NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 32 V 4.4856 8.2904 119.7643 62.9335 32.8496 175.9597 33 A 4.2847 8.0308 122.3784 51.7581 20.3313 176.9487 34 D 5.2928 8.6635 115.3509 53.6294 45.3764 174.8974 35 R 5.2274 7.7915 116.2585 54.4159 34.2300 174.4565 36 Y 4.8311 9.2069 120.7592 56.1023 40.4669 174.6777 37 A 4.9147 8.7645 127.0444 51.4218 20.0235 176.4488 38 V 4.4380 9.3479 122.7265 61.4787 34.4333 174.3152 39 Y 4.8363 9.1214 126.8483 56.7774 37.7212 175.2333 40 W 4.0621 9.1602 135.0000 55.9953 29.5134 174.4016 41 N 5.3283 7.9538 120.6510 51.1432 39.7488 175.9947 42 S 4.3154 9.8132 116.2174 60.7742 63.0951 175.3654 43 S 4.4328 8.6191 116.6636 59.4492 63.3793 174.3501 44 N 4.5197 8.3439 120.7138 52.6926 39.5421 173.3222 45 P 4.2520 0.0000 0.0000 65.9868 31.2926 178.7226 46 R 3.6348 7.7171 115.4836 59.0117 30.0228 178.6735 47 F 4.3959 7.9663 116.9488 60.1462 38.9991 177.7128 48 Q 4.0874 8.0093 116.9984 59.1690 28.4610 179.0167 49 R 4.0838 8.0809 118.4386 57.0365 29.8283 178.6185 50 G 4.0381 8.1155 106.2714 45.7556 0.0000 173.3451 51 D 4.9976 7.5337 118.3019 52.6685 40.1969 175.0643 52 Y 4.3379 8.3258 121.9972 59.5233 39.5341 174.3177 53 H 5.6899 9.0051 121.5394 54.0694 32.0683 172.5809 54 I 4.7257 8.6520 112.7202 59.4656 41.3354 173.3471 55 D 5.3240 8.5372 123.1283 52.9809 42.8712 175.9167 56 V 4.3251 8.4070 115.0954 59.9391 36.7804 173.5163 57 C 5.1821 9.7515 119.0596 54.8038 43.4317 174.2274 58 I 4.1019 8.0901 121.3449 63.2231 37.0820 176.6250 59 N 4.3756 9.8374 121.5006 53.3637 37.1238 174.2380 60 D 5.0022 8.0401 119.0493 54.2173 42.8549 174.6030 61 Y 5.0460 9.7393 116.9381 56.2509 41.9295 174.6925 62 L 5.2184 9.0539 124.6345 53.5107 44.9409 174.6215 63 D 5.0273 9.2360 126.6011 52.5705 43.2527 175.2108 64 V 4.4774 8.3163 124.8154 61.2283 33.5802 174.3039 65 F 4.9540 9.1600 127.2689 55.9340 40.7730 175.0697 66 C 5.0465 9.0333 121.9634 55.7090 39.7191 171.9485 67 P 4.5350 0.0000 0.0000 63.7865 31.9962 174.9296 68 H 5.2089 8.2269 122.1861 54.8507 33.0530 171.6119 69 Y 4.9107 8.4466 120.8710 56.1464 42.5135 174.8917 70 E 4.3347 8.8234 119.9384 56.1619 30.5184 178.0725 71 D 4.3562 8.9090 121.9098 57.3985 41.0009 178.0331 72 S 4.2901 8.0330 111.0801 59.0661 63.2061 173.7814 73 V 4.1118 7.4667 122.4246 60.9954 31.9270 174.7162 74 P 4.1448 0.0000 0.0000 62.9791 30.5741 176.7553 75 E 3.7462 8.0000 117.7783 58.4401 28.6985 176.3657 76 D 3.8421 7.8413 118.9802 57.1271 41.1516 178.1989 77 K 4.3764 7.7948 115.0207 56.1552 32.5097 175.6131 78 T 3.4554 8.3015 118.4323 61.9792 69.0376 174.3528 79 E 4.2766 8.9534 127.2762 55.6888 30.7704 176.2348 80 R 4.8276 7.6221 120.3518 54.9303 34.8832 173.6301 81 Y 5.3525 8.7127 118.3302 56.6848 43.4790 173.8472 82 V 4.5240 8.6762 120.8261 61.1265 34.3539 174.1735 83 L 4.9054 8.6708 127.6798 53.1915 44.0343 175.1169 84 Y 4.9282 9.0301 120.6588 56.2953 42.1590 174.0217 85 M 4.6320 8.1068 121.8194 54.1941 34.2817 175.3116 86 V 5.0660 8.5277 118.2824 59.7721 36.7658 174.3433 87 N 4.8792 8.2743 119.1402 51.6938 38.9610 175.9480 88 F 3.1706 8.6878 119.0603 61.3484 39.1401 176.4711 89 D 4.1555 8.1103 117.8869 57.3431 40.6148 178.8459 90 G 3.6210 9.1903 106.8505 47.8630 0.0000 175.0971 91 Y 4.0373 7.9910 121.8780 60.7139 38.6357 178.3229 92 S 3.8963 7.8462 114.8323 60.9832 62.9797 175.6439 93 A 4.2291 7.7394 120.2679 51.1436 19.3080 176.0851 94 C 4.0412 7.5047 114.0797 58.1947 38.3937 173.4108 95 D 4.7687 8.7483 119.2989 53.0132 42.0152 174.7092 96 H 4.6317 8.4057 120.9380 55.6077 29.0686 175.3536 97 T 4.0987 8.7470 118.7466 66.2536 69.1334 176.6763 98 S 4.1645 8.2600 115.6794 60.9672 63.1967 175.1032 99 K 4.3198 7.5956 122.5946 56.2217 34.4397 175.9750 100 G 4.2876 7.8662 112.5076 45.7163 0.0000 169.8984 101 F 5.1643 8.1288 112.9087 54.9542 41.5614 173.8899 102 K 3.7843 8.8955 122.2893 57.1810 31.9679 175.8045 103 R 3.7553 8.4742 126.1878 56.8527 31.5543 176.5910 104 W 4.5929 6.9691 116.4351 54.5094 33.9588 173.6443 105 E 4.5767 8.1488 122.8046 54.7902 31.2731 177.0494 106 C 4.9343 9.3534 128.1126 55.0839 39.0243 173.7550 107 N 5.0790 8.2873 