NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 S 4.4166 8.3349 115.4087 57.4062 64.8747 173.4102 14 L 3.8453 7.7849 122.0085 54.1170 41.9231 175.1233 15 S 4.4944 8.5974 119.6561 56.2540 64.9283 172.8190 16 A 4.0703 8.0661 126.1873 51.7422 18.7537 177.1632 17 Y 4.3390 8.1280 117.1206 58.5369 38.8349 176.3528 18 K 4.3828 9.6313 122.4449 58.2626 34.3783 176.4834 19 T 4.7979 8.0293 119.2223 61.9295 70.6485 173.2784 20 V 4.6058 9.0288 128.2325 61.1424 33.5069 174.4797 21 V 4.9129 8.7578 129.0256 61.0899 33.7399 174.6957 22 V 4.8638 8.6603 126.9998 59.8767 34.4652 174.7137 23 G 4.4387 8.7565 110.3473 45.3223 0.0000 172.6360 24 T 4.8653 8.4302 115.7075 60.6812 70.6763 173.0344 25 D 4.7944 9.2260 124.8138 52.7682 40.1269 176.7910 26 G 3.9507 8.2031 109.7372 45.5791 0.0000 174.1197 27 S 4.4297 8.0707 114.0952 57.7464 63.9434 174.2471 28 D 4.4325 8.6218 119.7227 57.6930 41.0025 178.0015 29 S 4.2453 8.3306 113.2920 61.7526 62.4213 177.7890 30 S 4.0597 7.5835 115.7372 58.9158 62.9148 177.0608 *32 R 4.1961 8.2613 120.2740 56.2960 31.8983 177.8947 33 A 3.9641 7.8502 119.2915 55.1741 18.1369 179.9172 34 V 3.5017 7.9596 116.7018 66.1038 31.5796 177.8488 35 D 4.3238 8.0449 118.1216 57.4896 40.7932 178.4961 36 R 3.8570 8.1535 118.7826 59.5723 30.0178 178.2818 37 A 3.9540 8.3284 120.4746 55.0358 18.2677 179.5244 38 A 3.8727 8.3818 119.6124 55.4699 18.3216 179.4845 39 Q 3.9417 8.2178 117.0874 59.4598 29.0065 178.6318 40 I 3.9974 7.4774 119.6303 64.1331 37.3612 177.8451 41 A 4.1570 8.4161 121.8522 53.1417 18.6019 178.8691 42 G 3.7853 8.8715 106.9526 47.2109 0.0000 176.1020 43 A 4.4854 8.7040 123.9636 52.5075 20.4894 177.0987 44 D 4.8364 8.0984 113.5721 54.0340 41.1059 175.6588 45 A 4.8999 7.4172 118.6195 50.0010 22.7501 176.2324 46 K 4.3864 9.3972 122.0219 55.4464 34.0817 175.3017 47 L 5.0879 8.9579 130.0466 53.6062 44.3865 174.9900 48 I 4.7868 8.6892 129.1133 59.9177 39.1097 175.0860 49 I 4.7397 8.8685 129.5479 60.1583 38.5280 175.0358 50 A 5.8500 9.0688 129.1468 49.7246 22.2403 175.1085 51 S 5.0038 8.1917 113.0434 56.6600 66.2434 172.8816 52 A 4.6047 8.6280 128.8936 51.9663 19.1964 176.0396 53 Y 4.5420 8.8260 125.2642 56.5014 39.5153 175.8355 54 L 4.1239 7.9853 127.5250 53.4659 40.9738 173.7257 55 P 4.1897 0.0000 0.0000 62.6595 32.1998 176.0033 *76 T 4.1034 8.0478 108.4273 61.0770 69.8435 173.8180 77 A 4.1729 8.6626 126.9585 52.1371 18.9452 176.7817 78 P 4.4150 0.0000 0.0000 65.1640 31.3255 178.9611 79 I 3.6697 7.6809 117.5786 64.0974 38.0555 177.1818 80 Y 4.1520 7.8164 117.5480 60.5763 37.5987 177.8501 81 E 4.1075 7.9859 120.8067 58.9801 29.7284 178.8040 82 I 3.7606 7.6806 119.6131 64.3643 37.3089 178.2242 83 L 4.0358 8.1170 119.8892 57.8416 41.3691 179.1553 84 H 4.1959 8.1703 118.1043 59.3515 29.7785 177.1355 85 D 4.3191 8.2452 120.5606 57.2878 40.5840 178.5674 86 A 3.9580 8.1497 121.3369 55.0128 18.3746 179.5500 87 K 3.8299 8.0720 118.1243 59.7668 32.2106 178.9550 88 E 4.0528 8.1143 118.8812 59.2601 29.0016 179.4792 89 R 3.8973 8.2264 118.2701 59.2559 30.1844 178.8499 90 A 3.8492 8.3064 120.8605 55.4521 18.2968 179.5012 91 H 4.5549 7.9139 115.8724 58.6129 28.6585 177.3774 92 N 4.5666 8.3816 113.8227 54.1430 38.1854 175.3118 93 A 4.5664 7.5639 122.7067 51.0578 20.9005 176.7956 94 G 3.6663 7.6283 102.7322 45.2278 0.0000 174.4163 95 A 4.9289 8.2428 124.7928 51.7386 18.8236 177.2209 96 K 4.3552 8.4324 121.9156 58.5469 34.2091 177.6203 97 N 4.7759 7.7256 116.8767 52.4890 36.3597 173.5248 98 V 4.8645 7.4698 119.5730 61.4594 34.0224 175.1912 99 E 4.9057 8.9280 123.9246 55.0013 33.1142 174.1223 100 E 4.9930 8.5957 119.8744 55.6715 32.4663 175.2955 101 R 4.4539 8.3604 118.0183 