NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 E 4.1956 8.3033 118.7979 55.1660 31.3869 176.2145 10 N 4.0718 8.3139 114.6150 53.7163 36.0679 172.6999 11 A 4.2454 7.6396 123.8232 51.3253 20.1418 177.9185 12 A 4.2225 8.2258 122.9309 51.1529 19.1621 176.2926 13 P 4.4215 0.0000 0.0000 61.9556 32.2598 176.2808 14 A 4.1404 8.3644 123.2633 52.6123 18.8341 177.2825 15 Q 4.5065 8.3266 120.4312 53.7435 32.9082 174.9510 16 A 4.2026 8.5076 124.6448 51.2674 19.3555 176.0220 17 P 4.3529 0.0000 0.0000 62.9268 33.1626 178.1849 18 V 3.6396 8.4536 121.6245 65.1548 31.1751 178.5606 19 S 4.1924 8.1348 113.1809 61.3671 62.2956 175.7762 20 D 4.5042 8.1627 121.0498 57.4029 40.6384 178.8819 21 R 3.9644 8.1633 118.4642 59.0762 30.0956 178.8882 22 A 3.9099 8.4071 120.9662 55.1416 18.4108 179.8573 23 W 4.3012 8.4270 117.2627 59.5633 29.0139 178.6827 24 A 4.1278 8.3430 121.1240 55.0465 17.9344 179.3339 25 L 3.8957 8.0844 118.7856 58.2198 42.2016 178.7931 26 F 4.1284 8.2181 120.4864 61.6933 39.2868 177.3939 27 R 3.9432 8.8617 117.7082 58.9807 29.6033 178.8801 28 A 3.9681 8.2030 120.3311 55.1744 18.8060 179.4561 29 L 4.0186 7.6621 116.8808 57.9039 41.8290 179.1530 30 D 4.2196 8.1957 118.4884 57.0928 40.8642 178.2688 31 G 3.7455 8.1610 104.9060 46.3546 0.0000 174.6288 32 K 4.4994 7.4819 118.8487 55.4726 32.4520 176.7787 33 G 3.8740 7.7446 106.9113 46.3058 0.0000 174.8675 34 L 4.1752 7.7620 118.1601 54.6688 42.2276 176.6118 35 V 4.1057 7.2753 118.4066 59.9076 33.0777 173.3192 36 P 4.4325 0.0000 0.0000 62.2306 31.9021 175.6547 37 D 4.5683 8.6933 120.1669 56.3028 41.1670 177.1843 38 G 4.1714 9.1771 110.5451 46.6109 0.0000 174.7096 39 Y 3.9686 8.2053 121.4974 60.8558 38.7896 178.7056 40 V 3.9028 8.1638 112.8162 64.3602 31.6458 178.3658 41 E 4.0775 8.3084 118.3061 59.1828 29.3805 179.3931 42 G 3.3417 8.1979 105.9183 47.4953 0.0000 175.7948 43 W 3.5835 7.6534 121.6464 59.0010 28.9991 178.3337 44 K 4.0071 8.1830 119.6841 59.4292 31.4722 178.5308 45 K 3.7995 7.7865 119.5423 59.8230 32.1368 178.7735 46 T 3.6319 7.4481 115.6999 66.6630 68.0688 176.6249 47 F 4.3266 7.6830 118.4939 60.5821 38.9510 177.1624 48 E 4.2261 8.1845 117.0812 58.1780 29.5611 177.8368 49 E 4.4929 8.2522 116.9483 56.9188 31.4416 177.0092 50 D 4.4878 7.6714 116.9951 56.3401 41.7153 176.9080 51 F 4.8066 7.7974 119.1267 57.7938 39.0433 175.0056 52 S 4.6318 8.5037 119.9323 55.1371 65.5865 173.3075 53 P 4.6121 0.0000 0.0000 65.2504 31.0909 178.7935 54 R 3.8713 7.9734 118.6125 59.0871 29.8373 179.1086 55 R 3.7972 7.8693 118.2728 59.1108 29.9995 179.1068 56 G 3.5890 7.8745 105.0885 47.7582 0.0000 175.4283 57 A 3.8541 8.1627 123.2698 54.8517 18.3934 179.2601 58 E 3.8013 8.1449 117.7425 59.4549 29.6460 179.1230 59 L 3.7225 7.6704 118.9821 57.5092 41.5475 179.7041 60 V 3.1854 7.7394 118.0089 65.8462 31.2167 177.9466 61 A 3.9667 7.5505 119.1954 54.9922 18.5039 179.3421 62 R 4.0261 7.9743 116.9739 59.6228 30.3000 178.5605 63 A 4.3132 8.2339 120.6400 55.2512 18.1562 179.6694 64 W 4.6584 8.5438 116.9091 59.0267 29.1825 177.1097 65 T 4.5682 7.8064 106.0678 61.2520 69.2539 174.6143 66 D 4.6633 7.9179 120.3197 51.1479 42.5790 173.0370 67 P 4.3208 0.0000 0.0000 65.2949 31.5176 177.7521 68 E 3.9680 8.2820 117.6297 59.3064 29.7147 178.5395 69 F 4.1115 8.6871 120.7970 61.0295 39.4523 176.8643 70 R 3.9119 8.5515 118.8994 59.8567 29.7282 178.5320 71 Q 3.9968 8.1704 117.5581 58.6732 28.6556 178.5848 72 L 3.7985 7.7380 121.3585 58.0266 42.1618 178.6043 73 L 3.6692 7.8103 120.5524 58.1517 41.7006 178.6970 74 L 4.2415 7.7681 117.1843 56.4090 41.7657 178.1884 75 T 4.5329 7.3126 108.4867 61.7057 71.7234 174.3399 76 D 4.5640 8.4915 120.9664 50.7930 41.7225 175.1670 77 G 3.7311 8.0223 111.6977 46.5440 0.0000 172.2397 78 T 3.7328 7.5814 