NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 P 4.5192 0.0000 0.0000 62.0138 33.2271 175.3495 9 L 4.4134 8.5901 125.9117 53.4406 42.2891 175.3601 10 L 4.2304 8.9512 127.5343 55.1530 43.0994 175.5542 11 E 4.7926 9.3121 126.9106 54.6875 32.6063 174.2836 12 L 4.7596 8.7807 126.2515 53.0403 44.2266 175.9706 13 D 4.5707 8.7274 123.5711 53.1809 40.3761 176.0850 14 V 4.2292 7.8750 124.6407 60.9599 32.7408 174.9746 15 Q 4.2510 8.7193 130.5391 58.8261 29.3527 175.9250 16 E 4.7471 7.7313 114.7068 55.0630 33.1296 173.9071 17 W 5.0979 8.6599 121.4860 55.2489 30.0446 176.6832 18 V 3.8185 8.6157 124.4881 65.4552 31.0637 176.5878 19 N 5.0414 8.1917 112.6452 52.4797 37.7265 172.9064 20 H 4.6764 7.9842 118.8029 55.6268 32.7788 173.2657 21 E 4.2218 8.2006 119.5433 55.1223 30.2934 178.0749 22 G 3.0008 8.1944 106.9374 46.1967 0.0000 173.4113 23 L 4.2422 7.0648 121.8380 52.7223 42.5240 177.5883 24 S 4.5328 8.2150 119.3268 57.6400 65.4703 174.6881 25 N 4.4114 8.6345 119.1584 56.4188 37.9592 177.5105 26 E 4.0281 8.2354 121.5412 59.9660 29.6498 179.2148 27 D 4.5126 7.8379 120.3006 58.4880 39.9071 180.5477 28 L 4.3740 7.9852 123.2376 57.0816 41.7123 178.8018 29 R 3.9398 7.6494 117.2969 57.6011 29.7222 179.4043 30 G 4.0400 8.9206 110.3915 44.5499 0.0000 173.1304 31 K 4.7359 7.5646 117.9925 54.1355 36.3278 175.6884 32 V 4.2977 8.0783 122.8699 62.5919 33.1879 174.9306 33 V 4.8290 8.5563 126.3545 61.0190 34.7954 174.1385 34 V 4.7232 8.7139 127.3685 61.0847 34.1738 174.0601 35 V 4.7312 8.8017 128.6643 61.1995 33.8271 173.7883 36 E 4.8010 9.6815 130.8372 54.8940 31.2454 174.6687 37 V 5.0214 9.2352 129.1748 61.4260 33.2546 174.5655 38 F 5.3416 9.1607 124.8475 56.0735 41.6942 174.1037 39 Q 4.6575 8.5070 119.5234 54.8708 32.0067 178.0838 *41 L 4.2331 8.4206 120.6662 56.1807 43.4993 175.4841 42 C 4.6114 7.6408 120.2802 57.2894 32.8696 172.7107 43 P 4.4111 0.0000 0.0000 65.6580 31.0373 178.9013 44 G 3.6669 8.1037 104.0552 47.9762 0.0000 175.3255 45 C 4.1731 8.0553 118.7002 62.5623 28.0469 176.2798 46 V 3.6207 7.6361 118.3794 66.2433 31.2693 177.5990 47 N 4.6163 8.6662 115.2818 56.0628 38.6917 174.6918 48 H 4.7154 8.0619 117.7510 56.8334 32.8064 175.2568 49 G 3.6159 8.4081 105.8005 47.7970 0.0000 175.7429 50 V 3.6004 8.3908 121.2025 65.2425 31.5042 176.3818 51 P 4.4683 0.0000 0.0000 65.5609 31.2807 178.3422 52 Q 3.8899 7.9900 117.8025 59.0957 28.9512 178.1743 53 A 3.9206 7.8800 121.3503 55.2353 18.3201 179.6446 54 Q 4.2395 8.3159 116.6479 58.9328 28.5367 178.8564 55 K 3.9385 8.0056 120.0063 59.5972 32.3256 178.5996 56 I 3.8370 7.4480 118.7329 64.6097 37.0817 177.5824 57 H 4.3917 7.9996 117.9615 59.2552 29.7568 177.5849 58 R 3.9910 7.7810 114.9069 56.2122 29.8338 176.2798 *60 I 3.8895 7.2071 118.9745 60.8220 38.4808 175.2448 61 D 4.4696 8.3418 123.9408 53.8929 40.4774 176.6696 62 E 4.4591 9.0080 124.8540 58.6077 29.8749 178.9824 63 S 4.1768 8.4091 112.6035 60.3642 63.3177 174.2774 64 Q 4.4926 7.6093 118.2967 56.9401 30.6747 175.3523 65 V 4.5801 8.0602 118.2648 60.9764 34.7658 173.3336 66 Q 4.7603 8.9722 129.3176 54.4705 30.8301 174.1133 67 V 4.4439 8.3539 126.7300 61.7851 33.0299 174.9423 68 I 4.8981 8.8613 128.2678 59.5538 40.9218 174.3958 69 G 4.7165 9.4238 114.4640 44.8402 0.0000 172.1745 70 L 5.1636 9.4643 127.1356 53.3982 45.1260 174.5674 71 H 4.2710 9.0503 127.8073 55.5063 30.9419 174.0713 72 S 4.7950 8.2660 122.4853 56.4841 63.8530 172.3294 73 V 3.6640 7.9152 122.6547 61.6890 31.5486 175.6521 74 F 5.1581 8.3797 121.0939 55.7998 39.0351 174.7805 75 E 4.5197 6.7247 117.6743 55.5716 32.2762 173.6499 76 H 4.0974 8.5754 112.7474 57.1555 26.4228 