NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2282 8.3049 118.1417 54.9731 32.5406 174.2063 2 F 4.8927 8.6473 118.2091 53.9989 42.4878 173.0511 3 D 4.9937 9.2283 124.6095 51.1700 42.0739 176.5767 4 A 3.9049 8.4535 120.2082 55.3590 17.8605 179.9463 5 F 4.0993 8.0547 115.8506 60.9540 39.3764 178.1620 6 T 4.0456 9.3985 109.8552 64.3381 68.2128 176.3275 7 K 3.1499 7.9845 122.9266 59.2824 32.3107 178.9224 8 V 3.5053 7.1429 118.9004 65.8244 31.4581 178.0692 9 V 3.5695 7.7670 118.2848 66.1090 30.9866 178.1500 10 S 4.1302 8.2499 114.2992 61.6073 62.3522 176.5044 11 Q 3.9443 7.7440 121.3040 58.4791 28.4525 178.3230 12 A 4.1384 7.8611 121.9414 54.9423 18.3567 179.1586 13 D 4.2882 8.2037 116.9791 57.6881 41.1373 178.5801 14 T 3.9206 7.5212 108.3036 64.0260 68.7258 175.5461 15 R 4.4374 7.2819 119.2175 54.8853 31.0730 176.1824 16 G 3.8780 8.0943 106.6285 46.8449 0.0000 173.2036 17 E 4.7681 8.0718 116.9428 54.2491 33.2181 175.7289 18 M 4.4903 8.1867 119.4611 53.7995 33.5268 176.6026 19 L 4.0868 8.2291 121.3781 54.8222 42.5516 178.2222 20 S 4.4399 8.3730 117.4378 58.2255 65.2302 175.7100 21 T 3.8409 8.3310 118.6711 66.7555 68.3801 176.8396 22 A 3.9766 7.9637 122.2466 55.0737 18.4761 179.3361 23 Q 3.8819 8.0908 118.0433 59.4832 28.9808 178.4379 24 I 3.7517 7.4875 119.4609 64.6301 37.4103 177.8457 25 D 4.4891 8.4223 119.5619 57.1652 40.3911 178.6951 26 A 3.9797 7.8279 121.0094 55.1943 18.5767 179.6664 27 L 3.9538 7.9238 116.8051 57.2920 41.5749 180.0731 28 S 4.1444 7.9143 115.8753 61.7094 62.8612 176.3166 29 Q 4.0011 8.0587 121.5814 59.1376 28.5058 177.8473 30 M 3.9849 7.5235 118.8518 58.6209 32.1117 178.1763 31 V 3.7807 7.7700 117.6733 65.6258 31.4328 177.8297 32 A 4.1507 7.9585 120.0860 54.2104 18.3472 178.3448 33 E 4.4735 7.8065 115.2913 56.3175 29.8099 177.8915 34 S 4.1285 7.6733 116.3613 61.9073 62.9046 176.2906 35 N 4.3584 8.2056 119.3008 56.1378 38.2766 177.3355 36 K 4.0580 7.9140 119.9954 59.2402 32.1035 179.4523 37 R 3.9226 7.8185 118.6532 59.5135 30.1061 178.4911 38 L 4.1714 8.0639 118.7747 57.7724 41.5055 179.2787 39 D 4.3703 8.1210 118.7497 57.0940 40.8475 178.6584 40 V 3.6174 7.7973 118.8872 66.1545 31.5344 178.2749 41 V 3.6511 7.8973 117.6796 66.1177 31.4651 177.4025 42 N 4.3469 8.4085 116.8618 56.7953 38.5251 177.0861 43 R 3.9654 8.2518 118.9311 59.2509 30.6024 178.8206 44 I 3.9197 7.7290 119.3270 64.7268 37.2623 178.5865 45 T 3.8938 8.0163 116.5329 66.8594 68.1220 176.7462 46 S 4.3991 8.1060 115.0511 60.2583 62.9579 174.7481 47 N 4.9628 7.7281 117.8601 52.5818 39.6375 175.9067 48 A 4.0069 8.0364 122.9453 55.7564 18.1979 180.8225 49 S 4.0894 8.0170 112.7034 62.0961 62.9863 177.0253 50 T 3.8647 7.8135 117.8299 66.5476 68.2822 176.6104 51 I 3.6573 7.8870 121.8148 64.3983 37.1152 178.6678 52 V 3.5373 7.8502 118.9897 65.9882 31.4283 178.1370 53 S 4.1037 8.2198 114.1366 61.6325 62.8227 176.1689 54 N 4.2781 8.2062 120.1660 55.7525 38.2479 177.2351 55 A 3.9003 7.9469 121.9317 54.9989 18.4656 179.5724 56 A 3.3549 8.0256 119.3150 55.1812 18.3616 179.7564 57 R 3.8996 8.2233 117.6616 59.7185 30.0407 178.6810 58 S 4.0712 8.0932 112.9305 60.9496 62.3720 175.8120 59 L 3.8393 7.7762 123.2037 58.2844 41.6043 179.1112 60 F 4.5888 7.5339 116.0789 60.5108 38.8556 177.2712 61 A 4.2055 7.7373 120.0452 54.8628 18.2328 179.0136 62 E 4.2908 7.8409 115.8809 57.6405 31.3152 177.1441 63 Q 4.6703 8.1640 117.6073 53.0310 29.1523 174.0161 64 P 4.5405 0.0000 0.0000 64.9314 31.6977 179.6126 65 Q 4.0151 8.0567 118.3047 58.6876 28.9423 178.3907 66 L 4.0569 7.9864 117.9564 56.8987 41.6709 177.8078 67 I 4.1585 7.2693 109.0676 60.2458 38.2103 175.5636 68 A 4.2366 7.5567 124.6189 50.6853 19.3629 175.1974 69 P 2.9700 0.0000 0.0000 64.0576 31.5711 177.1035 70 G 4.0458 8.3718 111.3606 45.3667 0.0000 174.8254 71 G 4.3556 8.1519 114.2666 44.5824 0.0000 175.4009 *73 A 