117.1928 66.4344 68.4043 176.2739 79 A 3.9271 8.1049 122.2382 54.9953 16.9545 179.5327 80 A 3.8976 7.7670 119.0120 55.4098 18.5686 180.0967 81 V 3.8548 8.1450 116.8912 66.0840 31.5216 178.0168 82 A 4.0714 8.3809 120.8036 55.2497 17.9263 179.5602 83 Q 3.8903 7.8708 115.5743 59.0235 28.8900 177.2285 84 Y 3.7415 7.4915 111.1487 57.4347 38.2053 175.8075 85 G 3.8495 7.9207 107.9683 47.0976 0.0000 173.8689 86 Y 5.0108 7.7022 114.3848 57.3135 38.2998 176.4847 87 L 4.3227 8.0198 120.1910 54.9039 42.5553 176.7061 88 G 4.0607 8.1696 107.7969 45.0024 0.0000 170.6382 89 P 4.4613 0.0000 0.0000 64.4805 31.8675 176.2669 90 Q 3.1801 8.6593 120.0170 56.3641 26.6893 174.5306 91 G 4.2169 7.6456 100.8539 44.7110 0.0000 175.4892 92 E 4.2692 8.1951 118.0589 56.4627 31.4865 175.8281 93 Y 4.4436 7.7383 119.0587 55.8269 40.9360 173.8681 94 I 4.7729 8.2323 128.3979 59.3666 40.0834 175.0992 95 V 4.5717 8.2619 125.9267 60.9544 34.2147 173.8680 96 A 5.0789 8.5978 129.5179 50.7223 20.6792 176.2721 97 V 4.3148 8.5833 115.5517 59.3872 34.6385 174.4912 98 E 4.7505 8.7306 126.5450 54.9190 29.8637 175.4666 99 D 4.9353 8.9743 128.0051 54.8265 42.4839 175.5919 100 T 4.7112 8.8170 111.1309 59.3161 72.5643 172.9435 101 P 4.3602 0.0000 0.0000 65.1151 31.5356 177.3517 102 T 4.6849 7.9908 106.8385 60.8726 70.4717 173.2053 103 L 5.1071 8.2215 124.8009 53.9048 45.9040 174.3338 104 K 4.9805 9.4732 128.0615 54.7978 34.3271 174.3451 105 N 5.6029 9.5572 125.1996 52.0875 41.2135 174.2803 106 V 4.8039 8.8763 121.0668 61.5165 35.5406 173.7653 107 I 5.2796 8.7409 127.5426 59.8474 39.7277 175.1854 108 V 4.4348 8.8334 123.8788 60.7290 34.1421 173.2418 109 C 5.2127 7.8378 118.7074 57.4586 32.3712 174.5252 110 S 4.3625 9.5029 122.4073 60.6439 62.9791 176.0739 111 L 4.1013 7.2140 119.9171 56.6098 42.1599 176.7156 *113 S 4.4267 7.5453 110.8428 58.2709 63.8035 172.6560 *115 T 4.0857 8.2456 114.8133 63.8634 69.7086 174.9257 116 A 4.8774 8.0035 127.3179 50.6039 16.4945 177.7159 117 W 4.6252 8.2319 123.4338 59.0125 29.7170 177.4610 118 P 3.9905 0.0000 0.0000 64.3131 31.2224 177.7678 119 I 4.2335 7.6465 109.6774 60.5063 38.9852 176.5238 120 L 4.3976 7.9660 119.2713 53.6010 43.0646 177.5384 121 G 4.1205 8.0716 103.6841 44.6711 0.0000 173.3757 122 L 3.6133 8.0961 118.8755 53.6862 42.0613 175.9952 123 P 3.9889 0.0000 0.0000 61.9467 32.0339 174.5344 124 P 4.3727 0.0000 0.0000 62.3336 32.4732 177.1357 125 T 3.8020 8.6007 116.4549 66.8761 68.3804 176.6819 126 W 4.2876 8.0238 117.7941 59.7288 27.9235 177.5776 127 Y 3.2352 6.5352 119.4751 59.5037 38.1582 176.8810 128 K 4.3358 7.5236 116.9567 55.8053 33.0857 177.3303 129 S 4.2746 7.2910 114.9843 57.8188 63.8592 175.4890 130 F 4.5807 8.4695 120.9136 60.7540 38.5883 177.8337 131 E 4.0516 8.3228 117.9700 59.6551 29.3992 178.6383 132 Y 4.1602 8.2270 119.4097 60.8914 38.7355 177.9131 133 R 3.8098 8.0870 117.5407 59.1758 30.2074 178.6405 134 A 4.1123 8.2449 119.9815 54.8606 18.8539 179.2475 135 R 4.1947 7.9365 116.2677 58.4911 30.4797 179.4924 136 V 3.7770 7.3853 118.3300 64.4626 31.3069 178.0134 137 V 3.6322 7.5641 118.3033 63.7815 31.6560 176.7656 138 R 4.2667 7.8624 119.1205 57.0348 31.6361 175.9201 139 E 4.7633 8.4938 114.9269 53.5647 29.3975 174.6314 140 P 4.2574 0.0000 0.0000 66.3903 31.8771 178.5443 141 R 3.8435 7.8853 118.1815 59.2092 30.0462 178.2727 142 K 3.9472 7.9586 118.9968 59.2994 32.3063 178.6886 143 V 3.6012 7.9244 118.5536 66.1303 31.4888 177.9761 144 L 4.0047 8.1797 118.8524 57.7639 41.4711 179.3563 145 S 4.3445 8.0865 114.3402 61.0536 62.1191 176.2270 146 E 4.0163 8.2397 119.9189 59.4813 29.2721 178.6446 147 M 4.2229 7.8054 116.6913 55.6810 32.1929 177.0666 148 G 4.0675 7.7887 107.7922 45.3037 0.0000 173.4946 149 T 4.4484 8.5048 117.2409 61.4361 70.3824 