NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 P 4.4854 0.0000 0.0000 62.8577 32.5824 174.9113 5 V 3.8114 8.2816 125.3955 61.1853 33.3246 173.6109 6 N 4.7581 9.0871 124.6452 51.5039 42.0488 172.9654 7 I 4.0466 8.3027 127.9976 61.4060 37.5850 176.0149 8 L 4.7404 8.5137 127.9838 53.4834 43.2285 176.6216 9 N 4.7062 9.1628 119.9933 51.8386 38.8131 176.0811 10 E 3.9222 8.6847 117.8292 59.6003 29.2603 179.5101 11 Q 3.9175 8.0411 119.0373 59.1270 29.2657 177.8321 12 E 3.8309 8.6809 119.5761 59.2662 29.4918 179.1572 13 A 3.8501 8.0313 120.6763 55.2164 18.5139 179.6111 14 L 3.9439 8.1494 117.7427 58.0211 41.4639 179.6484 15 E 4.0945 8.1387 117.5954 59.6510 29.5932 179.4760 16 R 3.6159 7.7676 117.8857 58.7221 29.9218 178.9035 17 L 4.3585 7.7524 120.4825 58.2647 41.9332 178.7497 18 Q 4.2898 8.0787 116.7166 57.7599 28.8338 177.5907 19 S 4.5487 7.6289 114.0358 58.5105 63.7729 174.0418 20 V 4.6978 7.0907 114.1971 59.9454 35.4843 175.1499 21 S 3.9958 8.5620 113.8838 57.7387 65.0374 172.7683 22 L 5.2361 8.1934 123.3655 53.8700 43.6658 175.4048 23 G 4.0449 9.4604 113.2862 45.1123 0.0000 170.8362 24 R 5.0442 8.0425 117.0970 54.2950 34.9362 174.7045 25 V 4.5931 8.1615 122.2359 61.0065 34.4732 174.2081 26 V 4.4637 8.5658 128.1445 61.3590 33.0917 174.9984 27 V 4.7673 8.3295 121.2409 59.8829 34.5816 175.1399 28 R 4.7978 8.1439 120.9183 55.2622 33.7973 174.3813 29 R 4.6249 8.8189 125.1047 55.5710 33.1339 177.1740 30 S 3.6633 8.7229 124.8517 59.9990 62.0979 173.9094 31 D 4.4508 9.2271 126.8749 57.6170 41.3058 176.3593 32 E 4.1561 7.6298 118.1884 55.6138 30.6891 174.6389 *34 D 4.7398 8.1309 118.2456 54.4690 42.8847 173.6713 35 I 4.8132 8.1602 121.6307 59.0451 40.9922 174.2722 36 F 5.1917 7.7373 123.2604 54.2358 41.4316 172.3779 37 P 4.9244 0.0000 0.0000 63.1614 32.2050 175.8331 38 V 4.4886 8.9435 114.2499 59.8422 36.4134 173.9501 39 N 5.5035 8.6687 120.9154 52.0383 39.7363 174.2820 40 F 5.4297 9.1057 118.5442 55.3003 42.0423 173.9336 41 I 4.4937 8.7285 118.2794 59.5617 41.4686 173.5859 42 V 4.6836 8.5451 129.2501 62.1033 32.8131 175.0248 43 D 4.4095 9.5599 127.6026 54.0721 43.7985 175.2226 44 K 3.9237 9.7249 128.4437 57.6852 29.3372 176.7051 45 G 3.9357 8.3942 104.7492 45.3907 0.0000 172.9697 46 A 4.7940 7.6178 121.2494 50.1962 22.5736 175.3577 47 I 4.7872 8.5074 120.6388 59.8978 39.5531 174.4470 48 Y 5.0843 9.2976 125.0868 56.3469 40.4617 174.9550 49 I 5.2605 8.7409 123.6579 59.6071 41.7283 174.0763 50 R 5.0435 8.7919 125.5812 54.9941 31.8030 175.0062 51 T 4.6664 8.9485 120.0124 60.4032 70.6080 174.4722 52 A 4.1267 8.7327 129.5377 54.6047 19.4776 177.9680 53 E 4.4924 7.7404 115.9631 56.2877 30.2192 178.9401 54 G 3.7457 8.0874 109.1610 47.5460 0.0000 174.8282 55 N 4.4325 8.0691 118.4899 55.7019 38.4459 177.2303 56 K 3.9019 7.9434 119.4468 59.6777 32.4987 178.2406 57 L 4.1336 7.8929 117.9240 57.9271 41.6209 179.1509 58 F 4.2291 8.0876 119.3352 60.3630 40.7101 176.6955 59 S 4.4368 7.8052 116.3432 56.8636 59.7221 174.0165 *61 N 4.4567 7.7595 118.3976 52.7014 40.3995 175.4237 62 L 4.1601 7.7128 117.0462 54.2290 42.5889 176.9151 63 N 4.4356 8.9074 121.3173 53.7910 39.6274 175.0703 64 H 4.4653 8.6186 121.3088 58.8019 30.1802 175.2439 65 D 4.9980 8.4378 119.0216 54.3538 41.1857 176.6402 66 V 4.6872 9.2002 116.1946 59.6494 36.6150 174.3505 67 L 5.1956 8.4314 121.7317 53.3284 44.2656 175.5719 68 F 5.1619 9.2478 124.3649 56.4396 42.6658 173.2637 69 E 5.0732 8.0839 125.4478 54.6262 33.5471 173.7371 70 A 4.9303 8.4641 124.8891 51.0485 23.1881 174.6233 71 D 3.9057 8.0548 117.3849 52.7741 42.3291 174.1329 72 E 4.2784 7.1859 117.9270 55.2899 33.4615 174.3295 73 V 4.8173 8.3898 127.6885 60.8102 31.6269 173.4441 