177.3568 77 H 4.0985 8.5595 117.3960 58.9514 28.8831 177.2926 78 D 4.4498 8.0427 117.3205 56.1470 39.3907 178.1432 79 V 3.6169 7.2624 116.2988 63.5257 30.7936 175.7968 *81 T 4.1599 7.6619 108.4831 60.4060 71.0035 172.3639 82 P 4.3610 0.0000 0.0000 66.1055 30.7201 179.5859 83 E 4.0099 8.1745 116.8251 61.0114 29.6795 182.4926 84 A 4.2431 7.8834 122.0431 54.9020 18.4319 179.4932 85 L 4.0024 8.4973 121.7705 58.8705 42.1484 180.0070 86 K 4.0759 8.0145 123.2716 59.6767 31.6071 181.4497 87 V 3.8283 7.5248 118.4678 65.9100 31.4216 177.9034 88 F 4.2117 8.6839 120.8333 61.4422 39.2065 177.1513 89 I 3.6052 8.1776 119.4847 64.3176 36.7426 177.9463 90 D 4.2875 8.1762 118.8618 57.3475 40.8654 178.1415 91 E 3.9655 8.4270 118.2366 59.2999 29.6500 178.6138 92 F 4.1245 8.1859 114.4598 56.2292 39.5030 175.6825 93 G 3.9026 7.5000 106.7666 46.3690 0.0000 174.3813 94 I 3.7032 7.5868 120.0689 60.6714 37.5103 176.7064 95 K 4.4117 8.2303 123.5113 55.8876 33.5292 176.4865 96 F 4.4605 7.0997 114.1634 55.0902 39.1177 173.3926 97 P 4.7343 0.0000 0.0000 63.3055 32.5393 175.0833 98 V 5.3349 9.2797 122.2092 61.1900 34.8080 173.9564 99 A 4.8506 9.0394 128.4530 49.9432 22.5797 174.8198 100 V 4.2133 8.3741 121.0338 60.6050 33.3233 174.8032 101 D 4.6258 8.4395 125.0162 54.3555 42.3918 177.7605 *103 P 4.2033 0.0000 0.0000 62.4087 32.4109 175.2266 104 R 4.5368 8.0569 119.2258 54.4978 32.4202 176.2223 105 E 4.1423 8.6978 119.2919 57.2340 30.0778 174.5013 106 G 3.9997 8.9930 111.5043 44.7102 0.0000 172.8188 107 Q 4.6538 7.6662 117.9679 53.4566 31.7901 175.9023 108 R 4.0454 8.7658 119.6492 58.9696 29.8431 176.5676 109 I 4.2631 7.4494 111.7950 58.3309 38.8706 173.6631 110 P 4.5896 0.0000 0.0000 61.6890 33.1095 176.3083 111 S 4.1674 8.5657 111.9708 62.0114 62.1858 177.8795 112 T 3.8824 8.3347 116.4661 63.6504 67.6352 176.6326 *114 K 4.1767 8.2042 122.7874 56.3841 33.7666 177.6731 115 K 3.7817 7.7139 118.1582 59.0626 32.0950 176.8956 116 Y 4.6816 7.4483 113.8602 56.9090 38.1174 175.4208 117 R 3.7846 7.7856 117.8934 57.0440 28.3204 176.7836 118 L 4.2267 7.7479 115.7847 54.4087 42.6898 177.6156 119 E 3.8361 8.9872 123.6735 57.1150 30.0492 177.0087 120 G 3.8415 6.8231 103.1146 46.0801 0.0000 170.5917 121 T 5.0204 8.5338 109.8132 59.3713 71.1976 172.6458 122 P 5.0184 0.0000 0.0000 62.8035 33.4481 174.9464 123 S 5.3464 9.0513 116.3223 56.9932 67.6896 172.9341 124 I 5.0443 8.6663 122.6232 59.6138 40.5350 174.5442 125 I 4.9601 8.7218 126.9760 59.4716 40.2390 174.2936 126 L 5.1871 9.2130 127.3134 52.9190 44.0986 175.5024 127 A 5.1631 8.6618 124.9284 50.0781 23.0365 175.8838 128 D 4.7830 8.5350 120.0159 52.1770 41.5679 177.5011 129 R 4.5939 8.3674 115.9445 58.3553 30.0765 178.3443 130 K 4.2071 8.5580 116.0270 55.8960 32.2693 177.4310 131 G 3.9542 8.3489 108.1262 45.3785 0.0000 173.7235 132 R 4.5682 7.7747 119.2168 55.2457 31.0690 175.5531 133 I 4.1615 8.6204 124.3845 61.7140 36.7768 176.0406 134 R 4.4599 8.8077 126.5948 57.1415 31.7977 176.6584 135 Q 4.6157 7.6699 118.4445 54.6743 32.7268 173.2512 136 V 4.9175 8.4737 127.0294 61.8855 34.5468 175.2101 137 Q 4.6910 9.0410 127.0811 54.0137 32.4272 170.6327 138 F 5.0389 9.1792 125.6681 56.9574 41.9165 176.3702 139 G 3.2322 6.7748 111.8508 43.9786 0.0000 172.5576 140 Q 3.9821 8.1180 119.3684 55.8484 29.5665 176.0528 141 V 4.4135 7.9719 123.6220 60.2848 34.5348 175.2257 142 D 4.5766 8.5068 125.4394 54.1882 43.1948 176.8650 143 D 4.3864 8.7171 125.4606 57.4791 40.9887 178.8881 144 F 4.2274 8.3860 120.6393 61.3238 39.5184 177.1494 145 V 3.3291 7.8159 117.3666 65.8922 31.4186 177.5622 146 L 4.0356 8.1528 120.2344 57.8806 41.7680 