55.1406 34.0851 172.0799 102 P 4.9375 0.0000 0.0000 62.3596 32.5993 175.5365 103 I 4.3980 9.1049 125.4195 59.9547 38.9837 174.8528 104 V 4.4925 8.3026 126.3084 62.2380 33.9224 177.1325 105 G 3.6994 8.7673 114.8829 45.1077 0.0000 172.5071 106 A 3.9400 8.5784 122.6383 52.0601 19.0507 176.4919 107 P 4.1961 0.0000 0.0000 66.6054 31.1990 178.8060 108 V 3.5202 7.6697 117.2403 65.9729 31.5907 177.4790 109 D 4.4124 8.1629 117.9086 57.3102 40.5886 178.6959 110 A 3.9486 8.0160 121.1577 55.0784 18.3868 179.3544 111 L 3.8443 8.2518 119.3203 58.3984 42.2769 179.3630 112 V 3.5542 8.2596 118.5582 65.9579 31.4568 177.5449 113 N 4.3167 8.3244 117.0546 56.4866 38.8084 176.6915 114 L 3.9252 8.5889 121.9928 58.0518 42.1613 178.7961 115 A 3.9895 8.2088 120.9085 55.3784 18.1079 179.4235 116 D 4.3714 7.8188 115.9509 57.1801 40.9378 178.1261 117 E 4.1956 8.0674 118.8918 57.8183 29.7681 177.3461 118 E 4.5024 8.0105 115.9889 54.5717 30.3126 175.6047 119 K 3.7935 8.2192 116.5481 56.9905 29.9105 175.3644 120 A 4.2843 8.1570 120.7167 52.6296 18.8701 177.8302 121 D 5.0087 8.4032 119.3917 52.5642 40.8926 175.6127 122 L 4.0124 7.4666 119.2386 54.6246 45.1451 173.1830 123 L 5.1996 8.5043 126.3225 53.0783 44.2469 176.0909 124 V 4.5039 8.6861 121.6407 61.4178 34.9647 174.5926 125 V 4.7556 8.2806 119.0328 59.7170 35.8185 174.9379 126 G 3.8918 8.5412 111.8646 44.3676 0.0000 173.5182 127 N 4.5005 8.4697 121.0103 53.6327 39.6993 174.3507 128 V 4.2981 7.2698 120.4372 61.1341 33.6238 172.1941 129 G 3.9244 7.8414 109.0287 45.8807 0.0000 172.2404 130 L 4.7172 8.4067 118.9981 53.1668 43.6185 176.8210 131 S 4.6499 8.4868 115.5056 58.4848 63.3838 174.7778 132 T 4.3622 7.4605 112.3621 60.9770 71.2214 175.2958 133 I 3.6406 8.2166 121.5195 64.6297 37.0252 178.5080 134 A 4.0590 8.0042 120.9095 55.0434 18.1022 179.4089 135 G 3.7144 8.0140 103.2471 48.4207 0.0000 175.7112 136 R 4.1253 8.2466 120.8834 58.5581 29.9396 178.8773 137 L 4.0411 8.2337 119.7435 57.3335 42.1551 177.9435 138 L 4.5557 7.9105 116.8248 54.8925 42.2244 176.9488 139 G 3.9501 7.6355 108.5398 44.7418 0.0000 173.5561 140 S 4.8073 8.1041 113.1437 56.5347 66.4638 175.1018 141 V 3.6055 8.1964 123.0759 65.5595 31.3570 176.5668 142 P 4.2498 0.0000 0.0000 65.8332 31.1454 178.1525 143 A 3.9512 7.7731 120.6019 54.8721 18.2821 179.1176 144 N 4.2310 8.1617 115.5111 56.8732 39.0069 177.2726 145 V 3.6061 8.3297 120.0546 65.8981 31.6180 177.7608 146 S 4.2727 8.1676 114.3797 60.7792 62.0463 176.3290 147 R 3.8593 7.9185 120.9524 59.4717 29.6828 178.5485 148 R 3.8273 8.2034 116.7248 59.0482 30.0912 177.5357 149 A 4.3175 8.1333 117.2185 51.2552 19.8122 176.7088 150 K 3.9050 7.5228 115.3312 56.8504 29.7611 174.4816 151 V 4.5429 7.6813 116.8338 60.1482 35.1305 174.7994 152 D 4.6463 8.3790 120.3647 53.5115 41.9335 176.2674 153 V 4.3446 8.0960 120.3618 60.8762 34.0580 174.4199 154 L 4.6074 8.5890 128.4708 53.1891 43.7518 175.0919 155 I 4.3000 8.3220 126.9547 59.5920 38.3049 175.0368 156 V 4.1933 8.2389 126.1226 61.3846 32.3190 175.3893 157 H 4.4965 8.8368 122.9744 55.6010 29.2886 174.2637 158 T 4.4452 7.9227 110.7770 59.4138 71.1633 174.6400 159 T 4.0293 8.4474 110.3821 62.3729 68.4301 173.7284 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 13 S 8.33 4.42 0.00 3.98 4.03 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 14 L 7.78 3.85 0.00 1.68 1.55 0.86 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.60 4.49 0.00 3.79 3.71 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 16 A 8.07 4.07 1.24 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 0.00 0.00 17 Y 8.13 4.34 0.00 3.00 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 18 K 