NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 67 V 4.0293 8.0549 120.3945 61.8513 32.5966 175.2704 68 P 4.3765 0.0000 0.0000 61.3200 32.2302 174.5367 69 N 4.5285 9.0068 118.3172 55.9690 41.0319 174.1816 70 V 4.8444 7.8305 118.0602 60.9889 33.9851 175.2763 71 V 4.2251 8.6533 128.5628 60.8025 33.3982 174.5878 72 V 3.8739 8.3076 128.8444 63.1379 31.1262 175.3382 73 T 4.2028 8.6871 119.7509 63.3144 70.6333 174.6988 74 G 4.1358 7.2603 106.7265 45.2484 0.0000 172.0838 75 L 5.2885 8.1731 121.7655 53.3034 45.3085 175.3157 76 T 4.8689 8.7903 115.7191 59.9039 72.6683 173.1027 77 L 4.7637 8.2212 124.6838 53.4021 42.5993 177.0192 78 V 3.8051 8.9790 126.7492 62.4955 31.8810 174.8636 79 C 5.0838 8.4062 129.1028 57.5283 33.6935 174.6066 80 S 4.1852 9.0582 122.5116 60.8608 62.7988 175.3024 81 S 4.3507 8.0151 112.8603 58.2122 63.5564 174.0493 82 A 2.5800 6.9703 124.4496 51.0542 18.4051 175.9122 83 P 4.2649 0.0000 0.0000 63.4249 32.0285 175.4608 84 G 4.0921 7.1077 106.7720 43.4376 0.0000 170.4078 85 P 4.3517 0.0000 0.0000 63.0346 32.3691 176.2746 86 L 4.4229 7.8802 117.1705 53.5133 41.3829 175.0885 87 E 5.0677 8.0259 118.6962 54.2412 33.6848 175.4182 88 L 4.5291 8.9101 125.3428 52.8319 45.4381 175.0978 89 D 4.6713 8.6435 123.1308 52.6846 42.0874 175.8223 90 L 4.4984 8.1686 125.3881 55.2419 41.7390 177.9838 91 T 4.3743 8.1545 107.8664 61.2570 69.4971 174.5858 92 G 4.1630 7.3417 112.0257 44.1911 0.0000 172.8189 93 D 4.2519 8.3036 120.3332 54.1583 40.5890 177.8516 94 L 3.3732 8.0787 128.0938 57.1588 42.1415 179.7526 95 E 4.1284 8.0254 118.2127 58.8717 29.9597 179.0177 96 S 4.2773 7.3603 113.3909 60.9579 63.0157 176.4804 97 F 4.6224 7.4703 120.4382 60.4498 38.3653 177.5289 98 K 4.1934 7.8113 115.9948 58.3623 31.8038 177.8323 99 K 4.4934 7.7185 116.3894 55.9347 32.3287 175.5003 100 Q 4.8250 7.7820 117.8679 54.3091 32.0724 174.6327 101 S 4.8393 8.0465 111.6781 57.5291 65.8425 173.7180 102 F 5.1380 9.1344 121.8699 56.6783 40.4723 174.9247 103 V 4.7988 8.7094 123.7243 61.7090 33.0779 174.7363 104 L 4.8255 8.4757 128.3329 52.9777 45.5411 175.4637 105 K 4.1482 5.9525 126.9772 55.4204 32.7645 176.3265 106 E 3.9872 8.5377 124.2248 57.5807 29.9519 178.5777 107 G 3.9901 8.4524 109.3458 45.7999 0.0000 174.4620 108 V 3.9295 7.1201 113.0148 61.7142 32.8595 175.0485 109 E 5.1534 8.7669 122.7843 55.8051 30.9871 174.9888 110 Y 5.1756 8.7954 121.0346 56.1137 42.5859 173.6127 111 R 4.7670 9.0495 117.5569 54.4656 34.7042 174.6702 112 I 4.6607 8.6814 124.6326 60.2595 39.0879 174.5290 113 K 4.8588 9.3655 129.1311 54.8028 34.2833 174.7860 114 I 4.6588 8.9473 129.8048 59.9459 38.9377 174.9963 115 S 5.1759 8.6096 124.8120 57.6138 64.4968 173.6543 116 F 5.3098 8.7640 118.0774 55.8267 41.5135 173.1240 117 R 4.7872 9.0412 120.3931 54.5583 32.9790 175.4277 118 V 4.7562 8.3643 122.3721 61.7910 33.3902 175.5245 119 N 4.3768 9.5121 126.7040 56.1237 38.5019 176.3310 120 R 4.4402 8.2339 113.4406 57.0899 32.1884 175.7102 121 E 4.7812 7.8577 114.9928 53.5853 32.8719 174.8485 122 I 4.0652 8.3853 123.8687 61.8063 37.9060 175.5079 123 V 4.3010 8.6910 127.7966 61.5713 33.0470 174.6936 124 S 5.1504 8.1950 123.7984 57.0263 65.5734 169.9488 125 G 4.0604 8.4688 118.6596 44.0430 0.0000 172.4200 *127 K 4.1378 8.2376 124.0968 56.3233 33.9199 173.3100 128 Y 5.2972 8.9279 128.5995 56.0295 41.0878 174.1923 129 I 4.8446 8.5091 126.9351 59.4174 41.1650 174.2917 130 E 4.7048 8.8490 124.8092 54.7815 33.4222 174.3776 131 H 5.2277 9.0505 121.5823 54.4575 31.4352 173.0399 132 T 4.9951 8.5073 121.1512 62.5571 70.3200 173.8325 133 Y 5.1111 9.3270 123.4098 56.1026 41.9065 174.4115 134 R 4.4425 8.9811 123.6920 54.8315 32.6924 175.9921 135 K 3.7594 9.5418 126.8001 57.5076 29.6422 175.5766 136 G 4.0031 8.2007 105.7429 45.1940 0.0000 173.1320 137 V 4.2990 7.6748 120.2236 60.4181 33.0050 174.5874 138 K 3.7605 8.6340 128.5986 56.6835 31.8625 175.9778 139 I 4.3206 7.9366 120.0637 60.9752 38.9483 175.1241 140 D 4.4894 7.2491 120.2841 53.3810 44.5375 174.0365 