74 K 4.5210 8.6233 123.8020 53.3113 34.9560 175.8926 75 D 4.5608 9.8401 123.3012 54.5075 37.9657 174.5081 76 G 4.0110 8.1370 108.6684 45.9096 0.0000 171.7773 77 K 5.2940 7.8289 123.0529 53.2438 35.3670 180.5901 78 A 5.3884 9.3146 126.3611 49.2914 22.3273 175.1096 79 W 5.9730 8.7478 117.5619 55.5490 32.4579 173.7799 80 S 5.2375 9.6100 114.2615 57.1569 66.6635 173.0635 81 V 4.8841 9.1663 121.9036 61.3200 34.3262 174.0775 82 V 4.8092 8.9760 128.3982 61.1320 34.0728 174.3784 83 V 4.8631 9.0186 127.3856 61.2586 34.7133 174.0481 84 R 5.0349 8.7953 126.9198 54.9120 31.9964 175.4624 85 A 4.9356 8.9016 124.3385 51.3067 23.8300 174.4412 86 T 4.9949 8.5969 115.5827 62.0076 70.5531 174.0923 87 A 5.1893 8.8875 129.4036 50.7067 20.6741 176.1633 88 E 4.8321 9.0084 120.8937 55.2114 33.5376 175.3095 89 I 4.4087 8.5230 122.2373 60.4285 36.5973 174.9711 90 V 3.8607 8.6859 128.0031 62.1624 30.9909 175.5275 91 R 4.3013 8.7543 129.7735 58.2746 31.7051 179.0635 92 K 4.0289 8.0299 122.5025 56.8251 32.9773 179.4818 93 L 4.2400 8.5816 124.5781 57.1903 41.7697 179.5894 94 D 4.3991 8.0865 118.5078 56.3535 39.3741 178.3984 95 E 4.0903 8.1683 119.6520 59.3167 29.5737 179.0237 96 I 3.8616 7.9832 119.6190 64.3985 36.9860 178.1846 97 A 4.0391 8.0149 120.4179 55.5002 18.3798 178.7803 98 Y 4.1567 8.1204 117.6439 60.7945 38.8807 178.0028 99 A 3.1995 8.3579 122.0134 54.8674 18.0354 179.2821 100 D 4.6254 8.2737 118.3444 57.0177 40.9298 178.7561 101 T 3.9788 7.2797 108.9899 62.8192 69.1263 174.8944 102 L 3.8835 6.8430 125.1799 54.7779 42.0410 178.2862 103 E 4.1197 8.4655 119.9696 55.1967 27.7897 171.4672 104 L 4.6431 8.0441 124.8940 52.8271 43.7049 176.6482 105 K 4.4439 8.2723 127.3641 53.6382 31.3912 174.5085 106 P 4.4870 0.0000 0.0000 61.8409 32.2997 177.6157 107 W 4.5734 8.6429 119.3832 59.4467 29.1005 176.6816 108 I 4.5687 7.4582 118.3581 58.0825 37.3700 172.3682 109 P 4.3508 0.0000 0.0000 62.5363 32.0368 176.6556 110 T 4.6864 7.9395 110.3325 59.4262 71.6459 174.1637 111 L 4.1061 8.6474 124.0494 57.9380 42.2972 177.2379 112 K 4.3729 7.9061 117.3619 55.2408 32.9043 175.3153 113 Y 5.0716 7.4888 120.6046 55.9573 40.9872 173.4593 114 N 5.0451 9.2841 116.4084 51.8454 43.4251 173.0966 115 Y 5.0438 8.5170 117.6182 56.5919 41.1489 174.7418 116 V 4.5791 9.0250 123.2502 61.2111 34.3812 174.1838 117 R 4.0785 8.9545 129.3409 54.9544 31.5996 174.9230 118 I 4.5812 8.6125 129.1093 59.8857 39.1058 175.2641 119 V 4.4344 8.5197 129.2361 60.3171 32.7637 173.3261 120 P 4.6610 0.0000 0.0000 63.5501 31.1878 175.9987 121 N 4.6849 9.4506 122.7272 54.9012 39.7187 175.2412 122 E 4.8063 7.9997 117.9513 54.3461 33.7781 174.1023 123 I 5.0591 8.3416 124.6309 59.9281 40.7970 174.7543 124 T 4.4989 9.2941 124.4277 61.8242 71.2484 173.1690 125 G 4.5447 8.6699 113.8927 44.3880 0.0000 171.4878 126 R 5.1104 9.1719 122.2581 54.2115 34.7141 173.9116 127 E 5.2525 8.8146 122.9715 54.5340 33.5140 174.2578 128 F 5.1999 9.7561 123.5628 56.0781 43.6090 173.8354 129 T 4.9280 8.0456 119.4847 61.8696 69.7252 174.8255 130 L 4.2981 8.8803 126.5693 54.9718 41.3334 177.1597 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 4 P 0.00 4.49 0.00 2.18 2.35 0.00 3.71 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 2.04 2.02 0.00 5 V 8.28 3.81 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 0.35 0.00 0.00 1.17 0.00 0.00 6 N 9.09 4.76 0.00 2.74 2.64 0.00 0.00 7.43 7.47 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 7 I 8.30 4.05 1.83 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 1.30 0.60 0.89 0.00 0.00 8 L 8.51 4.74 0.00 1.60 1.52 0.82 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 9 N 9.16 4.71 0.00 2.91 2.93 0.00 0.00 7.10 8.35 