9.63 4.38 0.00 1.83 1.86 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.57 7.81 19 T 8.03 4.80 4.25 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 1.25 0.00 0.00 20 V 9.03 4.61 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 0.98 0.00 0.00 0.91 0.00 0.00 21 V 8.76 4.91 2.04 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 1.03 0.00 0.00 0.91 0.00 0.00 22 V 8.66 4.86 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 0.74 0.00 0.00 1.01 0.00 0.00 23 G 8.76 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 24 T 8.43 4.87 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 1.23 0.00 0.00 25 D 9.23 4.79 0.00 2.75 2.68 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 26 G 8.20 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 27 S 8.07 4.43 0.00 3.96 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 28 D 8.62 4.43 0.00 2.69 2.77 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 0.00 0.00 0.00 29 S 8.33 4.25 0.00 3.84 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 30 S 7.58 4.06 0.00 4.10 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 *32 R 8.26 4.20 0.00 1.98 2.01 0.00 3.13 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.84 0.00 33 A 7.85 3.96 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 34 V 7.96 3.50 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 1.11 0.00 0.00 1.00 0.00 0.00 35 D 8.04 4.32 0.00 2.90 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 36 R 8.15 3.86 0.00 1.91 2.07 0.00 3.16 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 37 A 8.33 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 38 A 8.38 3.87 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 39 Q 8.22 3.94 0.00 2.10 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 40 I 7.48 4.00 2.02 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.85 1.04 0.00 0.00 41 A 8.42 4.16 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 42 G 8.87 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 0.00 0.00 0.00 43 A 8.70 4.49 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 44 D 8.10 4.84 0.00 2.68 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 45 A 7.42 4.90 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 46 K 9.40 4.39 0.00 1.82 1.69 0.00 1.59 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.38 7.81 47 L 8.96 5.09 0.00 1.75 1.48 0.92 1.15 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 48 I 8.69 4.79 1.86 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 1.23 0.82 0.91 0.00 0.00 49 I 8.87 4.74 1.86 0.00 0.00 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 1.14 0.89 0.90 0.00 0.00 50 A 9.07 5.85 1.19 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 0.00 0.00 0.00 0.00 0.00 51 S 8.19 5.00 0.00 3.84 3.61 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 52 A 8.63 4.60 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 53 Y 8.83 4.54 0.00 2.81 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 54 L 7.99 4.12 0.00 1.58 1.49 0.85 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 4.19 0.00 1.89 1.93 0.00 3.25 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.28 0.00 *76 T 8.05 4.10 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 77 A 8.66 4.17 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 78 P 0.00 4.42 0.00 2.20 2.15 0.00 3.68 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 2.15 2.19 0.00 79 I 7.68 3.67 1.88 0.00 0.00 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 1.44 1.29 0.32 0.00 0.00 80 Y 7.82 4.15 0.00 3.30 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 81 E 7.99 4.11 0.00 2.05 