115.0759 52.3169 38.3777 176.5964 108 R 4.7161 7.6561 116.9104 54.1032 30.4351 174.3291 109 P 4.7854 0.0000 0.0000 64.6054 31.9013 178.1523 110 H 5.1190 7.9290 115.7460 54.8766 29.4822 173.9214 111 S 4.2163 8.0738 114.4693 58.1386 63.0882 172.3215 112 P 4.3981 0.0000 0.0000 65.6865 31.0776 177.1988 113 N 4.7382 8.0862 115.3361 52.1442 38.5712 174.5213 114 G 3.7810 7.9918 104.1083 43.6802 0.0000 171.2210 115 P 4.2771 0.0000 0.0000 62.5424 31.8694 176.6393 116 L 4.0188 8.3741 121.4404 54.7860 42.7834 175.8859 117 K 4.4764 7.8163 123.2620 54.4017 35.0864 175.0499 118 F 4.6775 8.4251 125.0639 55.5261 42.6489 174.2452 119 S 4.9823 8.4364 116.3141 56.6387 66.2558 172.9284 120 E 4.7186 9.1342 125.2879 54.2080 31.9508 174.1815 121 K 4.1940 8.4304 127.9006 54.4353 33.8704 176.8180 122 F 3.9325 8.1500 128.2243 55.9012 37.2661 174.3980 123 Q 4.6297 7.8565 119.7061 54.1883 31.4251 177.9663 124 L 4.3946 8.6609 120.0236 56.4145 42.1308 177.5349 125 F 4.9844 8.0173 118.7022 56.3682 42.1792 173.7751 126 T 4.3758 7.8947 123.8806 61.1022 71.4034 172.4301 127 P 4.0700 0.0000 0.0000 63.3131 32.1570 175.8458 128 F 4.9883 7.0141 117.7890 55.7373 40.9572 176.1283 129 S 4.2925 8.6209 117.9000 60.8050 63.2928 174.8015 130 L 4.8025 7.9480 120.3793 54.7917 41.6571 176.2536 131 G 4.3500 7.8225 105.6914 43.8773 0.0000 172.3353 132 F 4.5834 8.7197 121.1817 55.9429 41.5373 174.2884 133 E 4.7931 7.2169 125.8036 54.6484 31.3439 175.4886 134 F 4.7379 9.3403 122.9747 55.9840 42.1574 174.7637 135 R 4.9394 9.0928 119.7149 53.6451 32.6508 174.5893 136 P 4.2589 0.0000 0.0000 63.9204 32.0542 176.4910 137 G 3.8659 8.6749 107.8511 45.8483 0.0000 173.4427 138 R 4.7975 7.3758 117.3381 54.1127 33.9052 174.3319 139 E 5.1089 8.4896 120.2312 55.0521 31.9187 174.9502 140 Y 4.4791 9.0431 120.3232 56.1087 42.6029 174.4860 141 F 5.5865 8.4977 118.6529 56.1367 43.4604 173.5153 142 Y 5.5416 9.9606 119.8830 56.4762 41.9797 174.5687 143 I 5.7502 9.1599 115.1652 59.7409 41.8043 173.6614 144 S 5.5770 9.0226 116.7070 56.6363 66.5901 173.3149 145 S 4.9397 8.9210 113.8405 56.1434 65.6464 173.3669 146 A 4.4333 8.9739 125.5819 52.6360 18.7121 178.1308 147 I 3.8643 8.6102 124.8419 63.9395 37.2469 176.2292 148 P 4.2131 0.0000 0.0000 64.7643 31.4153 176.0832 *150 D 4.5883 7.5487 117.3551 54.0779 41.1168 172.6951 151 N 4.9535 7.8845 119.3288 51.9730 42.0367 174.8479 152 G 4.0905 8.4489 108.5912 47.5823 0.0000 174.1068 153 R 3.6017 7.0083 119.7374 55.9413 27.1867 174.1669 154 R 4.7823 8.0805 117.7727 56.8750 37.7400 176.8697 155 S 4.4755 7.7724 114.8274 57.3266 64.1634 172.0179 156 C 4.9922 8.0620 114.3260 54.0065 38.5787 173.5704 157 L 4.5771 8.3802 120.9846 54.8380 42.5318 175.9765 158 K 5.4061 8.4063 119.5239 56.0960 35.8816 174.7799 159 L 5.0868 9.9349 122.9523 53.6530 46.1288 174.3859 160 K 5.0840 9.1074 127.0798 54.6585 34.9367 174.7299 161 V 4.7948 9.0950 126.9881 61.1007 34.6149 173.5980 162 F 5.1784 8.9766 130.9677 56.5994 41.3381 174.5102 163 V 3.9612 8.5070 127.6152 61.5358 32.2124 175.5378 164 R 4.0723 8.3952 128.5984 55.1742 30.9011 175.3026 165 P 4.3963 0.0000 0.0000 62.8517 32.7347 175.8526 166 T 4.0667 8.3304 118.5084 65.3973 69.1072 172.0972 167 N 4.8278 9.2761 124.6905 53.8616 34.7059 176.4214 168 S 4.3134 7.7394 111.1019 59.7505 62.6800 173.9533 169 C 4.6549 7.9651 116.7069 56.1458 40.8164 173.6062 170 M 3.4864 8.2230 125.8098 55.8359 32.0152 176.4298 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 32 V 8.29 4.49 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 0.73 0.00 0.00 0.87 0.00 0.00 33 A 8.03 4.28 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 34 D 8.66 5.29 0.00 2.61 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 35 R 7.79 5.23 0.00 1.68 1.91 0.00 2.92 0.00 0.00 3.49 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 36 Y 9.21 4.83 0.00 3.04 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 8.76 4.91 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 38 V 9.35 4.44 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 1.10 0.00 0.00 0.88 0.00 0.00 39 Y 9.12 4.84 0.00 3.12 