172.9619 150 E 4.2884 8.7480 126.7640 55.1068 30.4592 175.8626 151 I 4.3163 8.1420 124.5272 58.9583 39.1840 175.5108 152 A 4.2136 8.4542 128.7185 51.9075 18.8512 178.2142 153 S 4.1688 8.5366 114.1649 61.2897 63.1278 175.0810 154 D 4.6433 8.0354 118.2822 54.4166 40.7922 175.3857 155 I 4.5928 7.3170 121.0435 59.2017 39.0996 175.2074 156 E 4.1317 9.0211 129.1869 56.2506 30.7226 175.2864 157 I 4.8624 8.3145 127.5392 59.9216 39.1133 174.8582 158 R 4.4586 9.1029 127.5482 54.4843 32.6167 174.1137 159 V 4.7076 8.2949 126.5414 61.6426 33.2713 174.3118 160 Y 4.1625 9.1825 126.7694 56.6653 39.2070 174.1991 161 D 5.0226 8.5583 125.2930 53.5685 42.1783 176.9219 162 T 4.7288 9.3187 125.2020 63.0779 66.7098 174.6611 163 T 4.5078 8.4648 112.8942 61.3467 71.1990 175.3346 164 A 4.5936 7.3084 127.2344 52.1089 18.8663 178.0289 165 E 4.3196 8.7061 116.8336 59.1926 30.3722 176.4615 166 T 4.1709 7.7107 115.8368 63.8841 69.2626 173.7079 167 R 4.4753 8.8007 124.8797 54.5932 32.9561 174.4568 168 Y 5.8335 8.8935 121.3546 55.9573 40.3431 174.9660 169 M 4.9042 8.3187 118.1379 53.5597 35.1903 174.0325 170 V 4.2948 8.5616 121.5378 62.1702 33.0960 175.3647 171 L 4.4253 8.9344 131.0310 53.1836 42.4099 174.0860 172 P 5.2506 0.0000 0.0000 61.3641 32.5144 176.4944 173 Q 4.2653 8.6433 120.3059 56.0193 29.5372 176.4103 174 R 2.5568 8.0747 123.4781 54.3723 30.1105 174.5512 175 P 4.1811 0.0000 0.0000 61.9054 32.1897 175.8113 176 A 3.9541 8.0313 123.3089 53.7165 18.7166 178.0843 177 G 3.8519 8.8298 108.7668 45.5004 0.0000 174.2635 178 T 2.4800 6.6625 108.3824 60.2204 68.8618 173.8536 179 E 4.0484 7.6638 122.1464 58.2475 29.6235 177.5161 180 G 4.0711 8.9697 111.7858 45.0505 0.0000 173.6750 181 W 4.5880 7.9911 119.7517 56.7381 29.8259 176.7410 182 S 4.5535 9.2138 117.1180 58.0195 64.7216 175.5149 183 Q 4.1200 8.6481 121.1807 59.1676 28.2907 178.7904 184 E 3.9834 8.1969 119.7890 59.4764 29.5220 178.7960 185 Q 3.9438 7.9429 116.9595 58.8616 29.0913 178.4709 186 L 4.6734 8.4746 120.1099 58.1167 41.8014 179.2293 187 Q 4.0079 8.6612 118.4945 59.3004 28.4484 178.9347 188 E 4.0350 7.9610 119.4258 58.7003 29.7392 177.9689 189 I 4.5311 7.7485 110.1841 60.1149 38.3824 175.7330 190 V 4.0149 7.4707 121.8611 62.2501 31.1340 175.7425 191 T 4.5213 8.0319 118.3278 59.6477 72.1814 174.9670 192 K 3.7974 8.5580 121.4548 60.2704 31.9865 178.2325 193 D 4.6226 8.1700 117.9999 57.3844 40.5234 178.4145 194 C 4.8294 7.4904 118.0532 62.3162 28.3280 175.7160 195 L 4.1603 7.9706 120.5118 57.7463 41.1918 179.5640 196 I 3.9077 7.9712 120.1193 63.1546 36.9152 177.5384 197 G 4.3306 7.9904 104.7245 46.1927 0.0000 174.7735 198 V 3.9403 7.9289 111.8046 62.2782 32.4826 175.7575 199 A 4.9043 7.6922 121.2760 49.0666 21.9521 174.4779 200 I 4.7331 7.9961 120.1422 58.4951 39.3194 174.4241 201 P 4.4849 0.0000 0.0000 63.2024 31.7428 175.5605 202 Q 4.5985 8.6249 121.3317 54.0911 30.6316 174.9971 203 V 4.3788 8.1089 122.0629 60.2604 32.9650 173.7712 204 P 4.4361 0.0000 0.0000 62.9349 31.9171 176.3807 205 T 4.0754 8.4493 116.2348 64.1214 68.3030 174.3787 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 9 E 8.30 4.20 0.00 2.17 2.26 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 2.26 2.43 0.00 10 N 8.31 4.07 0.00 2.99 2.97 0.00 0.00 7.01 6.46 0.00 0.00 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 A 7.64 4.25 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 12 A 8.23 4.22 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 13 P 0.00 4.42 0.00 2.20 2.07 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 14 A 8.36 4.14 1.27 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 0.00 0.00 0.00 15 Q 8.33 4.51 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.97 0.00 0.00 0.00 0.00 0.00 2.27 2.57 0.00 16 A 8.51 