NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3071 8.3044 120.3201 55.8106 32.8373 175.8503 2 H 4.4353 8.7029 122.8667 55.4854 28.7844 172.8743 3 L 4.7545 7.7601 125.6668 52.3050 45.1041 177.1775 4 T 4.0693 8.2409 113.9713 60.8968 70.4504 173.8347 5 P 4.1665 0.0000 0.0000 66.1292 31.3431 178.8888 6 E 3.8415 8.0577 116.9056 59.1563 29.1105 178.3255 7 E 4.2820 7.9834 115.0822 57.0352 29.9354 177.2157 8 K 4.3042 7.9112 120.0755 56.8786 32.9461 176.5127 9 S 4.6605 7.7067 112.5280 58.4437 64.2164 175.5240 10 A 4.0712 7.9039 123.5874 54.7053 18.2745 179.6807 11 V 3.4696 7.3916 116.1294 66.4799 31.3575 178.4882 12 T 4.0205 7.8936 108.7927 64.5340 68.3632 176.0001 13 A 4.0620 7.6976 122.5086 55.1882 18.7081 179.2682 14 L 3.9622 8.0258 118.1097 57.4794 42.0455 178.7455 15 W 4.4914 8.4810 128.2700 59.9317 30.4495 177.4886 16 G 3.9518 7.9288 103.2188 45.7414 0.0000 173.7548 17 K 4.4925 7.6128 118.3986 55.6703 33.9463 176.3666 18 V 3.6150 7.6845 120.4528 62.2963 31.4432 176.2049 19 N 4.5063 8.3795 127.6537 51.8302 37.4592 175.0485 20 V 3.3097 7.6952 122.7424 65.7006 31.5096 177.1505 21 D 4.3882 7.6567 119.4846 57.1843 40.5021 177.9691 22 E 3.8841 7.8907 119.4654 59.4426 29.9434 179.4828 23 V 3.6986 8.1044 118.6915 65.4607 31.5164 178.2383 24 G 3.6907 8.1707 106.0647 47.3459 0.0000 175.3715 25 G 3.8068 7.7417 106.2115 45.8117 0.0000 175.6463 26 E 3.8911 7.8174 121.5198 58.9871 29.6260 178.6217 27 A 3.9120 7.8806 120.8455 55.1157 18.6842 179.3553 28 L 3.9463 7.8678 118.5627 58.2428 42.2079 179.2664 29 G 3.5495 7.9284 105.2747 47.8013 0.0000 175.9862 30 R 3.8514 7.6932 120.5943 58.6367 30.0014 178.6367 31 L 4.1229 7.8345 120.2692 58.4906 41.8391 179.2518 32 L 3.9268 7.4996 116.7490 57.3654 41.5690 179.0041 33 V 3.8194 7.4791 116.7987 64.3041 31.7472 177.4144 34 V 3.7044 8.1570 118.0470 63.1961 33.2066 175.4072 35 Y 3.7094 7.0393 116.0883 53.7257 37.9985 173.7197 36 P 4.2190 0.0000 0.0000 65.4484 31.8774 177.5891 37 W 4.3953 8.0957 114.8887 59.8939 27.8111 177.9723 38 T 4.5189 7.5367 109.9467 64.2656 68.1024 176.2570 39 Q 4.3549 8.5002 121.9578 58.4751 28.4895 177.9061 40 R 4.0438 7.9724 115.7326 57.8598 29.4319 177.6544 41 F 4.3533 7.8751 117.2991 58.1211 39.7769 176.8051 42 F 4.1987 7.5752 116.7611 56.9228 39.4191 177.4500 43 E 4.0145 8.1574 121.3702 59.3351 29.4818 179.2994 44 S 4.2712 8.0239 113.9485 61.5723 62.9986 175.9407 45 F 4.7853 8.3050 118.7901 59.5000 40.2820 176.4830 46 G 4.3630 6.6273 107.5365 45.7659 0.0000 175.0617 47 D 4.7119 8.7318 127.1799 53.0842 41.2515 175.1675 48 L 4.8954 8.2566 128.4672 54.5899 42.7599 178.7311 49 S 4.2360 8.2804 113.9347 60.6567 63.7794 173.9273 50 T 4.5491 7.3770 111.9333 58.4242 70.7677 173.7017 51 P 4.1802 0.0000 0.0000 66.0932 30.7530 178.7365 52 D 4.3335 7.7713 117.0793 56.8781 40.6727 178.6747 53 A 3.9975 8.1776 122.0614 55.0091 18.1769 179.7514 54 V 3.5071 7.5155 115.1193 66.6342 31.9079 177.3551 55 M 4.1385 8.2904 117.7410 57.8329 32.0480 178.1036 56 G 3.6847 7.5532 106.2337 47.1981 0.0000 174.3281 57 N 4.2716 8.1497 119.5756 53.3034 39.7233 173.8143 58 P 4.3696 0.0000 0.0000 65.3271 31.4638 178.7658 59 K 3.6507 8.5347 119.5168 59.1795 31.8422 179.2059 60 V 3.2915 7.5338 117.9617 65.8053 31.3084 178.0364 61 K 3.8318 7.5255 116.4347 59.4736 31.7578 178.9168 62 A 3.9393 7.7565 119.8032 55.7563 18.4990 178.8995 63 H 4.4266 8.4046 116.6914 59.2407 30.1473 177.5052 64 G 4.2655 8.3481 109.3087 47.3156 0.0000 175.5464 65 K 4.1201 7.9024 120.0593 58.8385 31.8133 179.2820 66 K 3.9956 8.0335 120.1265 59.0978 31.9087 179.1775 67 V 3.7732 7.6225 118.3159 65.8131 31.8958 177.4931 68 L 4.5187 8.0073 117.0555 56.2684 41.4614 179.3611 69 G 3.7359 8.0004 106.5786 47.5635 0.0000 175.9634 70 A 4.0628 7.8379 122.2177 54.5943 18.1168 179.5620 71 F 4.0805 8.0954 118.4760 61.7841 39.9097 177.2684 72 S 4.3154 8.3096 114.4110 61.6998 62.7478 176.2733 73 D 4.4125 8.4597 121.1014 57.1545 40.6013 178.5344 74 G 3.6358 8.2104 106.4086 47.4953 0.0000 175.5352 75 L 3.8741 7.3010 119.3522 56.9206 41.6292 178.7221 76 A 4.1065 7.4079 119.7500 53.4977 19.3549 177.2155 77 H 4.9189 7.3977 113.3153 54.4422 29.0335 174.7260 78 L 3.9733 7.8248 121.6944 57.3292 