NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4093 8.3349 115.4125 57.8604 64.3374 172.8322 2 L 4.2582 8.2505 122.0808 52.4264 42.3034 176.4998 3 S 4.5728 9.6753 120.9087 57.3827 66.8072 174.6493 4 D 4.3229 8.4716 120.7110 57.2358 40.4309 178.8997 5 K 3.9285 7.9714 119.7093 59.5501 32.2119 178.4360 6 D 4.4760 7.8694 120.0404 56.8951 40.7498 178.8209 7 K 3.8486 8.2544 118.8339 59.5036 31.9527 179.2823 8 A 3.9406 8.1831 120.6979 54.9871 18.2335 179.5295 9 A 3.9071 8.0398 119.3416 55.3287 18.3870 180.1266 10 V 3.4296 7.9681 116.9375 66.0964 31.5659 178.5030 11 R 3.8988 8.1362 117.7724 59.0676 29.7334 178.9686 12 A 3.9511 8.3242 120.9395 55.0181 18.3444 179.4203 13 L 3.8442 8.0932 119.0500 58.1635 42.1353 179.0509 14 W 4.0647 8.5578 128.6304 60.3366 30.3291 177.7877 15 S 3.9763 7.8338 112.6394 61.1338 61.8314 176.1189 16 K 3.9829 7.4056 120.3588 58.9223 32.2382 178.7365 17 I 3.4497 7.4355 111.8898 61.2618 37.9252 177.6688 18 G 2.2835 7.2863 108.9068 47.3274 0.0000 175.5890 19 K 3.9722 7.6670 119.3327 59.1104 32.5305 178.2086 20 S 4.7468 7.7822 115.7248 58.2524 63.2625 175.8231 21 S 4.2025 7.8161 120.9587 61.9300 62.4513 176.1336 22 D 4.3613 8.1488 121.5108 57.1885 40.6278 178.5696 23 A 4.0438 7.9622 120.6477 55.1105 18.3644 179.5558 24 I 3.7997 8.2156 118.7898 64.4537 37.2162 178.9174 25 G 3.6385 8.5684 106.9890 47.7192 0.0000 175.2091 26 N 4.3049 8.2312 119.7487 56.4611 39.0006 176.4096 27 D 4.3094 8.3190 119.2234 57.1841 41.2685 177.9414 28 A 4.0137 8.3450 121.5518 55.4279 18.5024 179.7134 29 L 4.0178 8.0392 117.3834 57.9948 41.5061 179.9903 30 S 4.1921 8.2961 115.2590 61.5918 62.7357 176.9957 31 R 3.9793 8.2814 120.9150 59.2634 29.7444 178.5073 32 M 4.2718 8.3349 118.4286 58.9987 32.1576 178.4622 33 I 3.8332 7.9882 112.7142 63.4024 37.4845 178.3087 34 V 3.6298 7.3292 119.7709 65.9345 31.6821 177.9387 35 V 3.6500 8.1422 116.9187 64.5166 32.8912 175.6093 36 Y 4.7568 8.1856 116.1807 54.4115 38.0064 174.1003 37 P 4.7215 0.0000 0.0000 64.9784 31.3666 178.4495 38 Q 4.1025 8.2222 117.2884 59.1784 28.4849 178.0855 39 T 4.1906 8.3178 111.4188 63.9351 68.7648 176.4250 40 K 4.3139 8.2487 122.0757 59.0152 31.8478 178.8651 41 I 3.5624 7.4573 113.9280 63.9363 37.0512 177.2437 42 Y 4.0595 7.2605 115.9987 58.8526 37.9091 175.9585 43 F 4.0786 7.6144 119.3671 56.6740 39.7373 177.1330 44 S 4.2570 7.5402 117.1038 60.5821 62.7060 174.6112 45 H 4.5479 7.8525 115.3645 56.2890 28.9592 175.1528 46 W 5.0249 7.6414 120.4037 54.7409 30.5927 174.4800 47 P 4.4519 0.0000 0.0000 65.8012 30.8619 176.1490 48 D 4.5416 7.6141 113.6922 52.7375 41.5095 175.0654 49 V 4.5058 8.3777 119.3727 61.2662 32.0778 174.3031 50 T 4.7547 8.0241 116.4582 58.4894 71.5581 172.0845 51 P 4.1907 0.0000 0.0000 64.0917 31.8127 176.4937 52 G 3.9383 8.7820 109.6313 46.3879 0.0000 174.5876 53 S 4.3825 7.4662 114.8375 56.9871 65.2099 173.1577 54 P 4.1388 0.0000 0.0000 65.9454 30.9276 178.7618 55 N 3.8540 7.6774 114.5521 56.1917 38.2606 177.4028 56 I 3.7866 7.3600 120.7052 64.1963 37.1856 178.7053 57 K 3.9502 8.3285 119.4201 59.3382 31.9197 179.2249 58 A 3.9760 8.0214 121.0021 55.5872 18.3301 179.2467 59 H 4.4000 8.6853 117.0731 59.2562 29.8865 177.6838 60 G 3.6795 8.4518 108.1244 47.7501 0.0000 175.8824 61 K 4.0860 8.1298 120.7368 58.9666 32.0057 179.6647 62 K 3.9752 7.8582 118.4134 59.4418 32.0507 179.4975 63 V 3.5600 7.8372 118.3553 66.4867 31.4538 178.0800 64 M 4.3056 8.4012 118.2771 58.0438 31.6870 179.0379 65 G 3.7292 8.2564 106.6107 47.5740 0.0000 176.1507 66 G 3.5858 8.0460 108.1250 47.5883 0.0000 176.0011 67 I 3.5896 7.8206 121.9519 64.0073 37.2122 178.3046 68 A 3.3085 8.0508 121.9205 54.8282 18.1170 179.4511 69 L 3.8543 8.0595 118.6470 58.1702 41.9479 178.9652 70 A 3.9466 7.7563 119.7706 55.2217 18.3196 179.4395 71 V 3.4808 7.8691 116.8293 66.2747 31.3032 178.5350 72 S 4.1955 7.8021 113.5209 60.5967 62.8266 175.7399 73 K 4.5332 7.9977 120.0316 56.3038 32.3574 178.1894 74 I 3.7988 7.3164 122.0312 64.3504 37.7761 176.5449 75 D 4.5304 8.0376 118.2019 56.7943 41.2241 176.3430 76 D 4.7314 8.1603 118.5637 51.6271 42.3454 175.0865 77 L 3.9276 8.1770 124.1041 