4.20 1.27 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 0.00 0.00 0.00 17 P 0.00 4.35 0.00 2.32 2.03 0.00 3.75 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 2.24 2.18 0.00 18 V 8.45 3.64 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 0.96 0.00 0.00 0.92 0.00 0.00 19 S 8.13 4.19 0.00 4.02 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 D 8.16 4.50 0.00 2.98 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 21 R 8.16 3.96 0.00 2.04 1.99 0.00 3.14 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 22 A 8.41 3.91 1.11 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 0.00 0.00 23 W 8.43 4.30 0.00 3.58 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 24 A 8.34 4.13 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.08 3.90 0.00 1.80 1.91 0.93 0.67 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 26 F 8.22 4.13 0.00 3.16 3.45 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 0.00 0.00 0.00 0.00 27 R 8.86 3.94 0.00 1.98 2.04 0.00 3.29 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.22 0.00 28 A 8.20 3.97 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 29 L 7.66 4.02 0.00 1.72 1.62 0.92 0.82 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 30 D 8.20 4.22 0.00 1.60 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 0.00 0.00 0.00 0.00 31 G 8.16 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 32 K 7.48 4.50 0.00 1.86 1.80 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.15 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.53 7.81 33 G 7.74 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 34 L 7.76 4.18 0.00 1.70 1.66 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 35 V 7.28 4.11 2.16 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 1.04 0.00 0.00 0.85 0.00 0.00 36 P 0.00 4.43 0.00 2.36 2.01 0.00 3.20 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 1.95 2.03 0.00 37 D 8.69 4.57 0.00 2.71 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.18 4.17 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 0.00 0.00 0.00 39 Y 8.21 3.97 0.00 3.36 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 40 V 8.16 3.90 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 1.18 0.00 0.00 0.95 0.00 0.00 41 E 8.31 4.08 0.00 2.21 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 0.00 2.42 2.47 0.00 42 G 8.20 3.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 W 7.65 3.58 0.00 3.28 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 44 K 8.18 4.01 0.00 1.95 2.01 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.51 7.81 45 K 7.79 3.80 0.00 1.87 1.81 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.40 7.81 46 T 7.45 3.63 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 47 F 7.68 4.33 0.00 3.04 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 48 E 8.18 4.23 0.00 1.92 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 2.33 2.54 0.00 49 E 8.25 4.49 0.00 1.94 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 2.20 2.26 0.00 50 D 7.67 4.49 0.00 2.57 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 51 F 7.80 4.81 0.00 3.06 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 52 S 8.50 4.63 0.00 3.75 3.58 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 53 P 0.00 4.61 0.00 2.28 2.40 0.00 3.74 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.04 0.00 54 R 7.97 3.87 0.00 1.81 2.00 0.00 3.27 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 55 R 7.87 3.80 0.00 1.72 1.36 0.00 3.02 0.00 0.00 2.56 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.22 0.00 56 G 7.87 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.16 3.85 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 58 E 8.14 3.80 