141 K 4.7731 8.5239 123.3013 54.8735 35.3545 175.7217 142 T 4.4010 8.7783 121.2972 61.8354 72.2612 172.5501 143 D 5.1385 8.5226 126.1266 52.9388 42.9609 175.6978 144 Y 4.8865 9.0164 122.0621 57.3074 41.4649 176.6418 *146 V 3.6230 8.6393 119.0108 61.9851 33.3165 177.0755 147 G 3.8876 8.0415 105.2612 44.2528 0.0000 171.7064 148 S 4.9326 8.3160 113.9407 58.2613 64.4824 173.3883 149 Y 4.7365 9.0304 121.5149 56.2366 41.6759 175.4468 150 G 4.4466 8.7458 111.0280 43.6761 0.0000 171.4832 151 P 4.7883 0.0000 0.0000 63.1551 31.6778 175.7267 152 R 4.4181 8.2832 118.7876 55.6195 33.3833 174.5241 153 A 4.0960 8.5287 125.9000 54.7158 18.8949 178.3533 154 E 4.0181 7.6634 115.4369 55.7470 30.3936 175.8673 155 E 4.1898 8.2195 122.6508 56.2828 31.1302 175.2192 156 Y 4.5253 8.5233 119.4200 56.7295 40.2527 174.7150 157 E 4.9484 8.7714 122.8385 54.6609 31.3976 175.0399 158 F 4.8256 9.4816 128.7835 57.4571 40.9635 174.1592 159 L 4.8488 7.7247 125.7242 52.8131 43.7343 176.6057 160 T 3.9641 7.8325 114.6438 60.0667 70.2106 172.8147 161 P 4.4261 0.0000 0.0000 62.1910 32.4120 175.0888 162 V 3.9214 8.1431 118.5734 63.0537 31.8454 175.8461 163 E 4.6372 9.0388 127.5266 54.7641 32.6973 174.6541 164 E 5.2355 8.2374 118.8375 54.4113 33.4716 175.8429 165 A 4.4295 9.1935 126.7439 51.1987 19.5888 175.3351 166 P 4.6169 0.0000 0.0000 62.8791 32.2501 175.4216 167 K 4.5129 8.4346 121.9487 54.7105 34.8276 174.5753 168 G 4.0422 9.1988 110.9592 44.6453 0.0000 177.5011 *170 L 4.2265 8.5749 123.1688 54.0642 43.2530 177.1970 171 A 4.5179 7.7256 119.6081 52.8159 19.4808 177.7779 172 R 4.2802 7.6692 114.9521 56.3862 31.1292 175.7392 173 G 3.7679 7.9720 106.7787 44.0599 0.0000 172.4485 174 S 5.1022 8.1725 115.5510 57.9613 64.2854 173.5502 175 Y 5.0145 9.1458 120.5583 56.2124 42.5531 174.4193 176 S 5.0448 9.1831 114.4768 56.7998 67.0656 173.0330 177 I 4.8925 8.4823 122.7607 59.5727 40.6667 174.5754 178 K 4.7704 9.0895 127.5282 55.2663 33.1760 175.7022 179 S 4.9802 8.4789 122.1681 57.2037 65.0334 174.0563 180 R 5.1381 8.6489 121.9205 54.6858 34.4134 173.7102 181 F 5.1916 9.6255 127.2531 57.4016 41.0165 174.3754 182 T 5.2971 8.7947 121.8582 60.2700 70.9902 170.6499 183 D 4.9741 8.0140 117.5046 52.7640 41.6978 174.5448 184 D 4.3491 8.4038 118.0759 58.2929 40.7267 178.4583 185 D 4.6786 8.1879 115.3349 53.8042 40.6970 176.2493 186 K 3.8714 7.8381 115.6681 57.4147 30.5258 175.7180 187 T 3.9079 7.6645 114.6321 63.7355 68.7585 173.6947 188 D 4.8173 8.2256 124.9547 53.1420 40.4425 175.5798 189 H 4.6261 8.8291 123.6082 58.3532 29.5712 175.8808 190 L 4.6414 7.8088 116.5062 54.3321 45.3647 173.4943 191 S 5.6527 9.1500 121.4405 56.7080 66.1253 173.1566 192 W 5.5509 9.2142 120.2421 55.3981 32.1786 173.0377 193 E 5.4494 9.2208 120.8486 54.3508 31.8631 174.4399 194 W 5.4977 9.1421 122.6754 55.0895 32.4516 173.5000 195 N 5.3610 8.8131 116.9792 51.4643 41.8868 173.4277 196 L 5.2327 8.4341 122.1449 53.8532 45.8904 175.0110 197 T 5.0356 9.5585 123.6120 61.9985 71.1284 173.3360 198 I 4.6291 8.8506 128.5360 60.1844 38.7436 175.3783 199 K 4.8399 8.4939 125.9312 54.0780 35.5290 177.6311 200 K 4.0176 8.6942 122.4497 59.0752 32.3461 176.5152 201 D 4.8241 7.4517 115.1130 51.8106 44.9443 175.5024 202 W 4.1630 8.8137 120.7883 58.5138 29.3357 176.5337 203 K 4.2179 8.2911 122.3391 56.9191 32.6290 174.4231 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 67 V 8.05 4.03 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 0.99 0.00 0.00 0.93 0.00 0.00 68 P 0.00 4.38 0.00 2.20 2.03 0.00 3.75 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 69 N 9.01 4.53 0.00 2.85 2.86 0.00 0.00 6.26 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 V 7.83 4.84 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 0.87 0.00 0.00 0.87 0.00 0.00 71 V 8.65 4.23 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 0.95 0.00 0.00 1.01 0.00 0.00 72 V 8.31 3.87 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.72 0.00 0.00 73 T 8.69 4.20 