56.9005 41.7438 178.2448 78 K 3.8135 7.9420 118.2252 60.0673 32.3517 178.5063 79 T 4.1327 8.1294 115.6157 66.5672 68.1787 177.1046 80 G 3.7279 8.1927 106.7630 46.8947 0.0000 174.7100 81 L 4.6653 7.8605 119.6620 54.5117 42.2911 178.2454 82 M 4.0187 7.6972 120.8733 58.8897 31.8926 178.3245 83 E 3.9802 8.1831 117.6191 59.6646 29.6443 179.3950 84 L 4.0585 7.9164 118.3105 57.7355 41.6025 179.4426 85 S 4.3763 8.2965 114.7374 60.8915 62.4371 175.6510 86 E 4.1479 8.4974 122.2451 59.5365 29.3320 178.6725 87 Q 4.0268 8.3383 117.9116 59.6700 28.9271 178.8737 88 H 4.2008 8.7511 116.7914 58.2719 28.4739 177.9672 89 A 2.5800 8.0816 122.5692 54.5136 18.4429 178.3531 90 Y 4.3019 7.7030 112.6981 58.8393 39.1434 177.2615 91 K 4.1938 7.8986 119.4225 58.5225 33.0285 177.3801 92 L 4.1209 7.9401 117.0971 55.6302 42.2148 177.4303 93 R 3.5118 7.5875 115.0708 56.9669 27.7115 177.1170 94 V 3.2220 7.5976 117.2249 61.7355 32.1349 174.8126 95 D 4.3973 8.8854 127.9138 54.0568 41.6070 175.4025 96 P 3.6507 0.0000 0.0000 65.3137 31.0504 178.5685 97 S 4.0954 8.1943 113.3004 61.6091 62.5577 176.3939 98 N 4.2546 8.0731 119.8011 55.7867 38.1166 177.4016 99 F 4.4359 7.5124 119.6682 60.3416 39.0306 177.5412 100 K 3.9546 7.9883 118.9350 59.3571 32.0593 178.8169 101 I 3.3424 7.2664 120.1433 64.2447 36.9364 178.1358 102 L 3.9745 8.0518 121.2680 58.2624 41.9066 178.6701 103 N 4.3300 8.4216 116.5718 56.5445 38.4812 176.8244 104 H 4.2314 8.1846 119.3093 59.6176 29.9967 177.1440 105 C 4.2044 8.1721 118.5026 62.8030 27.8648 176.2519 106 I 3.7387 8.0484 121.8068 64.3476 36.7321 178.4253 107 L 3.7474 7.9563 119.8511 57.6065 41.4323 179.7597 108 V 3.5314 7.7422 118.1304 65.8887 31.4286 178.1729 109 V 3.5272 7.8043 117.8684 66.2599 31.4316 177.9865 110 I 3.7532 7.7185 119.4756 64.4757 36.5966 178.4265 111 S 4.2662 7.6189 113.4444 61.4343 62.2916 176.0062 112 T 4.0182 7.6454 111.8748 64.9345 68.6711 176.1625 113 M 3.9337 7.9854 120.4699 56.1670 33.6087 176.7216 114 F 4.9829 8.4755 116.8184 55.0394 39.7096 173.6620 115 P 4.3804 0.0000 0.0000 65.9687 31.7553 178.8159 116 K 4.2042 8.1771 117.0999 59.2074 32.2250 178.1758 117 E 4.1526 8.2886 117.0110 59.0529 30.0656 177.5644 118 F 4.6803 8.2924 122.8098 57.3159 37.7601 174.7313 119 T 4.2617 7.3313 116.2256 60.1143 71.6900 173.7307 120 P 4.0803 0.0000 0.0000 65.6171 31.0658 178.8903 121 E 3.9107 8.0283 116.8563 59.3165 29.3915 179.0596 122 A 4.0110 7.7875 120.4016 55.0930 18.2990 179.1874 123 H 3.8155 7.9795 117.3460 59.2707 29.9508 177.7919 124 V 3.5880 7.9777 121.3083 65.0871 30.9652 178.4771 125 S 4.2607 7.8820 115.7961 61.1908 62.7076 176.4907 126 L 4.1385 8.3589 123.2875 57.9546 41.8265 178.5549 127 D 4.4066 8.5760 118.4618 57.3717 41.2474 178.3319 128 K 3.9988 8.2519 119.0365 59.3114 31.9318 179.0784 129 F 4.1714 8.5459 121.0126 61.5057 39.3230 177.2531 130 L 3.6165 8.4973 118.8850 57.7345 41.2937 179.8219 131 S 4.1447 8.2402 115.4215 61.4038 62.7216 176.8784 132 G 3.4657 8.0128 108.5505 47.5978 0.0000 175.9812 133 V 3.2203 7.5030 120.5749 65.5697 31.6263 177.9617 134 A 3.3845 7.8817 120.7859 54.9398 17.9431 179.4133 135 L 3.8066 7.7249 117.7391 58.1012 42.3538 178.7419 136 A 4.0468 7.9876 120.8936 55.0233 17.8015 179.6248 137 L 3.8877 7.9038 117.4359 57.3021 41.5699 178.7054 138 A 3.5738 7.5412 118.8665 52.4025 18.3145 178.5182 139 E 3.8967 7.4563 118.1029 59.2387 29.7190 177.9133 140 R 4.5516 8.0290 114.1822 56.5237 30.5229 177.2743 141 Y 3.8859 8.3898 117.9583 60.5165 38.0312 176.3418 142 R 4.1968 7.7419 118.7958 56.5077 29.3737 174.4843 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 S 8.33 4.41 0.00 3.99 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 2 L 8.25 4.26 0.00 1.78 1.69 1.11 0.67 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 3 S 9.68 4.57 0.00 4.06 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 4 D 8.47 4.32 0.00 2.71 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 5 K 7.97 3.93 0.00 1.81 1.80 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.53 7.81 6 D 7.87 4.48 0.00 3.00 2.73 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 7 K 8.25 3.85 