NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 P 4.3538 0.0000 0.0000 61.5215 33.1835 175.0487 9 S 4.3839 7.3660 112.0732 56.8753 65.0033 172.5171 10 D 4.5069 9.2294 123.0481 54.5270 45.6069 177.6111 11 M 4.3793 7.8177 118.5701 52.8307 33.5108 174.2475 12 P 4.6792 0.0000 0.0000 62.7579 32.8340 175.8323 13 V 4.8946 8.4424 119.4259 61.2302 35.0525 172.0409 14 A 4.8283 8.8040 123.1701 51.1649 23.0906 175.6969 15 H 4.9662 8.7196 120.0871 55.5163 31.0522 172.9677 16 V 4.5434 8.1435 116.5958 60.9092 33.8806 175.8170 17 V 5.3755 8.8688 114.0539 59.4516 36.4540 175.0616 18 A 4.5360 8.6777 123.8043 51.7831 19.4274 176.5119 19 N 4.5831 8.1008 116.7799 51.4620 40.3057 172.2468 20 P 3.2906 0.0000 0.0000 65.5543 31.6790 178.2090 21 Q 4.0266 7.8050 114.9273 57.5987 29.0523 176.6290 22 A 4.0754 7.8675 121.7209 52.0275 18.3734 174.9381 23 E 4.4962 7.4897 123.9946 58.0246 29.1983 177.6916 24 G 4.9517 7.6818 122.4820 46.3586 0.0000 170.0165 25 Q 4.5288 7.5463 117.0972 53.2208 32.1553 175.3327 26 L 4.1706 8.0939 120.8473 53.8881 41.2028 174.2150 27 Q 4.5696 7.9179 126.9952 53.8140 31.3176 174.0027 28 W 5.2277 9.4614 127.1210 56.2274 30.3103 175.7374 29 L 5.0966 9.5434 123.7956 53.1800 45.0369 176.9742 30 N 4.7440 8.7305 115.0509 54.2978 39.5477 175.8518 31 R 4.3492 7.8132 117.9410 55.9672 27.5911 175.3307 32 R 4.5944 7.8228 118.4733 54.0477 33.9266 174.8180 33 A 3.7897 8.0306 120.5080 56.0070 18.8068 177.5648 34 N 4.8198 7.8368 112.8236 53.2768 39.7522 175.0842 35 A 5.0485 7.5700 118.3447 50.2658 22.3373 176.3012 36 L 4.7577 8.6333 117.6434 52.5602 46.6996 175.7346 37 L 5.7565 8.0092 125.6111 55.4024 43.1612 171.9574 38 A 4.4604 8.4917 126.4842 51.4389 22.8439 175.3457 39 N 4.4067 9.7641 111.5999 54.8378 35.7090 174.7592 40 G 4.1152 8.3899 107.4449 45.6283 0.0000 174.5218 41 V 4.4231 7.3083 118.6459 62.5131 32.1163 175.2213 42 E 4.7915 8.7211 125.4279 54.5080 34.4505 174.3020 43 L 5.0980 8.5310 123.3271 53.7305 43.4128 175.7439 44 R 4.6008 8.6137 125.7800 55.4828 33.2659 175.7884 45 D 4.6448 9.3425 121.5558 55.7509 38.2220 172.8216 46 N 4.4168 8.5453 111.5627 54.5273 37.6693 173.0413 47 Q 4.9127 7.7957 112.4048 54.0783 34.0972 174.4458 48 L 4.7816 9.0804 121.9501 54.0240 43.9517 176.0032 49 V 4.8015 8.3859 122.1641 61.0361 34.1803 175.2955 50 V 3.5962 8.1591 121.2218 61.1349 32.0295 174.4354 51 P 4.4725 0.0000 0.0000 62.8381 32.0307 178.0103 52 S 4.6988 7.6236 115.4969 56.7635 66.0999 172.7130 53 E 4.5000 8.7932 120.9747 55.1695 30.3709 176.4054 54 G 4.0676 7.9847 111.0410 46.6743 0.0000 170.4259 55 L 5.2425 7.8235 119.2382 54.0636 43.5913 175.9005 56 Y 5.2024 9.6491 120.1673 56.1723 42.7375 173.8860 57 L 5.2373 9.0523 124.3687 53.6747 44.3877 175.0631 58 I 5.0084 9.3799 127.5679 59.6937 40.1685 174.3208 59 Y 5.3140 8.1957 123.9521 55.8067 42.1958 173.6974 60 S 4.9207 8.1657 111.5767 58.1031 66.8028 174.8245 61 Q 4.9822 8.0998 125.3123 54.7515 32.9686 173.9094 62 V 4.6815 8.4648 116.1876 59.6000 36.8660 173.5792 63 L 4.9252 8.1816 125.0508 53.2862 44.8866 174.8862 64 F 5.3974 8.8408 124.3544 56.0325 41.9200 174.6447 65 S 4.1463 9.0660 116.3529 56.4836 65.4893 173.2949 66 G 2.9735 6.6546 111.6589 44.3671 0.0000 171.8082 67 Q 4.8216 8.4853 121.3022 53.2808 27.4187 173.8666 68 G 4.2247 8.5116 110.4304 45.5210 0.0000 171.6865 69 C 4.6414 8.5986 120.3578 55.8037 41.1184 172.0504 70 P 4.4178 0.0000 0.0000 65.0920 30.5528 176.9323 71 S 4.5373 6.8546 110.3243 57.1113 67.1386 173.4822 72 T 4.3516 7.2717 125.1864 61.6567 69.8559 173.1714 