NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.6478 0.0000 0.0000 62.5401 33.1574 174.9860 3 N 5.0029 9.1191 117.7818 51.4733 42.8107 172.2032 4 T 5.1115 9.2259 118.5172 61.9975 72.3156 173.0253 5 I 4.8379 8.8244 125.5623 59.6212 41.5592 174.5906 6 R 5.1489 8.4241 118.5931 54.9317 32.5329 174.2234 7 L 5.0785 9.2017 120.8619 53.4632 46.3602 174.8841 8 H 5.3890 8.6181 119.3549 54.9993 33.1019 172.6652 9 R 4.6355 8.9134 123.1906 54.6444 34.9291 173.8862 10 V 4.6527 8.2894 122.2064 61.3171 33.2693 174.7929 11 L 4.8918 9.0160 127.3043 52.3645 44.7247 177.3468 12 S 4.7214 9.0664 119.8782 56.0492 61.7221 173.3969 13 A 4.5579 7.0441 121.2010 50.2046 22.4846 174.9033 14 P 4.4822 0.0000 0.0000 61.4953 32.3132 176.0808 15 P 4.3029 0.0000 0.0000 66.2789 30.9132 178.3967 16 E 3.9704 8.1583 118.4493 59.1146 29.7092 178.6564 17 R 3.9831 7.9589 118.6128 59.2602 29.9050 178.7075 18 V 3.6505 7.7582 117.0495 65.8516 31.9359 176.8177 19 Y 4.3721 8.5475 119.8015 61.0593 38.6886 178.4042 20 R 3.9288 8.4018 118.5948 59.3542 29.9592 178.8736 21 A 4.3250 7.7684 119.1052 55.1465 18.3646 179.2163 22 F 4.6563 8.2830 115.0073 59.3793 39.1980 176.3847 23 L 4.3644 7.6091 116.6406 55.2574 43.6255 176.1483 24 D 4.3813 8.6058 119.9705 53.1951 41.3871 174.7462 25 P 4.1946 0.0000 0.0000 66.2538 30.6591 178.3841 26 L 4.0030 8.7622 118.7374 57.2210 41.4128 179.3695 27 A 3.9763 8.0094 120.3251 55.2189 18.5417 179.1658 28 L 3.2608 8.2343 117.6605 58.0709 41.5462 179.8778 29 A 3.9106 7.7557 118.7650 54.4331 18.2373 179.0781 30 K 4.1227 7.2398 117.4942 58.5880 32.7749 178.1677 31 W 4.6201 8.0442 115.0551 57.9026 28.7447 177.5594 32 L 3.1538 6.9093 121.4873 56.8238 41.6141 175.5359 33 P 2.9729 0.0000 0.0000 61.5230 31.7823 174.4054 34 P 4.4395 0.0000 0.0000 61.6654 32.2032 175.1202 35 E 4.1375 8.8384 119.6149 58.3937 29.6369 178.1441 36 G 3.8242 9.1106 110.8626 45.1928 0.0000 172.2050 37 F 5.3266 7.7948 116.9657 55.5568 42.0458 175.1046 38 V 4.5227 8.8027 115.2166 59.7657 35.1088 174.1604 39 C 5.4541 8.4768 121.5807 57.6408 34.3078 172.7113 40 K 4.5078 8.8324 127.5718 54.6861 33.6202 175.4027 41 V 4.0091 8.3393 127.9323 61.6535 31.4274 175.3829 42 L 4.1874 8.5130 129.2577 57.1880 42.2861 177.3261 43 E 4.7238 8.6826 118.7864 54.2033 33.3080 175.2150 44 H 5.1509 7.7718 120.6999 54.6462 27.7194 175.1932 45 D 4.4819 8.3361 119.2852 54.2732 41.0179 175.6969 46 A 3.8796 7.9553 129.8725 50.1130 16.4232 176.2592 47 R 4.5349 7.6047 120.0313 53.1528 34.9560 175.3036 48 V 4.0243 8.2966 120.1602 65.5058 31.5246 175.6789 49 G 4.1249 9.6288 117.4817 45.2695 0.0000 173.8432 50 G 4.2575 8.8105 106.7835 45.9927 0.0000 172.7049 51 A 5.0983 8.5235 122.7367 50.8111 21.3987 175.3623 52 Y 4.6979 9.3984 122.8368 55.8127 41.3277 174.8689 53 K 4.6128 8.9175 124.8803 55.0561 37.4851 174.7309 *55 E 4.2146 8.7404 121.7184 56.2690 31.4069 174.5769 56 F 5.7672 9.2212 121.2463 56.6709 41.4735 174.8280 57 L 5.4435 9.0478 121.3540 52.7592 45.5974 175.7974 58 A 3.8163 9.3357 126.9729 51.8376 18.6555 178.1746 59 F 4.0682 9.0751 126.4346 60.8859 39.7267 176.2278 60 A 4.2140 8.0680 119.3112 52.7815 18.9444 177.5939 61 S 4.4065 7.9087 107.7288 56.9802 64.9454 175.4035 62 G 3.8156 8.6110 109.0643 44.4095 0.0000 172.7208 63 Q 4.0686 7.7865 121.5585 56.8207 29.8111 175.8140 64 K 5.3071 8.7935 125.5450 55.5888 35.2916 175.4234 65 H 4.9086 9.9168 119.6792 54.2425 32.4941 172.3179 66 A 4.9970 8.5953 125.3076 50.6452 21.5203 175.2290 67 F 5.1048 7.2107 113.6278 56.0118 41.1125 172.8833 68 G 3.6431 8.3031 106.0430 46.3822 0.0000 172.0711 69 G 4.7425 7.5747 105.2041 47.0837 0.0000 172.8123 70 R 4.8628 8.4886 120.1478 54.6146 35.4753 174.2648 71 Y 4.7948 8.4941 119.5124 58.0094 38.3406 176.4881 72 L 4.2391 9.3127 125.8058 56.9759 43.0599 177.3417 73 E 4.9037 8.1261 115.9624 54.9554 34.4382 174.9078 74 L 5.0358 8.4829 122.1008 53.6647 45.6246 175.8340 75 V 4.2267 8.9087 125.1718 60.2886 33.8642 172.8480 76 P 3.0700 0.0000 0.0000 63.4117 31.2261 176.3251 77 G 3.7839 5.4350 110.2004 46.1360 0.0000 173.3237 78 E 4.7676 8.1430 118.3841 