112.8146 55.5123 41.2993 176.6037 120 A 4.4874 8.0670 120.8716 53.8453 20.6243 179.2753 121 A 4.2096 8.2830 116.8918 54.3050 18.6260 178.7462 122 A 4.1196 8.0475 118.1844 54.2277 19.1816 178.4650 123 K 4.5881 8.0398 115.9844 53.9331 31.2839 176.0220 124 L 4.5041 7.0542 115.9780 53.3032 46.1146 174.0891 125 P 4.3653 0.0000 0.0000 65.7471 31.6729 177.0519 126 I 3.9631 7.5159 118.5329 61.1559 37.8936 175.7893 127 K 4.3407 8.7057 126.1964 56.9133 32.8023 176.5523 128 T 5.1084 8.3500 115.5085 60.2070 71.5476 172.7322 129 T 4.7699 7.9970 114.4285 60.9143 71.2916 171.3489 130 F 5.2103 8.9077 122.6933 56.7690 41.8243 175.1882 131 V 4.5899 6.9161 121.8028 61.6626 35.6779 174.1110 132 T 5.2091 7.9980 113.2536 58.5898 71.5364 174.0907 133 K 3.7257 8.4847 121.3785 59.5219 32.6331 173.4140 134 T 3.3470 7.9467 123.8550 62.5862 68.3068 173.1582 135 V 3.6744 8.4051 125.8852 65.4995 31.9526 175.3115 136 M 4.1098 7.4415 122.6963 56.3108 32.6018 173.7964 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 M 8.30 4.32 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 2 L 7.24 3.97 0.00 1.60 1.42 0.93 0.42 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 3 Q 8.69 4.13 0.00 0.95 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.70 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 4 P 0.00 4.38 0.00 1.65 1.96 0.00 2.20 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.33 0.00 5 K 8.51 4.09 0.00 1.68 1.80 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.38 7.81 6 R 7.45 4.72 0.00 1.76 1.73 0.00 3.25 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 7 T 8.13 4.56 4.61 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 1.36 0.00 0.00 8 K 8.79 3.90 0.00 1.62 1.65 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.67 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.79 1.11 7.81 9 F 7.51 5.04 0.00 3.13 2.84 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 10 R 8.98 4.24 0.00 1.87 2.01 0.00 3.41 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 11 K 7.85 4.62 0.00 1.65 1.59 0.00 1.67 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.22 1.36 7.81 12 M 8.07 4.73 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.51 0.00 13 H 8.38 4.44 0.00 3.09 3.17 0.00 5.74 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.82 3.83 0.00 1.68 1.83 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 15 G 7.82 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 16 R 7.93 4.28 0.00 1.87 1.88 0.00 3.03 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 1.38 1.52 0.00 17 N 8.50 4.87 0.00 2.72 2.82 0.00 0.00 6.69 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 18 R 8.38 4.43 0.00 1.75 1.87 0.00 3.52 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 19 G 9.05 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.34 3.52 0.00 1.77 1.71 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.27 4.46 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 22 Q 8.69 4.45 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.43 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 23 G 7.65 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 T 7.82 4.21 4.21 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 1.19 0.00 0.00 25 D 7.42 4.84 0.00 2.70 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 V 7.92 3.84 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 0.72 0.00 0.00 0.80 0.00 0.00 27 S 8.71 4.40 0.00 3.08 3.41 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 28 F 7.97 4.45 0.00 2.19 1.45 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 29 G 7.98 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 0.00 0.00 0.00 30 S 5.81 5.07 0.00 3.38 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 31 F 7.75 5.45 0.00 3.43 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 32 G 9.93 4.13 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 0.00 33 L 7.46 4.77 0.00 1.61 1.57 1.09 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.33 4.49 0.00 1.84 1.62 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.33 1.39 7.81 35 A 8.77 4.09 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 V 8.78 3.67 2.44 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 0.81 0.00 0.00 0.95 0.00 0.00 37 G 7.62 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 38 R 8.28 4.50 0.00 1.94 1.94 0.00 3.09 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 1.55 1.62 0.00 39 G 8.48 4.21 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 0.00 40 R 8.65 5.16 0.00 1.84 1.91 0.00 