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 10 E 8.68 3.92 0.00 2.02 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 2.40 2.37 0.00 11 Q 8.04 3.92 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.64 0.00 12 E 8.68 3.83 0.00 2.15 1.88 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 2.26 2.39 0.00 13 A 8.03 3.85 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 14 L 8.15 3.94 0.00 1.95 1.73 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.14 4.09 0.00 1.96 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 2.31 2.44 0.00 16 R 7.77 3.62 0.00 1.08 0.66 0.00 2.56 0.00 0.00 2.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.22 0.00 17 L 7.75 4.36 0.00 2.13 1.91 1.21 0.88 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 18 Q 8.08 4.29 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.68 0.00 0.00 0.00 0.00 0.00 2.44 2.55 0.00 19 S 7.63 4.55 0.00 4.07 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 20 V 7.09 4.70 2.28 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 1.05 0.00 0.00 1.52 0.00 0.00 21 S 8.56 4.00 0.00 3.68 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 22 L 8.19 5.24 0.00 1.83 1.75 1.08 1.21 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 23 G 9.46 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 24 R 8.04 5.04 0.00 1.49 1.55 0.00 2.92 0.00 0.00 3.05 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.50 0.00 25 V 8.16 4.59 1.85 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 0.94 0.00 0.00 1.13 0.00 0.00 26 V 8.57 4.46 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 0.89 0.00 0.00 0.79 0.00 0.00 27 V 8.33 4.77 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 0.80 0.00 0.00 1.16 0.00 0.00 28 R 8.14 4.80 0.00 1.81 1.68 0.00 3.13 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 29 R 8.82 4.62 0.00 1.81 1.73 0.00 3.27 0.00 0.00 3.14 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.70 0.00 30 S 8.72 3.66 0.00 4.02 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 31 D 9.23 4.45 0.00 2.66 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 32 E 7.63 4.16 0.00 2.03 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 2.33 2.24 0.00 *34 D 8.13 4.74 0.00 2.83 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 35 I 8.16 4.81 1.76 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.84 0.88 0.00 0.00 36 F 7.74 5.19 0.00 3.14 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 37 P 0.00 4.92 0.00 1.73 2.11 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.11 0.00 38 V 8.94 4.49 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 0.95 0.00 0.00 1.17 0.00 0.00 39 N 8.67 5.50 0.00 2.54 2.77 0.00 0.00 6.73 7.45 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 40 F 9.11 5.43 0.00 3.10 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 41 I 8.73 4.49 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.15 0.93 0.00 0.00 42 V 8.55 4.68 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 0.87 0.00 0.00 1.16 0.00 0.00 43 D 9.56 4.41 0.00 2.68 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.72 3.92 0.00 2.02 1.88 0.00 1.89 0.00 0.00 1.68 0.00 0.00 2.75 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.48 7.81 45 G 8.39 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 46 A 7.62 4.79 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 47 I 8.51 4.79 1.44 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.40 0.37 0.00 0.00 48 Y 9.30 5.08 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 49 I 8.74 5.26 2.01 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.95 1.04 0.00 0.00 50 R 8.79 5.04 0.00 1.91 1.80 0.00 2.62 0.00 0.00 2.91 