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.41 0.00 59 L 7.67 3.72 0.00 1.83 1.71 0.95 0.53 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 60 V 7.74 3.19 1.72 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 -0.37 0.00 0.00 0.75 0.00 0.00 61 A 7.55 3.97 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 62 R 7.97 4.03 0.00 1.83 1.80 0.00 3.05 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.18 0.00 63 A 8.23 4.31 1.49 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 64 W 8.54 4.66 0.00 3.54 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 65 T 7.81 4.57 4.33 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 1.40 0.00 0.00 66 D 7.92 4.66 0.00 2.83 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 67 P 0.00 4.32 0.00 2.24 2.14 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 2.16 2.21 0.00 68 E 8.28 3.97 0.00 2.09 2.16 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 2.42 2.40 0.00 69 F 8.69 4.11 0.00 3.26 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 70 R 8.55 3.91 0.00 2.33 2.15 0.00 3.46 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 71 Q 8.17 4.00 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.59 0.00 0.00 0.00 0.00 0.00 2.56 2.52 0.00 72 L 7.74 3.80 0.00 1.67 1.47 0.85 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.81 3.67 0.00 1.20 1.61 0.81 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.77 4.24 0.00 1.65 1.69 0.94 0.87 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 75 T 7.31 4.53 4.21 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 1.25 0.00 0.00 76 D 8.49 4.56 0.00 2.50 2.42 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 77 G 8.02 3.73 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 0.00 0.00 0.00 78 T 7.58 3.73 4.19 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 1.21 0.00 0.00 79 A 8.10 3.93 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 80 A 7.77 3.90 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 81 V 8.14 3.85 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 1.14 0.00 0.00 1.01 0.00 0.00 82 A 8.38 4.07 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 83 Q 7.87 3.89 0.00 2.38 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.68 0.00 84 Y 7.49 3.74 0.00 2.53 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 85 G 7.92 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 86 Y 7.70 5.01 0.00 3.04 2.89 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 87 L 8.02 4.32 0.00 1.70 1.65 0.94 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4.18 4.06 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 0.00 0.00 0.00 0.00 *115 T 8.25 4.09 4.43 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 1.20 0.00 0.00 116 A 8.00 4.88 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 0.00 117 W 8.23 4.63 0.00 3.09 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 0.00 118 P 0.00 3.99 0.00 2.26 2.03 0.00 3.41 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.61 0.00 119 I 7.65 4.23 1.83 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 1.38 0.77 0.94 0.00 0.00 120 L 7.97 4.40 0.00 1.78 1.65 0.89 0.67 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 0.00 121 G 8.07 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 0.00 122 L 8.10 3.61 0.00 1.35 1.18 0.17 -0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 3.99 0.00 2.07 1.72 0.00 3.54 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 1.94 2.22 0.00 124 P 0.00 4.37 0.00 1.90 2.10 0.00 2.99 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.57 0.00 125 T 8.60 3.80 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 1.20 0.00 0.00 126 W 8.02 4.29 0.00 3.54 3.32 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 0.00 127 Y 6.54 3.24 