57.1852 34.8249 175.6646 79 R 5.1748 7.7525 117.6867 55.2487 34.0058 174.0245 80 I 5.1959 8.8910 125.9381 59.8758 41.7325 173.9896 81 R 5.2916 9.0928 126.9473 54.6873 33.1562 173.5893 82 Y 5.5417 8.7102 123.5806 55.8362 42.0955 174.4141 83 T 4.7358 8.8358 111.2999 61.1725 71.2730 172.9606 84 D 5.2688 8.4656 121.0389 52.7270 44.6314 174.6927 85 R 4.7697 9.2873 123.9385 54.5198 34.5075 174.1886 86 F 4.6924 9.1922 123.1130 56.9462 40.0292 175.9542 87 D 4.6901 8.7312 123.0136 55.0328 41.0567 176.6267 88 D 4.2962 7.7360 118.2336 53.7685 41.7102 176.3214 89 A 4.1259 8.2319 128.7253 54.8951 16.9698 175.3112 90 G 3.4297 7.8320 110.2822 45.8620 0.0000 172.7856 91 L 4.6319 7.3508 118.3423 52.6745 42.3716 173.8721 92 P 4.4334 0.0000 0.0000 62.3911 32.7115 174.6230 93 G 3.7862 7.9706 104.0192 43.9205 0.0000 171.6781 94 D 4.8625 8.0809 118.1552 52.0012 44.5150 174.4862 *96 I 4.1012 7.8820 120.3636 61.3276 38.7088 174.8995 97 T 4.9537 8.2572 120.7637 60.3528 70.8951 172.3682 98 T 4.9699 8.7986 122.0193 60.3841 70.9664 172.1988 99 I 4.9086 9.2955 130.7772 59.7448 39.5743 174.6067 100 T 5.1276 9.0085 117.4429 59.8011 71.3700 172.9206 101 L 5.7894 9.1258 124.8662 51.9894 44.9891 175.7726 102 A 4.8718 8.2775 122.6416 49.5721 22.9425 173.6642 103 P 4.9785 0.0000 0.0000 62.7260 32.8653 175.4070 104 L 4.8056 8.5686 119.5810 53.1306 46.0179 177.7299 105 S 4.1475 8.7458 116.8054 61.8383 62.8882 175.7638 106 C 4.3831 8.2563 113.4748 58.3483 31.5624 174.8133 107 G 4.4075 7.0581 114.0205 45.2399 0.0000 173.0460 108 A 5.1270 5.8000 120.5807 50.3675 24.3942 176.6897 109 D 5.0176 9.1876 121.1786 52.5911 43.3668 174.8008 110 L 5.0981 9.0550 128.5909 53.3181 44.6922 174.6532 111 S 5.1760 9.1400 121.5247 56.5358 65.3286 172.6130 112 I 5.0767 8.6752 127.3115 59.3904 40.8651 174.8237 113 V 4.8134 8.3978 124.9120 60.0604 35.0471 174.1489 114 Q 4.9451 9.1995 123.4136 54.2764 31.4407 174.7519 115 E 4.7239 8.8891 123.9888 53.9146 32.3701 175.7360 116 G 3.8894 8.5940 106.6171 46.6818 0.0000 173.9482 117 I 3.8921 7.9164 121.6016 59.6810 37.7885 174.2983 118 P 4.4693 0.0000 0.0000 62.9615 31.6745 177.2549 119 D 4.3698 8.6324 121.1467 57.0693 41.1254 177.8250 120 A 3.9823 7.9420 121.4016 54.7959 18.5123 177.5115 121 I 3.9750 7.2679 117.4066 59.4528 37.2147 174.2412 122 P 4.3256 0.0000 0.0000 62.1262 31.8206 175.2435 123 P 4.2295 0.0000 0.0000 65.7497 31.2521 178.0979 124 E 4.2224 8.4192 115.6804 59.9952 29.2004 179.0056 125 N 4.4450 8.3356 117.1183 56.1930 38.4673 177.2485 126 C 4.1998 8.0865 118.3575 62.8388 28.1215 175.7580 127 Y 4.3143 7.9477 117.8998 61.1715 37.6336 178.1903 128 L 4.2159 8.3015 120.0762 57.7938 41.7632 179.9042 129 G 3.5244 8.2822 105.4831 47.7571 0.0000 175.8525 130 W 4.2957 8.5254 122.2283 59.4130 29.1104 178.6352 131 Q 4.2411 8.8598 118.5751 59.1386 28.2873 179.0276 132 Q 4.0667 8.0986 118.5311 59.2219 28.7290 178.9796 133 S 4.4863 8.1730 116.1278 61.6691 62.8655 176.8049 134 L 4.1198 8.8938 122.2859 57.4837 41.2414 179.3898 135 K 3.9938 8.0792 119.3221 59.7095 32.0366 178.9852 136 Q 4.0823 8.1631 117.9774 58.6708 28.5752 178.3673 137 L 3.5202 8.2639 121.5912 57.8737 42.0126 178.8574 138 A 3.8870 8.0303 120.4537 55.2001 18.1077 179.4673 139 A 3.9504 7.5907 117.8642 54.9790 18.4309 179.3674 140 L 4.0829 7.3659 118.5886 58.0047 42.4064 178.8874 141 V 3.9231 7.6185 117.2287 63.8397 31.8794 177.8312 142 E 4.3268 8.0206 120.1543 57.0957 29.6934 175.9342 143 P 4.2197 0.0000 0.0000 63.5947 32.1141 175.6300 144 D 4.6640 8.7161 119.5445 54.9007 42.1479 173.2491 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 2 P 0.00 4.65 0.00 1.94 2.01 0.00 3.58 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 1.91 2.11 0.00 3 N 9.12 5.00 0.00 2.65 2.65 0.00 0.00 7.23 6.17 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 4 T 9.23 5.11 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 1.19 0.00 0.00 5 I 8.82 4.84 1.66 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 1.08 0.26 0.30 0.00 0.00 6 R 8.42 5.15 0.00 1.86 1.83 0.00 3.02 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 