NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 Q 4.3209 8.3293 121.7113 55.4584 30.9710 174.7690 5 I 4.3928 7.3095 109.6952 58.2191 40.3832 173.0631 6 R 4.4602 9.1871 121.5997 55.1185 31.6696 177.4857 7 K 4.3762 8.5281 119.7663 55.3574 32.8693 175.5203 8 P 4.5016 0.0000 0.0000 62.3113 31.8780 176.2221 9 L 4.2401 8.9295 121.3348 55.6655 41.3818 176.3801 10 L 4.5135 8.3683 120.5973 53.6176 43.0201 177.5073 11 K 3.8735 8.6763 124.3276 59.6566 32.4881 178.5925 12 S 4.1108 8.3158 113.0631 61.5247 62.5043 176.3241 13 S 4.2813 8.3974 113.9283 59.8529 62.5818 174.5718 14 L 4.6611 8.0157 120.4643 54.6634 42.0453 177.4953 15 L 4.0985 7.9087 120.3821 58.1505 41.4860 178.3259 16 D 4.5525 7.9041 114.6930 55.0645 41.3287 176.8665 17 Q 3.8636 8.0288 119.0070 56.1998 28.9307 175.6460 18 N 4.5591 8.5486 121.5031 51.8246 38.4685 173.5500 19 L 4.8213 7.9018 124.4822 52.1569 46.2946 176.6445 20 T 4.1824 8.4266 110.4594 61.0802 70.7554 175.0020 21 E 3.8404 8.7107 122.0607 59.8103 29.4771 178.9722 22 E 3.8652 8.0670 117.5115 59.5268 29.3098 178.7973 23 E 4.0029 8.2050 118.4900 59.8720 29.4876 180.1140 24 V 3.6947 8.0769 112.2327 64.3496 31.5872 178.1097 25 N 4.4361 8.1803 116.3138 56.8121 38.3736 177.1374 26 M 4.1771 8.3612 122.1891 58.8432 31.9542 177.4501 *27 K 4.3693 7.5024 120.5280 54.2709 34.0380 177.5773 28 F 4.4816 8.7740 122.7202 61.6195 39.3941 177.9782 29 V 3.3732 8.5599 119.1623 64.6716 31.0286 178.0789 30 Q 3.8739 8.0297 120.2235 59.1055 28.8745 177.6786 31 D 4.5192 8.0490 118.5505 57.1110 41.1619 178.1077 32 L 4.0729 7.8529 119.5704 57.7633 41.6832 178.9522 33 L 3.9991 7.9836 119.0794 58.2751 41.5670 179.3390 34 N 4.2995 8.6376 116.2497 56.2131 38.4296 176.9349 35 W 4.0193 8.4410 129.6806 60.6918 30.5891 177.8685 36 V 3.5632 8.0599 116.9680 66.2966 31.1883 177.3984 37 D 4.4374 8.2419 118.5516 57.4955 40.6317 178.7273 38 E 3.8824 8.3558 118.1202 59.6683 29.1811 178.9962 39 M 3.6708 7.8707 119.8330 57.7415 31.7841 178.3106 40 Q 3.7553 7.9157 120.2171 58.5781 29.1709 178.2139 41 V 3.5246 7.7416 120.0919 65.1154 31.4483 178.4513 42 Q 3.7592 7.3816 119.2283 57.8673 28.8448 179.5533 43 L 4.0739 7.1698 122.1676 57.3995 42.0596 178.2431 44 D 4.3649 7.8786 117.5868 57.8310 40.8968 179.2143 45 R 3.9434 8.2006 116.9945 57.6677 30.1236 177.3649 46 T 3.5431 7.0107 115.4968 64.0065 68.9860 172.6439 47 E 4.2548 7.9125 123.7156 54.2942 32.5731 175.8131 48 W 4.5713 8.3438 120.3332 56.8653 30.5001 177.7861 49 G 4.3114 8.6245 103.3000 45.7969 0.0000 173.0929 50 S 4.8059 8.5102 113.2411 57.4404 64.1359 173.2527 51 D 5.3935 8.1126 122.3899 50.4554 43.7101 175.8026 52 L 3.8618 8.4386 119.7913 57.8554 42.0763 176.6563 53 P 4.5427 0.0000 0.0000 65.0723 31.2569 178.7063 54 S 4.1027 8.6131 113.0264 61.2984 62.7759 176.5972 55 V 3.8683 8.1440 123.5132 65.3665 31.0819 177.4915 56 E 3.9790 8.4576 118.6795 59.7569 29.3184 179.4919 57 S 4.1127 8.0586 112.5332 61.8353 62.5409 175.8293 58 H 4.1950 8.3808 119.1210 58.6788 28.2272 177.3263 59 L 3.9512 8.1352 121.4498 58.2944 42.1103 178.4001 60 E 4.0645 8.6637 119.2135 59.3524 29.6439 177.9762 61 N 4.2264 8.5056 117.4926 57.3261 38.8958 176.1942 62 H 4.2678 8.9911 121.7874 59.0839 29.7956 177.7716 63 K 4.0031 8.2553 126.3864 60.2002 31.5409 183.3457 64 N 4.5637 8.1687 117.1901 55.9987 38.4950 177.6584 65 V 3.5255 7.7527 119.5791 66.2874 31.6564 177.5615 66 H 4.2147 8.4703 119.7113 58.5778 29.6933 177.0875 67 R 3.8822 8.4701 120.6588 59.4348 29.9869 178.2593 68 A 4.1361 8.0721 120.4758 55.5179 18.2325 179.6203 69 I 4.1084 7.8844 116.8966 64.6811 37.2527 178.1238 70 E 4.3199 8.2276 119.4777 59.1910 29.5883 178.8195 71 E 4.0894 8.4480 118.3002 58.6782 29.6608 178.7317 72 F 3.7614 8.3664 120.9471 60.7084 39.1770 176.4386 73 E 3.6594 8.0006 