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 0.00 2.49 2.38 0.00 82 I 7.68 3.76 2.03 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 1.65 0.70 0.91 0.00 0.00 83 L 8.12 4.04 0.00 1.77 1.90 0.85 0.88 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 84 H 8.17 4.20 0.00 3.43 3.56 0.00 5.78 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 85 D 8.25 4.32 0.00 2.77 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 86 A 8.15 3.96 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 87 K 8.07 3.83 0.00 2.08 1.95 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.45 7.81 88 E 8.11 4.05 0.00 2.18 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 2.26 2.34 0.00 89 R 8.23 3.90 0.00 2.01 1.97 0.00 3.30 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.79 0.00 90 A 8.31 3.85 1.31 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 0.00 0.00 91 H 7.91 4.55 0.00 3.40 3.34 0.00 5.63 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 92 N 8.38 4.57 0.00 2.67 2.86 0.00 0.00 6.87 6.91 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 93 A 7.56 4.57 1.33 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 94 G 7.63 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 0.00 0.00 0.00 95 A 8.24 4.93 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 96 K 8.43 4.36 0.00 1.76 1.86 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.39 7.81 97 N 7.73 4.78 0.00 2.90 2.78 0.00 0.00 6.50 7.68 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 98 V 7.47 4.86 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 0.79 0.00 0.00 0.85 0.00 0.00 99 E 8.93 4.91 0.00 2.06 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 2.19 2.26 0.00 100 E 8.60 4.99 0.00 2.03 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 0.00 2.27 2.39 0.00 101 R 8.36 4.45 0.00 1.89 1.77 0.00 3.09 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 102 P 0.00 4.94 0.00 1.89 1.74 0.00 3.74 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 1.99 0.00 103 I 9.10 4.40 2.00 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 1.11 1.04 0.92 0.00 0.00 104 V 8.30 4.49 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 0.84 0.00 0.00 1.00 0.00 0.00 105 G 8.77 3.70 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 0.00 0.00 0.00 106 A 8.58 3.94 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 0.00 107 P 0.00 4.20 0.00 2.27 2.33 0.00 3.70 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 2.07 2.02 0.00 108 V 7.67 3.52 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 1.03 0.00 0.00 0.92 0.00 0.00 109 D 8.16 4.41 0.00 2.76 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 0.00 110 A 8.02 3.95 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 0.00 111 L 8.25 3.84 0.00 1.90 1.86 0.90 0.75 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 0.00 112 V 8.26 3.55 2.22 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 0.93 0.00 0.00 0.92 0.00 0.00 113 N 8.32 4.32 0.00 2.94 2.93 0.00 0.00 6.84 6.65 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 0.00 114 L 8.59 3.93 0.00 1.75 1.81 0.92 1.18 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 0.00 115 A 8.21 3.99 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 0.00 116 D 7.82 4.37 0.00 2.83 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 0.00 117 E 8.07 4.20 0.00 2.19 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 2.31 2.39 0.00 118 E 8.01 4.50 0.00 2.10 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 2.25 2.46 0.00 119 K 8.22 3.79 0.00 1.87 1.88 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.36 7.81 120 A 8.16 4.28 1.20 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 