NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.5966 8.4249 119.2032 53.3549 40.6914 174.7038 2 K 4.3335 7.6023 115.0725 54.4175 34.2578 174.0812 3 A 4.2326 8.5930 123.1046 52.2389 19.3106 177.0098 4 S 4.6058 8.8208 117.3925 56.5933 65.4564 173.7845 5 V 4.2425 8.4627 125.0126 62.6080 31.9528 174.5200 6 V 4.8538 8.7625 128.9105 60.4002 34.1380 174.6391 7 A 4.4915 8.9627 130.8588 52.7372 18.7918 177.5341 8 N 4.3539 9.0440 122.3990 56.2673 39.7301 175.3356 9 Q 4.4832 7.8309 114.8105 54.7826 31.2253 174.2287 10 L 4.7481 8.2878 121.0172 54.4127 43.1104 175.6572 11 I 4.6188 8.5914 127.0564 59.0662 40.0520 174.8157 12 P 4.5119 0.0000 0.0000 62.2069 33.4006 175.3614 13 I 4.2358 8.0486 117.6131 61.5920 38.4914 175.4029 14 N 4.2365 8.4920 119.5510 54.6795 35.9150 173.9039 15 T 4.7236 7.2004 113.3376 61.3174 73.2794 174.4313 16 A 5.0253 8.6201 128.5253 51.3834 19.0010 177.3011 17 L 4.3541 8.7688 122.8812 54.9278 43.6054 176.2645 18 T 4.9006 8.0899 110.2423 59.4030 71.8813 174.9453 19 L 3.9970 8.4879 120.4733 58.0849 41.7463 179.1289 20 I 3.8846 7.7384 117.9631 64.5733 37.4743 177.3695 21 M 4.0816 7.9263 120.0661 57.8988 32.0181 175.4858 22 M 4.6027 8.0757 119.3287 54.7368 32.8750 175.7619 23 K 4.5299 8.5904 125.7971 54.5466 34.8351 176.3796 24 A 4.4128 8.5185 128.3622 50.6178 16.9668 175.2870 25 E 4.4567 8.4834 122.5739 54.0328 32.7118 175.4217 26 V 4.2084 8.2656 126.0854 61.8824 30.1398 175.1105 27 V 4.5369 7.7538 117.2528 59.3533 36.0038 174.8267 28 T 4.5918 8.0644 111.4777 59.2911 70.6737 172.7493 29 P 4.4372 0.0000 0.0000 62.4192 32.0608 177.0740 30 M 4.3616 8.3166 118.1461 55.2095 31.0805 176.2509 31 G 4.0209 8.6176 118.3175 47.6186 0.0000 172.7632 32 I 4.6307 8.7284 121.7949 58.6088 40.5759 174.9719 33 P 4.7905 0.0000 0.0000 62.0151 32.9302 175.6723 34 A 4.5602 8.2196 120.7860 52.4532 18.9779 178.4032 35 E 4.0572 8.3612 121.2922 60.7620 30.1891 178.4837 36 E 4.6129 7.7938 118.0452 55.8229 30.1657 178.1066 37 I 3.6959 7.9702 122.3362 64.2697 37.2645 176.1186 38 P 4.2910 0.0000 0.0000 65.6064 31.2484 177.8369 39 N 4.5486 7.8857 115.2069 56.0292 39.1359 176.9726 40 L 4.1591 8.6851 120.8343 56.5800 41.8437 177.9231 41 V 3.6811 7.2862 117.7526 64.3753 31.8479 175.9143 42 G 3.9491 8.8979 113.9114 46.0933 0.0000 173.6598 43 M 4.3754 7.7236 117.0764 55.1180 32.7827 175.0969 44 Q 5.1362 8.3769 119.2511 53.9895 30.5939 176.0401 45 V 4.1245 8.2763 116.7951 61.0242 33.1352 176.5718 46 N 4.6302 8.3638 118.4871 55.1118 39.3280 174.8312 47 R 4.6291 7.4355 113.3580 54.7298 33.2437 173.4506 48 A 4.3643 8.5636 120.6971 52.1517 19.2704 177.2727 49 V 4.3332 9.0104 123.4582 60.5034 33.6828 174.4370 50 P 4.7849 0.0000 0.0000 62.3290 32.9967 175.2386 51 L 4.3053 8.4621 119.2786 54.9804 42.5618 177.3682 52 G 3.8032 8.4100 110.5775 46.9556 0.0000 173.5652 53 T 4.3375 7.7135 116.4151 62.3491 69.8307 175.1326 54 T 4.3717 8.4410 121.2445 61.5104 68.9376 173.6058 55 L 4.0934 8.6570 127.7304 55.4432 42.8376 175.4986 56 M 4.7583 8.3718 126.9812 52.7893 33.7397 175.8976 57 P 3.8853 0.0000 0.0000 65.3560 31.9351 177.2732 58 D 4.5037 8.0003 117.7394 56.9849 41.1863 176.8785 59 M 4.2074 8.0598 118.4664 56.8124 32.5375 175.9709 60 V 4.5359 7.2600 118.0388 60.6966 34.4478 173.4956 61 K 3.9334 9.1955 127.2227 57.9976 30.5777 178.8195 62 N 4.2539 5.7700 125.3346 52.7683 38.2368 173.0633 63 Y 4.2535 6.7515 121.6237 59.0372 38.8073 175.8124 64 E 4.6571 7.1413 114.9131 56.0447 32.3401 175.2590 65 D 4.6744 8.5456 118.7685 53.5037 39.4965 177.2572 66 G 3.8109 7.8232 109.3307 48.2576 0.0000 173.2349 67 T 4.0948 7.7231 109.8162 61.6429 69.1098 173.9059 68 T 4.1825 7.9602 115.0037 63.5235 69.9787 174.6393 69 S 4.5705 7.5992 120.2655 55.8870 65.4565 170.4956 70 P 4.0280 0.0000 0.0000 62.7741 29.3842 176.0953 71 G 3.7703 8.7936 106.3967 45.3044 0.0000 174.2518 72 L 4.3209 7.4923 119.5318 52.8934 41.6672 177.7637 73 K 4.6779 7.6829 118.2242 56.3956 33.8771 