179.2014 147 G 3.5304 8.0237 105.7915 47.6763 0.0000 175.6351 148 L 3.8222 7.5406 121.6908 57.3320 41.7397 179.6479 149 L 3.9137 7.8021 118.7088 57.8958 41.5204 179.6848 150 L 4.0946 7.9733 119.0138 57.6443 41.1038 179.8353 151 G 3.5395 8.2772 105.9814 47.7928 0.0000 175.7253 152 S 4.1516 8.2659 115.7610 61.1180 62.1774 176.2922 153 L 4.0100 7.5751 120.3164 57.7730 41.4237 179.2120 154 L 4.1093 8.0810 118.2563 57.2039 41.5946 178.8018 155 S 4.5062 7.4550 111.9108 57.9402 64.0217 174.3311 156 E 3.9593 7.2829 121.9679 56.9889 29.8644 176.8395 157 T 4.2150 8.1798 113.8074 61.9702 68.9977 173.5170 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 4.52 0.00 2.15 2.17 0.00 3.57 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 2.04 2.17 0.00 9 L 8.59 4.41 0.00 1.63 1.65 1.04 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.95 4.23 0.00 1.59 1.68 0.80 0.87 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 11 E 9.31 4.79 0.00 2.06 1.83 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 2.27 2.47 0.00 12 L 8.78 4.76 0.00 1.72 1.55 1.01 1.21 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 13 D 8.73 4.57 0.00 2.60 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 14 V 7.87 4.23 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 0.03 0.00 0.00 0.67 0.00 0.00 15 Q 8.72 4.25 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.39 0.00 0.00 0.00 0.00 0.00 2.34 2.28 0.00 16 E 7.73 4.75 0.00 2.07 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 2.23 2.31 0.00 17 W 8.66 5.10 0.00 3.37 3.31 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 18 V 8.62 3.82 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 0.84 0.00 0.00 0.98 0.00 0.00 19 N 8.19 5.04 0.00 2.87 2.90 0.00 0.00 5.72 7.90 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 20 H 7.98 4.68 0.00 3.13 3.11 0.00 5.73 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.20 4.22 0.00 2.03 1.73 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 2.23 1.88 0.00 22 G 8.19 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 0.00 0.00 0.00 23 L 7.06 4.24 0.00 1.47 1.49 0.78 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 24 S 8.22 4.53 0.00 4.06 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 25 N 8.63 4.41 0.00 2.78 2.93 0.00 0.00 6.81 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 26 E 8.24 4.03 0.00 1.93 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 2.32 2.32 0.00 27 D 7.84 4.51 0.00 2.80 2.58 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 28 L 7.99 4.37 0.00 1.88 1.76 0.97 0.99 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 29 R 7.65 3.94 0.00 1.81 1.73 0.00 3.30 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.46 0.00 30 G 8.92 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 0.00 0.00 0.00 31 K 7.56 4.74 0.00 1.93 1.65 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.77 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.33 1.33 7.81 32 V 8.08 4.30 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 1.01 0.00 0.00 0.92 0.00 0.00 33 V 8.56 4.83 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 0.90 0.00 0.00 0.94 0.00 0.00 34 V 8.71 4.72 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 0.76 0.00 0.00 0.88 0.00 0.00 35 V 8.80 4.73 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 1.01 0.00 0.00 0.94 0.00 0.00 36 E 9.68 4.80 0.00 2.01 1.83 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 2.20 2.37 0.00 37 V 9.24 5.02 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 0.99 0.00 0.00 1.03 0.00 0.00 38 F 9.16 5.34 0.00 3.20 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 