NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3001 M 4.3107 8.3049 120.3238 53.6372 34.5494 175.2233 3002 E 3.5659 8.1841 116.1688 56.7591 26.7453 173.6787 3003 L 4.2224 7.5401 119.1836 54.8787 43.7206 178.4170 3004 T 4.3249 8.8146 114.9084 60.2512 71.2188 174.0294 3005 P 4.2418 0.0000 0.0000 65.8462 31.3207 179.1102 3006 R 3.9296 7.9713 114.2904 59.3466 29.1518 178.6819 3007 E 3.9548 7.8495 118.0000 59.1747 29.2587 179.4490 3008 K 4.0048 7.8172 117.5075 59.3048 32.3783 178.6234 3009 D 4.4704 8.3771 118.8282 57.3708 41.1666 178.5353 3010 K 4.0776 8.1845 118.8630 59.2826 31.9662 179.3011 3011 L 4.0562 7.6835 119.4899 57.4676 41.4468 179.2732 3012 L 3.9960 7.8488 120.5879 57.9276 42.0670 178.7543 3013 L 3.9542 7.8054 119.8730 58.0277 42.2376 178.3577 3014 F 4.1490 8.4107 120.6446 61.8418 39.1990 177.2616 3015 T 3.7488 8.1715 114.9942 66.5385 68.0920 176.5391 3016 A 3.9597 8.1465 122.4862 55.0962 18.2846 179.5831 3017 A 3.8955 7.9445 119.3095 55.1025 18.4893 179.8389 3018 L 3.7388 7.4429 117.4873 57.6760 41.4555 179.8499 3019 V 3.5010 7.4990 117.8322 65.9423 31.4172 177.9961 3020 A 3.9240 7.6612 120.4333 55.0259 18.2135 178.9445 3021 E 3.8198 8.3870 118.2541 59.8418 29.5190 179.4997 3022 R 3.9776 7.8813 117.4715 59.1227 30.1913 179.2754 3023 R 3.9676 7.8301 118.1251 58.8868 30.0436 178.7069 3024 L 3.9412 8.3027 120.4515 58.0307 41.8541 178.8175 3025 A 3.9884 7.7781 119.8966 55.2372 18.3795 179.4860 3026 R 4.1015 7.5254 115.2027 57.5443 30.1260 177.7789 3027 G 3.9434 8.0198 106.8706 45.2245 0.0000 173.2927 3028 L 4.4725 7.3385 118.1376 53.5053 43.0737 176.6834 3029 K 4.4798 8.4085 121.3841 55.5614 32.8085 177.0709 3030 L 4.4588 8.8422 126.1433 55.0751 43.2098 177.0374 3031 N 4.7570 8.9093 119.9145 52.1335 40.4963 174.3099 3032 Y 4.1122 8.9393 118.1872 60.9119 38.7547 176.7442 3033 P 3.9156 0.0000 0.0000 65.7584 31.3693 178.1506 3034 E 3.8890 8.5514 118.2767 59.2516 29.3742 179.4863 3035 S 4.0351 7.9148 115.0883 61.5669 62.9188 176.8882 3036 V 3.4406 7.3895 120.3529 65.8461 31.1618 177.9058 3037 A 3.9105 7.9524 120.4216 54.9538 18.3256 179.2307 3038 L 3.8535 7.9439 118.8381 58.5434 42.3244 179.3159 3039 I 3.7466 7.6787 119.6068 64.4048 37.0057 178.6381 3040 S 4.1535 8.1596 115.7936 61.6601 62.7059 176.6253 3041 A 4.0619 8.2357 123.4845 54.9774 18.0694 179.3044 3042 F 4.0715 8.2232 119.0077 61.7021 39.4807 177.4664 3043 I 3.6205 7.8618 118.9446 64.5960 36.8789 178.3031 3044 M 3.9418 7.9879 119.4881 58.5421 31.8054 178.7583 3045 E 4.0158 8.2277 118.7832 59.0447 29.5337 179.6125 3046 G 3.3345 7.6669 105.7944 47.6005 0.0000 175.6374 3047 A 3.2245 7.6968 123.2335 54.5447 17.9621 179.7211 3048 R 3.7241 7.3647 116.2693 59.5669 30.1945 178.2633 3049 D 4.4858 7.7968 117.8459 55.5325 40.7739 177.3986 3050 G 4.0619 7.4641 106.8021 45.0927 0.0000 173.8943 3051 K 4.2497 7.6328 118.6747 55.7823 32.8222 177.7370 3052 S 4.5440 8.3559 116.2763 57.7980 65.5009 175.4854 3053 V 3.5155 8.0202 121.5263 66.0486 30.7472 178.0021 3054 A 4.0100 7.8985 119.9958 55.2782 18.2047 179.6140 3055 S 3.9943 8.0181 113.3831 61.9078 62.8794 177.0522 3056 L 4.1309 8.0419 121.5845 58.0268 41.1166 179.4359 3057 M 4.0711 8.1364 117.8949 57.6007 32.0735 177.7685 3058 E 4.3131 7.6991 118.9043 58.6689 30.3999 177.7916 3059 E 4.2389 8.6094 119.0572 59.5287 29.3503 179.5237 3060 G 3.8237 8.4383 104.5935 46.8751 0.0000 174.7934 3061 R 4.6129 7.5020 119.8768 55.7823 30.2669 176.1622 3062 H 4.9148 7.7792 115.1538 55.5352 30.0026 175.0098 3063 V 3.5572 7.8093 121.2336 64.6935 31.6893 176.2971 3064 L 4.9521 7.4563 116.9712 52.9726 45.3057 175.7109 3065 T 4.5761 8.4373 111.7936 59.3595 71.2149 175.4077 3066 R 3.8638 8.4691 121.8275 59.2878 30.0273 177.6406 3067 E 4.2990 