119.4181 59.2736 29.2923 178.7640 74 S 4.0927 7.7988 114.0140 61.6211 62.7835 176.7502 75 S 4.1035 7.4690 118.1908 60.6680 62.4675 176.2527 76 L 3.6580 6.9633 122.7000 58.0003 41.7207 179.0548 77 K 3.9448 8.2865 118.8011 59.3987 32.0961 178.9426 78 E 3.8845 8.1992 119.4223 59.1333 29.3069 178.7341 79 A 4.3691 8.1618 120.1952 55.1214 18.6352 179.3527 80 K 4.1174 8.4014 117.6635 59.8058 32.1505 179.6133 81 I 3.8843 8.1299 112.7887 63.5278 37.5328 178.1725 82 S 4.0733 7.9955 117.0395 61.1169 62.6000 175.6721 83 E 3.8081 8.0878 122.2670 59.3889 28.9505 179.0423 84 I 3.7476 7.2848 119.3163 64.2425 37.2833 177.7921 85 Q 4.1141 7.7707 116.3666 56.6732 28.7688 176.3526 86 M 4.4417 6.9521 119.9844 54.7898 33.3673 175.1868 87 T 4.6042 7.9469 113.2152 60.1016 70.8368 173.0090 88 A 4.3894 8.3266 128.3319 51.5259 18.5513 176.2984 89 P 4.4657 0.0000 0.0000 65.3755 32.2537 178.6545 90 L 4.1439 7.9149 118.4823 56.8257 41.2731 179.0733 91 K 3.9495 8.2612 120.5051 59.4993 32.1955 178.4475 92 L 3.9916 7.3786 119.6104 58.0473 41.6911 179.5137 93 S 4.1081 8.0975 112.3153 61.4702 62.3423 175.3905 94 Y 3.8989 8.0427 122.0722 61.0102 38.6299 177.8707 95 T 3.8170 8.2895 117.0036 66.8068 68.6021 175.5474 96 D 4.3413 7.8131 119.1713 57.6637 41.1547 178.9146 97 K 3.9044 7.6554 118.0496 59.1976 31.9651 179.0649 98 L 3.7692 7.8921 121.0229 58.5454 42.0748 178.8744 99 H 4.5925 8.5221 117.7815 58.2435 28.6427 177.7101 100 R 3.8946 8.0302 120.6060 59.2891 29.8690 178.1611 101 L 3.9646 8.3914 120.3545 58.3990 41.8903 178.6308 102 E 4.0578 8.5190 118.7580 59.6102 29.1822 179.5472 103 S 4.2007 7.7939 111.3132 61.5751 62.8230 175.7153 104 Q 4.1533 8.5814 121.1664 59.2562 28.7553 178.5004 105 Y 4.0806 8.6317 120.6953 60.5885 38.6667 177.4763 106 A 3.7643 7.8026 120.2846 55.1216 18.6800 179.6598 107 K 4.0266 7.7363 116.7505 58.6595 32.3784 177.7934 108 L 4.2083 6.5046 118.1186 56.4831 41.0767 177.6801 109 L 3.8596 8.6204 120.6260 55.4674 41.7359 174.7308 110 N 4.7441 7.4557 115.1274 55.8049 40.1452 176.5136 111 T 3.8638 8.3375 117.3980 66.6983 68.6219 176.4755 112 S 4.2024 8.2243 114.5463 61.6382 62.2268 176.4285 113 R 4.0144 7.9256 120.1056 59.2431 29.9682 178.5068 114 N 4.2196 7.9604 115.8467 56.5296 38.4776 177.5492 115 Q 4.3738 8.3097 119.4266 58.7572 28.7739 178.3580 116 E 3.8310 8.2896 120.7997 59.3393 29.7394 179.1888 117 R 3.9508 8.2644 116.4864 59.5356 29.3831 178.5192 118 H 4.1580 8.6430 117.3194 58.6236 28.6068 177.6927 119 L 4.2047 8.4111 121.1115 57.9652 41.4142 178.6414 120 D 4.3723 8.2502 118.1573 57.8238 41.0463 178.3901 121 T 3.8803 8.2410 109.9219 64.8521 68.5741 175.7985 122 L 3.8671 8.2027 123.1830 58.1703 41.9820 178.6191 123 H 4.1226 8.4014 118.0957 59.2737 29.9000 176.2010 124 N 4.1617 8.3151 118.8954 57.0644 38.5919 176.1743 125 F 4.0684 8.5411 121.6883 61.4868 39.4565 177.4288 126 V 2.9555 8.0506 117.9608 65.8293 31.2383 177.7276 127 T 3.7443 7.8193 115.8640 66.9580 68.3688 176.5942 128 R 3.7857 7.6840 119.1112 59.2299 30.0505 179.0975 129 A 3.8715 7.6800 120.8563 55.1545 18.1708 179.8014 130 T 3.9300 7.9874 114.5176 66.9546 68.4798 176.5797 131 N 4.3684 8.2062 118.2548 56.2475 38.5346 177.1636 132 E 3.9859 8.0446 119.8642 59.7108 29.5635 179.3820 133 L 4.1420 8.3197 119.0833 57.9523 41.5751 179.8480 134 I 3.7166 8.1472 119.9762 64.0797 37.0220 177.9032 135 W 4.2767 8.4517 129.2966 60.6767 30.4088 177.5654 136 L 4.1846 8.7079 119.0338 58.2004 40.9883 179.1084 137 N 4.2882 8.2995 115.7352 56.7378 39.2621 176.3371 138 E 4.0620 8.3729 118.4423 58.6367 29.6150 179.0059 139 K 3.7003 7.8862 120.0001 58.5321 31.7371 178.4236 140 E 3.8804 7.9515 122.5647 60.3587 29.2157 179.3954 141 E 4.0125 7.6409 118.7695 61.7528 29.5933 179.8445 142 S 4.6648 7.8989 113.9520 60.6041 