42.6477 176.5987 79 D 5.0021 7.4686 117.5953 52.5435 40.6577 175.8038 80 N 4.7175 7.1090 113.2951 53.9382 41.9607 174.7140 81 L 4.3679 7.1408 120.6970 56.8566 42.3284 179.1382 82 K 4.1818 8.0836 118.1333 59.2806 32.0878 178.8820 83 G 3.7472 7.9416 104.6875 47.8894 0.0000 175.6541 84 T 3.9163 7.3890 116.4961 65.2920 68.5793 175.9685 85 F 4.8162 8.0465 118.0049 57.2167 39.7293 177.7553 86 A 4.0702 7.8863 123.4016 55.5714 18.2821 180.5761 87 T 3.7989 7.8185 113.7444 66.8540 68.6858 176.5525 88 L 4.0456 7.9958 121.6712 58.2733 42.2457 178.7700 89 S 4.4225 8.2371 113.1736 61.2065 62.3047 175.9341 90 E 4.0879 8.1181 121.4238 58.7561 29.2593 178.8338 91 L 3.9132 8.0424 120.5469 58.6847 42.2970 178.9313 92 H 4.2484 8.4775 115.9437 58.6737 28.2808 177.0868 93 C 3.6508 7.4816 119.5291 61.9544 31.1822 175.3320 94 D 4.2986 7.8859 119.7930 57.1133 40.6373 178.1375 95 K 4.1007 7.6623 116.6654 58.9892 32.6122 178.3466 96 L 4.0971 7.7902 116.7588 55.5191 42.3168 176.6133 97 H 4.1761 7.3832 113.0762 56.7920 26.2640 175.1632 98 V 4.2485 7.9451 117.9896 60.7618 33.1415 174.6315 99 D 4.3022 8.6698 127.0931 53.7083 41.5758 174.9043 100 P 2.9700 0.0000 0.0000 64.7588 30.9176 177.5136 101 E 3.9833 8.0395 116.6437 57.9833 29.6233 177.5679 102 N 4.5809 7.9309 116.0501 56.2212 38.5314 176.8726 103 F 4.3852 7.8455 119.4238 61.0203 38.9497 177.8845 104 R 4.1419 8.0232 116.9064 58.8524 30.0016 178.7572 105 L 3.7945 8.0895 119.4907 57.4752 41.4303 179.1435 106 L 4.1976 8.0074 120.0723 57.6465 42.1392 179.0868 107 G 3.6543 7.7223 105.0423 47.6798 0.0000 175.8174 108 K 4.2134 8.1112 121.3050 58.9688 32.8212 179.4722 109 V 3.6626 7.7347 119.6369 65.6249 31.5147 177.6743 110 L 3.8527 8.2060 120.4668 58.0960 41.9740 178.9329 111 V 3.5703 7.6268 117.6709 66.4731 31.3875 177.7359 112 C 4.0927 7.8240 116.3250 62.7181 27.8278 176.4356 113 V 3.3304 7.4049 119.3809 65.9060 31.1060 178.1168 114 L 3.8289 7.6102 118.4347 57.5318 41.2737 179.4668 115 A 3.7482 7.3329 120.7776 55.0719 18.1056 179.2015 116 H 4.0243 7.9809 115.9860 59.4812 30.0671 176.4216 117 H 4.5273 7.8819 114.9229 56.0200 28.9400 175.7823 118 F 5.0092 7.5611 118.0357 55.8809 43.1328 177.1741 119 G 3.8370 8.4165 108.8516 45.8996 0.0000 174.8324 120 K 4.0054 9.2093 123.3245 59.3901 32.0199 176.6244 121 E 4.0894 8.1374 116.6990 59.5883 29.9686 178.3059 122 F 4.5164 8.1951 121.0947 57.5077 37.7747 174.5710 123 T 4.1144 7.3262 115.1134 60.8858 71.2599 173.2904 124 P 4.1674 0.0000 0.0000 65.4424 31.1952 177.3150 125 P 4.2834 0.0000 0.0000 64.9987 31.2134 179.0153 126 V 3.5132 7.0367 117.5995 65.8373 31.4596 177.4476 127 Q 3.5863 7.4334 119.1406 59.2092 28.8458 178.4029 128 A 3.9564 7.7944 120.9122 55.4740 18.3020 179.5367 129 A 3.9201 7.7411 118.9145 55.4108 18.3434 179.5290 130 Y 3.7223 8.0643 115.4579 61.0883 38.1579 178.0268 131 Q 4.1429 8.6952 119.4989 59.1230 28.8306 179.3478 132 K 3.9654 7.9828 119.0265 59.3802 32.1584 179.5995 133 V 3.4314 7.3746 118.5079 66.1514 31.3824 178.5877 134 V 3.7481 8.0793 111.9416 64.2889 31.3516 178.4711 135 A 4.0878 8.0746 120.4577 55.0558 18.1876 179.9658 136 G 3.4876 8.0567 104.3952 47.8058 0.0000 176.1957 137 V 3.2432 7.5556 120.1380 65.2714 31.4201 178.1059 138 A 3.8941 8.1292 120.9758 55.1645 18.0810 179.2519 139 N 4.4651 8.0171 113.0671 55.5132 38.7245 177.0427 140 A 4.2524 7.3509 121.4137 54.7771 18.5864 179.5761 141 L 3.9810 7.6819 116.4569 57.2754 41.6186 178.5329 142 A 4.5193 8.1315 118.8252 52.5809 18.6350 178.4943 143 H 4.3377 7.9950 118.9833 58.8862 30.0852 176.3121 144 K 4.2999 8.4676 116.6056 56.5641 32.3862 176.6295 145 Y 4.1012 7.4606 117.4872 58.8691 38.4872 176.2762 146 H 4.3324 8.4578 116.0342 56.5986 27.9463 173.9840 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 4.31 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 2 H 8.70 4.44 0.00 3.13 3.24 0.00 5.87 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 3 L 7.76 4.75 0.00 1.53 1.44 0.83 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.24 4.07 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 5 P 0.00 4.17 0.00 2.16 2.15 0.00 3.58 0.00 0.00 3.75 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 6 E 8.06 3.84 