178.1277 74 S 4.7643 8.4734 120.2860 56.3627 65.7878 173.7951 75 V 4.0210 8.4143 122.2928 63.1495 32.5913 174.9772 76 V 4.7970 8.4117 126.7340 60.9882 35.2423 174.5786 77 A 4.5011 9.1453 130.0701 51.2588 17.6409 177.1794 78 N 4.6365 8.7038 120.4591 56.4894 39.6770 174.4912 79 Q 4.7067 7.8353 114.9777 53.6516 32.1735 174.6263 80 L 4.8566 8.2255 121.9607 54.2202 42.9952 175.7957 81 I 4.6541 8.1202 126.4841 58.6253 40.0591 173.6712 82 P 4.6424 0.0000 0.0000 62.1958 32.2826 176.1758 83 I 4.0127 8.1823 121.1450 61.9937 37.6427 175.6097 84 N 4.7289 8.5807 120.0000 53.1869 35.0848 173.1346 85 T 4.5377 7.2590 113.7316 61.6365 73.4236 173.9100 86 A 4.9615 9.1308 128.8715 51.8416 17.4988 175.7677 87 L 4.5825 8.2687 121.4591 55.4348 43.2782 176.4972 88 T 5.0649 7.9848 111.3405 59.5235 71.5646 174.0092 89 L 4.0107 8.5389 120.2212 58.9884 40.4995 178.5234 90 V 3.7184 7.3016 118.1424 66.2707 31.6874 177.0331 91 M 4.2241 7.9267 117.9606 57.1832 32.4471 175.6970 92 M 4.7290 7.6612 119.0884 54.4818 33.2233 176.3347 93 K 4.3856 9.3982 123.5531 54.4630 34.6935 175.3784 94 A 5.1185 8.8640 127.9313 50.4875 18.0926 175.7437 95 E 4.6624 8.2904 118.2459 54.5739 33.9778 175.2411 96 E 4.3750 8.9670 121.1885 55.6981 29.1676 175.9051 97 V 4.4941 8.0355 124.9677 59.9853 34.6770 174.4072 98 S 4.7554 8.2090 114.9783 55.7432 65.0633 172.1959 99 P 4.5090 0.0000 0.0000 61.9781 32.2973 176.4917 100 K 4.3149 8.2108 118.3495 55.4734 32.4755 176.4572 101 G 3.4118 8.6848 116.4221 47.8153 0.0000 171.8781 102 I 4.5959 5.5827 120.3112 58.4232 40.3358 175.1952 103 P 4.9032 0.0000 0.0000 61.9384 32.8461 175.6133 104 S 4.7831 8.2864 112.3637 58.4268 63.6647 175.4609 105 E 4.1863 8.3591 121.0746 59.4463 30.4602 176.8163 106 E 4.5790 7.9818 116.3085 55.7129 30.4926 177.2825 107 I 3.7324 7.7492 121.9789 64.0349 38.2984 177.8691 108 S 4.1202 8.1171 113.8965 60.9430 62.3280 174.8713 109 K 4.1244 7.9933 119.8252 58.1285 32.5594 176.9207 110 L 4.5045 7.6726 116.9448 54.0330 41.8740 176.1529 111 V 3.7628 7.4043 119.8975 64.5045 31.5153 175.9527 112 G 3.8619 8.7919 116.1849 46.4681 0.0000 172.9924 113 M 4.4244 7.7238 116.2959 54.4210 33.1768 175.0408 114 Q 4.8817 8.7393 120.2342 54.4675 29.9708 176.1988 115 V 3.9810 8.4002 123.7444 61.5974 33.0030 176.2760 116 N 4.7049 8.8120 119.0044 53.7885 39.7838 174.0529 117 R 4.8406 7.4392 115.0527 54.4913 34.8217 174.0860 118 A 4.4021 8.4386 121.9552 51.8014 19.5428 177.0636 119 V 4.1777 8.4412 121.9353 61.5725 34.4467 175.0888 120 Y 5.0099 8.0661 125.0507 56.8569 40.5165 175.0974 121 L 4.4846 8.4347 122.2233 55.3897 42.2644 175.6180 122 D 5.2433 8.6026 117.3988 54.5786 40.9495 175.2212 123 Q 4.8680 8.1532 122.4569 53.9738 32.9315 173.9829 124 T 4.4006 8.3792 121.5717 63.1717 69.5033 174.1010 125 L 4.2006 8.9462 129.2349 55.1787 43.0986 175.7981 126 M 5.0037 8.3844 124.5638 52.5513 35.5118 174.9000 127 P 3.9908 0.0000 0.0000 65.5744 31.8560 177.6932 128 D 4.4614 7.9305 118.1052 57.0720 41.1193 177.1830 129 M 4.0425 7.9847 118.0219 57.6657 32.5299 176.1167 130 V 4.0407 7.2314 119.2729 61.4730 31.5492 175.7028 131 K 4.2616 8.6535 126.8811 58.4897 33.1121 177.0840 132 N 4.9235 7.9288 116.4189 53.1943 39.0198 174.2591 133 Y 4.4804 7.8746 118.5163 57.1862 39.8070 174.9952 134 E 3.9213 7.4530 122.8962 56.5466 29.6190 176.7513 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 N 8.42 4.60 0.00 2.67 2.90 0.00 0.00 7.01 5.80 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 2 K 7.60 4.33 0.00 1.73 1.75 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.40 1.57 7.81 3 A 8.59 4.23 1.22 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 0.00 0.00 4 S 8.82 4.61 0.00 3.88 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 5 V 8.46 4.24 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 0.78 0.00 0.00 0.95 0.00 0.00 6 V 8.76 4.85 2.07 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 1.01 0.00 0.00 0.97 0.00 0.00 7 