0.00 1.93 1.85 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.47 1.62 7.81 8 A 8.18 3.94 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 9 A 8.04 3.91 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 10 V 7.97 3.43 1.77 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 0.18 0.00 0.00 0.82 0.00 0.00 11 R 8.14 3.90 0.00 2.05 1.96 0.00 3.16 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 12 A 8.32 3.95 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 13 L 8.09 3.84 0.00 1.88 1.85 0.95 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 14 W 8.56 4.06 0.00 3.38 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 15 S 7.83 3.98 0.00 3.98 4.08 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 0.00 0.00 0.00 0.00 16 K 7.41 3.98 0.00 1.64 1.66 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.53 7.81 17 I 7.44 3.45 0.90 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 0.49 -0.29 0.00 0.00 18 G 7.29 2.28 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 0.00 19 K 7.67 3.97 0.00 1.86 1.86 0.00 1.59 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.29 1.52 7.81 20 S 7.78 4.75 0.00 4.15 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 21 S 7.82 4.20 0.00 4.32 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 0.00 22 D 8.15 4.36 0.00 2.72 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 23 A 7.96 4.04 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 24 I 8.22 3.80 2.13 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.99 1.02 0.00 0.00 25 G 8.57 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 26 N 8.23 4.30 0.00 2.83 2.98 0.00 0.00 6.89 7.78 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 27 D 8.32 4.31 0.00 2.93 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 28 A 8.34 4.01 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 29 L 8.04 4.02 0.00 1.84 1.75 1.08 0.95 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 30 S 8.30 4.19 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 31 R 8.28 3.98 0.00 2.11 2.06 0.00 3.17 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 32 M 8.33 4.27 0.00 2.32 2.16 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.69 0.00 33 I 7.99 3.83 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.84 0.96 0.00 0.00 34 V 7.33 3.63 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 0.82 0.00 0.00 0.99 0.00 0.00 35 V 8.14 3.65 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 0.25 0.00 0.00 0.91 0.00 0.00 36 Y 8.19 4.76 0.00 3.22 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 37 P 0.00 4.72 0.00 2.28 2.36 0.00 3.95 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.91 0.00 38 Q 8.22 4.10 0.00 2.28 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.96 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 39 T 8.32 4.19 4.47 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 1.43 0.00 0.00 40 K 8.25 4.31 0.00 2.05 1.96 0.00 1.89 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.53 1.54 7.81 41 I 7.46 3.56 1.58 0.00 0.00 -0.43 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 0.48 0.82 0.00 0.00 42 Y 7.26 4.06 0.00 2.41 2.31 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 43 F 7.61 4.08 0.00 2.53 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 44 S 7.54 4.26 0.00 3.88 3.96 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 0.00 0.00 0.00 45 H 7.85 4.55 0.00 3.38 3.44 0.00 5.51 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 W 7.64 5.02 0.00 3.47 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 47 P 0.00 4.45 0.00 2.08 2.17 0.00 3.80 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 2.05 2.14 0.00 48 D 7.61 4.54 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 49 V 8.38 4.51 2.16 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 0.88 0.00 0.00 1.02 0.00 0.00 50 T 8.02 4.75 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 1.28 0.00 0.00 51 P 0.00 4.19 0.00 2.07 2.05 0.00 3.84 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 52 G 8.78 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 53 S 7.47 4.38 0.00 