NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 E 4.2966 8.2876 121.4659 56.4103 31.4345 178.3141 23 D 4.5450 7.9019 117.3033 52.5318 39.0863 174.2146 24 E 4.1809 9.5855 123.4085 59.9095 31.0198 179.7216 25 V 2.6716 7.2302 109.4076 63.1083 31.8317 176.6380 26 N 4.6897 7.9279 115.4420 53.1101 38.8789 174.3079 27 S 4.8173 7.5442 114.5684 56.4550 63.9645 174.4648 28 C 4.5007 8.8001 124.0816 59.5342 40.1139 174.2218 29 D 4.4752 8.0049 118.0443 54.6125 41.1340 176.1922 30 Y 4.4677 8.0864 122.4831 57.2899 39.2200 176.9481 31 W 4.3038 8.8201 123.9143 59.6828 28.1223 177.6473 32 R 3.0760 5.8400 116.1604 58.1083 29.3325 176.3064 33 H 5.1292 7.7928 115.5154 56.0105 29.2116 174.5549 34 C 4.5556 8.3780 116.2289 57.0687 42.6785 173.5468 35 A 5.1547 7.7430 121.6046 50.3657 19.1400 176.0292 36 V 3.3913 7.3261 119.6247 63.4577 33.2482 174.4609 37 D 4.7882 9.5091 126.7770 54.3136 42.6810 175.3523 38 G 3.6167 7.4162 114.9629 45.4567 0.0000 168.6878 39 F 5.1769 8.0968 118.7631 55.4653 40.8809 175.1320 40 L 4.5799 8.4832 125.9219 54.7805 41.7934 177.7077 41 C 4.3139 9.0365 122.6290 59.8207 40.3337 176.2084 42 S 4.3708 8.0008 112.2155 59.9977 62.6410 175.3096 43 C 4.7107 8.0884 117.0933 57.1897 40.5017 173.3123 44 C 4.7018 8.4790 116.9555 56.7585 40.0675 174.6721 45 G 3.9623 8.7831 107.3698 45.1120 0.0000 174.1601 46 G 4.3528 7.7105 109.6156 44.3654 0.0000 170.6394 47 T 5.0756 8.0652 109.8893 60.0942 72.2104 174.4188 48 T 4.1473 8.4614 109.9815 64.2293 68.9104 175.4423 49 T 4.6203 7.7855 110.4089 60.9193 69.7742 173.4800 50 T 4.6528 7.6579 110.3470 60.4964 71.7625 172.7854 51 C 4.7895 8.6216 122.1566 55.8420 40.0648 171.9385 52 P 4.6436 0.0000 0.0000 61.6563 31.6397 174.2456 53 P 4.3245 0.0000 0.0000 64.7288 31.4636 177.1774 54 G 3.9359 9.0303 111.0002 45.0976 0.0000 172.9189 55 S 4.8887 7.6347 114.0059 56.9937 65.3632 173.6912 56 T 4.6169 8.9168 119.2648 61.2929 70.3549 172.6357 57 P 4.8505 0.0000 0.0000 62.6529 32.1833 176.0254 58 S 4.8313 8.6237 118.5103 56.9224 63.9444 172.8614 59 P 4.3955 0.0000 0.0000 64.1663 31.7237 175.4355 60 I 4.5261 7.0729 111.2806 58.9336 41.3590 175.8038 61 S 3.8711 6.7263 119.4961 58.3987 66.0087 179.1408 *63 I 4.0138 8.6774 118.9895 60.9863 37.6178 173.8494 64 G 4.4070 9.1133 113.9781 44.9496 0.0000 172.7340 65 T 5.0946 8.6037 117.9299 62.0219 70.1659 173.9709 66 C 5.1805 9.1850 124.3717 55.2255 43.4871 172.7677 67 H 5.2074 8.9451 122.6337 55.5821 30.7097 173.7863 68 N 3.5138 8.9646 126.0526 51.4819 39.1759 174.0197 69 P 4.2764 0.0000 0.0000 64.9925 32.0243 177.2729 70 H 4.3662 8.4747 117.1522 57.8054 28.7684 175.7523 71 D 4.7000 7.8337 114.6390 52.1082 40.2523 176.2584 72 G 3.7817 8.0613 107.6400 46.3995 0.0000 173.4553 73 K 4.6477 8.2349 118.4476 54.2778 35.5204 175.0271 74 D 5.3853 8.3611 122.0322 53.8055 42.7308 175.1750 75 Y 5.1142 9.3991 120.0855 56.1244 42.4428 174.4749 76 L 4.9022 9.2300 122.6071 54.0801 43.4678 175.7127 77 I 4.5528 8.6798 125.2722 59.3600 40.0565 174.4942 78 S 4.4086 9.0182 123.1089 57.1310 63.5407 173.0036 79 Y 5.4615 7.9383 126.8304 56.6752 36.2278 174.7045 80 H 4.5741 8.2562 119.8543 55.6076 30.9805 174.1894 81 D 5.4778 9.1467 121.2437 53.2779 44.2664 174.3850 82 C 5.4664 9.0323 117.4346 55.7140 41.3049 172.8727 83 C 5.4040 9.9385 120.8185 55.5216 44.4329 174.9614 84 G 3.9478 9.7774 107.5373 45.3956 0.0000 173.6037 85 K 4.6209 7.2411 117.1198 54.2411 36.1396 176.1838 86 T 4.0240 8.3665 111.0495 60.9293 69.4301 173.7984 87 A 3.8491 8.5232 124.0988 52.7716 18.6310 178.3589 88 C 3.9802 8.1868 124.0971 58.3347 43.6951 175.1878 89 G 3.1513 5.5720 104.4773 45.0697 0.0000 172.9388 90 R 4.5274 7.1392 117.5948 55.5279 33.1596 176.4951 91 C 4.3330 8.7160 116.3359 58.2272 37.6197 172.8534 92 Q 4.6630 7.8925 119.3604 56.3306 29.8922 176.6460 93 C 5.0395 9.5575 123.4547 55.2342 44.5155 173.0830 94 N 5.1862 8.3204 118.6809 52.5790 38.3491 172.8761 95 T 4.6162 8.9233 119.2339 61.2168 72.0346 175.2193 96 Q 4.7623 8.2215 122.4644 55.7444 31.1068 175.1836 97 T 3.9343 8.0411 116.8632 65.1363 68.5047 174.5484 