A 8.96 4.49 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 8 N 9.04 4.35 0.00 2.75 2.84 0.00 0.00 7.19 6.68 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 9 Q 7.83 4.48 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.60 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 10 L 8.29 4.75 0.00 1.67 1.60 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.59 4.62 1.87 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 1.28 1.11 0.91 0.00 0.00 12 P 0.00 4.51 0.00 2.17 2.10 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 13 I 8.05 4.24 1.84 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 1.39 0.96 0.84 0.00 0.00 14 N 8.49 4.24 0.00 2.82 2.93 0.00 0.00 6.57 6.71 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 15 T 7.20 4.72 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 1.22 0.00 0.00 16 A 8.62 5.03 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.77 4.35 0.00 1.63 1.60 0.93 0.60 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 18 T 8.09 4.90 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 19 L 8.49 4.00 0.00 1.66 1.77 0.92 0.81 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 20 I 7.74 3.88 1.87 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 1.41 0.34 0.91 0.00 0.00 21 M 7.93 4.08 0.00 2.06 2.32 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 2.62 2.63 0.00 22 M 8.08 4.60 0.00 2.03 2.18 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 23 K 8.59 4.53 0.00 1.86 1.67 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.35 7.81 24 A 8.52 4.41 1.22 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 0.00 0.00 25 E 8.48 4.46 0.00 2.02 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 26 V 8.27 4.21 2.07 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 0.84 0.00 0.00 0.96 0.00 0.00 27 V 7.75 4.54 2.07 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 0.92 0.00 0.00 0.97 0.00 0.00 28 T 8.06 4.59 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 29 P 0.00 4.44 0.00 2.18 2.07 0.00 3.74 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 1.96 1.93 0.00 30 M 8.32 4.36 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 31 G 8.62 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 0.00 0.00 0.00 32 I 8.73 4.63 1.75 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.84 0.82 0.00 0.00 33 P 0.00 4.79 0.00 2.06 2.08 0.00 3.71 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 34 A 8.22 4.56 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 35 E 8.36 4.06 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 36 E 7.79 4.61 0.00 2.17 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 2.35 2.55 0.00 37 I 7.97 3.70 1.87 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 1.72 0.87 0.91 0.00 0.00 38 P 0.00 4.29 0.00 2.23 2.19 0.00 3.64 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 1.99 2.06 0.00 39 N 7.89 4.55 0.00 2.88 2.94 0.00 0.00 6.96 7.87 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 40 L 8.69 4.16 0.00 1.91 1.73 1.14 1.01 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 41 V 7.29 3.68 2.21 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 0.87 0.00 0.00 0.98 0.00 0.00 42 G 8.90 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 43 M 7.72 4.38 0.00 2.32 2.26 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.71 0.00 44 Q 8.38 5.14 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 7.09 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 45 V 8.28 4.12 2.07 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 0.87 0.00 0.00 1.01 0.00 0.00 46 N 8.36 4.63 0.00 2.79 2.82 0.00 0.00 6.67 7.51 0.00 0.00 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 R 7.44 4.63 0.00 1.80 1.98 0.00 2.95 0.00 0.00 3.32 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 48 A 8.56 4.36 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 49 V 9.01 4.33 2.07 