8.0990 113.2070 57.5799 30.2491 176.6747 3068 Q 4.5611 8.1768 118.5258 55.9905 29.9784 175.2443 3069 V 5.0637 7.3021 110.4776 59.2901 35.7754 175.4450 3070 M 4.3401 8.8632 122.0728 54.9432 33.1816 176.0223 3071 E 4.0584 8.5903 121.7377 57.7530 30.2043 176.5659 3072 G 4.1591 8.9372 113.4059 44.8060 0.0000 175.7140 3073 V 3.6798 7.6260 119.0249 65.5830 31.8178 176.2397 3074 P 4.3134 0.0000 0.0000 65.6919 31.4358 178.3370 3075 E 4.1175 7.9999 116.8268 58.9953 29.5293 178.4714 3076 M 4.3508 7.8083 117.0480 56.5629 32.1127 176.7495 3077 I 4.6509 7.2840 120.2680 58.3357 37.4753 173.9083 3078 P 4.6159 0.0000 0.0000 65.2653 32.5699 176.2271 3079 D 4.9466 7.1937 117.7281 52.8821 42.6315 175.3820 3080 I 4.7613 8.4758 119.6543 59.7161 41.1909 174.6662 3081 Q 5.5977 8.8432 123.9429 53.2331 32.3917 174.9193 3082 V 4.5676 8.1983 120.3298 60.8068 34.6150 172.2900 3083 E 5.6174 8.9678 120.8421 54.3125 32.7260 174.7318 3084 A 4.5541 8.3321 121.8886 51.2661 23.2827 175.6450 3085 T 4.3206 8.2784 116.2182 62.8875 68.7794 175.4529 3086 F 4.3926 9.2337 126.6756 55.4408 40.2822 175.5102 3087 P 4.3139 0.0000 0.0000 65.2313 31.0620 177.1100 3088 D 4.7649 8.2827 116.3957 52.8572 39.9178 176.6805 3089 G 3.9138 8.1435 107.3044 45.0530 0.0000 173.1662 3090 S 5.4496 8.1580 114.4327 58.3542 63.4173 174.5403 3091 K 4.6884 8.8391 122.1732 54.6518 36.8569 174.5277 3092 L 4.8720 8.4314 124.2255 53.6879 43.7943 175.5314 3093 V 4.4014 8.7436 126.3161 61.4851 33.8459 174.1185 3094 T 4.8583 8.6078 124.6264 61.8339 70.7141 173.7433 3095 V 4.2576 8.7578 127.8550 61.4603 33.3197 174.2486 3096 H 4.6738 8.8939 125.5830 55.6879 28.3067 175.6019 3097 N 4.1410 8.9534 119.6663 53.6665 36.0654 173.7202 3098 P 4.4224 0.0000 0.0000 64.7349 32.1358 176.6708 3099 I 4.7934 7.1164 119.0725 59.2795 38.4493 175.5203 3100 I 4.1233 8.2230 118.1529 60.9194 37.5374 175.2674 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 3001 M 8.30 4.31 0.00 2.00 2.18 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 3002 E 8.18 3.57 0.00 2.14 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 2.21 2.45 0.00 3003 L 7.54 4.22 0.00 1.62 1.60 0.89 0.96 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 3004 T 8.81 4.32 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 1.25 0.00 0.00 3005 P 0.00 4.24 0.00 2.18 2.15 0.00 3.60 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 2.11 2.15 0.00 3006 R 7.97 3.93 0.00 2.04 2.20 0.00 2.97 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 3007 E 7.85 3.95 0.00 2.26 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 0.00 2.30 2.33 0.00 3008 K 7.82 4.00 0.00 1.91 1.87 0.00 1.71 0.00 0.00 1.63 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.55 7.81 3009 D 8.38 4.47 0.00 2.89 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 3010 K 8.18 4.08 0.00 1.98 1.85 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.67 1.62 7.81 3011 L 7.68 4.06 0.00 1.91 1.76 0.90 0.55 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 3012 L 7.85 4.00 0.00 1.77 1.91 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 3013 L 7.81 3.95 0.00 1.82 1.92 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 3014 F 8.41 4.15 0.00 3.14 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 3015 T 8.17 3.75 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 1.22 0.00 0.00 3016 A 8.15 3.96 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 3017 A 7.94 3.90 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3018 L 7.44 3.74 0.00 1.75 1.58 0.78 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 3019 V 7.50 3.50 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 0.98 0.00 0.00 0.92 0.00 0.00 3020 A 7.66 3.92 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 