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.20 0.00 51 T 8.95 4.67 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 1.33 0.00 0.00 52 A 8.73 4.13 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 53 E 7.74 4.49 0.00 1.95 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 2.25 2.20 0.00 54 G 8.09 3.75 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 0.00 0.00 0.00 55 N 8.07 4.43 0.00 2.76 2.90 0.00 0.00 6.74 7.19 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 56 K 7.94 3.90 0.00 1.74 1.95 0.00 1.77 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.53 7.81 57 L 7.89 4.13 0.00 1.70 1.78 0.89 0.98 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 58 F 8.09 4.23 0.00 3.18 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 59 S 7.81 4.44 0.00 4.13 3.85 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 *61 N 7.76 4.46 0.00 2.68 2.82 0.00 0.00 7.27 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 62 L 7.71 4.16 0.00 1.59 1.58 0.99 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 63 N 8.91 4.44 0.00 2.69 2.69 0.00 0.00 7.19 8.33 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 64 H 8.62 4.47 0.00 3.13 3.32 0.00 5.67 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.44 5.00 0.00 2.72 2.62 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 66 V 9.20 4.69 2.20 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 0.91 0.00 0.00 1.03 0.00 0.00 67 L 8.43 5.20 0.00 1.54 1.52 0.88 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 68 F 9.25 5.16 0.00 2.94 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 69 E 8.08 5.07 0.00 1.79 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 2.28 2.29 0.00 70 A 8.46 4.93 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 71 D 8.05 3.91 0.00 2.43 2.53 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 72 E 7.19 4.28 0.00 1.56 1.12 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 2.24 2.17 0.00 73 V 8.39 4.82 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 0.84 0.00 0.00 0.84 0.00 0.00 74 K 8.62 4.52 0.00 1.71 1.62 0.00 2.01 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.25 1.23 7.81 75 D 9.84 4.56 0.00 2.81 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 76 G 8.14 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 77 K 7.83 5.29 0.00 1.38 1.64 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.25 1.22 7.81 78 A 9.31 5.39 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 79 W 8.75 5.97 0.00 3.57 3.18 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 80 S 9.61 5.24 0.00 3.93 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 81 V 9.17 4.88 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 1.03 0.00 0.00 1.17 0.00 0.00 82 V 8.98 4.81 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 0.97 0.00 0.00 0.95 0.00 0.00 83 V 9.02 4.86 2.36 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 1.04 0.00 0.00 1.06 0.00 0.00 84 R 8.80 5.03 0.00 1.83 1.83 0.00 3.32 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 1.58 1.58 0.00 85 A 8.90 4.94 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 86 T 8.60 4.99 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 1.21 0.00 0.00 87 A 8.89 5.19 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 88 E 9.01 4.83 0.00 2.05 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 2.32 2.26 0.00 89 I 8.52 4.41 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 1.23 0.69 0.91 0.00 0.00 90 V 8.69 3.86 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 1.09 0.00 0.00 1.14 0.00 0.00 91 R 8.75 4.30 0.00 1.81 1.91 0.00 3.20 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.51 0.00 92 