0.00 1.43 2.43 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 0.00 128 K 7.52 4.34 0.00 1.85 1.85 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.17 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.55 1.51 7.81 129 S 7.29 4.27 0.00 4.26 4.06 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 0.00 0.00 0.00 0.00 130 F 8.47 4.58 0.00 3.07 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 0.00 131 E 8.32 4.05 0.00 2.19 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 2.47 2.52 0.00 132 Y 8.23 4.16 0.00 3.35 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 0.00 133 R 8.09 3.81 0.00 1.99 2.14 0.00 3.28 0.00 0.00 3.52 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.83 0.00 134 A 8.24 4.11 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 0.00 135 R 7.94 4.19 0.00 2.01 1.97 0.00 3.16 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 136 V 7.39 3.78 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 0.04 0.00 0.00 0.90 0.00 0.00 137 V 7.56 3.63 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 0.63 0.00 0.00 0.86 0.00 0.00 138 R 7.86 4.27 0.00 1.74 1.94 0.00 3.15 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 139 E 8.49 4.76 0.00 2.06 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 2.26 2.21 0.00 140 P 0.00 4.26 0.00 2.29 2.49 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.00 0.00 141 R 7.89 3.84 0.00 1.90 1.96 0.00 3.18 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 1.70 1.69 0.00 142 K 7.96 3.95 0.00 1.86 1.79 0.00 1.78 0.00 0.00 1.95 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.62 1.50 7.81 143 V 7.92 3.60 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 1.16 0.00 0.00 0.97 0.00 0.00 144 L 8.18 4.00 0.00 1.93 1.93 1.09 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 145 S 8.09 4.34 0.00 3.96 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.24 4.02 0.00 2.11 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 2.34 2.52 0.00 147 M 7.81 4.22 0.00 1.77 2.13 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.34 0.00 148 G 7.79 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.50 4.45 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 1.23 0.00 0.00 150 E 8.75 4.29 0.00 1.95 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 0.00 2.27 2.26 0.00 151 I 8.14 4.32 1.88 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 1.37 0.89 0.93 0.00 0.00 152 A 8.45 4.21 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 0.00 153 S 8.54 4.17 0.00 3.99 4.02 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 0.00 154 D 8.04 4.64 0.00 2.69 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 0.00 155 I 7.32 4.59 2.00 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 1.29 0.58 0.92 0.00 0.00 156 E 9.02 4.13 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 157 I 8.31 4.86 1.87 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 1.25 0.72 0.93 0.00 0.00 158 R 9.10 4.46 0.00 1.79 1.91 0.00 3.26 0.00 0.00 2.82 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.25 0.00 159 V 8.29 4.71 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 0.80 0.00 0.00 0.93 0.00 0.00 160 Y 9.18 4.16 0.00 2.55 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 0.00 0.00 0.00 0.00 161 D 8.56 5.02 0.00 2.66 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.32 4.73 4.40 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 1.34 0.00 0.00 163 T 8.46 4.51 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 1.27 0.00 0.00 164 A 7.31 4.59 1.01 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 0.00 165 E 8.71 4.32 0.00 1.80 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 2.16 2.17 0.00 166 T 7.71 4.17 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 