4.1327 8.6174 128.3747 51.2158 19.8326 176.1637 74 Y 4.2339 7.6364 118.3871 58.7096 39.7724 175.8851 75 T 3.1115 7.3623 111.8690 62.0713 68.8528 172.9395 76 S 4.0242 8.2835 118.6282 61.6392 62.7754 176.9412 77 R 3.8363 7.8093 120.8667 59.6629 29.9265 178.7297 78 R 3.9204 7.5732 116.5926 59.1483 29.9367 178.6871 79 M 3.9449 8.0017 117.8682 58.6377 32.2904 177.9965 80 A 3.9756 8.1980 120.8081 55.3505 18.6428 179.4933 81 A 3.9913 8.2592 119.2148 55.2482 18.2330 179.5480 82 C 4.1202 8.2031 117.3994 62.6800 31.7296 175.7677 83 L 4.0496 8.2458 120.8570 57.7671 41.1826 179.4035 84 R 3.9249 8.1976 118.6734 59.6697 30.0140 178.2946 85 D 4.5166 8.1408 118.3909 57.6968 40.8137 178.7781 86 M 4.1451 7.9544 119.3615 58.1666 31.8679 178.4030 87 E 3.9370 8.2711 119.5365 59.2699 29.8531 178.8358 88 I 3.6966 8.1919 120.1940 64.5826 37.3221 178.4167 89 I 3.7569 7.8114 120.4826 64.3656 37.0483 178.2439 90 L 3.9350 8.0470 121.0990 58.0183 41.7616 178.8661 91 R 3.5415 8.0050 118.8737 59.7473 29.9554 178.2198 92 Y 3.4918 7.7129 116.1393 60.4472 37.7382 178.5205 93 V 3.3817 7.5352 119.6804 66.0602 31.5782 178.2332 94 T 3.9919 7.6571 109.1412 64.7510 68.4204 176.2600 95 Y 4.3025 7.5061 119.7489 60.9573 37.9034 177.9994 96 A 4.0540 7.9015 123.1220 54.5102 18.1238 179.8847 97 V 3.8040 7.5335 115.7696 66.1053 31.7215 177.7193 98 F 4.2876 8.1449 119.1055 61.3787 39.6185 176.6861 99 A 4.2320 8.7398 120.2361 52.7018 18.0114 178.9018 100 G 4.0004 8.7074 104.6417 45.8115 0.0000 172.8168 101 D 4.7518 7.5441 117.1344 51.4625 44.4354 175.8108 102 A 4.0023 8.7508 126.5377 53.5303 18.6254 179.6862 103 S 4.1339 8.2829 114.0515 61.8370 62.7453 177.2799 104 V 3.6550 7.7889 122.1467 64.2342 31.0245 178.0094 105 L 3.8750 7.7814 120.4114 57.9109 42.2305 178.6236 106 E 3.9006 8.1526 118.4367 59.4691 29.2005 179.1823 107 D 4.2437 8.1501 117.7790 57.4692 41.1546 178.6481 108 R 4.1531 7.6388 115.5995 57.1729 30.3975 175.8382 109 C 4.2175 7.3095 115.1104 60.6835 33.8467 175.0381 110 L 3.9321 8.0845 119.4132 56.7930 41.4827 176.4925 111 N 4.2361 7.6721 117.2445 54.7267 38.8464 174.4836 112 G 4.3563 8.8938 113.3043 46.1792 0.0000 174.4406 113 L 3.5519 7.7539 122.3185 57.8870 42.0297 178.6984 114 R 3.9260 8.0121 118.1958 59.9118 29.8227 177.9862 115 E 3.9830 8.0490 117.4169 59.6047 29.5453 179.2344 116 T 3.8300 7.6263 115.7117 66.9252 68.4404 176.3099 117 Y 4.4824 7.8987 118.6389 61.0468 37.6566 178.2259 118 L 3.9781 7.8999 120.1510 58.1359 42.2258 178.6907 119 A 4.1588 7.8957 119.7359 55.2442 18.4748 179.4639 120 L 4.1773 7.9523 116.2545 56.0932 41.7169 178.5778 121 G 3.9853 8.2536 106.2825 45.3599 0.0000 173.3428 122 T 3.9880 7.5565 116.4477 62.1362 69.2400 172.8049 123 P 4.4477 0.0000 0.0000 61.8062 31.1347 176.9115 124 G 3.8517 8.9932 113.7277 47.2037 0.0000 173.9266 125 S 4.3857 8.0442 115.7623 61.3423 62.9976 176.6502 126 S 4.1780 8.0791 119.0105 61.1474 62.5724 176.7053 127 V 3.5228 7.5476 120.4145 65.7902 31.2966 177.6713 128 A 4.0271 8.5654 120.9077 55.3589 18.3686 179.7635 129 V 3.6095 7.8951 116.7717 66.0729 31.6014 178.5318 130 G 3.5556 8.0672 105.6586 47.5547 0.0000 176.0059 131 V 3.8352 8.3276 121.2389 65.7642 31.5400 178.4280 132 G 3.5681 8.4105 105.8023 47.6934 0.0000 175.8819 133 K 3.9726 7.9544 120.4770 59.4768 31.9694 179.4230 134 M 4.0101 7.9543 118.9014 57.8807 31.8240 178.5804 135 K 2.4800 7.7838 119.8428 59.0712 32.2282 178.4091 136 E 3.8088 7.8509 118.4574 59.5792 29.3843 179.4872 137 A 3.9303 7.6770 120.2083 54.9723 18.4029 179.5644 138 A 3.9520 8.1904 119.7715 55.3154 18.4456 179.9131 139 L 3.9292 8.0129 117.3910 57.8175 41.4282 179.5951 140 A 3.9984 7.5859 119.7120 55.0971 18.4243 179.5030 141 I 3.8574 7.5402 118.0959 64.4427 37.0171 178.7562 142 V 3.6364 7.7915 118.1922 65.8188 31.4896 177.1071 143 N 4.7622 8.0962 113.5345 52.6954 39.0367 174.6848 144 D 4.3370 