66.2154 179.1306 143 E 3.7014 7.2278 118.0705 59.0336 29.7508 181.2882 144 V 4.1006 7.6546 125.8308 60.5474 31.2037 178.4170 145 A 4.9871 8.4741 135.0000 53.7292 18.5033 177.7821 *161 Y 4.6172 7.2900 115.5745 57.2690 38.6659 177.9488 *162 H 4.6222 7.4983 113.3682 53.4101 31.1699 175.7346 163 A 4.1674 8.3309 129.2921 53.3195 17.1963 179.8608 164 E 4.6147 7.9293 115.5608 59.9733 30.9797 180.5102 165 L 4.3454 8.0684 123.6271 60.9240 40.8477 183.8407 166 M 4.3830 8.2241 122.9135 60.0258 31.1474 181.7774 167 R 4.2809 8.1276 121.6455 62.4728 29.7754 183.5532 168 E 4.3326 8.4664 122.1057 61.6716 29.7274 181.5450 169 L 4.6377 8.5011 126.2889 60.2294 40.7293 181.6371 170 E 4.3948 8.0053 120.6985 61.6951 29.5745 181.6393 171 Q 4.3801 8.1070 123.7555 60.7200 28.1741 181.5348 172 K 3.8144 8.1373 128.5615 59.8774 31.5211 181.0111 173 E 3.7715 8.2254 122.0195 61.8787 29.3543 181.7470 174 E 4.0648 7.4249 117.5320 61.0801 29.4515 180.8644 175 S 4.3731 7.5071 113.0225 60.7714 62.7462 175.8519 176 I 3.5176 7.9933 123.6456 64.2109 36.4833 178.0023 177 K 4.0046 7.9545 115.4131 56.8329 31.8528 176.2599 178 A 4.4475 7.4467 119.4222 52.9474 21.5479 178.8544 179 V 3.6231 7.4772 113.8399 66.4510 31.3817 177.9285 180 Q 4.0686 8.2214 121.1830 60.1121 28.9713 178.9954 181 E 4.0352 8.0849 118.5789 60.8323 29.6572 180.7462 182 I 3.8301 7.8781 119.3883 64.5946 37.1712 178.3165 183 A 3.3812 7.9789 121.4621 54.8125 18.1029 178.8796 184 E 3.7818 8.1411 117.9561 59.6702 29.5066 179.0318 185 Q 3.8597 7.7849 118.8867 59.3622 29.3491 178.0636 186 L 3.8804 8.0866 120.2870 57.6228 41.4442 179.8113 187 L 3.8365 8.1189 119.2068 57.8395 41.4819 179.0408 188 L 3.7853 7.8448 117.8066 58.2476 41.7394 179.1259 189 E 4.0358 8.2322 115.4236 56.0000 30.7192 175.7759 190 N 4.0265 8.6333 117.6744 54.4640 37.6441 173.7064 191 H 3.9438 7.9379 119.9476 55.2833 31.0099 174.2240 192 P 4.0341 0.0000 0.0000 65.1684 31.2704 176.2669 193 A 4.4164 7.3293 121.5726 51.6757 19.6324 179.0110 194 R 3.7865 7.6772 119.5432 61.3062 29.1244 177.6185 195 L 3.9784 7.9088 119.0988 57.9797 41.7405 179.6346 196 T 4.1195 7.8784 108.8217 64.5827 68.6968 176.5612 197 I 3.7547 7.7089 122.9751 64.4588 37.1198 177.7151 198 E 3.8883 8.3334 119.9182 59.2865 29.2394 178.9021 199 A 4.0038 8.0144 120.6279 55.4378 18.6437 179.1187 200 Y 3.7837 8.3666 115.2477 61.1113 37.9315 178.7826 201 R 4.0894 8.7023 119.6088 59.7662 30.1567 178.4437 202 A 4.0279 8.3913 120.2950 54.9380 18.3683 179.3503 203 A 3.9460 8.1957 119.4138 55.4880 18.4080 179.4911 204 M 4.0177 8.4045 116.8776 59.1612 32.4386 178.4371 205 Q 4.1879 8.3675 118.1505 59.2628 28.8886 179.2429 206 T 3.9239 8.4027 117.1962 66.6889 68.5706 176.5576 207 Q 4.1613 8.3404 121.4557 59.0306 29.0830 177.3524 208 W 4.6994 8.5678 129.4914 61.2051 30.4360 177.4598 209 S 3.7584 8.2120 111.8208 61.3495 61.8889 176.3806 210 W 4.3015 8.0495 121.0001 59.8064 28.9425 178.3129 211 I 3.7267 8.3893 120.1306 64.7270 36.6265 178.0896 212 L 3.6659 7.5700 119.4629 58.0216 41.2060 179.4975 213 Q 4.2095 7.9224 117.6559 58.3169 28.9819 177.8487 214 L 4.1545 7.5471 119.7482 58.3537 41.8607 178.9886 215 C 4.1977 7.8010 114.5774 61.1899 28.1175 173.7539 216 Q 4.1461 8.5259 124.8967 55.9487 28.9397 172.9784 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 4 Q 8.33 4.32 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.61 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 5 I 7.31 4.39 1.89 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 1.53 0.39 0.81 0.00 0.00 6 R 9.19 4.46 0.00 2.05 2.03 0.00 3.19 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.02 0.00 7 K 8.53 4.38 0.00 1.83 1.84 0.00 1.73 0.00 0.00 1.81 0.00 0.00 3.23 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.55 7.81 