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 1.01 0.00 0.00 0.97 0.00 0.00 50 P 0.00 4.78 0.00 2.11 2.08 0.00 3.80 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 1.97 1.99 0.00 51 L 8.46 4.31 0.00 1.53 1.63 0.92 0.90 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 52 G 8.41 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 0.00 0.00 0.00 53 T 7.71 4.34 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 54 T 8.44 4.37 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 1.22 0.00 0.00 55 L 8.66 4.09 0.00 1.91 1.53 0.82 0.95 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 56 M 8.37 4.76 0.00 2.07 1.91 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.45 0.00 57 P 0.00 3.89 0.00 2.21 1.75 0.00 3.68 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.84 0.00 58 D 8.00 4.50 0.00 2.65 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 59 M 8.06 4.21 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.51 0.00 60 V 7.26 4.54 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.97 0.00 0.00 61 K 9.20 3.93 0.00 1.83 1.60 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.60 1.36 7.81 62 N 5.77 4.25 0.00 2.68 2.77 0.00 0.00 7.15 7.38 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 63 Y 6.75 4.25 0.00 3.10 3.10 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 64 E 7.14 4.66 0.00 2.31 2.07 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 2.45 2.55 0.00 65 D 8.55 4.67 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 66 G 7.82 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 67 T 7.72 4.09 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 1.32 0.00 0.00 68 T 7.96 4.18 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 69 S 7.60 4.57 0.00 3.89 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 70 P 0.00 4.03 0.00 2.17 1.89 0.00 3.84 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 1.98 1.96 0.00 71 G 8.79 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 72 L 7.49 4.32 0.00 1.83 1.64 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 73 K 7.68 4.68 0.00 1.91 1.83 0.00 1.56 0.00 0.00 1.98 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.43 7.81 74 S 8.47 4.76 0.00 3.92 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.41 4.02 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 0.91 0.00 0.00 0.98 0.00 0.00 76 V 8.41 4.80 2.40 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 1.04 0.00 0.00 0.98 0.00 0.00 77 A 9.15 4.50 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 78 N 8.70 4.64 0.00 2.78 2.86 0.00 0.00 7.06 6.81 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 79 Q 7.84 4.71 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.66 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 80 L 8.23 4.86 0.00 1.67 1.56 1.00 0.98 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 81 I 8.12 4.65 1.82 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 1.26 0.64 0.87 0.00 0.00 82 P 0.00 4.64 0.00 2.03 2.00 0.00 3.74 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 1.95 1.96 0.00 83 I 8.18 4.01 1.83 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 1.31 1.55 0.89 0.00 0.00 84 N 8.58 4.73 0.00 2.82 2.82 0.00 0.00 7.07 7.53 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 85 T 7.26 4.54 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 86 A 9.13 4.96 1.32 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 87 L 8.27 4.58 0.00 1.72 1.78 0.91 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 88 T 7.98 5.06 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 1.24 0.00 0.00 89 L 8.54 4.01 0.00 1.77 1.86 0.92 0.54 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 90 V 7.30 3.72 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 0.93 0.00 0.00 91 M 7.93 4.22 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.55 0.00 92 M 7.66 4.73 0.00 1.93 2.21 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 2.60 