NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3674 8.2649 123.5814 52.2205 20.1894 176.6026 2 T 4.4766 7.9691 116.9876 60.4670 72.9285 173.6283 3 L 4.1190 9.4831 126.5482 58.3647 41.8536 179.8178 4 K 4.0803 7.9922 116.7934 59.1143 32.3582 178.8690 5 D 4.5058 7.8862 118.9896 57.5517 40.9861 178.6527 6 I 3.8376 8.3940 120.5789 64.6304 37.1188 178.3951 7 T 4.0650 8.4459 116.2208 65.5041 68.2675 176.8201 8 R 3.8799 7.9427 121.6081 59.7373 30.1618 177.8240 9 R 3.8391 8.1651 116.8565 59.3424 30.0527 178.4751 10 L 4.0740 8.1544 117.9983 58.1208 41.7378 179.8204 11 K 3.8514 8.0026 118.1966 59.8104 32.0228 179.5235 12 S 4.2509 8.4685 114.5259 61.4709 63.2038 176.3829 13 I 3.7895 8.7145 124.1247 63.4425 36.4598 178.4988 14 K 4.0314 8.1557 120.0573 59.1728 31.7292 179.1302 15 N 4.3417 7.7211 115.4136 56.5619 38.6281 177.3640 16 I 3.6582 7.8827 121.2546 64.7376 37.1370 178.2490 17 Q 4.0013 8.0821 120.0797 58.9413 28.8793 178.2348 18 K 4.0743 7.7595 119.3570 59.1740 32.0232 179.2052 19 I 3.6865 8.1291 120.6665 64.4921 36.5339 178.1298 20 T 3.8596 7.9825 116.3253 66.9428 67.9272 176.3651 21 K 3.9396 8.0316 121.0582 59.5856 32.3256 178.7337 22 S 4.1181 8.1445 113.4076 61.6861 62.3195 176.0750 23 M 4.1334 8.4036 121.5399 57.7816 31.5049 178.7829 24 K 3.9249 7.7271 119.2669 59.7827 32.6125 178.6619 25 M 3.9659 7.6783 118.1529 58.3820 31.7824 179.1157 26 V 3.5279 7.7667 117.6637 66.0920 31.7378 177.8528 27 A 4.0313 8.1581 120.2814 55.2292 17.8224 179.5808 28 A 4.0727 8.5357 118.7965 55.6797 18.8278 178.8936 29 A 3.9100 7.9662 118.4323 55.8482 18.2179 179.6180 30 K 3.8453 8.4086 114.9649 59.8536 32.2115 178.9747 31 Y 4.1405 7.7379 118.0235 60.0774 39.0450 177.3903 32 A 3.7287 8.3539 122.7739 54.7544 18.5518 179.3570 33 R 3.7790 7.9071 115.2113 59.5111 30.1710 178.7377 34 A 3.9239 8.1299 120.2959 55.3005 18.1890 179.3590 35 E 3.7768 7.5113 115.8212 59.0237 29.8145 179.0370 36 R 4.0376 7.7150 118.0618 59.2148 30.2594 178.3797 37 E 4.0282 8.0232 117.5212 59.2172 29.5701 179.1806 38 L 4.0377 8.3756 120.9159 58.6646 42.3270 178.8945 39 K 4.1272 7.9219 117.4769 59.4742 32.0598 176.8920 40 P 4.4370 0.0000 0.0000 65.6593 31.3538 178.6990 41 A 4.3762 7.7444 118.3127 54.9480 18.2737 179.3788 42 R 4.5633 7.6392 114.8824 58.1284 31.6718 177.7524 43 V 4.0600 7.4814 119.7442 59.9777 29.7128 172.9991 44 Y 4.1202 7.0849 125.9060 58.5499 44.5166 174.9758 *77 L 4.1542 8.0022 124.1669 56.2810 40.0370 177.0935 78 C 4.6961 7.8127 125.0056 60.1345 30.0767 174.8575 79 G 3.9883 8.2748 106.8130 46.0260 0.0000 175.1993 80 A 4.6750 8.0826 118.4858 51.9505 19.6430 178.8272 81 I 3.9163 6.5628 122.0092 64.5188 36.9749 176.9816 82 H 4.2142 8.3358 120.3589 59.3192 29.1092 177.7146 83 S 4.1166 7.9360 115.4210 61.5647 62.9347 176.1703 84 S 4.1058 7.7570 119.0764 61.4451 62.3824 177.5059 85 V 3.6182 7.5053 112.6946 64.1701 31.7548 177.9111 86 A 4.1679 7.9101 120.5891 55.4734 18.0894 179.6453 87 K 3.9044 8.5832 116.7889 59.7017 32.0523 179.0153 88 Q 4.1588 7.5614 116.2511 57.7479 28.9857 176.8858 89 M 4.2603 7.6634 117.3353 56.8805 33.6425 175.4274 90 K 4.6024 7.8564 118.9374 55.2103 33.9208 174.8540 *209 L 4.2825 7.7272 125.9287 55.0218 42.9155 178.3298 210 A 3.9826 8.6324 118.6246 54.8723 19.7802 180.4824 211 N 4.1936 8.0108 112.5917 56.4105 39.9222 176.9756 212 I 4.2220 7.6853 117.6344 63.1131 38.5044 178.0758 213 I 3.7573 8.9149 122.8889 64.6882 36.9651 177.8018 214 Y 4.1512 8.6564 120.2675 60.9589 38.5046 176.4459 215 Y 4.2284 7.7333 118.9797 59.8180 38.8946 177.2564 216 S 4.0231 8.8550 115.5784 61.8520 62.4478 