73 H 4.6094 7.7474 119.0333 55.5513 27.5999 175.3787 74 V 4.3232 7.0880 117.6245 60.7996 34.5489 174.1674 75 L 4.8005 8.2079 125.6761 52.9690 45.0516 175.5690 76 L 4.5357 9.0435 124.6152 53.2348 43.8754 175.7763 77 T 5.1728 8.9093 112.6437 60.3238 72.7468 172.1938 78 H 5.6266 9.0761 122.8678 55.0193 33.3677 172.1897 79 T 5.0882 8.9720 120.5660 62.0939 73.6221 173.1771 80 I 5.2358 9.0729 125.5821 59.0078 39.6136 175.0420 81 S 5.1752 8.3744 123.0801 57.1581 65.6834 173.2281 82 R 4.6690 8.7572 121.9222 54.7160 33.3718 174.9387 83 I 5.0084 8.3861 124.6022 60.0305 40.7756 174.8158 84 T 4.8179 8.4087 123.5825 61.3036 69.4744 173.1115 85 P 4.2377 0.0000 0.0000 65.9391 30.8662 177.3813 86 A 3.8763 7.2207 120.2079 54.5484 18.7035 177.1400 87 I 3.7290 7.5253 127.0462 61.1762 37.1112 176.4036 88 N 4.6965 8.3023 126.8998 51.8224 37.2585 173.5157 89 R 4.7199 7.4187 117.7302 53.4996 34.8435 173.4389 90 P 4.5530 0.0000 0.0000 62.7032 32.2707 175.7592 91 V 4.2517 8.7244 124.7811 60.8421 34.0237 174.2840 92 N 4.6153 8.9119 125.5246 54.2406 37.2135 174.9750 93 L 4.2170 8.8069 124.2804 56.8868 42.5331 177.6746 94 L 4.8794 7.5941 117.7014 53.0467 45.6057 175.3835 95 S 5.1738 8.7117 116.9713 56.9984 65.9500 172.5829 96 A 4.8584 8.8218 125.9415 50.8679 22.8359 175.0912 97 I 5.1798 8.2340 118.9345 59.9168 41.5214 175.1586 98 R 4.7057 8.9473 122.3289 54.9252 34.9947 174.5630 99 S 4.4799 8.4095 117.1841 55.7180 63.3196 172.0481 100 P 4.1189 0.0000 0.0000 65.3977 31.3523 178.5934 101 C 4.3197 6.9979 114.2236 57.7433 40.8459 172.6625 102 Q 4.3019 8.0822 115.3212 57.1082 35.8644 175.2670 *111 A 4.0483 7.6746 118.3943 52.9904 19.4725 174.5695 112 N 4.1689 8.5535 118.8486 53.2124 34.9460 172.1631 113 P 4.8581 0.0000 0.0000 62.0301 33.3779 175.4439 114 W 5.4173 8.4372 117.2048 55.5644 31.7354 173.4535 115 Y 5.0620 9.1462 120.6191 56.4247 40.5246 174.9789 116 E 4.8566 9.5003 125.2868 54.0159 31.9411 174.0737 117 P 5.1101 0.0000 0.0000 62.2595 33.6084 175.5964 118 I 4.8052 8.6241 120.6362 60.1193 41.6187 173.5371 119 Y 5.2025 8.8789 127.3107 55.7148 41.7897 174.3924 120 L 4.8835 8.4145 125.7460 52.9361 45.3460 175.8015 121 G 4.6734 8.5624 109.4732 44.7160 0.0000 171.8477 122 G 4.3841 8.4854 108.9508 45.9278 0.0000 171.9126 123 V 5.1663 8.3514 120.5892 61.1422 33.2621 174.9344 124 F 4.9223 9.6691 125.6311 55.7272 43.8680 173.6151 125 Q 4.7757 8.9230 123.1232 55.7156 29.5413 174.7622 126 L 4.8541 9.6215 127.3677 53.0402 45.1281 175.4070 127 E 5.0462 9.4496 122.2924 53.6408 31.9194 174.0434 128 P 4.5209 0.0000 0.0000 64.0135 31.3955 176.5684 129 G 3.9884 8.4103 110.7277 44.8899 0.0000 173.4779 130 D 4.5706 7.8431 119.6396 54.4362 42.5290 175.6361 131 R 4.8416 8.8020 119.5597 54.6225 33.3628 174.6156 132 L 5.3525 9.0237 124.7789 53.2066 44.7986 175.8093 133 S 4.9769 8.5587 115.2507 57.0153 67.1900 172.6676 134 A 4.7609 8.1532 121.5649 50.2986 20.9289 175.2062 135 E 4.9836 9.1756 121.7161 54.7278 33.7685 175.2958 136 I 5.8444 8.3248 113.6097 58.2463 40.1524 175.1764 137 N 4.4511 8.5811 122.7495 55.0886 38.2169 175.6385 138 R 4.6613 7.8240 118.8390 53.4077 30.0751 173.9931 139 P 4.5790 0.0000 0.0000 63.4775 31.5157 177.7486 140 D 4.4453 7.8625 118.7790 54.9583 40.3260 176.6304 141 Y 4.4277 7.9699 116.3803 57.5160 38.4388 175.2180 142 L 4.1449 7.6583 122.3715 55.3100 42.8515 176.4028 143 D 4.4182 7.8059 123.3140 52.3737 41.2902 175.5257 144 F 4.6384 6.6520 122.1378 55.7598 37.5874 176.9574 145 A 4.1211 7.5022 125.0610 54.5658 19.0414 178.0019 146 E 