8 P 0.00 4.50 0.00 1.94 1.75 0.00 3.69 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.44 0.00 9 L 8.93 4.24 0.00 1.80 1.87 1.06 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.37 4.51 0.00 1.74 1.61 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.68 3.87 0.00 1.54 1.69 0.00 1.09 0.00 0.00 1.54 0.00 0.00 2.49 0.00 0.00 2.22 0.00 0.00 0.00 0.00 1.16 0.42 7.81 12 S 8.32 4.11 0.00 3.96 4.11 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 13 S 8.40 4.28 0.00 3.96 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 14 L 8.02 4.66 0.00 1.73 1.71 0.99 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.91 4.10 0.00 1.65 1.71 0.89 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 16 D 7.90 4.55 0.00 2.65 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 17 Q 8.03 3.86 0.00 2.29 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.03 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 18 N 8.55 4.56 0.00 2.90 2.68 0.00 0.00 7.12 7.78 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 19 L 7.90 4.82 0.00 1.61 1.89 0.94 0.96 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 20 T 8.43 4.18 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 21 E 8.71 3.84 0.00 2.01 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 2.31 2.37 0.00 22 E 8.07 3.87 0.00 2.02 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 2.39 2.35 0.00 23 E 8.20 4.00 0.00 2.26 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 24 V 8.08 3.69 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 0.81 0.00 0.00 0.92 0.00 0.00 25 N 8.18 4.44 0.00 2.87 2.77 0.00 0.00 7.02 6.94 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 26 M 8.36 4.18 0.00 2.13 2.37 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 3.00 0.00 *27 K 7.50 4.37 0.00 1.76 1.70 0.00 1.63 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.48 7.81 28 F 8.77 4.48 0.00 3.19 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.56 3.37 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 0.60 0.00 0.00 0.60 0.00 0.00 30 Q 8.03 3.87 0.00 2.34 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 31 D 8.05 4.52 0.00 2.79 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 32 L 7.85 4.07 0.00 1.81 1.68 0.42 -0.48 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 33 L 7.98 4.00 0.00 1.87 1.75 0.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.64 4.30 0.00 2.93 2.91 0.00 0.00 6.73 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 35 W 8.44 4.02 0.00 3.61 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 V 8.06 3.56 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 0.94 0.00 0.00 1.00 0.00 0.00 37 D 8.24 4.44 0.00 2.88 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 38 E 8.36 3.88 0.00 2.03 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 2.16 2.11 0.00 39 M 7.87 3.67 0.00 1.54 1.51 0.00 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2.89 2.82 0.00 0.00 7.07 8.65 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 0.00 115 Q 8.31 4.37 0.00 2.40 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.74 2.62 0.00 116 E 8.29 3.83 0.00 2.11 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 0.00 2.23 2.33 0.00 117 R 8.26 3.95 0.00 2.01 2.12 0.00 2.77 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 118 H 8.64 4.16 0.00 3.22 2.83 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 L 8.41 4.20 0.00 1.97 1.83 0.89 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 120 D 8.25 4.37 0.00 2.92 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 0.00 121 T 8.24 3.88 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 1.22 0.00 0.00 122 L 8.20 3.87 0.00 2.07 1.90 1.05 0.78 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 0.00 