176.6351 217 L 3.9195 7.8905 122.5637 57.2971 41.3453 179.1714 218 K 3.6222 7.8967 118.7530 58.7475 32.2674 178.5008 219 E 4.1533 7.7087 118.6313 58.4488 29.8741 177.9926 220 S 4.2274 7.8326 111.6178 60.1345 62.3530 175.0598 221 T 4.2083 7.4078 110.2654 63.9331 69.7684 176.9133 222 T 3.9829 7.8171 118.8052 66.7038 68.4568 176.8674 223 S 4.1128 8.0005 116.6199 61.9063 62.8158 175.7738 224 E 3.9772 7.7989 122.1275 58.9418 29.4665 178.5124 225 Q 4.1683 8.4796 118.3772 58.4185 28.9580 179.6055 226 S 3.5664 7.8252 116.5023 61.1317 63.0712 176.0141 227 A 3.8687 7.9399 123.4904 55.2637 18.1370 179.5746 228 R 3.7686 8.2844 117.4115 60.3652 30.1636 177.4791 229 M 3.8089 7.5708 116.4155 59.5930 31.9621 177.9386 230 T 3.7900 8.1624 114.4624 66.7062 68.9684 176.1760 231 A 3.9639 7.9033 122.2773 55.8012 18.0071 179.6835 232 M 4.1503 8.5116 116.4968 57.6591 31.4092 178.5885 233 D 4.3011 7.9408 119.1103 57.4127 41.4028 177.7811 234 N 4.4652 8.3911 116.4147 55.5692 38.4764 177.4029 235 A 3.9952 7.9232 123.0813 55.0335 18.4777 179.5716 236 S 4.1656 7.8488 111.5453 60.7675 63.3657 176.8017 237 K 4.0058 7.6069 121.9313 59.3425 31.5922 178.9720 238 N 4.3713 8.5172 117.1616 56.1536 38.4478 177.4080 239 A 4.0218 8.2827 122.5616 55.1049 18.4212 179.9843 240 S 4.0611 8.2701 113.9130 61.8415 62.9970 176.6799 241 E 4.0188 8.0576 120.6788 59.3285 28.9817 179.1721 242 M 4.0554 7.7439 118.5316 58.5649 32.3065 178.3422 243 I 3.2243 8.1121 120.1756 64.2058 37.2005 178.0277 244 D 4.4069 8.2073 119.8915 56.6348 40.6720 178.7423 245 K 4.0663 8.0429 120.2906 59.5631 32.2870 179.0227 246 L 4.0676 8.8564 120.4992 58.0255 41.4312 179.5097 247 T 4.0687 7.7633 115.9659 66.6754 68.3359 176.6210 248 L 4.0488 7.6801 119.5703 58.0766 41.6285 179.6655 249 T 3.9303 7.7514 115.9449 66.2587 68.2918 176.5538 250 F 3.9203 8.7284 123.0247 61.5869 39.4998 177.1240 251 N 4.4172 8.6718 115.9968 56.0011 38.1902 177.8385 252 R 3.8907 8.1164 119.9067 59.4600 30.0729 179.1814 253 T 3.7512 7.7195 115.5155 66.4045 68.5531 176.5240 254 R 3.7556 8.0645 120.9766 59.5908 29.9834 178.4162 255 Q 3.8922 7.9158 117.0985 58.9437 28.7728 178.3732 256 A 3.9545 8.1660 122.0607 55.4162 18.3079 179.7524 257 V 3.4943 8.5038 117.5145 66.3442 31.4386 178.3230 258 I 3.7333 7.5982 118.9589 64.5523 36.7840 178.6947 259 T 3.8440 7.9848 116.6527 66.4161 68.1127 176.4680 260 K 3.7815 7.8572 120.3470 59.8598 32.3944 177.8947 261 E 3.9855 8.0307 118.9036 59.0425 29.5367 178.0967 262 L 3.9228 7.7847 120.0479 58.7486 42.0348 179.4462 263 I 3.7197 8.0919 119.4180 64.1846 36.8864 178.3842 264 E 3.9644 8.5891 120.1657 59.3650 29.2179 179.1182 265 I 3.6741 7.6855 119.3143 64.4247 37.3134 177.9898 266 I 3.6804 8.0620 120.7158 64.8656 36.8181 178.5362 267 S 4.2320 8.1849 114.7139 61.7329 62.8051 176.8661 268 G 3.6982 8.2902 108.1527 47.4895 0.0000 175.7047 269 A 4.0071 8.4227 123.2883 55.0015 18.2656 179.4195 270 A 4.1190 8.0070 117.0740 53.9946 18.5054 178.4796 271 A 4.4135 7.2205 117.8378 52.0140 19.1704 177.2203 272 L 4.1433 7.6139 123.3470 55.2037 41.7923 176.8066 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 A 8.26 4.37 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 2 T 7.97 4.48 4.57 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 1.27 0.00 0.00 3 L 9.48 4.12 0.00 1.71 1.85 0.79 0.54 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 4 K 7.99 4.08 0.00 1.75 1.90 0.00 1.79 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.49 7.81 5 D 7.89 4.51 0.00 3.01 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 6 I 8.39 3.84 2.12 