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 40 W 9.16 4.06 0.00 3.50 2.95 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 41 N 7.95 5.33 0.00 3.04 3.05 0.00 0.00 5.87 7.75 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 42 S 9.81 4.32 0.00 4.06 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 0.00 43 S 8.62 4.43 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 44 N 8.34 4.52 0.00 3.01 3.16 0.00 0.00 7.03 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 45 P 0.00 4.25 0.00 2.12 2.06 0.00 3.62 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 2.08 2.17 0.00 46 R 7.72 3.63 0.00 1.14 0.66 0.00 2.52 0.00 0.00 2.87 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.32 0.00 47 F 7.97 4.40 0.00 3.22 2.93 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 48 Q 8.01 4.09 0.00 2.24 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.96 0.00 0.00 0.00 0.00 0.00 2.56 2.59 0.00 49 R 8.08 4.08 0.00 1.99 2.06 0.00 3.16 0.00 0.00 3.09 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.87 0.00 50 G 8.12 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 51 D 7.53 5.00 0.00 2.80 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 52 Y 8.33 4.34 0.00 2.83 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 53 H 9.01 5.69 0.00 3.21 3.29 0.00 5.52 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 I 8.65 4.73 1.65 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.39 1.00 0.00 0.00 55 D 8.54 5.32 0.00 2.58 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 V 8.41 4.33 1.69 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 -0.18 0.00 0.00 -0.07 0.00 0.00 57 C 9.75 5.18 0.00 2.96 2.96 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 58 I 8.09 4.10 1.88 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 1.40 0.75 1.00 0.00 0.00 59 N 9.84 4.38 0.00 2.75 3.03 0.00 0.00 7.04 7.94 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 60 D 8.04 5.00 0.00 2.93 2.96 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 61 Y 9.74 5.05 0.00 2.88 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 62 L 9.05 5.22 0.00 2.03 1.44 1.05 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 63 D 9.24 5.03 0.00 2.52 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 0.00 0.00 0.00 64 V 8.32 4.48 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 0.99 0.00 0.00 0.44 0.00 0.00 65 F 9.16 4.95 0.00 2.59 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 66 C 9.03 5.05 0.00 2.98 3.15 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 67 P 0.00 4.54 0.00 2.50 2.21 0.00 3.78 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.65 0.00 68 H 8.23 5.21 0.00 3.06 3.06 0.00 5.87 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 Y 8.45 4.91 0.00 2.74 2.82 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 70 E 8.82 4.33 0.00 1.99 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 2.43 2.39 0.00 71 D 8.91 4.36 0.00 2.66 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 72 S 8.03 4.29 0.00 3.99 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 73 V 7.47 4.11 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 0.63 0.00 0.00 1.08 0.00 0.00 74 P 0.00 4.14 0.00 2.18 2.13 0.00 3.95 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.99 0.00 75 E 8.00 3.75 0.00 2.14 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 2.28 2.27 0.00 76 D 7.84 3.84 0.00 2.62 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 77 K 7.79 4.38 0.00 1.64 1.78 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.39 7.81 78 T 8.30 3.46 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 1.00 0.00 0.00 79 E 8.95 4.28 0.00 2.17 1.74 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 2.38 2.46 0.00 80 R 7.62 4.83 0.00 1.58 1.79 0.00 3.08 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 81 Y 8.71 5.35 0.00 2.80 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 82 V 8.68 4.52 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 0.16 0.00 0.00 0.88 0.00 0.00 83 L 8.67 4.91 0.00 1.44 1.26 -0.14 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 