NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.1271 8.2649 123.5542 51.8864 20.6771 177.2815 2 L 3.4534 7.3201 116.6346 53.1951 41.9795 174.7526 3 D 5.2686 8.9644 123.8410 50.7699 44.9917 176.0889 4 T 3.9538 8.3408 115.7392 67.1311 67.0643 176.4424 5 N 4.4150 8.3412 117.5707 56.5554 38.0985 176.7206 6 Y 3.9163 8.8375 121.0615 60.7410 38.8551 176.5918 7 C 4.7326 7.9744 113.6135 57.5156 40.8640 174.7848 8 F 4.5434 7.7709 118.4603 58.0945 39.1753 177.0449 9 S 4.5273 7.4624 111.2183 60.9021 64.0615 174.0054 10 S 4.8730 7.5277 116.7462 57.7311 64.0914 174.9553 11 T 4.3463 8.1047 111.9198 62.1737 67.8245 173.2345 12 E 4.2783 8.7033 127.9584 55.2158 30.5083 176.1793 13 K 4.0799 7.9869 116.9109 57.3564 30.8511 172.8800 14 N 4.8978 7.3902 112.4860 50.6609 41.8850 172.6515 15 C 3.8060 7.9730 120.6244 56.2173 41.5755 172.3874 16 C 4.9076 8.5118 126.2356 55.9213 47.9660 172.8072 17 V 3.8214 8.2679 114.8671 61.7658 31.0819 176.8209 18 R 4.0456 8.3156 126.3987 55.4183 32.1371 174.9213 19 Q 4.9863 8.3612 120.6332 54.7389 31.1065 174.6743 20 L 4.8247 8.6217 126.8793 53.9700 46.2444 173.2612 21 Y 5.0533 8.7914 126.8871 55.8633 41.6977 173.8872 22 I 4.3886 7.2222 126.9088 59.3009 40.1096 174.0662 23 D 4.1692 9.3191 128.4919 52.7903 41.6274 176.6878 24 F 4.2073 8.0237 126.0229 60.9856 39.1210 178.3934 25 R 4.3530 7.8849 116.1126 57.0778 30.1420 177.4403 26 K 4.5399 8.0488 114.3346 56.0980 34.6500 176.5428 27 D 4.5733 8.8158 118.4819 55.2807 41.7265 177.3510 28 L 4.1002 7.7370 116.3900 53.9585 43.1152 177.4125 29 G 3.9156 8.2291 105.0629 45.5921 0.0000 172.7157 30 W 5.0542 8.3409 120.2186 55.7403 29.9059 177.1036 31 K 4.6969 8.9777 120.4535 55.8955 32.6981 176.5604 32 W 4.6456 7.8586 114.8615 56.3119 28.8372 175.8839 33 I 3.8381 6.6824 120.7909 60.0198 36.7989 174.8064 34 H 4.4694 8.9286 126.7965 59.0984 30.6474 175.1870 35 E 4.7413 7.9809 115.2668 54.6567 33.5601 173.9889 36 P 4.8696 0.0000 0.0000 62.2984 32.2517 176.2751 37 K 4.3617 8.8246 118.3792 57.8365 32.5379 176.5442 38 G 3.8380 7.9757 103.9498 46.8447 0.0000 171.8085 39 Y 4.8946 7.0567 116.1278 56.1890 41.7114 174.0039 40 H 4.9100 8.8681 118.2131 55.3299 28.6944 174.7879 41 A 4.2021 8.0684 127.3259 52.0377 19.7863 177.9959 42 N 4.9517 8.7174 113.0815 53.4519 38.0029 172.4368 43 F 4.8629 7.5984 111.0724 57.2920 41.6697 171.9998 44 C 5.3130 8.8659 116.5121 55.3568 42.9171 173.4168 45 L 4.6336 8.6587 123.6762 54.7075 45.5990 173.4736 46 G 4.4376 9.1103 110.5165 42.5885 0.0000 171.7949 47 P 4.5729 0.0000 0.0000 62.7886 32.1468 176.4813 48 C 5.5560 8.1428 115.1286 53.9786 40.5491 172.2819 49 P 4.5234 0.0000 0.0000 61.8394 31.9671 176.5156 50 Y 4.1810 8.5366 120.0158 59.3865 39.1470 175.9923 51 I 2.9682 7.6452 125.6398 61.4909 33.9412 173.5936 52 W 4.9715 7.5585 129.3090 57.0075 32.0526 173.8001 53 S 3.3997 7.8311 121.9148 58.3452 60.4928 172.2037 54 L 4.4297 7.6878 118.8098 54.2193 41.8936 176.8293 55 D 4.3116 8.7167 124.9095 56.7831 41.6284 176.4843 56 T 4.6973 7.4087 110.4847 59.4822 71.8235 174.2634 57 Q 4.0432 8.6201 121.6458 59.4101 28.6360 178.7724 58 Y 4.1055 8.0894 119.8019 60.8329 38.7272 178.1586 59 S 4.1148 8.0805 115.6194 61.5037 63.0023 176.6220 60 K 4.0857 8.0169 121.2267 59.4072 31.7074 179.6510 61 V 3.5809 7.8641 118.5626 66.0007 31.4196 178.0656 62 L 3.7919 8.0099 118.8745 57.5733 41.4093 179.3446 63 A 4.0359 8.1407 120.5959 55.4041 18.3125 179.5990 64 L 3.8712 8.1199 117.2154 57.9844 41.6813 179.5170 65 Y 3.9686 8.1779 119.6658 60.7232 38.7061 177.1869 66 N 4.6884 8.3540 117.2526 55.0997 39.0401 176.1855 67 Q 4.0680 7.6233 120.3694 59.7677 29.4564 176.8767 68 H 4.6432 7.7121 114.2003 55.9627 28.8341 175.1030 69 N 4.6722 7.7074 117.8836 50.3892 40.3396 171.7908 70 P 4.4215 0.0000 0.0000 63.2035 32.3230 176.9253 71 G 3.9353 8.8421 110.4412 46.5883 0.0000 174.9638 72 A 4.1516 7.6439 122.5574 52.5905 18.5375 180.3066 73 S 3.8590 7.8428 107.1844 58.0966 62.2001 170.0324 74 A 4.6036 7.6438 121.4956 51.4641 19.7104 175.2437 75 A 4.6582 8.1839 122.7575 50.8000 22.1181 173.9793 76 P 4.6245 0.0000 0.0000 