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 1.58 0.78 1.07 0.00 0.00 7 T 8.45 4.07 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 1.12 0.00 0.00 8 R 7.94 3.88 0.00 2.03 2.03 0.00 3.13 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 9 R 8.17 3.84 0.00 1.90 1.93 0.00 3.24 0.00 0.00 3.35 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.93 0.00 10 L 8.15 4.07 0.00 1.83 1.69 0.80 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.00 3.85 0.00 2.10 1.86 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.58 7.81 12 S 8.47 4.25 0.00 3.99 4.20 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 13 I 8.71 3.79 1.86 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 1.52 0.97 0.90 0.00 0.00 14 K 8.16 4.03 0.00 2.00 1.83 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.66 7.81 15 N 7.72 4.34 0.00 2.88 2.85 0.00 0.00 6.97 7.10 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 16 I 7.88 3.66 1.86 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 1.40 1.09 0.90 0.00 0.00 17 Q 8.08 4.00 0.00 2.15 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 18 K 7.76 4.07 0.00 1.96 1.83 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.63 7.81 19 I 8.13 3.69 2.01 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 1.52 0.88 0.90 0.00 0.00 20 T 7.98 3.86 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 21 K 8.03 3.94 0.00 1.87 1.97 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.44 7.81 22 S 8.14 4.12 0.00 3.94 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 23 M 8.40 4.13 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.54 0.00 24 K 7.73 3.92 0.00 1.84 1.95 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.46 7.81 25 M 7.68 3.97 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.56 0.00 26 V 7.77 3.53 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 1.02 0.00 0.00 1.02 0.00 0.00 27 A 8.16 4.03 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 28 A 8.54 4.07 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 0.00 0.00 0.00 0.00 0.00 29 A 7.97 3.91 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 30 K 8.41 3.85 0.00 1.97 1.92 0.00 1.84 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.63 7.81 31 Y 7.74 4.14 0.00 3.00 3.29 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 32 A 8.35 3.73 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 33 R 7.91 3.78 0.00 1.96 2.00 0.00 3.13 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 1.71 1.94 0.00 34 A 8.13 3.92 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 35 E 7.51 3.78 0.00 1.54 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 0.00 2.24 2.29 0.00 36 R 7.71 4.04 0.00 2.05 1.92 0.00 3.14 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.63 0.00 37 E 8.02 4.03 0.00 1.91 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 2.36 2.31 0.00 38 L 8.38 4.04 0.00 1.79 1.74 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 39 K 7.92 4.13 0.00 1.94 1.83 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.81 1.68 7.81 40 P 0.00 4.44 0.00 2.27 2.19 0.00 3.75 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 2.17 2.20 0.00 41 A 7.74 4.38 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 0.00 0.00 0.00 0.00 0.00 42 R 7.64 4.56 0.00 2.02 2.20 0.00 3.20 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.89 0.00 43 V 7.48 4.06 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 0.76 0.00 0.00 0.99 0.00 0.00 44 Y 7.08 4.12 0.00 3.25 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 L 8.00 4.15 0.00 1.73 1.73 