123 H 8.40 4.12 0.00 3.27 3.47 0.00 5.67 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 0.00 124 N 8.32 4.16 0.00 2.84 3.03 0.00 0.00 6.89 7.23 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 0.00 125 F 8.54 4.07 0.00 3.01 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 0.00 126 V 8.05 2.96 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 0.60 0.00 0.00 0.58 0.00 0.00 127 T 7.82 3.74 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 1.14 0.00 0.00 128 R 7.68 3.79 0.00 1.77 1.82 0.00 3.11 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.79 0.00 129 A 7.68 3.87 1.06 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 0.00 130 T 7.99 3.93 4.44 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 1.27 0.00 0.00 131 N 8.21 4.37 0.00 2.85 2.87 0.00 0.00 7.07 7.02 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 0.00 132 E 8.04 3.99 0.00 2.15 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 2.48 2.38 0.00 133 L 8.32 4.14 0.00 1.96 1.78 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 134 I 8.15 3.72 2.10 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 1.44 0.73 0.95 0.00 0.00 135 W 8.45 4.28 0.00 3.52 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 0.00 136 L 8.71 4.18 0.00 2.10 1.89 1.59 0.70 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 0.00 137 N 8.30 4.29 0.00 2.79 2.98 0.00 0.00 7.37 7.61 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 0.00 138 E 8.37 4.06 0.00 2.13 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 2.34 2.11 0.00 139 K 7.89 3.70 0.00 1.50 1.63 0.00 1.37 0.00 0.00 1.12 0.00 0.00 2.76 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.30 0.65 7.81 140 E 7.95 3.88 0.00 2.01 2.06 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 2.26 2.35 0.00 141 E 7.64 4.01 0.00 2.13 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 2.28 2.24 0.00 142 S 7.90 4.66 0.00 3.55 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 0.00 143 E 7.23 3.70 0.00 2.00 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 0.00 2.27 2.19 0.00 144 V 7.65 4.10 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 0.86 0.00 0.00 0.93 0.00 0.00 145 A 8.47 4.99 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 *161 Y 7.29 4.62 0.00 2.28 2.35 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 *162 H 7.50 4.62 0.00 2.86 2.84 0.00 7.24 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 A 8.33 4.17 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 0.00 164 E 7.93 4.61 0.00 1.92 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 2.15 2.16 0.00 165 L 8.07 4.35 0.00 1.64 1.67 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 166 M 8.22 4.38 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.19 0.00 167 R 8.13 4.28 0.00 1.81 1.96 0.00 3.23 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.26 0.00 168 E 8.47 4.33 0.00 1.97 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 2.25 2.21 0.00 169 L 8.50 4.64 0.00 1.63 1.72 0.92 1.19 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 0.00 170 E 8.01 4.39 0.00 2.03 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 2.26 2.20 0.00 171 Q 8.11 4.38 0.00 2.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 172 K 8.14 3.81 0.00 1.77 1.85 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.33 7.81 173 E 8.23 3.77 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 174 E 7.42 4.06 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.21 0.00 175 S 7.51 4.37 0.00 3.71 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 0.00 176 I 7.99 3.52 1.26 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 -0.04 0.43 0.00 0.00 177 K 7.95 4.00 0.00 1.64 1.93 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.42 