3.08 0.00 0.00 3.31 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 41 L 8.51 4.87 0.00 1.65 1.65 0.92 0.32 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 42 T 9.87 4.01 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 1.06 0.00 0.00 43 A 8.08 3.55 1.52 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 44 R 8.85 4.16 0.00 1.76 1.90 0.00 3.06 0.00 0.00 3.16 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 45 Q 7.72 4.03 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 46 I 7.77 4.45 1.99 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.34 0.93 0.00 0.00 47 E 7.96 3.99 0.00 2.27 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 2.32 2.47 0.00 48 A 8.02 3.95 1.41 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 49 A 8.43 4.04 1.42 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 0.00 0.00 50 R 7.83 3.62 0.00 2.12 2.13 0.00 3.14 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 51 R 8.15 3.92 0.00 1.86 1.96 0.00 3.17 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.06 0.00 52 A 7.33 3.94 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 53 M 8.09 3.98 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.49 0.00 54 T 8.82 3.86 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 1.17 0.00 0.00 55 R 8.23 4.23 0.00 1.73 1.98 0.00 3.28 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 56 A 7.28 4.29 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 57 V 8.19 3.73 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 0.83 0.00 0.00 0.88 0.00 0.00 58 K 8.31 4.20 0.00 1.90 1.92 0.00 1.76 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.44 7.81 59 R 7.77 4.36 0.00 1.69 1.85 0.00 3.42 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.37 0.00 60 Q 8.22 3.77 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.39 0.00 0.00 0.00 0.00 0.00 2.56 2.39 0.00 61 G 8.84 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 62 K 8.18 4.57 0.00 1.68 1.26 0.00 1.57 0.00 0.00 1.65 0.00 0.00 2.48 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.30 1.02 7.81 63 I 7.37 5.66 1.79 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 1.36 0.74 1.10 0.00 0.00 64 W 8.89 5.10 0.00 3.38 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 65 I 8.31 5.10 1.96 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.18 0.96 0.00 0.00 66 R 8.90 4.27 0.00 1.93 1.98 0.00 3.31 0.00 0.00 3.29 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 67 V 7.12 4.45 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 0.58 0.00 0.00 0.69 0.00 0.00 68 F 8.28 4.72 0.00 2.89 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 69 P 0.00 4.59 0.00 2.31 2.05 0.00 2.20 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.62 0.00 70 D 7.92 4.38 0.00 3.14 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 71 K 8.75 4.55 0.00 1.89 2.08 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.36 1.42 7.81 72 P 0.00 2.97 0.00 1.88 1.30 0.00 3.67 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.76 0.00 73 I 7.51 3.04 1.18 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 1.46 0.99 0.64 0.00 0.00 74 T 7.69 4.48 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 1.06 0.00 0.00 75 E 8.43 4.71 0.00 1.86 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 2.14 2.23 0.00 76 K 8.46 4.59 0.00 1.73 1.68 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.69 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.43 7.81 77 P 0.00 4.39 0.00 2.07 2.03 0.00 3.72 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 2.03 2.10 0.00 78 L 8.80 4.09 0.00 1.60 1.24 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 79 A 9.02 4.41 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 80 V 7.47 4.38 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 0.73 0.00 0.00 0.92 0.00 0.00 81 R 8.57 3.97 0.00 1.76 1.91 0.00 3.27 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 1.61 1.73 0.00 82 M 8.36 4.38 0.00 2.03 1.96 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 2.53 2.46 0.00 83 G 8.51 4.03 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 0.00 0.00 0.00 84 K 8.02 4.48 0.00 1.69 1.75 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.54 1.37 7.81 85 G 8.41 4.03 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 0.00 0.00 0.00 86 K 8.29 4.00 0.00 1.70 1.70 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.39 7.81 87 G 8.34 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 0.00 0.00 0.00 88 N 8.09 5.08 0.00 2.58 2.65 0.00 0.00 7.46 8.71 