62.6027 32.2903 175.3928 77 C 4.8453 8.4506 121.9470 57.5914 34.8373 173.5226 78 C 5.1308 8.8816 125.6299 56.5119 44.2849 172.7269 79 V 4.8734 9.0101 120.0314 58.3145 35.7550 173.7806 80 P 4.7826 0.0000 0.0000 63.8980 31.1818 175.2436 81 Q 4.4927 8.9992 121.5682 56.7439 31.7081 175.1565 82 A 4.7160 7.9847 121.8251 50.2157 21.0568 175.4102 83 L 5.2671 8.5738 121.8790 53.9339 44.1729 176.1894 84 E 4.9456 9.4275 121.2111 53.5898 33.5873 173.8824 85 P 4.9337 0.0000 0.0000 63.1692 32.7233 175.6744 86 L 4.6887 8.5816 122.2032 52.4799 44.9120 173.6373 87 P 5.0219 0.0000 0.0000 63.0272 31.8505 175.7351 88 I 4.8874 9.1546 117.3697 58.9503 41.9503 174.1838 89 V 4.9578 9.3446 124.0613 61.3537 33.9165 173.9387 90 Y 5.2273 8.7205 125.4173 55.5327 41.8173 173.7440 91 Y 4.5941 8.9202 119.3570 57.0139 39.2084 175.9993 92 V 4.1175 8.2674 125.8112 61.9091 31.5356 176.9018 93 G 4.0866 8.2029 118.9313 46.1199 0.0000 174.3333 94 R 4.2289 8.5811 122.8429 56.8838 30.8047 176.3209 95 K 4.1286 7.8800 118.9740 55.0737 32.4112 174.0639 96 P 3.1513 0.0000 0.0000 61.9707 31.6919 175.5844 97 K 4.2976 7.9632 126.9548 54.4058 34.3790 175.1170 98 V 4.9423 8.0342 125.6889 61.3204 34.3170 174.0587 99 E 4.8238 9.1715 125.5466 55.4736 35.0541 173.6960 100 Q 4.8388 8.5231 119.2984 54.2608 31.0380 176.0771 101 L 4.4518 8.6311 126.1090 53.5959 42.2569 176.7648 102 S 4.2788 8.6603 119.4837 58.7315 63.6854 173.9631 103 N 4.2479 8.6179 118.4442 55.1108 35.0723 173.5855 104 M 4.9334 7.9053 114.7950 54.6838 35.6063 177.3194 105 I 4.9047 8.3492 119.9076 59.2535 40.7950 174.9106 106 V 4.7057 8.3727 125.8574 60.6423 32.2702 175.8755 107 R 4.7115 9.3026 124.8933 56.6560 31.9433 176.0448 108 S 4.9815 7.7846 112.1949 57.4282 66.5696 173.4585 109 C 5.7317 8.7067 118.3293 55.4512 41.9942 173.0233 110 K 4.4806 8.6718 116.7564 56.5979 36.0507 173.7061 111 C 5.3069 8.7697 119.3490 55.8948 40.4567 174.3077 112 S 4.7392 9.1272 119.5178 58.4718 63.9340 174.0339 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 A 8.26 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 2 L 7.32 3.45 0.00 1.62 1.39 0.84 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 3 D 8.96 5.27 0.00 2.90 2.71 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 4 T 8.34 3.95 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 1.55 0.00 0.00 5 N 8.34 4.41 0.00 2.96 2.93 0.00 0.00 6.70 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 Y 8.84 3.92 0.00 3.04 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 7 C 7.97 4.73 0.00 2.78 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 8 F 7.77 4.54 0.00 3.17 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 7.46 4.53 0.00 3.95 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 10 S 7.53 4.87 0.00 3.89 3.59 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 11 T 8.10 4.35 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 12 E 8.70 4.28 0.00 2.41 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 2.84 2.25 0.00 13 K 7.99 4.08 0.00 1.81 1.73 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.39 7.81 14 N 7.39 4.90 0.00 2.42 2.32 0.00 0.00 6.95 8.61 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 15 C 7.97 3.81 0.00 3.43 3.36 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 16 C 8.51 4.91 0.00 3.08 2.87 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 17 V 8.27 3.82 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.59 0.00 0.00 18 R 8.32 4.05 0.00 0.67 1.43 0.00 3.17 0.00 0.00 2.96 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.17 0.00 19 Q 8.36 4.99 0.00 2.31 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.66 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 20 L 8.62 4.82 0.00 2.32 1.81 0.90 0.68 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 21 Y 8.79 5.05 0.00 3.13 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 22 I 7.22 4.39 1.18 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.43 0.56 0.00 0.00 23 D 9.32 4.17 0.00 2.63 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 8.02 4.21 0.00 3.14 