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 1.20 0.00 0.00 74 G 7.26 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 0.00 0.00 0.00 0.00 75 L 8.17 5.29 0.00 1.66 1.23 0.78 -0.03 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 76 T 8.79 4.87 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 1.18 0.00 0.00 77 L 8.22 4.76 0.00 1.16 1.53 0.90 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 78 V 8.98 3.81 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 0.87 0.00 0.00 0.89 0.00 0.00 79 C 8.41 5.08 0.00 3.07 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 80 S 9.06 4.19 0.00 4.01 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.02 4.35 0.00 4.20 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 82 A 6.97 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 P 0.00 4.26 0.00 2.04 1.91 0.00 2.86 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.73 0.00 84 G 7.11 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 85 P 0.00 4.35 0.00 2.18 2.03 0.00 3.69 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 86 L 7.88 4.42 0.00 1.27 0.93 0.89 0.63 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 87 E 8.03 5.07 0.00 1.83 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 2.11 2.34 0.00 88 L 8.91 4.53 0.00 1.15 0.73 0.54 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.64 4.67 0.00 2.81 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 90 L 8.17 4.50 0.00 1.36 1.26 -0.39 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.15 4.37 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 1.15 0.00 0.00 92 G 7.34 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 0.00 0.00 0.00 0.00 93 D 8.30 4.25 0.00 2.66 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 94 L 8.08 3.37 0.00 1.71 1.70 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.03 4.13 0.00 2.05 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 2.35 2.21 0.00 96 S 7.36 4.28 0.00 4.16 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 0.00 97 F 7.47 4.62 0.00 3.43 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 98 K 7.81 4.19 0.00 1.96 1.91 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.24 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.58 7.81 99 K 7.72 4.49 0.00 1.79 1.83 0.00 1.64 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.39 7.81 100 Q 7.78 4.83 0.00 2.28 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 101 S 8.05 4.84 0.00 3.88 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 0.00 102 F 9.13 5.14 0.00 3.21 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 0.00 103 V 8.71 4.80 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.04 0.00 0.00 104 L 8.48 4.83 0.00 1.74 1.26 1.04 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 105 K 5.95 4.15 0.00 0.79 0.74 0.00 1.51 0.00 0.00 1.53 0.00 0.00 2.74 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.09 1.23 7.81 106 E 8.54 3.99 0.00 2.28 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 2.31 2.19 0.00 107 G 8.45 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 0.00 108 V 7.12 3.93 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 1.03 0.00 0.00 109 E 8.77 5.15 0.00 1.91 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 2.29 2.34 0.00 110 Y 8.80 5.18 0.00 3.12 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 0.00 111 R 9.05 4.77 0.00 1.71 1.71 0.00 3.04 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.52 0.00 112 I 8.68 4.66 1.97 0.00 0.00 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 1.52 1.35 1.12 0.00 0.00 113 K 9.37 4.86 0.00 1.70 1.68 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.74 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.34 7.81 114 I 8.95 4.66 1.95 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 -0.09 0.52 0.00 0.00 115 S 8.61 5.18 0.00 3.76 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 0.00 116 F 8.76 5.31 0.00 2.79 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 9.04 4.79 0.00 1.76 