84 Y 9.03 4.93 0.00 2.83 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 85 M 8.11 4.63 0.00 1.18 1.10 0.00 0.00 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.08 0.00 86 V 8.53 5.07 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 0.85 0.00 0.00 1.10 0.00 0.00 87 N 8.27 4.88 0.00 3.15 3.04 0.00 0.00 7.05 8.00 0.00 0.00 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 F 8.69 3.17 0.00 2.67 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.11 4.16 0.00 2.86 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 G 9.19 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 7.99 4.04 0.00 3.06 2.79 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 92 S 7.85 3.90 0.00 3.50 3.65 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 93 A 7.74 4.23 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 94 C 7.50 4.04 0.00 3.01 3.15 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 95 D 8.75 4.77 0.00 2.46 2.47 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 96 H 8.41 4.63 0.00 1.96 2.76 0.00 5.57 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 T 8.75 4.10 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 1.13 0.00 0.00 98 S 8.26 4.16 0.00 3.85 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 99 K 7.60 4.32 0.00 1.77 1.71 0.00 1.84 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.44 7.81 100 G 7.87 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 F 8.13 5.16 0.00 3.07 2.95 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 0.00 102 K 8.90 3.78 0.00 1.59 1.67 0.00 1.61 0.00 0.00 1.57 0.00 0.00 2.62 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.01 1.01 7.81 103 R 8.47 3.76 0.00 0.67 0.66 0.00 2.35 0.00 0.00 2.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.78 0.00 104 W 6.97 4.59 0.00 2.73 1.74 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 0.00 105 E 8.15 4.58 0.00 1.83 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 2.15 2.20 0.00 106 C 9.35 4.93 0.00 3.19 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 0.00 107 N 8.29 5.08 0.00 2.79 2.88 0.00 0.00 6.13 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 0.00 108 R 7.66 4.72 0.00 1.86 1.91 0.00 3.33 0.00 0.00 3.43 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.55 0.00 109 P 0.00 4.79 0.00 2.15 2.40 0.00 3.92 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.94 0.00 110 H 7.93 5.12 0.00 3.18 3.33 0.00 5.72 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 8.07 4.22 0.00 4.01 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 0.00 112 P 0.00 4.40 0.00 2.21 2.27 0.00 3.76 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 2.00 2.02 0.00 113 N 8.09 4.74 0.00 2.69 2.82 0.00 0.00 7.11 7.65 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 0.00 114 G 7.99 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 0.00 115 P 0.00 4.28 0.00 2.26 2.36 0.00 3.72 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.14 0.00 116 L 8.37 4.02 0.00 1.55 1.26 1.04 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 117 K 7.82 4.48 0.00 1.20 1.22 0.00 0.99 0.00 0.00 1.39 0.00 0.00 2.61 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.75 0.39 7.81 118 F 8.43 4.68 0.00 1.81 1.53 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 0.00 119 S 8.44 4.98 0.00 3.67 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 0.00 120 E 9.13 4.72 0.00 2.22 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.47 0.00 121 K 8.43 4.19 0.00 1.51 1.50 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.78 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.90 0.21 7.81 122 F 8.15 3.93 0.00 2.79 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 0.00 123 Q 7.86 4.63 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.92 0.00 0.00 0.00 0.00 0.00 2.54 2.51 0.00 124 L 8.66 4.39 0.00 1.75 1.84 0.96 0.97 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 0.00 125 F 8.02 4.98 0.00 2.90 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 0.00 126 T 7.89 4.38 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 1.29 0.00 