39 Q 8.51 4.66 0.00 1.73 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.77 0.00 0.00 0.00 0.00 0.00 2.25 1.92 0.00 *41 L 8.42 4.23 0.00 1.54 1.69 0.86 0.72 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 42 C 7.64 4.61 0.00 2.91 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 43 P 0.00 4.41 0.00 2.23 2.12 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 44 G 8.10 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 45 C 8.06 4.17 0.00 3.20 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 46 V 7.64 3.62 2.34 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 1.02 0.00 0.00 0.95 0.00 0.00 47 N 8.67 4.62 0.00 2.74 2.93 0.00 0.00 6.78 8.02 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 48 H 8.06 4.72 0.00 3.10 3.18 0.00 5.67 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.41 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 50 V 8.39 3.60 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 0.99 0.00 0.00 0.68 0.00 0.00 51 P 0.00 4.47 0.00 2.19 2.11 0.00 3.66 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.22 0.00 52 Q 7.99 3.89 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 53 A 7.88 3.92 1.25 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 0.00 0.00 0.00 54 Q 8.32 4.24 0.00 2.41 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.52 2.74 0.00 55 K 8.01 3.94 0.00 1.75 2.05 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.49 7.81 56 I 7.45 3.84 1.96 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.74 0.88 0.00 0.00 57 H 8.00 4.39 0.00 3.18 3.66 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 R 7.78 3.99 0.00 2.02 1.94 0.00 3.26 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 *60 I 7.21 3.89 1.86 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 1.29 0.47 0.90 0.00 0.00 61 D 8.34 4.47 0.00 2.74 2.52 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 62 E 9.01 4.46 0.00 2.05 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 0.00 2.39 2.32 0.00 63 S 8.41 4.18 0.00 4.02 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 64 Q 7.61 4.49 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 65 V 8.06 4.58 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 0.96 0.00 0.00 0.91 0.00 0.00 66 Q 8.97 4.76 0.00 2.18 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.64 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 67 V 8.35 4.44 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 0.01 0.00 0.00 0.82 0.00 0.00 68 I 8.86 4.90 2.04 0.00 0.00 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 1.34 0.93 1.14 0.00 0.00 69 G 9.42 4.72 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 0.00 0.00 0.00 70 L 9.46 5.16 0.00 1.74 1.57 0.83 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 71 H 9.05 4.27 0.00 2.96 2.97 0.00 5.77 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.27 4.79 0.00 3.74 3.77 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 73 V 7.92 3.66 1.91 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 0.52 0.00 0.00 0.55 0.00 0.00 74 F 8.38 5.16 0.00 3.07 3.05 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 75 E 6.72 4.52 0.00 1.77 1.67 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 1.53 2.05 0.00 76 H 8.58 4.10 0.00 3.22 3.28 0.00 5.62 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.56 4.10 0.00 3.10 3.34 0.00 5.70 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 D 8.04 4.45 0.00 2.78 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 79 V 7.26 3.62 2.30 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 0.75 0.00 0.00 0.90 0.00 0.00 *81 T 7.66 4.16 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 1.17 0.00 0.00 82 P 0.00 4.36 0.00 2.18 2.28 0.00 3.59 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 2.10 2.13 0.00 83 E 8.17 4.01 0.00 1.97 1.96 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 2.31 1.94 0.00 84 A 7.88 4.24 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 85 L 8.50 4.00 0.00 1.93 1.85 0.97 0.53 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 86 K 8.01 4.08 0.00 1.81 1.80 0.00 1.87 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.32 7.81 87 V 7.52 3.83 2.32 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 0.95 0.00 0.00 1.02 0.00 0.00 88 F 8.68 4.21 0.00 3.11 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 89 I 8.18 3.61 2.16 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 1.42 0.64 0.93 0.00 0.00 90 D 8.18 4.29 0.00 2.90 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 91 E 8.43 3.97 0.00 2.17 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 2.53 2.58 0.00 92 F 8.19 4.12 0.00 2.40 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 93 G 7.50 3.90 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 0.00 0.00 0.00 94 I 7.59 3.70 1.63 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.40 -0.09 0.00 0.00 95 K 8.23 4.41 0.00 1.77 1.85 0.00 1.78 0.00 0.00 1.81 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.54 7.81 96 F 7.10 4.46 0.00 3.16 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 97 P 0.00 4.73 0.00 2.30 2.09 0.00 3.74 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.76 0.00 98 V 9.28 5.33 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 1.26 0.00 0.00 1.11 0.00 0.00 99 A 9.04 4.85 -0.01 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 0.00 100 V 8.37 4.21 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 0.83 0.00 0.00 0.90 0.00 0.00 101 D 8.44 4.63 0.00 2.81 1.64 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 *103 P 0.00 4.20 0.00 2.21 2.06 0.00 3.72 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.97 0.00 104 R 8.06 4.54 0.00 1.83 1.81 0.00 3.09 0.00 0.00 3.55 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 105 E 8.70 4.14 0.00 1.98 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 0.00 2.23 1.88 0.00 106 G 8.99 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 0.00 0.00 0.00 107 Q 7.67 4.65 0.00 2.16 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.90 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 108 R 8.77 4.05 0.00 2.22 2.22 0.00 3.11 0.00 0.00 3.39 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 109 I 7.45 4.26 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.48 0.87 0.00 0.00 110 P 0.00 4.59 0.00 2.48 2.09 0.00 3.81 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 2.11 1.93 0.00 111 S 8.57 4.17 0.00 3.83 3.84 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 0.00 112 T 8.33 3.88 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 1.39 0.00 0.00 *114 K 8.20 4.18 0.00 2.06 1.86 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.33 7.81 115 K 7.71 3.78 0.00 1.57 1.76 0.00 1.55 0.00 0.00 1.23 0.00 0.00 2.26 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.30 0.86 7.81 116 Y 7.45 4.68 0.00 3.01 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 0.00 117 R 7.79 3.78 0.00 1.95 1.96 0.00 3.15 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 118 L 7.75 4.23 0.00 1.64 1.64 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.99 3.84 0.00 1.72 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 1.91 2.07 0.00 120 G 6.82 3.84 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 