7.4236 122.2469 53.8212 41.2979 174.8644 145 P 4.3836 0.0000 0.0000 63.7525 31.7495 176.4332 146 A 4.0501 7.6620 123.0193 53.3312 18.9306 177.6138 147 G 4.0543 8.6496 110.4044 45.6892 0.0000 172.9297 148 I 4.4868 7.2537 114.9015 59.2966 41.1785 173.8388 149 T 3.9958 8.3584 122.7868 62.8890 68.7735 172.8215 150 P 4.3187 0.0000 0.0000 62.3694 31.9365 175.8322 151 G 3.8731 7.8456 109.6576 45.6610 0.0000 171.4745 152 D 4.6987 8.6292 119.0036 53.4263 42.0297 175.4992 153 C 4.9149 8.4732 122.3983 59.1028 29.8518 175.8172 154 S 4.1334 8.4056 118.0771 61.7561 62.3750 176.3858 155 A 4.0051 7.9316 123.8661 54.4016 18.1289 179.3330 156 L 3.8280 7.8242 118.3111 58.4108 42.3661 178.7150 157 A 4.1274 8.4216 121.1386 55.2689 18.2447 179.6285 158 S 3.9748 8.1349 111.6233 61.5389 62.2851 176.0511 159 E 3.7099 7.7278 120.6955 59.0501 29.7485 178.5257 160 I 3.9360 8.2149 120.0958 64.4687 37.2703 178.2062 161 A 4.3200 8.3305 121.8150 55.2556 18.1576 179.9056 162 G 3.4949 7.7793 103.7445 48.0815 0.0000 175.6466 163 Y 4.4029 7.4817 118.5449 61.0170 37.8685 178.3016 164 F 4.1536 8.2993 118.3067 60.6969 39.0637 177.3235 165 D 4.4596 8.5213 118.6285 57.2912 40.5907 178.9946 166 R 3.9635 8.0704 118.4872 59.0562 29.8179 178.9022 167 A 3.9313 8.0350 120.0571 55.1964 18.2885 179.2889 168 A 4.0670 8.2475 119.0445 55.6207 18.2398 179.8070 169 A 3.9895 8.0759 117.3570 54.8832 18.4830 179.3544 170 A 4.1148 7.8345 118.7063 54.4779 18.6119 179.2486 171 V 4.1896 7.4753 108.4953 62.2690 32.2171 176.4672 172 S 4.3492 7.7127 119.1863 58.7444 62.6925 173.8525 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 1 M 8.30 4.23 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 2 F 8.65 4.89 0.00 3.23 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 3 D 9.23 4.99 0.00 3.08 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 4 A 8.45 3.90 0.98 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 0.00 0.00 5 F 8.05 4.10 0.00 3.29 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 6 T 9.40 4.05 4.55 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 1.35 0.00 0.00 7 K 7.98 3.15 0.00 1.98 1.76 0.00 1.01 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.34 7.81 8 V 7.14 3.51 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 0.92 0.00 0.00 0.87 0.00 0.00 9 V 7.77 3.57 2.23 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 1.01 0.00 0.00 1.00 0.00 0.00 10 S 8.25 4.13 0.00 3.97 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 7.74 3.94 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 12 A 7.86 4.14 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 13 D 8.20 4.29 0.00 2.82 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 14 T 7.52 3.92 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 1.25 0.00 0.00 15 R 7.28 4.44 0.00 1.92 2.00 0.00 3.26 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 16 G 8.09 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 0.00 0.00 0.00 17 E 8.07 4.77 0.00 1.93 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 0.00 2.33 2.23 0.00 18 M 8.19 4.49 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 19 L 8.23 4.09 0.00 1.62 1.61 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.37 4.44 0.00 4.04 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 21 T 8.33 3.84 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 1.25 0.00 0.00 22 A 7.96 3.98 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 23 Q 8.09 3.88 0.00 2.19 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.73 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 24 I 7.49 3.75 2.03 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 1.55 0.89 0.94 0.00 0.00 25 D 8.42 4.49 0.00 2.87 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 26 A 7.83 3.98 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 27 L 7.92 3.95 0.00 