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 25 R 7.88 4.35 0.00 1.84 2.04 0.00 3.12 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.65 0.00 26 K 8.05 4.54 0.00 1.68 1.79 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.43 7.81 27 D 8.82 4.57 0.00 2.54 2.51 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 0.00 0.00 0.00 0.00 28 L 7.74 4.10 0.00 1.19 0.65 0.39 0.61 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 29 G 8.23 3.92 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 0.00 0.00 0.00 30 W 8.34 5.05 0.00 3.29 2.53 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 0.00 0.00 0.00 0.00 31 K 8.98 4.70 0.00 1.82 1.85 0.00 1.80 0.00 0.00 1.83 0.00 0.00 3.14 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.42 1.51 7.81 32 W 7.86 4.65 0.00 3.46 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 33 I 6.68 3.84 1.02 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 -0.30 -0.36 0.56 0.00 0.00 34 H 8.93 4.47 0.00 3.35 3.76 0.00 5.96 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.98 4.74 0.00 2.10 1.76 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 2.18 2.31 0.00 36 P 0.00 4.87 0.00 2.38 2.12 0.00 3.85 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 37 K 8.82 4.36 0.00 1.91 1.93 0.00 1.74 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.66 7.81 38 G 7.98 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 39 Y 7.06 4.89 0.00 3.05 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 40 H 8.87 4.91 0.00 3.11 3.28 0.00 5.69 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 41 A 8.07 4.20 0.98 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 42 N 8.72 4.95 0.00 3.02 3.31 0.00 0.00 6.87 7.07 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 43 F 7.60 4.86 0.00 3.07 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 C 8.87 5.31 0.00 3.03 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 45 L 8.66 4.63 0.00 1.97 1.47 1.07 1.31 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 46 G 9.11 4.44 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 0.00 47 P 0.00 4.57 0.00 2.17 2.20 0.00 3.61 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 2.21 1.91 0.00 48 C 8.14 5.56 0.00 3.12 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 49 P 0.00 4.52 0.00 2.15 1.98 0.00 3.80 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.55 0.00 50 Y 8.54 4.18 0.00 2.90 2.99 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 51 I 7.65 2.97 1.46 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 -0.36 0.77 0.00 0.00 52 W 7.56 4.97 0.00 3.24 3.04 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 0.00 0.00 0.00 0.00 53 S 7.83 3.40 0.00 3.41 3.42 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 54 L 7.69 4.43 0.00 1.63 1.60 0.98 1.15 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 55 D 8.72 4.31 0.00 2.62 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 T 7.41 4.70 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 1.33 0.00 0.00 57 Q 8.62 4.04 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.67 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 58 Y 8.09 4.11 0.00 3.07 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 59 S 8.08 4.11 0.00 4.10 3.92 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 60 K 8.02 4.09 0.00 1.96 2.01 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.78 1.63 7.81 61 V 7.86 3.58 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 1.05 0.00 0.00 0.99 0.00 0.00 62 L 8.01 3.79 0.00 1.45 1.58 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.14 4.04 1.56 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 0.00 0.00 64 L 8.12 3.87 0.00 1.90 1.65 0.81 -0.29 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 65 Y 8.18 3.97 0.00 3.03 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 66 N 8.35 4.69 0.00 3.11 2.89 0.00 0.00 7.11 7.79 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 67 Q 7.62 4.07 0.00 2.28 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 68 H 7.71 4.64 0.00 2.93 3.24 0.00 5.85 