3.98 4.04 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 54 P 0.00 4.14 0.00 2.05 2.07 0.00 3.51 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 55 N 7.68 3.85 0.00 1.93 1.42 0.00 0.00 7.15 7.26 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 56 I 7.36 3.79 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.20 0.93 0.00 0.00 57 K 8.33 3.95 0.00 1.91 1.85 0.00 1.64 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.46 1.59 7.81 58 A 8.02 3.98 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 59 H 8.69 4.40 0.00 3.68 3.51 0.00 5.79 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 60 G 8.45 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 61 K 8.13 4.09 0.00 2.05 1.91 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.68 1.75 7.81 62 K 7.86 3.98 0.00 1.98 1.89 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.72 7.81 63 V 7.84 3.56 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 1.06 0.00 0.00 0.93 0.00 0.00 64 M 8.40 4.31 0.00 2.30 2.28 0.00 0.00 0.00 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.03 2.93 0.00 65 G 8.26 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 0.00 0.00 0.00 66 G 8.05 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 0.00 0.00 0.00 67 I 7.82 3.59 1.84 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.86 0.57 0.00 0.00 68 A 8.05 3.31 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 69 L 8.06 3.85 0.00 1.84 1.85 0.91 0.89 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 70 A 7.76 3.95 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 71 V 7.87 3.48 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 0.84 0.00 0.00 0.18 0.00 0.00 72 S 7.80 4.20 0.00 4.03 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 73 K 8.00 4.53 0.00 1.79 1.78 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.55 7.81 74 I 7.32 3.80 2.12 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 1.60 1.00 0.94 0.00 0.00 75 D 8.04 4.53 0.00 2.71 2.72 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 0.00 0.00 0.00 0.00 76 D 8.16 4.73 0.00 2.62 2.47 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 77 L 8.18 3.93 0.00 1.65 1.58 0.77 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.94 3.81 0.00 1.71 1.97 0.00 1.87 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.53 7.81 79 T 8.13 4.13 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 1.21 0.00 0.00 80 G 8.19 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 0.00 0.00 0.00 81 L 7.86 4.67 0.00 1.59 1.56 0.73 1.01 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 82 M 7.70 4.02 0.00 2.04 2.14 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 2.84 2.62 0.00 83 E 8.18 3.98 0.00 2.02 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 0.00 2.42 2.42 0.00 84 L 7.92 4.06 0.00 1.87 1.70 0.95 0.76 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 85 S 8.30 4.38 0.00 4.10 4.08 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 0.00 0.00 0.00 0.00 86 E 8.50 4.15 0.00 2.18 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 0.00 2.32 2.47 0.00 87 Q 8.34 4.03 0.00 2.45 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.59 0.00 88 H 8.75 4.20 0.00 3.50 3.75 0.00 5.80 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 89 A 8.08 2.58 0.83 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 0.00 0.00 90 Y 7.70 4.30 0.00 2.90 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 91 K 7.90 4.19 0.00 1.73 2.12 0.00 1.77 0.00 0.00 2.04 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.44 7.81 92 L 7.94 4.12 0.00 1.56 1.56 0.65 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 93 R 7.59 3.51 0.00 1.95 1.95 0.00 3.19 0.00 0.00 3.11 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.63 0.00 94 V 7.60 3.22 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 -0.08 0.00 0.00 0.45 0.00 0.00 95 D 8.89 4.40 0.00 2.78 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 96 P 0.00 3.65 0.00 2.06 1.97 0.00 3.59 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.55 0.00 97 S 8.19 4.10 0.00 4.01 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 