98 R 3.9020 8.8101 123.6573 56.6238 27.9435 175.8914 99 E 4.4341 7.9773 119.2321 56.3558 30.3487 175.9763 100 R 4.7763 8.5093 122.9206 53.4538 35.3009 172.8092 101 P 4.3837 0.0000 0.0000 62.0342 32.1904 177.9444 102 G 3.7322 8.2990 109.5418 48.6530 0.0000 174.1385 103 Y 4.3938 7.2995 115.5650 58.1099 38.9524 175.2953 104 E 4.7942 7.9011 119.8533 56.4848 30.4287 176.3474 105 F 4.2914 8.0553 125.6815 61.8506 40.2776 176.8399 106 F 4.5738 8.0431 115.0125 58.4608 38.8620 175.7487 107 L 4.6578 8.3853 120.5393 54.5399 42.6395 175.1783 108 H 5.5924 8.4424 119.3887 54.3086 30.6678 174.2526 109 N 4.9593 8.9737 122.9698 52.9603 37.3448 174.3044 110 D 4.6047 7.2695 116.2913 54.4167 40.9826 176.2828 111 V 4.1171 6.7111 111.2689 59.0086 35.2273 175.0781 112 N 4.2081 7.9829 120.4384 52.7529 38.2885 175.2988 113 W 4.6918 8.1605 123.6965 57.8147 28.9443 176.5961 114 C 4.8508 8.6102 116.5754 56.8189 40.3244 175.2400 115 M 3.7306 7.8451 117.8700 57.8680 30.4754 177.1696 116 A 4.6568 7.9664 118.6942 51.6950 19.7018 176.1881 117 N 4.7142 8.2205 115.0970 52.7877 39.4452 174.8829 118 E 4.0414 8.9311 120.9677 58.8131 29.6227 176.9779 119 N 4.9522 7.8781 115.5692 51.7445 41.2427 173.6366 120 S 4.6807 8.7955 119.0550 59.0561 63.8931 174.1538 121 T 4.0516 8.0233 119.8275 63.9921 69.1271 173.1763 122 F 4.6210 9.0189 129.7110 58.7212 39.9247 173.2952 123 H 4.6425 8.5272 125.8937 57.1338 31.2162 171.7979 124 C 4.8861 7.1038 109.9166 54.8408 45.7842 171.5820 125 T 5.4058 9.6157 117.0853 62.1054 71.1248 174.1034 126 T 4.8759 9.1522 115.5147 60.3359 72.3705 173.5763 127 S 4.4986 8.5518 117.7573 56.6440 64.4597 172.6881 128 V 4.0080 8.4824 124.8051 61.1968 33.0182 174.4155 129 L 4.1946 8.3902 130.6157 55.4812 42.0370 176.1434 130 V 3.8412 9.0168 127.6257 63.6376 32.2812 176.2823 131 G 4.0115 7.3794 105.3915 45.7144 0.0000 171.0991 132 L 3.8790 8.1523 118.9818 54.5583 42.1077 176.8929 133 A 4.5612 8.6386 125.6184 50.6138 21.2075 177.5909 134 K 3.9847 8.4317 116.6828 57.3327 32.8669 175.0872 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 22 E 8.29 4.30 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 2.24 2.27 0.00 23 D 7.90 4.54 0.00 2.88 2.74 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 24 E 9.59 4.18 0.00 1.87 1.78 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 2.30 2.44 0.00 25 V 7.23 2.67 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 0.19 0.00 0.00 0.84 0.00 0.00 26 N 7.93 4.69 0.00 2.68 2.83 0.00 0.00 6.76 7.57 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 27 S 7.54 4.82 0.00 3.98 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 28 C 8.80 4.50 0.00 3.04 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 29 D 8.00 4.48 0.00 2.77 2.79 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 30 Y 8.09 4.47 0.00 3.18 2.81 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 31 W 8.82 4.30 0.00 3.65 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 32 R 5.84 3.08 0.00 0.75 1.42 0.00 2.87 0.00 0.00 2.74 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 33 H 7.79 5.13 0.00 3.35 3.29 0.00 5.62 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 C 8.38 4.56 0.00 3.07 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 7.74 5.15 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 36 V 7.33 3.39 1.95 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 0.88 0.00 0.00 0.81 0.00 0.00 37 D 9.51 4.79 0.00 2.48 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 38 G 7.42 3.62 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 0.00 0.00 0.00 39 F 8.10 5.18 0.00 3.14 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 40 L 8.48 4.58 0.00 1.76 1.59 0.99 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 41 C 9.04 4.31 0.00 3.14 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 42 S 8.00 4.37 0.00 3.99 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 43 C 8.09 4.71 0.00 3.09 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 44 C 8.48 4.70 0.00 2.96 2.96 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 