1.99 1.88 1.05 0.55 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 28 S 7.91 4.14 0.00 4.11 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 29 Q 8.06 4.00 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 30 M 7.52 3.98 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.61 0.00 31 V 7.77 3.78 2.29 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 1.00 0.00 0.00 1.24 0.00 0.00 32 A 7.96 4.15 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 33 E 7.81 4.47 0.00 1.96 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 2.48 2.43 0.00 34 S 7.67 4.13 0.00 4.08 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.21 4.36 0.00 2.80 2.93 0.00 0.00 7.15 6.90 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 36 K 7.91 4.06 0.00 1.96 1.87 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.47 1.46 7.81 37 R 7.82 3.92 0.00 1.89 2.12 0.00 3.11 0.00 0.00 3.53 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 38 L 8.06 4.17 0.00 1.79 1.78 0.95 1.06 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 39 D 8.12 4.37 0.00 2.91 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 40 V 7.80 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 1.12 0.00 0.00 0.99 0.00 0.00 41 V 7.90 3.65 2.37 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 1.04 0.00 0.00 1.19 0.00 0.00 42 N 8.41 4.35 0.00 2.99 3.02 0.00 0.00 7.29 7.18 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 43 R 8.25 3.97 0.00 2.02 2.00 0.00 3.25 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.83 0.00 44 I 7.73 3.92 1.94 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.24 1.01 0.00 0.00 45 T 8.02 3.89 4.32 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 0.00 0.00 1.21 0.00 0.00 46 S 8.11 4.40 0.00 3.91 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 47 N 7.73 4.96 0.00 2.75 2.76 0.00 0.00 6.68 6.77 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 48 A 8.04 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 57 R 8.22 3.90 0.00 1.94 2.11 0.00 3.11 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 58 S 8.09 4.07 0.00 3.89 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 59 L 7.78 3.84 0.00 1.63 1.28 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 60 F 7.53 4.59 0.00 3.08 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 61 A 7.74 4.21 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 62 E 7.84 4.29 0.00 2.11 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 2.32 2.50 0.00 63 Q 8.16 4.67 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 64 P 0.00 4.54 0.00 2.22 2.33 0.00 3.72 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.01 0.00 65 Q 8.06 4.02 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.94 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 66 L 7.99 4.06 0.00 1.72 1.77 1.17 0.89 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 67 I 7.27 4.16 1.74 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.71 0.25 0.00 0.00 68 A 7.56 4.24 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 69 P 0.00 2.97 0.00 1.71 1.42 0.00 3.48 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.71 0.00 70 G 8.37 4.05 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 0.00 0.00 0.00 71 G 8.15 4.36 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 0.00 *73 A 8.62 4.13 1.14 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 0.00 0.00 74 Y 7.64 4.23 0.00 3.01 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 T 7.36 3.11 3.98 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 0.70 0.00 0.00 76 S 8.28 4.02 0.00 3.81 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 77 R 7.81 3.84 0.00 1.83 1.88 0.00 3.17 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 78 R 7.57 3.92 0.00 2.07 1.95 0.00 3.20 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 79 M 8.00 3.94 