4.7370 7.6733 112.1294 53.8589 32.3229 176.1524 147 S 4.1753 8.3389 116.5299 60.1929 63.2762 175.5045 148 G 4.1234 8.9863 111.2342 45.8385 0.0000 174.5820 149 Q 4.2702 7.8290 118.1356 58.0811 29.4050 176.6310 150 V 4.7328 7.8708 117.7264 61.4357 34.8888 173.9748 151 Y 5.7452 8.6349 124.9774 56.5484 42.5540 173.4651 152 F 5.0745 8.8710 120.7004 57.2548 43.0497 173.1386 153 G 3.8901 8.3955 112.3800 44.9183 0.0000 171.0515 154 I 5.5783 8.2112 112.3124 59.8210 41.5279 173.6393 155 I 4.9766 8.2218 121.2511 59.7188 41.6531 173.0374 156 A 3.9434 8.1854 130.5277 50.7616 19.4290 177.4193 157 L 4.2076 8.0602 122.2262 54.9199 41.5066 176.8764 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 8 P 0.00 4.35 0.00 2.05 2.14 0.00 3.68 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 1.92 2.07 0.00 9 S 7.37 4.38 0.00 3.98 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 10 D 9.23 4.51 0.00 2.73 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 11 M 7.82 4.38 0.00 2.03 1.97 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 2.52 2.46 0.00 12 P 0.00 4.68 0.00 2.17 2.12 0.00 3.80 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 2.16 2.07 0.00 13 V 8.44 4.89 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 0.57 0.00 0.00 1.01 0.00 0.00 14 A 8.80 4.83 1.03 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 0.00 0.00 15 H 8.72 4.97 0.00 3.31 3.26 0.00 5.78 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.14 4.54 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 0.60 0.00 0.00 0.80 0.00 0.00 17 V 8.87 5.38 2.29 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 0.83 0.00 0.00 1.05 0.00 0.00 18 A 8.68 4.54 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 19 N 8.10 4.58 0.00 2.69 2.51 0.00 0.00 6.95 7.69 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 20 P 0.00 3.29 0.00 1.90 1.93 0.00 3.55 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 1.93 1.94 0.00 21 Q 7.81 4.03 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.23 0.00 0.00 0.00 0.00 0.00 2.37 2.25 0.00 22 A 7.87 4.08 1.26 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 0.00 0.00 0.00 23 E 7.49 4.50 0.00 2.00 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 2.46 2.52 0.00 24 G 7.68 4.95 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 25 Q 7.55 4.53 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.89 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 26 L 8.09 4.17 0.00 1.41 1.28 0.66 -0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 7.92 4.57 0.00 2.06 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 28 W 9.46 5.23 0.00 3.30 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 29 L 9.54 5.10 0.00 1.58 1.56 0.90 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.73 4.74 0.00 2.79 2.90 0.00 0.00 6.09 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 31 R 7.81 4.35 0.00 1.84 1.96 0.00 3.38 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 32 R 7.82 4.59 0.00 1.94 1.79 0.00 3.36 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 33 A 8.03 3.79 1.26 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 0.00 0.00 0.00 34 N 7.84 4.82 0.00 2.73 2.83 0.00 0.00 6.62 7.35 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 35 A 7.57 5.05 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 36 L 8.63 4.76 0.00 1.59 1.54 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.01 5.76 0.00 1.64 1.58 0.91 0.93 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 38 A 8.49 4.46 