7.81 178 A 7.45 4.45 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 0.00 179 V 7.48 3.62 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 0.92 0.00 0.00 0.87 0.00 0.00 180 Q 8.22 4.07 0.00 2.24 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 181 E 8.08 4.04 0.00 2.01 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 2.31 1.97 0.00 182 I 7.88 3.83 2.23 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 1.48 0.68 1.04 0.00 0.00 183 A 7.98 3.38 1.16 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 0.00 184 E 8.14 3.78 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 185 Q 7.78 3.86 0.00 2.31 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.54 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 186 L 8.09 3.88 0.00 1.62 1.47 0.93 0.30 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 0.00 187 L 8.12 3.84 0.00 1.92 1.63 0.81 0.58 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 0.00 188 L 7.84 3.79 0.00 1.79 1.74 0.92 0.82 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 0.00 189 E 8.23 4.04 0.00 2.03 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 2.31 2.34 0.00 190 N 8.63 4.03 0.00 2.72 2.77 0.00 0.00 7.07 5.28 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 0.00 191 H 7.94 3.94 0.00 3.30 2.91 0.00 5.84 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 P 0.00 4.03 0.00 1.38 1.93 0.00 2.75 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.11 0.00 193 A 7.33 4.42 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 R 7.68 3.79 0.00 2.01 2.29 0.00 2.79 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 195 L 7.91 3.98 0.00 1.74 1.81 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 196 T 7.88 4.12 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 1.34 0.00 0.00 197 I 7.71 3.75 1.80 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.48 0.29 0.00 0.00 198 E 8.33 3.89 0.00 2.06 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 2.32 2.42 0.00 199 A 8.01 4.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.37 3.78 0.00 3.33 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 0.00 201 R 8.70 4.09 0.00 2.14 2.17 0.00 3.27 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 1.77 1.79 0.00 202 A 8.39 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 0.00 203 A 8.20 3.95 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 0.00 204 M 8.40 4.02 0.00 2.28 2.12 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.61 0.00 205 Q 8.37 4.19 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.59 0.00 0.00 0.00 0.00 0.00 2.55 2.70 0.00 206 T 8.40 3.92 4.51 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 0.00 0.00 1.43 0.00 0.00 207 Q 8.34 4.16 0.00 2.31 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.70 0.00 0.00 0.00 0.00 0.00 2.48 2.58 0.00 208 W 8.57 4.70 0.00 3.52 3.40 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 0.00 209 S 8.21 3.76 0.00 3.85 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 0.00 210 W 8.05 4.30 0.00 3.61 3.09 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 0.00 211 I 8.39 3.73 2.11 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 1.66 0.64 1.00 0.00 0.00 212 L 7.57 3.67 0.00 1.43 1.41 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 213 Q 7.92 4.21 0.00 2.11 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.28 0.00 214 L 7.55 4.15 0.00 1.89 1.72 0.91 0.97 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 0.00 215 C 7.80 4.20 0.00 2.92 2.99 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 0.00 216 Q 8.53 4.15 0.00 2.17 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.55 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 * Residues marked with a * may have inaccurate shift predictions.