0.00 2.02 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 2.38 2.41 0.00 7 E 7.98 4.28 0.00 2.13 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 0.00 2.40 2.21 0.00 8 K 7.91 4.30 0.00 1.85 1.93 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.35 7.81 9 S 7.71 4.66 0.00 3.88 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.90 4.07 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.39 3.47 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.47 0.00 0.00 12 T 7.89 4.02 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 1.19 0.00 0.00 13 A 7.70 4.06 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.03 3.96 0.00 1.82 1.87 -0.22 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.48 4.49 0.00 3.79 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 16 G 7.93 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 17 K 7.61 4.49 0.00 1.92 1.99 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.35 7.81 18 V 7.68 3.61 1.04 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 -0.22 0.00 0.00 0.82 0.00 0.00 19 N 8.38 4.51 0.00 2.72 2.55 0.00 0.00 6.76 7.71 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 20 V 7.70 3.31 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 1.09 0.00 0.00 0.93 0.00 0.00 21 D 7.66 4.39 0.00 2.84 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 7.89 3.88 0.00 1.91 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 23 V 8.10 3.70 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 0.80 0.00 0.00 0.80 0.00 0.00 24 G 8.17 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 0.00 0.00 0.00 25 G 7.74 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 26 E 7.82 3.89 0.00 2.16 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 2.17 2.22 0.00 27 A 7.88 3.91 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 28 L 7.87 3.95 0.00 1.73 1.62 0.71 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.93 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 30 R 7.69 3.85 0.00 1.89 1.88 0.00 3.03 0.00 0.00 2.97 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 31 L 7.83 4.12 0.00 1.81 1.88 1.06 0.78 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 32 L 7.50 3.93 0.00 1.81 1.67 0.68 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.48 3.82 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.95 0.00 0.00 34 V 8.16 3.70 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 0.08 0.00 0.00 0.71 0.00 0.00 35 Y 7.04 3.71 0.00 2.68 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 0.00 0.00 0.00 36 P 0.00 4.22 0.00 2.25 2.14 0.00 3.14 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.05 0.00 37 W 8.10 4.40 0.00 3.65 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 38 T 7.54 4.52 4.46 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 1.23 0.00 0.00 39 Q 8.50 4.35 0.00 2.25 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.89 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 40 R 7.97 4.04 0.00 1.77 1.97 0.00 2.73 0.00 0.00 3.07 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.56 0.00 41 F 7.88 4.35 0.00 2.49 2.55 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 42 F 7.58 4.20 0.00 2.81 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 0.00 0.00 0.00 43 E 8.16 4.01 0.00 1.98 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 2.39 2.30 0.00 44 S 8.02 4.27 0.00 3.93 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 45 F 8.30 4.79 0.00 3.15 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 46 G 6.63 4.36 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 0.00 47 D 8.73 4.71 0.00 2.65 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.26 4.90 0.00 1.66 1.63 1.06 1.07 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 49 S 8.28 4.24 0.00 3.98 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 50 T 7.38 4.55 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 1.21 0.00 0.00 51 P 0.00 4.18 0.00 2.14 2.11 0.00 3.57 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 52 D 7.77 4.33 0.00 2.67 2.69 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 53 A 8.18 4.00 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 54 V 7.52 3.51 