3021 E 8.39 3.82 0.00 2.06 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 0.00 2.28 2.34 0.00 3022 R 7.88 3.98 0.00 1.90 1.94 0.00 3.14 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 3023 R 7.83 3.97 0.00 1.91 1.95 0.00 3.10 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 3024 L 8.30 3.94 0.00 1.80 1.81 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 3025 A 7.78 3.99 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 3026 R 7.53 4.10 0.00 1.91 1.99 0.00 3.14 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 3027 G 8.02 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 3028 L 7.34 4.47 0.00 1.68 1.59 0.91 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 3029 K 8.41 4.48 0.00 1.64 1.73 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.46 7.81 3030 L 8.84 4.46 0.00 1.58 1.56 0.89 0.31 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 3031 N 8.91 4.76 0.00 2.89 3.00 0.00 0.00 6.71 7.10 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 3032 Y 8.94 4.11 0.00 3.08 3.01 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 3033 P 0.00 3.92 0.00 2.25 2.28 0.00 3.96 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.11 0.00 3034 E 8.55 3.89 0.00 2.21 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 2.30 2.39 0.00 3035 S 7.91 4.04 0.00 3.94 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 3036 V 7.39 3.44 1.75 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 0.90 0.00 0.00 0.43 0.00 0.00 3037 A 7.95 3.91 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 3038 L 7.94 3.85 0.00 1.85 1.75 0.89 0.84 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 3039 I 7.68 3.75 1.86 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 1.44 1.07 0.92 0.00 0.00 3040 S 8.16 4.15 0.00 4.07 3.93 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 3041 A 8.24 4.06 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 3042 F 8.22 4.07 0.00 3.18 3.34 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 3043 I 7.86 3.62 2.08 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.01 0.98 0.00 0.00 3044 M 7.99 3.94 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.57 0.00 3045 E 8.23 4.02 0.00 1.97 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 2.55 2.50 0.00 3046 G 7.67 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3047 A 7.70 3.22 0.23 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 3048 R 7.36 3.72 0.00 1.68 2.03 0.00 3.23 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 3049 D 7.80 4.49 0.00 2.79 2.66 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 0.00 0.00 0.00 0.00 3050 G 7.46 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 3051 K 7.63 4.25 0.00 1.90 1.81 0.00 1.69 0.00 0.00 1.83 0.00 0.00 3.16 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.33 7.81 3052 S 8.36 4.54 0.00 4.03 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 3053 V 8.02 3.52 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 1.01 0.00 0.00 0.26 0.00 0.00 3054 A 7.90 4.01 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 3055 S 8.02 3.99 0.00 4.11 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 3056 L 8.04 4.13 0.00 1.85 1.84 1.11 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 3057 M 8.14 4.07 0.00 2.04 2.32 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.76 0.00 3058 E 7.70 4.31 0.00 1.96 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 2.47 0.00 3059 E 8.61 4.24 0.00 2.27 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.56 0.00 3060 G 8.44 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 3061 R 7.50 4.61 0.00 1.64 1.84 0.00 3.08 0.00 0.00 3.06 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 