1.83 0.00 3.02 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.49 0.00 118 V 8.36 4.76 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.21 0.00 0.00 119 N 9.51 4.38 0.00 2.65 2.87 0.00 0.00 6.89 7.31 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 0.00 120 R 8.23 4.44 0.00 1.80 1.96 0.00 3.17 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 121 E 7.86 4.78 0.00 1.88 1.81 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 2.20 2.38 0.00 122 I 8.39 4.07 1.91 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 1.29 0.70 1.01 0.00 0.00 123 V 8.69 4.30 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 1.01 0.00 0.00 1.09 0.00 0.00 124 S 8.19 5.15 0.00 3.83 3.86 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 0.00 125 G 8.47 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 0.00 0.00 0.00 *127 K 8.24 4.14 0.00 1.77 1.59 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.77 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.38 7.81 128 Y 8.93 5.30 0.00 2.99 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 I 8.51 4.84 1.71 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 1.26 0.53 0.80 0.00 0.00 130 E 8.85 4.70 0.00 1.88 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 131 H 9.05 5.23 0.00 3.24 3.06 0.00 5.62 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 T 8.51 5.00 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 1.33 0.00 0.00 133 Y 9.33 5.11 0.00 2.80 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 0.00 134 R 8.98 4.44 0.00 1.73 1.63 0.00 3.13 0.00 0.00 2.84 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 1.43 0.00 135 K 9.54 3.76 0.00 1.77 1.75 0.00 1.61 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.42 7.81 136 G 8.20 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 7.67 4.30 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 1.02 0.00 0.00 1.00 0.00 0.00 138 K 8.63 3.76 0.00 1.19 1.46 0.00 1.55 0.00 0.00 1.38 0.00 0.00 2.84 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.99 0.48 7.81 139 I 7.94 4.32 1.87 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.90 0.92 0.00 0.00 140 D 7.25 4.49 0.00 2.72 2.41 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 0.00 141 K 8.52 4.77 0.00 1.48 1.51 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.52 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.78 1.18 7.81 142 T 8.78 4.40 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 0.60 0.00 0.00 143 D 8.52 5.14 0.00 2.43 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 0.00 144 Y 9.02 4.89 0.00 3.21 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 *146 V 8.64 3.62 1.61 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 0.45 0.00 0.00 -0.07 0.00 0.00 147 G 8.04 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 0.00 0.00 0.00 148 S 8.32 4.93 0.00 3.79 3.82 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 0.00 149 Y 9.03 4.74 0.00 2.80 2.44 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 0.00 150 G 8.75 4.45 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 0.00 0.00 0.00 151 P 0.00 4.79 0.00 2.24 2.14 0.00 3.89 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 2.05 2.14 0.00 152 R 8.28 4.42 0.00 1.80 1.70 0.00 2.21 0.00 0.00 2.70 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.39 0.00 153 A 8.53 4.10 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 0.00 154 E 7.66 4.02 0.00 1.78 1.57 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 2.10 2.17 0.00 155 E 8.22 4.19 0.00 1.97 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 156 Y 8.52 4.53 0.00 1.45 2.38 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 0.00 157 E 8.77 4.95 0.00 1.84 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 2.17 2.22 0.00 158 F 9.48 4.83 0.00 3.44 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 0.00 159 L 7.72 4.85 0.00 1.29 1.29 0.86 0.81 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 T 7.83 3.96 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 