0.00 127 P 0.00 4.07 0.00 1.66 2.12 0.00 3.31 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.36 0.00 128 F 7.01 4.99 0.00 3.06 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 S 8.62 4.29 0.00 4.00 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 0.00 130 L 7.95 4.80 0.00 1.69 1.75 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 131 G 7.82 4.35 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 0.00 132 F 8.72 4.58 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 0.00 133 E 7.22 4.79 0.00 1.49 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 2.04 1.99 0.00 134 F 9.34 4.74 0.00 3.06 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 0.00 135 R 9.09 4.94 0.00 1.80 1.88 0.00 3.24 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 136 P 0.00 4.26 0.00 2.15 2.04 0.00 3.88 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 2.00 1.98 0.00 137 G 8.67 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 0.00 138 R 7.38 4.80 0.00 2.10 1.38 0.00 3.20 0.00 0.00 3.64 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 139 E 8.49 5.11 0.00 1.58 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 140 Y 9.04 4.48 0.00 3.00 2.79 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 0.00 141 F 8.50 5.59 0.00 3.27 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 0.00 142 Y 9.96 5.54 0.00 3.36 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 0.00 143 I 9.16 5.75 2.04 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 1.46 1.07 0.00 0.00 144 S 9.02 5.58 0.00 4.00 3.65 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 0.00 145 S 8.92 4.94 0.00 3.98 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 0.00 146 A 8.97 4.43 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 0.00 147 I 8.61 3.86 1.81 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 1.29 0.55 0.90 0.00 0.00 148 P 0.00 4.21 0.00 2.15 2.13 0.00 3.60 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 *150 D 7.55 4.59 0.00 2.72 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 0.00 151 N 7.88 4.95 0.00 2.76 2.67 0.00 0.00 6.95 7.99 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 0.00 152 G 8.45 4.09 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 0.00 0.00 0.00 153 R 7.01 3.60 0.00 1.89 1.86 0.00 3.32 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 154 R 8.08 4.78 0.00 1.93 1.92 0.00 3.12 0.00 0.00 3.29 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.57 0.00 155 S 7.77 4.48 0.00 4.03 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 0.00 156 C 8.06 4.99 0.00 3.37 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 0.00 157 L 8.38 4.58 0.00 1.36 0.62 0.20 0.42 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 0.00 158 K 8.41 5.41 0.00 1.71 1.71 0.00 1.16 0.00 0.00 0.61 0.00 0.00 2.58 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.27 1.45 7.81 159 L 9.93 5.09 0.00 1.87 2.05 0.28 0.53 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 0.00 160 K 9.11 5.08 0.00 2.05 1.77 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.27 1.22 7.81 161 V 9.09 4.79 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 1.09 0.00 0.00 162 F 8.98 5.18 0.00 3.04 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 0.00 163 V 8.51 3.96 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 0.71 0.00 0.00 0.78 0.00 0.00 164 R 8.40 4.07 0.00 1.71 1.84 0.00 3.28 0.00 0.00 3.36 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.62 0.00 165 P 0.00 4.40 0.00 2.13 2.22 0.00 3.80 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 2.12 2.10 0.00 166 T 8.33 4.07 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 0.00 167 N 9.28 4.83 0.00 2.93 3.50 0.00 0.00 6.27 7.64 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 0.00 168 S 7.74 4.31 0.00 4.10 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 0.00 169 C 7.97 4.65 0.00 2.96 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 0.00 170 M 8.22 3.49 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.53 0.00 * Residues marked with a * may have inaccurate shift predictions.