98 N 8.07 4.25 0.00 2.44 2.75 0.00 0.00 6.94 7.67 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 99 F 7.51 4.44 0.00 3.12 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 0.00 100 K 7.99 3.95 0.00 1.81 1.94 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.53 7.81 101 I 7.27 3.34 1.80 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.34 -0.10 0.00 0.00 102 L 8.05 3.97 0.00 1.79 1.73 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.42 4.33 0.00 2.94 2.88 0.00 0.00 6.66 7.93 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 0.00 104 H 8.18 4.23 0.00 3.30 3.52 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 C 8.17 4.20 0.00 3.24 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 0.00 106 I 8.05 3.74 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.82 0.96 0.00 0.00 107 L 7.96 3.75 0.00 1.88 1.78 1.15 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.74 3.53 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 0.99 0.00 0.00 0.85 0.00 0.00 109 V 7.80 3.53 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 1.11 0.00 0.00 0.99 0.00 0.00 110 I 7.72 3.75 1.27 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.45 0.65 0.00 0.00 111 S 7.62 4.27 0.00 4.03 4.05 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 0.00 112 T 7.65 4.02 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 1.23 0.00 0.00 113 M 7.99 3.93 0.00 1.17 1.87 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.37 0.00 114 F 8.48 4.98 0.00 3.09 3.15 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 0.00 115 P 0.00 4.38 0.00 2.22 2.24 0.00 3.83 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 2.02 2.01 0.00 116 K 8.18 4.20 0.00 1.84 1.96 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.50 7.81 117 E 8.29 4.15 0.00 2.07 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 2.30 2.39 0.00 118 F 8.29 4.68 0.00 3.08 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 0.00 119 T 7.33 4.26 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 1.25 0.00 0.00 120 P 0.00 4.08 0.00 2.12 2.08 0.00 3.55 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 121 E 8.03 3.91 0.00 2.01 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 2.40 0.00 122 A 7.79 4.01 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 0.00 123 H 7.98 3.82 0.00 2.42 3.10 0.00 5.62 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.98 3.59 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 0.82 0.00 0.00 0.92 0.00 0.00 125 S 7.88 4.26 0.00 3.87 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 0.00 126 L 8.36 4.14 0.00 2.04 1.96 1.07 1.60 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 0.00 127 D 8.58 4.41 0.00 3.13 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 0.00 128 K 8.25 4.00 0.00 2.07 1.88 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.70 7.81 129 F 8.55 4.17 0.00 3.13 3.22 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 0.00 130 L 8.50 3.62 0.00 1.70 1.81 1.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.24 4.14 0.00 4.02 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 0.00 132 G 8.01 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 0.00 0.00 0.00 133 V 7.50 3.22 1.77 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 0.71 0.00 0.00 -0.04 0.00 0.00 134 A 7.88 3.38 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 0.00 135 L 7.72 3.81 0.00 1.64 1.75 0.86 0.89 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 0.00 136 A 7.99 4.05 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 0.00 137 L 7.90 3.89 0.00 1.10 1.29 -0.02 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.54 3.57 1.11 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 0.00 0.00 139 E 7.46 3.90 0.00 1.97 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 2.35 2.47 0.00 140 R 8.03 4.55 0.00 1.99 2.25 0.00 3.50 0.00 0.00 3.30 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.87 0.00 141 Y 8.39 3.89 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 0.00 142 R 7.74 4.20 0.00 1.88 1.86 0.00 3.08 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00