0.00 0.00 0.00 121 T 8.53 5.02 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 1.38 0.00 0.00 122 P 0.00 5.02 0.00 2.11 2.25 0.00 3.27 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.94 0.00 123 S 9.05 5.35 0.00 3.88 3.84 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 0.00 124 I 8.67 5.04 1.86 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 1.34 0.82 0.89 0.00 0.00 125 I 8.72 4.96 1.81 0.00 0.00 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 1.15 0.85 0.72 0.00 0.00 126 L 9.21 5.19 0.00 1.50 1.52 0.89 0.73 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 0.00 127 A 8.66 5.16 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 0.00 128 D 8.53 4.78 0.00 2.88 2.83 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 0.00 129 R 8.37 4.59 0.00 1.89 2.02 0.00 3.38 0.00 0.00 3.44 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.60 0.00 130 K 8.56 4.21 0.00 1.86 1.82 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.36 7.81 131 G 8.35 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 0.00 132 R 7.77 4.57 0.00 2.09 1.85 0.00 3.13 0.00 0.00 3.78 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 133 I 8.62 4.16 1.89 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.37 0.79 0.00 0.00 134 R 8.81 4.46 0.00 1.65 1.95 0.00 3.33 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.68 0.00 135 Q 7.67 4.62 0.00 2.11 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.86 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 136 V 8.47 4.92 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 0.85 0.00 0.00 0.88 0.00 0.00 137 Q 9.04 4.69 0.00 1.73 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.53 0.00 0.00 0.00 0.00 0.00 2.18 2.16 0.00 138 F 9.18 5.04 0.00 3.03 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 0.00 139 G 6.77 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 0.00 0.00 0.00 140 Q 8.12 3.98 0.00 1.91 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.63 0.00 0.00 0.00 0.00 0.00 2.04 1.97 0.00 141 V 7.97 4.41 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 0.86 0.00 0.00 0.96 0.00 0.00 142 D 8.51 4.58 0.00 2.88 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 0.00 143 D 8.72 4.39 0.00 2.87 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 0.00 144 F 8.39 4.23 0.00 3.09 3.31 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 0.00 145 V 7.82 3.33 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 0.94 0.00 0.00 0.98 0.00 0.00 146 L 8.15 4.04 0.00 1.86 1.80 0.89 0.95 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 0.00 147 G 8.02 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.54 3.82 0.00 1.66 1.55 0.52 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 149 L 7.80 3.91 0.00 1.79 1.67 0.89 0.45 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 0.00 150 L 7.97 4.09 0.00 1.66 1.68 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 151 G 8.28 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 S 8.27 4.15 0.00 3.86 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 0.00 153 L 7.58 4.01 0.00 1.79 1.69 0.92 0.80 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 0.00 154 L 8.08 4.11 0.00 1.59 1.72 0.90 1.09 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 0.00 155 S 7.46 4.51 0.00 3.86 3.90 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 0.00 156 E 7.28 3.96 0.00 2.14 1.87 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 2.32 2.27 0.00 157 T 8.18 4.21 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 * Residues marked with a * may have inaccurate shift predictions.