G 8.78 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 0.00 0.00 0.00 46 G 7.71 4.35 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 0.00 47 T 8.07 5.08 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 48 T 8.46 4.15 4.30 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 1.27 0.00 0.00 49 T 7.79 4.62 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 1.19 0.00 0.00 50 T 7.66 4.65 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 1.20 0.00 0.00 51 C 8.62 4.79 0.00 2.99 3.06 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 52 P 0.00 4.64 0.00 2.21 2.19 0.00 3.66 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 53 P 0.00 4.32 0.00 2.01 2.01 0.00 3.69 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 54 G 9.03 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 55 S 7.63 4.89 0.00 3.85 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 56 T 8.92 4.62 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 1.23 0.00 0.00 57 P 0.00 4.85 0.00 1.92 1.96 0.00 3.67 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 58 S 8.62 4.83 0.00 4.13 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 59 P 0.00 4.40 0.00 2.23 2.25 0.00 3.80 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 2.06 2.01 0.00 60 I 7.07 4.53 1.84 0.00 0.00 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 1.65 1.17 0.99 0.00 0.00 61 S 6.73 3.87 0.00 3.71 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 *63 I 8.68 4.01 1.84 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.67 0.85 0.00 0.00 64 G 9.11 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.60 5.09 4.30 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 1.26 0.00 0.00 66 C 9.18 5.18 0.00 3.12 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 67 H 8.95 5.21 0.00 3.18 3.28 0.00 5.91 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 68 N 8.96 3.51 0.00 1.64 2.52 0.00 0.00 6.54 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 69 P 0.00 4.28 0.00 2.04 2.06 0.00 2.84 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.83 0.00 70 H 8.47 4.37 0.00 3.03 3.29 0.00 5.80 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 D 7.83 4.70 0.00 2.70 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 72 G 8.06 3.78 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 0.00 73 K 8.23 4.65 0.00 1.79 1.42 0.00 1.80 0.00 0.00 1.52 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.52 7.81 74 D 8.36 5.39 0.00 2.66 2.61 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 0.00 0.00 0.00 0.00 75 Y 9.40 5.11 0.00 3.20 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 76 L 9.23 4.90 0.00 1.55 1.56 0.90 0.75 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 77 I 8.68 4.55 1.37 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.72 0.27 0.00 0.00 78 S 9.02 4.41 0.00 3.66 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.94 5.46 0.00 2.88 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 80 H 8.26 4.57 0.00 3.10 3.23 0.00 5.59 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 9.15 5.48 0.00 2.85 2.90 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 0.00 0.00 0.00 82 C 9.03 5.47 0.00 2.84 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 83 C 9.94 5.40 0.00 2.78 3.24 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 84 G 9.78 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 85 K 7.24 4.62 0.00 1.35 1.45 0.00 1.55 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.24 1.29 7.81 86 T 8.37 4.02 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 1.22 0.00 0.00 87 A 8.52 3.85 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 88 C 8.19 3.98 0.00 2.44 2.79 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 89 G 5.57 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 0.00 0.00 0.00 90 R 7.14 4.53 0.00 1.73 1.83 0.00 3.29 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 91 C 8.72 4.33 0.00 3.15 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 92 Q 7.89 4.66 0.00 2.30 