2.51 0.00 93 K 9.40 4.39 0.00 1.71 1.79 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.32 1.34 7.81 94 A 8.86 5.12 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 95 E 8.29 4.66 0.00 1.97 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 0.00 2.19 2.19 0.00 96 E 8.97 4.37 0.00 1.99 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 0.00 2.31 2.39 0.00 97 V 8.04 4.49 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 0.80 0.00 0.00 0.81 0.00 0.00 98 S 8.21 4.76 0.00 3.98 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.51 0.00 2.19 2.11 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 100 K 8.21 4.31 0.00 1.87 1.89 0.00 1.57 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 1.35 1.41 7.81 101 G 8.68 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 0.00 0.00 0.00 102 I 5.58 4.60 1.68 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.50 0.77 0.00 0.00 103 P 0.00 4.90 0.00 2.10 2.09 0.00 3.80 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.01 0.00 104 S 8.29 4.78 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.36 4.19 0.00 2.12 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 0.00 2.32 2.37 0.00 106 E 7.98 4.58 0.00 2.10 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 2.30 2.25 0.00 107 I 7.75 3.73 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 1.31 1.24 0.95 0.00 0.00 108 S 8.12 4.12 0.00 3.87 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 0.00 109 K 7.99 4.12 0.00 1.75 1.95 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.45 7.81 110 L 7.67 4.50 0.00 1.84 1.71 1.15 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.40 3.76 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 0.82 0.00 0.00 0.98 0.00 0.00 112 G 8.79 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 M 7.72 4.42 0.00 2.34 2.22 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.71 0.00 114 Q 8.74 4.88 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.07 0.00 0.00 0.00 0.00 0.00 2.38 2.19 0.00 115 V 8.40 3.98 2.07 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 0.86 0.00 0.00 1.01 0.00 0.00 116 N 8.81 4.70 0.00 2.68 2.86 0.00 0.00 6.81 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 0.00 117 R 7.44 4.84 0.00 1.72 1.77 0.00 3.36 0.00 0.00 3.35 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 118 A 8.44 4.40 1.02 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 0.00 0.00 119 V 8.44 4.18 2.19 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 0.89 0.00 0.00 0.94 0.00 0.00 120 Y 8.07 5.01 0.00 3.09 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 L 8.43 4.48 0.00 1.88 1.62 0.98 1.05 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 0.00 122 D 8.60 5.24 0.00 2.59 2.64 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 0.00 123 Q 8.15 4.87 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 7.34 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 124 T 8.38 4.40 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 1.22 0.00 0.00 125 L 8.95 4.20 0.00 1.71 1.71 0.82 0.64 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 0.00 126 M 8.38 5.00 0.00 2.01 1.85 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.43 0.00 127 P 0.00 3.99 0.00 2.16 1.89 0.00 3.67 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.91 0.00 128 D 7.93 4.46 0.00 2.67 2.77 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 0.00 129 M 7.98 4.04 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 130 V 7.23 4.04 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 0.94 0.00 0.00 0.90 0.00 0.00 131 K 8.65 4.26 0.00 1.92 1.94 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.48 7.81 132 N 7.93 4.92 0.00 2.73 2.88 0.00 0.00 6.91 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Y 7.87 4.48 0.00 2.87 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 E 7.45 3.92 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 2.17 2.11 0.00