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 39 N 9.76 4.41 0.00 2.98 2.88 0.00 0.00 7.05 7.86 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 40 G 8.39 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 0.00 0.00 0.00 41 V 7.31 4.42 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 1.00 0.00 0.00 42 E 8.72 4.79 0.00 1.90 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 0.00 2.28 2.27 0.00 43 L 8.53 5.10 0.00 1.63 1.60 1.09 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.61 4.60 0.00 1.87 1.77 0.00 3.33 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 45 D 9.34 4.64 0.00 2.85 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 46 N 8.55 4.42 0.00 2.87 2.95 0.00 0.00 7.00 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 47 Q 7.80 4.91 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.47 6.67 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 48 L 9.08 4.78 0.00 1.43 1.39 -0.25 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.39 4.80 2.06 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 1.00 0.00 0.00 0.92 0.00 0.00 50 V 8.16 3.60 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 0.15 0.00 0.00 0.85 0.00 0.00 51 P 0.00 4.47 0.00 2.24 1.97 0.00 3.77 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.20 0.00 52 S 7.62 4.70 0.00 3.91 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 53 E 8.79 4.50 0.00 2.04 1.92 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 2.33 2.55 0.00 54 G 7.98 4.07 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 0.00 0.00 0.00 55 L 7.82 5.24 0.00 1.62 1.63 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 9.65 5.20 0.00 2.87 2.84 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 57 L 9.05 5.24 0.00 1.84 1.65 1.14 1.01 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 58 I 9.38 5.01 1.91 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 1.25 0.63 0.88 0.00 0.00 59 Y 8.20 5.31 0.00 2.98 3.14 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 0.00 0.00 0.00 60 S 8.17 4.92 0.00 4.08 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 61 Q 8.10 4.98 0.00 1.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.51 0.00 0.00 0.00 0.00 0.00 2.16 2.53 0.00 62 V 8.46 4.68 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 0.35 0.00 0.00 0.49 0.00 0.00 63 L 8.18 4.93 0.00 1.84 1.44 1.08 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.84 5.40 0.00 3.41 3.16 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 65 S 9.07 4.15 0.00 3.11 3.32 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 66 G 6.65 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 0.00 0.00 0.00 67 Q 8.49 4.82 0.00 1.92 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.50 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 68 G 8.51 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 0.00 0.00 0.00 0.00 69 C 8.60 4.64 0.00 2.97 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 70 P 0.00 4.42 0.00 2.08 2.17 0.00 3.64 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 2.15 2.23 0.00 71 S 6.85 4.54 0.00 4.01 3.79 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 72 T 7.27 4.35 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 1.03 0.00 0.00 73 H 7.75 4.61 0.00 3.16 3.24 0.00 5.84 0.00 0.00 0.00 0.00 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 7.09 4.32 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 0.40 0.00 0.00 0.84 0.00 0.00 75 L 8.21 4.80 0.00 1.41 1.41 0.86 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 