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 0.94 0.00 0.00 0.98 0.00 0.00 55 M 8.29 4.14 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.77 0.00 56 G 7.55 3.68 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 0.00 0.00 0.00 57 N 8.15 4.27 0.00 3.01 2.86 0.00 0.00 6.81 7.08 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 58 P 0.00 4.37 0.00 2.25 2.25 0.00 3.72 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 59 K 8.53 3.65 0.00 1.41 1.05 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.78 7.81 60 V 7.53 3.29 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 1.06 0.00 0.00 1.03 0.00 0.00 61 K 7.53 3.83 0.00 1.95 1.77 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.54 1.54 7.81 62 A 7.76 3.94 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 63 H 8.40 4.43 0.00 3.24 3.26 0.00 5.81 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 64 G 8.35 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 65 K 7.90 4.12 0.00 1.77 1.86 0.00 1.86 0.00 0.00 1.54 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.61 1.65 7.81 66 K 8.03 4.00 0.00 1.90 1.82 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.48 7.81 67 V 7.62 3.77 2.26 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 1.08 0.00 0.00 0.91 0.00 0.00 68 L 8.01 4.52 0.00 1.91 1.85 1.06 0.71 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 69 G 8.00 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 0.00 0.00 0.00 70 A 7.84 4.06 1.55 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 71 F 8.10 4.08 0.00 3.29 3.47 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 0.00 0.00 0.00 0.00 72 S 8.31 4.32 0.00 4.34 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 73 D 8.46 4.41 0.00 2.97 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 8.21 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 75 L 7.30 3.87 0.00 1.65 1.52 -0.08 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.41 4.11 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 77 H 7.40 4.92 0.00 3.16 3.16 0.00 5.83 0.00 0.00 0.00 0.00 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.82 3.97 0.00 1.49 1.64 0.73 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.47 5.00 0.00 2.77 2.69 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 80 N 7.11 4.72 0.00 2.82 2.70 0.00 0.00 7.29 6.54 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 81 L 7.14 4.37 0.00 1.80 1.98 0.87 1.05 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 82 K 8.08 4.18 0.00 1.72 1.85 0.00 1.68 0.00 0.00 1.53 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.46 7.81 83 G 7.94 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 0.00 0.00 0.00 84 T 7.39 3.92 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 0.74 0.00 0.00 85 F 8.05 4.82 0.00 3.15 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 86 A 7.89 4.07 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 87 T 7.82 3.80 4.26 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 1.22 0.00 0.00 88 L 8.00 4.05 0.00 1.89 1.84 1.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.24 4.42 0.00 4.37 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 90 E 8.12 4.09 0.00 2.29 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 91 L 8.04 3.91 0.00 1.77 1.89 0.90 0.90 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 92 H 8.48 4.25 0.00 3.53 3.72 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.48 3.65 0.00 1.23 2.39 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 94 D 7.89 4.30 0.00 2.77 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 95 K 7.66 4.10 0.00 1.83 1.81 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.37 7.81 96 L 7.79 4.10 0.00 1.82 1.74 0.73 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.38 4.18 0.00 3.46 3.41 0.00 5.63 0.00 0.00 0.00 0.00 8.