7 L 9.20 5.08 0.00 1.42 1.57 0.46 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 8 H 8.62 5.39 0.00 3.08 3.12 0.00 5.70 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 9 R 8.91 4.64 0.00 1.68 1.70 0.00 3.33 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.75 0.00 10 V 8.29 4.65 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 0.79 0.00 0.00 0.92 0.00 0.00 11 L 9.02 4.89 0.00 1.53 1.48 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 12 S 9.07 4.72 0.00 3.97 3.81 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 13 A 7.04 4.56 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 14 P 0.00 4.48 0.00 2.20 1.98 0.00 3.62 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 2.11 2.07 0.00 15 P 0.00 4.30 0.00 2.45 2.33 0.00 3.70 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 2.06 2.02 0.00 16 E 8.16 3.97 0.00 2.08 2.00 0.00 0.00 0.00 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 2.48 0.00 17 R 7.96 3.98 0.00 1.92 2.06 0.00 3.28 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 18 V 7.76 3.65 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 1.09 0.00 0.00 0.99 0.00 0.00 19 Y 8.55 4.37 0.00 3.21 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 20 R 8.40 3.93 0.00 2.16 2.03 0.00 3.23 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.12 0.00 21 A 7.77 4.33 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 22 F 8.28 4.66 0.00 3.26 3.28 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 23 L 7.61 4.36 0.00 1.44 1.45 0.35 0.53 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 24 D 8.61 4.38 0.00 2.71 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 25 P 0.00 4.19 0.00 2.15 2.00 0.00 3.66 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.62 0.00 26 L 8.76 4.00 0.00 1.77 1.76 0.92 0.83 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 27 A 8.01 3.98 1.57 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 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.23 3.26 0.00 1.62 1.59 1.04 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 29 A 7.76 3.91 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 30 K 7.24 4.12 0.00 1.69 2.04 0.00 1.82 0.00 0.00 1.81 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.45 7.81 31 W 8.04 4.62 0.00 3.52 3.13 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 0.00 0.00 0.00 0.00 32 L 6.91 3.15 0.00 0.98 1.44 0.83 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 33 P 0.00 2.97 0.00 1.96 1.23 0.00 3.54 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.90 0.00 34 P 0.00 4.44 0.00 2.17 2.08 0.00 2.83 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 35 E 8.84 4.14 0.00 2.07 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 0.00 2.36 2.38 0.00 36 G 9.11 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 37 F 7.79 5.33 0.00 2.89 2.65 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 38 V 8.80 4.52 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 0.72 0.00 0.00 1.14 0.00 0.00 39 C 8.48 5.45 0.00 2.98 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 40 K 8.83 4.51 0.00 1.83 1.68 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.35 7.81 41 V 8.34 4.01 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 0.93 0.00 0.00 0.96 0.00 0.00 42 L 8.51 4.19 0.00 1.70 1.65 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.68 4.72 0.00 1.88 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 2.32 2.18 0.00 44 H 7.77 5.15 0.00 3.04 3.23 0.00 5.77 0.00 0.00 0.00 0.00 8.