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 80 A 8.20 3.98 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 81 A 8.26 3.99 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 82 C 8.20 4.12 0.00 3.19 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 83 L 8.25 4.05 0.00 1.89 1.75 0.98 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 84 R 8.20 3.92 0.00 1.99 2.16 0.00 3.13 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 85 D 8.14 4.52 0.00 3.11 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 86 M 7.95 4.15 0.00 2.03 2.26 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 87 E 8.27 3.94 0.00 2.18 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 0.00 2.28 2.35 0.00 88 I 8.19 3.70 2.14 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.55 1.09 0.00 0.00 89 I 7.81 3.76 2.07 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 1.44 1.30 0.95 0.00 0.00 90 L 8.05 3.94 0.00 1.92 1.84 1.14 0.69 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 91 R 8.01 3.54 0.00 1.74 1.79 0.00 2.95 0.00 0.00 2.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.90 0.00 92 Y 7.71 3.49 0.00 2.94 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 93 V 7.54 3.38 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 0.38 0.00 0.00 0.44 0.00 0.00 94 T 7.66 3.99 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 95 Y 7.51 4.30 0.00 3.04 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.90 4.05 0.61 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 0.00 0.00 97 V 7.53 3.80 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 0.97 0.00 0.00 1.26 0.00 0.00 98 F 8.14 4.29 0.00 3.17 3.33 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 99 A 8.74 4.23 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 R 7.64 4.15 0.00 1.74 1.97 0.00 3.29 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 109 C 7.31 4.22 0.00 1.46 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 0.00 110 L 8.08 3.93 0.00 1.67 1.66 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 111 N 7.67 4.24 0.00 2.87 2.74 0.00 0.00 7.18 7.42 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 0.00 112 G 8.89 4.36 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 0.00 113 L 7.75 3.55 0.00 1.63 1.53 0.23 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 114 R 8.01 3.93 0.00 2.21 1.93 0.00 3.25 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.80 0.00 115 E 8.05 3.98 0.00 2.23 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 2.38 2.45 0.00 116 T 7.63 3.83 4.08 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 1.11 0.00 0.00 117 Y 7.90 4.48 0.00 3.13 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 0.00 118 L 7.90 3.98 0.00 1.86 1.73 0.97 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 119 A 7.90 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 0.00 120 L 7.95 4.18 0.00 1.90 1.82 1.07 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.25 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 0.00 0.00 0.00 122 T 7.56 3.99 4.16 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 0.73 0.00 0.00 123 P 0.00 4.45 0.00 2.19 2.21 0.00 3.61 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 2.03 1.94 0.00 124 G 8.99 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 0.00 0.00 0.00 125 S 8.04 4.39 0.00 4.06 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 S 8.08 4.18 0.00 4.05 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 0.00 127 V 7.55 3.52 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 1.16 0.00 0.00 0.52 0.00 0.00 128 A 8.57 4.03 1.47 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 0.00 0.00 0.00 129 V 7.90 3.61 2.24 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 0.97 0.00 0.00 0.96 0.00 0.00 130 G 8.07 3.56 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 