76 L 9.04 4.54 0.00 1.25 0.76 -0.38 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 77 T 8.91 5.17 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 1.18 0.00 0.00 78 H 9.08 5.63 0.00 3.35 3.19 0.00 5.56 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.97 5.09 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 1.25 0.00 0.00 80 I 9.07 5.24 1.74 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 0.97 0.14 0.85 0.00 0.00 81 S 8.37 5.18 0.00 3.72 3.72 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 82 R 8.76 4.67 0.00 1.69 1.66 0.00 2.99 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.45 0.00 83 I 8.39 5.01 1.93 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 0.46 0.90 0.00 0.00 84 T 8.41 4.82 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 1.22 0.00 0.00 85 P 0.00 4.24 0.00 2.02 2.13 0.00 3.67 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.25 0.00 86 A 7.22 3.88 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 87 I 7.53 3.73 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 1.30 0.45 0.91 0.00 0.00 88 N 8.30 4.70 0.00 2.66 2.74 0.00 0.00 7.01 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 89 R 7.42 4.72 0.00 1.67 1.76 0.00 3.26 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 90 P 0.00 4.55 0.00 1.92 1.97 0.00 3.61 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 91 V 8.72 4.25 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 1.05 0.00 0.00 1.02 0.00 0.00 92 N 8.91 4.62 0.00 2.63 2.80 0.00 0.00 7.20 7.85 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 93 L 8.81 4.22 0.00 1.38 0.88 0.41 0.91 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 94 L 7.59 4.88 0.00 1.48 1.52 0.94 1.01 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 95 S 8.71 5.17 0.00 3.81 3.67 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 96 A 8.82 4.86 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 97 I 8.23 5.18 1.86 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 1.34 0.72 0.92 0.00 0.00 98 R 8.95 4.71 0.00 1.63 1.69 0.00 3.23 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.81 0.00 99 S 8.41 4.48 0.00 3.66 3.72 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 0.00 100 P 0.00 4.12 0.00 0.78 0.89 0.00 3.34 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.53 0.00 101 C 7.00 4.32 0.00 2.72 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 0.00 102 Q 8.08 4.30 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.56 0.00 0.00 0.00 0.00 0.00 2.19 2.26 0.00 *111 A 7.67 4.05 1.29 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 0.00 0.00 112 N 8.55 4.17 0.00 3.09 2.96 0.00 0.00 7.02 8.03 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 0.00 113 P 0.00 4.86 0.00 2.11 2.04 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 114 W 8.44 5.42 0.00 3.36 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 0.00 115 Y 9.15 5.06 0.00 2.88 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 0.00 116 E 9.50 4.86 0.00 2.19 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 2.45 2.31 0.00 117 P 0.00 5.11 0.00 2.17 2.14 0.00 3.87 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 2.06 2.09 0.00 118 I 8.62 4.81 1.99 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.95 1.06 0.00 0.00 119 Y 8.88 5.20 0.00 3.00 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 0.00 120 L 8.41 4.88 0.00 1.44 1.42 0.97 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.56 4.67 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 