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 89 V 8.32 3.33 1.69 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 0.30 0.00 0.00 0.87 0.00 0.00 90 E 8.05 4.14 0.00 1.87 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 2.34 2.36 0.00 91 Y 6.53 4.84 0.00 3.09 2.91 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 0.00 0.00 0.00 0.00 92 W 9.28 5.47 0.00 3.13 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 93 V 9.12 4.66 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 0.78 0.00 0.00 1.10 0.00 0.00 94 A 9.09 5.00 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 95 L 8.60 4.59 0.00 1.57 1.69 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 96 I 8.85 4.93 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.95 0.95 0.00 0.00 97 Q 8.31 4.85 0.00 2.04 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.00 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 98 P 0.00 4.34 0.00 2.20 2.06 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 2.13 2.03 0.00 99 G 9.05 3.98 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 0.00 0.00 0.00 100 K 7.99 4.12 0.00 2.15 1.67 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.54 7.81 101 V 7.71 4.20 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 0.76 0.00 0.00 0.94 0.00 0.00 102 L 8.86 3.84 0.00 1.55 1.04 0.83 0.54 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 0.00 103 Y 7.00 5.88 0.00 2.95 3.19 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 0.00 104 E 8.89 5.38 0.00 2.19 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 0.00 2.31 2.35 0.00 105 M 9.38 5.68 0.00 2.28 2.45 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.47 0.00 106 D 8.67 5.32 0.00 2.86 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 0.00 107 G 8.01 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 0.00 0.00 0.00 108 V 7.56 4.43 2.10 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 0.66 0.00 0.00 0.87 0.00 0.00 109 P 0.00 4.32 0.00 2.13 2.03 0.00 3.58 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 2.11 2.19 0.00 110 E 8.93 3.36 0.00 2.28 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 2.35 2.40 0.00 111 E 8.03 3.75 0.00 2.04 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 0.00 2.32 2.34 0.00 112 L 7.49 3.91 0.00 1.58 1.67 0.77 0.94 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 0.00 113 A 7.89 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.74 3.32 0.00 1.59 1.53 0.00 2.71 0.00 0.00 2.81 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.50 0.00 115 E 7.43 4.48 0.00 1.90 1.81 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 2.25 2.40 0.00 116 A 7.05 4.43 1.05 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 0.00 117 F 7.81 4.65 0.00 3.35 3.13 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 0.00 118 K 8.10 3.99 0.00 1.86 1.80 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.43 7.81 119 L 7.49 4.13 0.00 1.93 1.66 0.94 0.72 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 0.00 120 A 8.07 4.49 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 0.00 121 A 8.28 4.21 1.41 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 0.00 122 A 8.05 4.12 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 0.00 123 K 8.04 4.59 0.00 1.70 1.77 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.52 7.81 124 L 7.05 4.50 0.00 1.81 1.57 1.10 1.22 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 0.00 125 P 0.00 4.37 0.00 2.05 2.11 0.00 3.71 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 126 I 7.52 3.96 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.36 0.99 0.00 0.00 127 K 8.71 4.34 0.00 1.78 1.88 0.00 1.58 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.45 7.81 128 T 8.35 5.11 4.39 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 1.33 0.00 0.00 129 T 8.00 4.77 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 1.25 0.00 0.00 130 F 8.91 5.21 0.00 3.11 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 0.00 131 V 6.92 4.59 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 0.86 0.00 0.00 0.84 0.00 0.00 132 T 8.00 5.21 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 1.42 0.00 0.00 133 K 8.48 3.73 0.00 1.51 1.74 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.29 1.28 7.81 134 T 7.95 3.35 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 1.17 0.00 0.00 135 V 8.41 3.67 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 0.73 0.00 0.00 0.91 0.00 0.00 136 M 7.44 4.11 0.00 2.05 1.81 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00