3062 H 7.78 4.91 0.00 3.16 3.18 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3063 V 7.81 3.56 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 0.55 0.00 0.00 0.17 0.00 0.00 3064 L 7.46 4.95 0.00 1.56 1.46 0.87 0.76 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 3065 T 8.44 4.58 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 3066 R 8.47 3.86 0.00 1.92 1.98 0.00 3.17 0.00 0.00 3.39 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 3067 E 8.10 4.30 0.00 2.11 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 0.00 2.26 2.32 0.00 3068 Q 8.18 4.56 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 3069 V 7.30 5.06 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 0.67 0.00 0.00 1.00 0.00 0.00 3070 M 8.86 4.34 0.00 1.97 2.00 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 2.91 2.50 0.00 3071 E 8.59 4.06 0.00 1.93 1.85 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 2.29 2.31 0.00 3072 G 8.94 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 0.00 0.00 0.00 0.00 3073 V 7.63 3.68 2.25 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 1.02 0.00 0.00 1.02 0.00 0.00 3074 P 0.00 4.31 0.00 2.22 2.25 0.00 3.61 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 3075 E 8.00 4.12 0.00 2.24 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 2.33 2.33 0.00 3076 M 7.81 4.35 0.00 1.80 2.31 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.38 0.00 3077 I 7.28 4.65 1.93 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 1.64 1.38 0.99 0.00 0.00 3078 P 0.00 4.62 0.00 2.14 2.33 0.00 3.86 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 3079 D 7.19 4.95 0.00 2.82 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 3080 I 8.48 4.76 1.88 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 1.22 0.78 0.92 0.00 0.00 3081 Q 8.84 5.60 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.69 0.00 0.00 0.00 0.00 0.00 2.24 2.15 0.00 3082 V 8.20 4.57 2.11 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 0.73 0.00 0.00 0.96 0.00 0.00 3083 E 8.97 5.62 0.00 1.88 1.93 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 2.24 2.15 0.00 3084 A 8.33 4.55 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 3085 T 8.28 4.32 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 1.22 0.00 0.00 3086 F 9.23 4.39 0.00 3.25 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 3087 P 0.00 4.31 0.00 2.09 2.15 0.00 3.85 0.00 0.00 3.79 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 3088 D 8.28 4.76 0.00 2.77 2.75 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 3089 G 8.14 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 3090 S 8.16 5.45 0.00 3.81 3.88 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 3091 K 8.84 4.69 0.00 1.02 1.31 0.00 1.49 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 0.79 7.81 3092 L 8.43 4.87 0.00 1.84 1.55 0.94 0.88 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 3093 V 8.74 4.40 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 1.00 0.00 0.00 1.17 0.00 0.00 3094 T 8.61 4.86 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 1.05 0.00 0.00 3095 V 8.76 4.26 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 0.97 0.00 0.00 0.98 0.00 0.00 3096 H 8.89 4.67 0.00 3.10 3.21 0.00 5.90 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 3097 N 8.95 4.14 0.00 2.79 2.79 0.00 0.00 6.55 8.04 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 3098 P 0.00 4.42 0.00 2.19 2.30 0.00 3.81 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 3099 I 7.12 4.79 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 1.33 0.64 0.88 0.00 0.00 3100 I 8.22 4.12 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 1.25 0.65 0.91 0.00 0.00