0.00 0.00 0.00 131 V 8.33 3.84 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 1.33 0.00 0.00 1.08 0.00 0.00 132 G 8.41 3.57 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 0.00 133 K 7.95 3.97 0.00 1.93 1.80 0.00 1.62 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.56 7.81 134 M 7.95 4.01 0.00 2.20 2.32 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.55 0.00 135 K 7.78 2.48 0.00 1.26 1.71 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.19 1.04 7.81 136 E 7.85 3.81 0.00 2.12 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 137 A 7.68 3.93 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 0.00 138 A 8.19 3.95 1.32 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 0.00 0.00 0.00 0.00 0.00 139 L 8.01 3.93 0.00 1.80 1.69 0.95 0.53 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 0.00 140 A 7.59 4.00 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 0.00 141 I 7.54 3.86 2.01 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 1.41 0.84 0.97 0.00 0.00 142 V 7.79 3.64 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 0.87 0.00 0.00 1.06 0.00 0.00 143 N 8.10 4.76 0.00 2.85 2.84 0.00 0.00 6.99 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 0.00 144 D 7.42 4.34 0.00 2.85 2.67 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 0.00 145 P 0.00 4.38 0.00 2.22 2.15 0.00 3.82 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 146 A 7.66 4.05 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 0.00 147 G 8.65 4.05 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 0.00 0.00 0.00 148 I 7.25 4.49 1.88 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 1.43 0.69 0.92 0.00 0.00 149 T 8.36 4.00 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 1.22 0.00 0.00 150 P 0.00 4.32 0.00 2.04 1.98 0.00 3.75 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 2.03 2.08 0.00 151 G 7.85 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 0.00 0.00 0.00 152 D 8.63 4.70 0.00 2.63 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 0.00 153 C 8.47 4.91 0.00 2.98 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 0.00 154 S 8.41 4.13 0.00 4.05 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 0.00 155 A 7.93 4.01 1.32 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 0.00 0.00 0.00 0.00 0.00 156 L 7.82 3.83 0.00 1.78 1.86 0.96 1.23 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 0.00 157 A 8.42 4.13 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 0.00 158 S 8.13 3.97 0.00 4.05 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 0.00 159 E 7.73 3.71 0.00 1.94 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 1.85 2.07 0.00 160 I 8.21 3.94 2.11 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 1.62 1.06 1.23 0.00 0.00 161 A 8.33 4.32 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 0.00 162 G 7.78 3.49 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 0.00 0.00 0.00 163 Y 7.48 4.40 0.00 3.08 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 0.00 164 F 8.30 4.15 0.00 3.29 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.52 4.46 0.00 2.92 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 0.00 166 R 8.07 3.96 0.00 2.16 2.03 0.00 3.25 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.98 0.00 167 A 8.04 3.93 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 0.00 168 A 8.25 4.07 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 0.00 169 A 8.08 3.99 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 0.00 170 A 7.83 4.11 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 V 7.48 4.19 2.33 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 1.01 0.00 0.00 1.17 0.00 0.00 172 S 7.71 4.35 0.00 3.87 3.80 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 * Residues marked with a * may have inaccurate shift predictions.