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 78 C 7.81 4.70 0.00 2.85 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 79 G 8.27 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 80 A 8.08 4.68 1.25 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 0.00 0.00 0.00 81 I 6.56 3.92 1.77 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 1.56 1.24 0.99 0.00 0.00 82 H 8.34 4.21 0.00 3.16 3.35 0.00 5.63 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 S 7.94 4.12 0.00 4.04 4.10 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 84 S 7.76 4.11 0.00 4.09 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 0.00 85 V 7.51 3.62 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.01 0.00 0.00 86 A 7.91 4.17 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 87 K 8.58 3.90 0.00 1.76 1.87 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 88 Q 7.56 4.16 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.94 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 89 M 7.66 4.26 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 90 K 7.86 4.60 0.00 1.69 1.67 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.33 7.81 *209 L 7.73 4.28 0.00 1.81 1.04 0.94 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 210 A 8.63 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 0.00 211 N 8.01 4.19 0.00 2.82 2.89 0.00 0.00 6.93 7.82 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 0.00 212 I 7.69 4.22 2.01 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.00 1.01 0.00 0.00 213 I 8.91 3.76 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.86 0.96 0.00 0.00 214 Y 8.66 4.15 0.00 2.90 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 0.00 215 Y 7.73 4.23 0.00 3.25 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 0.00 216 S 8.85 4.02 0.00 4.11 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 L 7.89 3.92 0.00 1.85 1.57 0.94 0.86 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 0.00 218 K 7.90 3.62 0.00 1.19 1.51 0.00 1.40 0.00 0.00 1.41 0.00 0.00 2.87 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.56 0.21 7.81 219 E 7.71 4.15 0.00 1.67 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 1.73 1.47 0.00 220 S 7.83 4.23 0.00 3.95 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 0.00 221 T 7.41 4.21 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 1.23 0.00 0.00 222 T 7.82 3.98 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 1.38 0.00 0.00 223 S 8.00 4.11 0.00 3.83 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 0.00 224 E 7.80 3.98 0.00 2.14 1.87 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 2.32 2.38 0.00 225 Q 8.48 4.17 0.00 2.23 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.62 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 226 S 7.83 3.57 0.00 3.87 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 0.00 227 A 7.94 3.87 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 0.00 0.00 0.00 0.00 0.00 228 R 8.28 3.77 0.00 1.83 1.91 0.00 3.12 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 229 M 7.57 3.81 0.00 2.26 2.08 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.57 0.00 230 T 8.16 3.79 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 1.17 0.00 0.00 231 A 7.90 3.96 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 0.00 232 M 8.51 4.15 0.00 2.18 2.11 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 2.60 2.83 0.00 233 D 7.94 4.30 0.00 2.78 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 0.00 234 N 8.39 4.47 0.00 2.76 2.83 0.00 0.00 6.94 7.53 