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 D 8.34 4.48 0.00 2.72 2.85 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 0.00 0.00 0.00 0.00 46 A 7.96 3.88 0.93 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 0.00 0.00 47 R 7.60 4.53 0.00 1.85 1.78 0.00 3.14 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 48 V 8.30 4.02 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 0.98 0.00 0.00 49 G 9.63 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 50 G 8.81 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 0.00 0.00 0.00 0.00 51 A 8.52 5.10 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 52 Y 9.40 4.70 0.00 2.55 2.54 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 53 K 8.92 4.61 0.00 1.63 1.53 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.29 1.46 7.81 *55 E 8.74 4.21 0.00 2.20 2.00 0.00 0.00 0.00 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 2.38 0.00 56 F 9.22 5.77 0.00 2.95 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 57 L 9.05 5.44 0.00 1.74 1.62 1.06 0.61 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 58 A 9.34 3.82 1.08 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 0.00 0.00 59 F 9.08 4.07 0.00 2.92 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 60 A 8.07 4.21 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 61 S 7.91 4.41 0.00 3.90 3.88 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 62 G 8.61 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 7.79 4.07 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 64 K 8.79 5.31 0.00 1.98 1.84 0.00 1.59 0.00 0.00 1.86 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.48 7.81 65 H 9.92 4.91 0.00 3.17 3.31 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 66 A 8.60 5.00 1.16 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 0.00 0.00 67 F 7.21 5.10 0.00 2.60 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 68 G 8.30 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 69 G 7.57 4.74 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 0.00 0.00 0.00 70 R 8.49 4.86 0.00 1.75 1.84 0.00 3.14 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 71 Y 8.49 4.79 0.00 3.25 2.94 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 72 L 9.31 4.24 0.00 1.71 1.78 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.13 4.90 0.00 1.95 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 2.34 2.40 0.00 74 L 8.48 5.04 0.00 1.52 1.65 0.76 0.67 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 75 V 8.91 4.23 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 0.99 0.00 0.00 0.94 0.00 0.00 76 P 0.00 3.07 0.00 1.89 1.84 0.00 3.78 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 1.98 2.11 0.00 77 G 5.44 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 78 E 8.14 4.77 0.00 1.87 1.86 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 2.15 2.24 0.00 79 R 7.75 5.17 0.00 1.86 1.73 0.00 3.14 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 80 I 8.89 5.20 1.96 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.02 1.27 0.00 0.00 81 R 9.09 5.29 0.00 1.93 1.81 0.00 3.10 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 82 Y 8.71 5.54 0.00 3.16 3.19 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 83 T 8.84 4.74 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 1.25 0.00 0.00 84 D 8.47 5.27 0.00 2.69 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.29 4.77 0.00 1.73 1.81 0.00 3.42 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 86 F 9.19 4.69 0.00 3.12 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 87 D 8.73 4.69 0.00 2.71 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 88 D 7.74 4.30 0.00 2.76 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 89 A 8.23 4.13 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 90 G 7.83 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 7.35 4.63 0.00 1.50 1.24 0.57 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.43 0.00 2.18 2.07 0.00 3.71 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 1.97 1.95 0.00 93 G 7.97 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 94 D 8.08 4.86 0.00 2.62 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 I 7.88 4.10 1.84 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 1.22 0.65 0.86 0.00 0.00 97 T 8.26 4.95 4.14 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 0.80 0.00 0.00 98 T 8.80 4.97 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 1.15 0.00 0.00 99 I 9.30 4.91 1.65 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 1.31 0.72 0.34 0.00 0.00 100 T 9.01 5.13 