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.95 4.25 2.27 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 0.57 0.00 0.00 0.72 0.00 0.00 99 D 8.67 4.30 0.00 2.72 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 0.00 100 P 0.00 2.97 0.00 1.67 1.38 0.00 3.23 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.44 0.00 101 E 8.04 3.98 0.00 2.02 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 102 N 7.93 4.58 0.00 2.77 2.86 0.00 0.00 6.86 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 7.85 4.39 0.00 3.08 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 0.00 104 R 8.02 4.14 0.00 1.89 1.97 0.00 3.27 0.00 0.00 3.44 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.80 0.00 105 L 8.09 3.79 0.00 1.64 1.14 0.86 0.28 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 0.00 106 L 8.01 4.20 0.00 1.81 1.85 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 107 G 7.72 3.65 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 0.00 0.00 0.00 108 K 8.11 4.21 0.00 2.11 2.14 0.00 1.28 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.68 1.63 7.81 109 V 7.73 3.66 2.24 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 1.03 0.00 0.00 1.21 0.00 0.00 110 L 8.21 3.85 0.00 1.72 1.63 0.85 0.48 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 0.00 111 V 7.63 3.57 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 1.29 0.00 0.00 1.18 0.00 0.00 112 C 7.82 4.09 0.00 3.11 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 0.00 113 V 7.40 3.33 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 0.88 0.00 0.00 0.86 0.00 0.00 114 L 7.61 3.83 0.00 0.93 0.96 0.54 0.68 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 0.00 115 A 7.33 3.75 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.98 4.02 0.00 3.12 3.27 0.00 5.75 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.88 4.53 0.00 2.52 2.58 0.00 5.65 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 7.56 5.01 0.00 3.37 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.42 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 9.21 4.01 0.00 1.77 1.94 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.55 7.81 121 E 8.14 4.09 0.00 2.17 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 2.42 2.47 0.00 122 F 8.20 4.52 0.00 3.07 3.21 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 0.00 123 T 7.33 4.11 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 1.33 0.00 0.00 124 P 0.00 4.17 0.00 2.15 2.13 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 125 P 0.00 4.28 0.00 2.11 2.06 0.00 3.54 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 2.08 2.11 0.00 126 V 7.04 3.51 1.74 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 1.10 0.00 0.00 0.93 0.00 0.00 127 Q 7.43 3.59 0.00 1.80 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 128 A 7.79 3.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.74 3.92 1.24 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 0.00 0.00 0.00 130 Y 8.06 3.72 0.00 3.47 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 0.00 131 Q 8.70 4.14 0.00 2.21 2.22 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 2.64 2.62 0.00 132 K 7.98 3.97 0.00 1.94 1.80 0.00 1.60 0.00 0.00 1.52 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.63 7.81 133 V 7.37 3.43 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 0.74 0.00 0.00 0.70 0.00 0.00 134 V 8.08 3.75 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 1.10 0.00 0.00 1.09 0.00 0.00 135 A 8.07 4.09 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 0.00 136 G 8.06 3.49 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 0.00 137 V 7.56 3.24 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 0.24 0.00 0.00 0.49 0.00 0.00 138 A 8.13 3.89 1.44 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 0.00 139 N 8.02 4.47 0.00 2.80 2.89 0.00 0.00 7.04 7.50 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 0.00 140 A 7.35 4.25 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 0.00 141 L 7.68 3.98 0.00 1.40 0.98 0.67 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.13 4.52 1.31 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 0.00 143 H 8.00 4.34 0.00 3.37 3.59 0.00 5.75 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.47 4.30 0.00 1.81 1.83 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.53 1.82 7.81 145 Y 7.46 4.10 0.00 3.03 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 0.00 146 H 8.46 4.33 0.00 3.20 3.22 0.00 5.75 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