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 0.00 235 A 7.92 4.00 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 0.00 236 S 7.85 4.17 0.00 4.07 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 0.00 237 K 7.61 4.01 0.00 2.02 1.89 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.56 7.81 238 N 8.52 4.37 0.00 2.95 2.85 0.00 0.00 6.84 6.71 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 0.00 239 A 8.28 4.02 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 0.00 240 S 8.27 4.06 0.00 4.13 3.91 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 0.00 0.00 0.00 241 E 8.06 4.02 0.00 2.02 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 2.33 2.52 0.00 242 M 7.74 4.06 0.00 2.14 2.16 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 2.59 2.57 0.00 243 I 8.11 3.22 1.86 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 1.51 0.91 0.89 0.00 0.00 244 D 8.21 4.41 0.00 2.70 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 0.00 245 K 8.04 4.07 0.00 2.13 1.93 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 246 L 8.86 4.07 0.00 1.78 1.73 0.93 0.74 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 0.00 247 T 7.76 4.07 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 1.24 0.00 0.00 248 L 7.68 4.05 0.00 1.91 1.73 0.93 0.70 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 0.00 249 T 7.75 3.93 4.42 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 1.22 0.00 0.00 250 F 8.73 3.92 0.00 3.07 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 0.00 251 N 8.67 4.42 0.00 2.85 2.91 0.00 0.00 7.13 8.13 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 0.00 252 R 8.12 3.89 0.00 1.83 1.95 0.00 3.12 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.91 0.00 253 T 7.72 3.75 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 254 R 8.06 3.76 0.00 1.22 1.89 0.00 3.27 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 255 Q 7.92 3.89 0.00 2.32 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 256 A 8.17 3.95 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 0.00 257 V 8.50 3.49 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 0.99 0.00 0.00 0.93 0.00 0.00 258 I 7.60 3.73 1.94 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 1.50 1.54 0.90 0.00 0.00 259 T 7.98 3.84 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 260 K 7.86 3.78 0.00 1.85 2.05 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.46 7.81 261 E 8.03 3.99 0.00 2.04 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 2.30 2.31 0.00 262 L 7.78 3.92 0.00 1.93 1.80 0.92 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 263 I 8.09 3.72 1.98 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 1.51 0.85 0.90 0.00 0.00 264 E 8.59 3.96 0.00 2.18 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 0.00 2.32 2.56 0.00 265 I 7.69 3.67 1.97 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 1.63 0.91 0.91 0.00 0.00 266 I 8.06 3.68 2.00 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 1.52 0.90 0.91 0.00 0.00 267 S 8.18 4.23 0.00 4.01 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 268 G 8.29 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 0.00 0.00 0.00 0.00 269 A 8.42 4.01 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 0.00 270 A 8.01 4.12 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 0.00 271 A 7.22 4.41 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 0.00 272 L 7.61 4.14 0.00 1.66 1.59 0.92 0.93 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 * Residues marked with a * may have inaccurate shift predictions.