0.50 0.00 0.00 167 R 8.80 4.48 0.00 1.56 1.69 0.00 3.25 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 168 Y 8.89 5.83 0.00 2.84 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 M 8.32 4.90 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 170 V 8.56 4.29 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 0.78 0.00 0.00 1.07 0.00 0.00 171 L 8.93 4.43 0.00 1.76 1.71 0.80 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 172 P 0.00 5.25 0.00 2.29 2.11 0.00 3.74 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 2.12 2.19 0.00 173 Q 8.64 4.27 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 174 R 8.07 2.56 0.00 0.67 1.13 0.00 2.64 0.00 0.00 2.84 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.50 0.00 175 P 0.00 4.18 0.00 2.05 2.02 0.00 2.90 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.98 0.00 176 A 8.03 3.95 1.15 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 0.00 0.00 177 G 8.83 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 0.00 178 T 6.66 2.48 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 -0.10 0.00 0.00 179 E 7.66 4.05 0.00 1.92 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 2.25 2.26 0.00 180 G 8.97 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 W 7.99 4.59 0.00 3.38 3.22 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 0.00 182 S 9.21 4.55 0.00 4.07 4.02 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 0.00 183 Q 8.65 4.12 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.94 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 184 E 8.20 3.98 0.00 2.05 1.95 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 2.37 2.41 0.00 185 Q 7.94 3.94 0.00 2.31 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.74 0.00 0.00 0.00 0.00 0.00 1.97 2.22 0.00 186 L 8.47 4.67 0.00 2.13 2.24 1.26 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 187 Q 8.66 4.01 0.00 2.28 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.58 2.54 0.00 188 E 7.96 4.03 0.00 2.10 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 0.00 2.38 2.36 0.00 189 I 7.75 4.53 2.18 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.08 1.31 0.00 0.00 190 V 7.47 4.01 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 0.68 0.00 0.00 0.74 0.00 0.00 191 T 8.03 4.52 4.28 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 1.26 0.00 0.00 192 K 8.56 3.80 0.00 1.86 1.93 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.71 7.81 193 D 8.17 4.62 0.00 2.81 2.75 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 0.00 194 C 7.49 4.83 0.00 3.17 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 0.00 195 L 7.97 4.16 0.00 1.90 1.70 0.94 0.69 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 0.00 196 I 7.97 3.91 2.10 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 1.33 0.98 1.28 0.00 0.00 197 G 7.99 4.33 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 0.00 198 V 7.93 3.94 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 1.02 0.00 0.00 1.01 0.00 0.00 199 A 7.69 4.90 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 0.00 200 I 8.00 4.73 1.90 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 1.46 0.72 0.94 0.00 0.00 201 P 0.00 4.48 0.00 2.21 2.40 0.00 3.77 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 2.46 2.33 0.00 202 Q 8.62 4.60 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.72 0.00 0.00 0.00 0.00 0.00 2.45 2.28 0.00 203 V 8.11 4.38 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 0.86 0.00 0.00 0.76 0.00 0.00 204 P 0.00 4.44 0.00 2.18 2.05 0.00 4.06 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 205 T 8.45 4.08 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 1.23 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.