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 1.18 0.00 0.00 101 L 9.13 5.79 0.00 1.51 1.59 1.10 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 102 A 8.28 4.87 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 4.98 0.00 2.08 2.05 0.00 3.73 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 1.97 1.98 0.00 104 L 8.57 4.81 0.00 1.69 1.53 0.97 1.05 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 0.00 105 S 8.75 4.15 0.00 3.86 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 0.00 106 C 8.26 4.38 0.00 3.10 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 0.00 107 G 7.06 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 0.00 108 A 5.80 5.13 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 0.00 109 D 9.19 5.02 0.00 2.73 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.06 5.10 0.00 1.76 1.66 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 111 S 9.14 5.18 0.00 3.90 3.76 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 0.00 112 I 8.68 5.08 1.50 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.38 0.22 0.00 0.00 113 V 8.40 4.81 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 0.85 0.00 0.00 0.94 0.00 0.00 114 Q 9.20 4.95 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.71 0.00 0.00 0.00 0.00 0.00 2.28 2.25 0.00 115 E 8.89 4.72 0.00 1.77 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 2.23 2.04 0.00 116 G 8.59 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 0.00 117 I 7.92 3.89 1.96 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 1.31 0.54 0.86 0.00 0.00 118 P 0.00 4.47 0.00 1.99 1.87 0.00 3.43 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 1.82 2.02 0.00 119 D 8.63 4.37 0.00 2.62 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 0.00 120 A 7.94 3.98 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 0.00 121 I 7.27 3.98 1.76 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.55 0.84 0.00 0.00 122 P 0.00 4.33 0.00 2.24 2.21 0.00 3.69 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 123 P 0.00 4.23 0.00 2.29 2.22 0.00 3.65 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.18 0.00 124 E 8.42 4.22 0.00 2.27 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 0.00 2.42 2.48 0.00 125 N 8.34 4.45 0.00 3.04 2.91 0.00 0.00 7.02 7.12 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 0.00 126 C 8.09 4.20 0.00 2.99 3.02 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 0.00 127 Y 7.95 4.31 0.00 3.26 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 0.00 128 L 8.30 4.22 0.00 1.93 1.79 0.98 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.28 3.52 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 0.00 130 W 8.53 4.30 0.00 3.61 3.35 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 0.00 131 Q 8.86 4.24 0.00 2.35 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.52 2.78 0.00 132 Q 8.10 4.07 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 133 S 8.17 4.49 0.00 4.20 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 0.00 134 L 8.89 4.12 0.00 1.83 1.82 1.08 0.96 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 0.00 135 K 8.08 3.99 0.00 1.99 2.07 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.51 7.81 136 Q 8.16 4.08 0.00 2.65 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.70 0.00 137 L 8.26 3.52 0.00 0.76 1.52 -0.23 0.64 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 0.00 138 A 8.03 3.89 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 0.00 139 A 7.59 3.95 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 0.00 140 L 7.37 4.08 0.00 1.62 1.80 0.95 1.05 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 0.00 141 V 7.62 3.92 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 0.82 0.00 0.00 0.91 0.00 0.00 142 E 8.02 4.33 0.00 2.06 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 0.00 2.51 2.28 0.00 143 P 0.00 4.22 0.00 2.03 1.99 0.00 3.87 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 2.14 2.07 0.00 144 D 8.72 4.66 0.00 2.72 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.