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.72 6.76 0.00 0.00 0.00 0.00 0.00 2.19 1.92 0.00 93 C 9.56 5.04 0.00 2.75 2.86 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 94 N 8.32 5.19 0.00 2.56 2.60 0.00 0.00 6.93 7.70 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 95 T 8.92 4.62 4.35 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 1.23 0.00 0.00 96 Q 8.22 4.76 0.00 1.90 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.06 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 97 T 8.04 3.93 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 98 R 8.81 3.90 0.00 2.01 2.08 0.00 3.40 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 99 E 7.98 4.43 0.00 1.99 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 2.61 2.52 0.00 100 R 8.51 4.78 0.00 1.71 1.70 0.00 3.36 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 101 P 0.00 4.38 0.00 0.88 1.74 0.00 3.12 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 1.99 1.98 0.00 102 G 8.30 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 0.00 103 Y 7.30 4.39 0.00 3.03 3.08 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 0.00 104 E 7.90 4.79 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 2.37 2.23 0.00 105 F 8.06 4.29 0.00 2.88 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 0.00 106 F 8.04 4.57 0.00 3.08 2.79 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 0.00 107 L 8.39 4.66 0.00 1.83 1.70 1.01 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 108 H 8.44 5.59 0.00 3.30 3.40 0.00 5.57 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 N 8.97 4.96 0.00 2.73 2.81 0.00 0.00 6.98 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 0.00 110 D 7.27 4.60 0.00 2.47 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 6.71 4.12 1.51 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 0.65 0.00 0.00 -0.19 0.00 0.00 112 N 7.98 4.21 0.00 2.63 2.58 0.00 0.00 6.96 7.95 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 0.00 113 W 8.16 4.69 0.00 3.59 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 0.00 114 C 8.61 4.85 0.00 3.41 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 0.00 115 M 7.85 3.73 0.00 2.22 2.27 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.72 0.00 116 A 7.97 4.66 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 8.22 4.71 0.00 3.01 2.90 0.00 0.00 6.81 7.20 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 0.00 118 E 8.93 4.04 0.00 1.92 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 2.32 2.40 0.00 119 N 7.88 4.95 0.00 2.68 2.66 0.00 0.00 6.99 7.63 0.00 0.00 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 S 8.80 4.68 0.00 4.07 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 0.00 121 T 8.02 4.05 4.33 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 1.31 0.00 0.00 122 F 9.02 4.62 0.00 3.22 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 0.00 123 H 8.53 4.64 0.00 3.31 3.27 0.00 5.86 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 C 7.10 4.89 0.00 3.17 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 0.00 125 T 9.62 5.41 4.37 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 1.43 0.00 0.00 126 T 9.15 4.88 4.52 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 1.26 0.00 0.00 127 S 8.55 4.50 0.00 3.81 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 0.00 128 V 8.48 4.01 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 0.87 0.00 0.00 0.94 0.00 0.00 129 L 8.39 4.19 0.00 1.58 1.53 1.01 1.00 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 0.00 130 V 9.02 3.84 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 0.75 0.00 0.00 0.84 0.00 0.00 131 G 7.38 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 0.00 0.00 0.00 132 L 8.15 3.88 0.00 1.51 1.38 0.80 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 133 A 8.64 4.56 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 0.00 134 K 8.43 3.98 0.00 1.83 1.78 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.14 1.05 7.81 * Residues marked with a * may have inaccurate shift predictions.