K 8.03 4.03 0.00 1.76 1.71 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.11 7.81 93 L 8.58 4.24 0.00 1.74 1.76 0.92 1.03 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 94 D 8.09 4.40 0.00 2.88 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 95 E 8.17 4.09 0.00 2.29 2.17 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 2.46 2.44 0.00 96 I 7.98 3.86 2.09 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 1.64 0.84 1.07 0.00 0.00 97 A 8.01 4.04 1.43 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 98 Y 8.12 4.16 0.00 3.11 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 99 A 8.36 3.20 0.35 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 0.00 100 D 8.27 4.63 0.00 2.89 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 0.00 101 T 7.28 3.98 4.13 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 1.22 0.00 0.00 102 L 6.84 3.88 0.00 1.48 1.41 0.01 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 103 E 8.47 4.12 0.00 1.99 1.79 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 2.23 1.86 0.00 104 L 8.04 4.64 0.00 1.64 1.63 1.09 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.27 4.44 0.00 1.80 1.78 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.35 7.81 106 P 0.00 4.49 0.00 2.17 2.02 0.00 3.78 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 107 W 8.64 4.57 0.00 3.43 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 0.00 108 I 7.46 4.57 1.94 0.00 0.00 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 1.55 0.75 0.95 0.00 0.00 109 P 0.00 4.35 0.00 2.11 1.98 0.00 3.74 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 110 T 7.94 4.69 4.27 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 1.23 0.00 0.00 111 L 8.65 4.11 0.00 1.64 1.77 0.97 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 112 K 7.91 4.37 0.00 2.04 1.68 0.00 1.91 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.39 0.98 7.81 113 Y 7.49 5.07 0.00 2.90 2.80 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 0.00 114 N 9.28 5.05 0.00 2.66 2.69 0.00 0.00 7.30 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 0.00 115 Y 8.52 5.04 0.00 3.09 3.03 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 0.00 116 V 9.03 4.58 2.18 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 1.00 0.00 0.00 1.03 0.00 0.00 117 R 8.95 4.08 0.00 1.66 1.66 0.00 3.10 0.00 0.00 3.31 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.77 0.00 118 I 8.61 4.58 1.80 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.39 0.78 0.00 0.00 119 V 8.52 4.43 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 0.94 0.00 0.00 0.87 0.00 0.00 120 P 0.00 4.66 0.00 1.96 1.97 0.00 3.75 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 2.10 2.05 0.00 121 N 9.45 4.68 0.00 2.67 2.86 0.00 0.00 6.74 8.30 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 0.00 122 E 8.00 4.81 0.00 1.99 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 2.27 2.31 0.00 123 I 8.34 5.06 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 1.36 0.79 0.93 0.00 0.00 124 T 9.29 4.50 4.27 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 1.24 0.00 0.00 125 G 8.67 4.54 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 0.00 126 R 9.17 5.11 0.00 1.82 1.55 0.00 3.13 0.00 0.00 3.03 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.79 0.00 127 E 8.81 5.25 0.00 2.00 1.66 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 2.26 2.62 0.00 128 F 9.76 5.20 0.00 2.99 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 0.00 129 T 8.05 4.93 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 0.00 130 L 8.88 4.30 0.00 1.53 1.60 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.