0.00 0.00 0.00 121 D 8.40 5.01 0.00 2.87 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 0.00 122 L 7.47 4.01 0.00 0.52 1.04 0.48 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 123 L 8.50 5.20 0.00 1.49 1.50 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 124 V 8.69 4.50 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 1.08 0.00 0.00 0.84 0.00 0.00 125 V 8.28 4.76 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 0.72 0.00 0.00 0.91 0.00 0.00 126 G 8.54 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 0.00 127 N 8.47 4.50 0.00 2.67 2.72 0.00 0.00 6.87 7.71 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 0.00 128 V 7.27 4.30 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 0.67 0.00 0.00 0.92 0.00 0.00 129 G 7.84 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 0.00 130 L 8.41 4.72 0.00 1.62 1.57 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.49 4.65 0.00 3.96 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 0.00 132 T 7.46 4.36 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 0.00 133 I 8.22 3.64 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 1.57 0.64 0.91 0.00 0.00 134 A 8.00 4.06 1.31 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 0.00 0.00 135 G 8.01 3.71 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 0.00 0.00 0.00 136 R 8.25 4.13 0.00 1.91 1.98 0.00 3.29 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.77 0.00 137 L 8.23 4.04 0.00 1.67 1.75 0.92 0.88 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 0.00 138 L 7.91 4.56 0.00 1.69 1.67 0.92 1.13 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 0.00 139 G 7.64 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 0.00 140 S 8.10 4.81 0.00 4.04 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 0.00 141 V 8.20 3.61 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 0.97 0.00 0.00 0.93 0.00 0.00 142 P 0.00 4.25 0.00 2.30 2.29 0.00 3.65 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 2.07 2.04 0.00 143 A 7.77 3.95 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 0.00 144 N 8.16 4.23 0.00 2.99 2.92 0.00 0.00 6.90 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 0.00 145 V 8.33 3.61 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 0.94 0.00 0.00 0.97 0.00 0.00 146 S 8.17 4.27 0.00 3.98 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 0.00 147 R 7.92 3.86 0.00 1.95 2.03 0.00 3.15 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 148 R 8.20 3.83 0.00 1.80 1.98 0.00 3.20 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 149 A 8.13 4.32 1.31 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 0.00 0.00 150 K 7.52 3.91 0.00 1.81 1.83 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.35 7.81 151 V 7.68 4.54 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 0.80 0.00 0.00 0.93 0.00 0.00 152 D 8.38 4.65 0.00 2.69 2.63 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 0.00 0.00 0.00 0.00 153 V 8.10 4.34 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 0.81 0.00 0.00 0.93 0.00 0.00 154 L 8.59 4.61 0.00 1.61 1.54 0.96 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.32 4.30 1.88 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 1.31 0.75 0.93 0.00 0.00 156 V 8.24 4.19 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 0.85 0.00 0.00 0.99 0.00 0.00 157 H 8.84 4.50 0.00 3.34 3.31 0.00 5.55 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 T 7.92 4.45 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 0.00 159 T 8.45 4.03 4.25 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 1.20 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.