0.00 0.00 0.00 122 G 8.49 4.38 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 0.00 123 V 8.35 5.17 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 0.95 0.00 0.00 0.98 0.00 0.00 124 F 9.67 4.92 0.00 2.95 2.91 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 0.00 125 Q 8.92 4.78 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 126 L 9.62 4.85 0.00 1.24 1.26 0.37 0.72 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 0.00 127 E 9.45 5.05 0.00 1.94 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 2.26 2.39 0.00 128 P 0.00 4.52 0.00 2.13 2.17 0.00 3.34 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 129 G 8.41 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 0.00 0.00 0.00 130 D 7.84 4.57 0.00 2.57 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 0.00 131 R 8.80 4.84 0.00 1.85 1.79 0.00 3.08 0.00 0.00 3.32 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 132 L 9.02 5.35 0.00 1.52 1.60 0.72 0.41 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 0.00 133 S 8.56 4.98 0.00 3.81 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 0.00 134 A 8.15 4.76 0.40 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 0.00 135 E 9.18 4.98 0.00 1.89 1.82 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 2.22 2.20 0.00 136 I 8.32 5.84 2.17 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 1.04 0.31 0.99 0.00 0.00 137 N 8.58 4.45 0.00 2.79 3.00 0.00 0.00 6.74 7.54 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 0.00 138 R 7.82 4.66 0.00 1.93 2.29 0.00 3.34 0.00 0.00 3.42 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 139 P 0.00 4.58 0.00 2.32 2.15 0.00 3.83 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 1.98 1.95 0.00 140 D 7.86 4.45 0.00 2.51 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 0.00 141 Y 7.97 4.43 0.00 3.46 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 0.00 142 L 7.66 4.14 0.00 1.55 1.04 0.81 0.59 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 0.00 143 D 7.81 4.42 0.00 2.44 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 0.00 0.00 0.00 0.00 144 F 6.65 4.64 0.00 3.04 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 0.00 145 A 7.50 4.12 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 0.00 146 E 7.67 4.74 0.00 2.05 1.90 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 2.36 2.28 0.00 147 S 8.34 4.18 0.00 3.90 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 0.00 148 G 8.99 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 0.00 0.00 0.00 149 Q 7.83 4.27 0.00 2.36 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.57 0.00 0.00 0.00 0.00 0.00 2.49 2.39 0.00 150 V 7.87 4.73 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 1.12 0.00 0.00 0.93 0.00 0.00 151 Y 8.63 5.75 0.00 3.20 3.17 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 0.00 0.00 0.00 0.00 152 F 8.87 5.07 0.00 1.74 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 0.00 153 G 8.40 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 0.00 0.00 0.00 154 I 8.21 5.58 1.94 0.00 0.00 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 0.89 0.66 0.54 0.00 0.00 155 I 8.22 4.98 1.96 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 1.29 1.31 1.01 0.00 0.00 156 A 8.19 3.94 0.78 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 0.00 0.00 157 L 8.06 4.21 0.00 1.50 1.54 0.94 0.70 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 * Residues marked with a * may have inaccurate shift predictions.