0.36 0.00 0.00 161 P 0.00 4.43 0.00 2.23 2.19 0.00 3.89 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 2.34 2.13 0.00 162 V 8.14 3.92 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 0.82 0.00 0.00 0.90 0.00 0.00 163 E 9.04 4.64 0.00 1.16 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 2.25 2.36 0.00 164 E 8.24 5.24 0.00 1.78 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 2.57 2.31 0.00 165 A 9.19 4.43 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 0.00 166 P 0.00 4.62 0.00 2.11 2.06 0.00 3.59 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 1.91 1.73 0.00 167 K 8.43 4.51 0.00 1.75 1.69 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.30 1.38 7.81 168 G 9.20 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 *170 L 8.57 4.23 0.00 1.66 1.80 0.92 0.71 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 0.00 171 A 7.73 4.52 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 0.00 172 R 7.67 4.28 0.00 1.92 1.88 0.00 3.32 0.00 0.00 3.36 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 173 G 7.97 3.77 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 0.00 0.00 0.00 174 S 8.17 5.10 0.00 3.72 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 0.00 175 Y 9.15 5.01 0.00 2.94 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 0.00 176 S 9.18 5.04 0.00 3.76 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 0.00 177 I 8.48 4.89 0.56 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.68 0.93 0.00 0.00 178 K 9.09 4.77 0.00 1.89 1.78 0.00 1.56 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.15 0.00 0.00 0.00 0.00 1.32 1.23 7.81 179 S 8.48 4.98 0.00 2.72 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 0.00 180 R 8.65 5.14 0.00 1.63 1.80 0.00 3.11 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.50 0.00 181 F 9.63 5.19 0.00 3.51 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 0.00 182 T 8.79 5.30 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 1.14 0.00 0.00 183 D 8.01 4.97 0.00 3.09 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 0.00 184 D 8.40 4.35 0.00 2.77 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 0.00 185 D 8.19 4.68 0.00 2.67 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 0.00 186 K 7.84 3.87 0.00 1.89 1.84 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.37 7.81 187 T 7.66 3.91 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 1.20 0.00 0.00 188 D 8.23 4.82 0.00 2.63 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 0.00 189 H 8.83 4.63 0.00 3.62 3.52 0.00 5.74 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 L 7.81 4.64 0.00 1.81 1.77 0.71 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 191 S 9.15 5.65 0.00 3.90 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 0.00 192 W 9.21 5.55 0.00 3.62 3.30 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 0.00 193 E 9.22 5.45 0.00 2.01 1.94 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 2.19 2.36 0.00 194 W 9.14 5.50 0.00 3.42 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 0.00 195 N 8.81 5.36 0.00 2.83 2.83 0.00 0.00 6.20 6.74 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 0.00 196 L 8.43 5.23 0.00 1.55 1.34 1.16 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 197 T 9.56 5.04 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 1.26 0.00 0.00 198 I 8.85 4.63 2.15 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.76 0.92 0.00 0.00 199 K 8.49 4.84 0.00 1.68 1.70 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.34 1.35 7.81 200 K 8.69 4.02 0.00 1.69 1.80 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.60 7.81 201 D 7.45 4.82 0.00 2.64 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 W 8.81 4.16 0.00 3.28 3.27 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 0.00 203 K 8.29 4.22 0.00 1.92 1.81 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.46 7.81 * Residues marked with a * may have inaccurate shift predictions.