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 N 7.71 4.67 0.00 2.28 2.43 0.00 0.00 6.88 7.81 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 70 P 0.00 4.42 0.00 2.01 1.95 0.00 3.77 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 1.98 2.02 0.00 71 G 8.84 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.64 4.15 1.54 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 73 S 7.84 3.86 0.00 4.12 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 74 A 7.64 4.60 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 75 A 8.18 4.66 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 76 P 0.00 4.62 0.00 2.00 2.05 0.00 3.72 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 77 C 8.45 4.85 0.00 3.01 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.88 5.13 0.00 3.26 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 9.01 4.87 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 0.82 0.00 0.00 1.02 0.00 0.00 80 P 0.00 4.78 0.00 2.11 2.11 0.00 3.75 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 81 Q 9.00 4.49 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.72 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 82 A 7.98 4.72 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 83 L 8.57 5.27 0.00 1.55 1.64 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 84 E 9.43 4.95 0.00 1.90 1.83 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 2.25 2.27 0.00 85 P 0.00 4.93 0.00 2.24 2.08 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 2.02 1.99 0.00 86 L 8.58 4.69 0.00 1.63 1.37 0.92 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 5.02 0.00 2.13 2.07 0.00 3.78 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 88 I 9.15 4.89 1.85 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.93 0.89 0.00 0.00 89 V 9.34 4.96 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.94 0.00 0.00 90 Y 8.72 5.23 0.00 3.42 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 91 Y 8.92 4.59 0.00 2.90 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 92 V 8.27 4.12 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 0.76 0.00 0.00 0.91 0.00 0.00 93 G 8.20 4.09 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 0.00 0.00 0.00 94 R 8.58 4.23 0.00 1.84 2.03 0.00 3.21 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 95 K 7.88 4.13 0.00 1.93 1.66 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.38 7.81 96 P 0.00 3.15 0.00 1.66 1.45 0.00 3.57 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.24 0.00 97 K 7.96 4.30 0.00 1.27 0.74 0.00 1.32 0.00 0.00 1.25 0.00 0.00 2.67 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.06 1.12 7.81 98 V 8.03 4.94 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 0.87 0.00 0.00 0.87 0.00 0.00 99 E 9.17 4.82 0.00 2.12 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 100 Q 8.52 4.84 0.00 1.92 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.10 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 101 L 8.63 4.45 0.00 1.62 1.67 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.66 4.28 0.00 3.90 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 0.00 103 N 8.62 4.25 0.00 2.94 2.95 0.00 0.00 6.78 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 0.00 104 M 7.91 4.93 0.00 1.76 2.03 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 2.53 2.75 0.00 105 I 8.35 4.90 2.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.29 1.08 0.00 0.00 106 V 8.37 4.71 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 0.85 0.00 0.00 1.02 0.00 0.00 107 R 9.30 4.71 0.00 1.76 2.04 0.00 3.36 0.00 0.00 3.29 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.10 0.00 108 S 7.78 4.98 0.00 3.96 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 C 8.71 5.73 0.00 2.73 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.67 4.48 0.00 1.75 1.80 0.00 1.41 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.41 7.81 111 C 8.77 5.31 0.00 3.05 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 0.00 112 S 9.13 4.74 0.00 3.72 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