NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.4830 8.1693 120.6409 54.9176 43.4790 175.5632 8 H 4.9142 8.3643 115.7732 53.3018 31.8227 170.9163 9 K 4.5317 9.5025 122.3522 56.1088 33.4892 177.2350 10 E 5.0178 9.2123 124.0147 53.5761 33.1057 173.9552 11 P 4.8200 0.0000 0.0000 63.3557 32.3286 174.8895 12 A 4.9113 8.3730 121.5974 51.4940 23.0944 175.4346 13 T 4.6480 8.5124 115.0472 61.3164 72.1099 173.9854 14 L 4.1582 8.6783 128.0759 55.9523 42.3315 175.6210 15 I 4.3390 8.6091 126.8433 62.3199 38.4933 175.8528 16 K 4.6148 7.5799 121.1191 54.9025 35.7182 174.3194 17 A 4.3822 8.7366 130.7365 52.3709 19.0630 176.7738 18 I 4.1988 7.8127 123.0678 62.6503 38.6010 175.0585 19 D 4.4355 7.4654 116.9533 53.2580 43.7238 176.0926 20 G 3.8000 8.9061 110.4319 47.7737 0.0000 173.9563 21 D 4.9278 8.0642 116.3625 53.0269 40.5824 175.1582 22 T 5.3921 7.7156 115.6258 62.2357 73.0608 173.2330 23 V 4.7010 8.7565 123.2903 60.2004 35.5965 173.2554 24 K 5.0210 9.4276 124.7460 55.0499 33.9688 175.0423 25 L 5.3880 9.0500 126.5134 53.0952 46.2868 175.4417 26 M 4.8524 8.8671 121.8114 55.2124 33.4574 174.9257 27 Y 4.9262 9.0946 125.1061 56.1530 42.4658 175.3113 28 K 3.4036 9.1828 126.7226 57.6326 29.7431 175.5908 29 G 4.0171 8.3884 101.7987 46.2873 0.0000 173.6038 30 Q 4.9016 7.7268 117.6694 52.6382 32.8194 173.2160 31 P 4.9700 0.0000 0.0000 63.4493 32.1201 175.2059 32 M 4.8911 9.4109 122.2038 54.5490 36.3978 173.2641 33 T 5.0506 8.3693 120.0219 62.1386 71.3946 173.4683 34 F 5.0654 9.2159 123.8664 55.6255 42.4873 174.0197 35 R 5.0205 8.9698 123.8607 54.3310 32.0528 175.1962 36 L 4.3611 8.5052 127.2348 54.5312 42.3278 177.1795 37 L 3.7668 8.5648 124.6939 55.7847 42.7605 177.8571 38 L 3.8067 8.7943 120.5144 55.4329 39.2973 173.8759 39 V 4.9084 7.3543 109.4939 59.6206 35.0651 174.8944 40 D 4.9959 9.2617 124.7063 52.9070 42.8991 175.7810 41 T 4.7568 8.3877 113.8410 59.4713 71.2019 172.9344 42 P 4.2626 0.0000 0.0000 62.8707 32.1753 174.3118 43 E 4.4468 8.8234 121.1395 55.3940 29.5429 175.6089 *53 K 4.1606 8.4318 126.5000 55.3684 34.6505 176.8006 54 Y 4.4125 7.0898 114.0122 59.0216 35.6935 170.8537 55 G 3.7650 8.0261 107.5785 47.5810 0.0000 174.1189 56 P 4.2893 0.0000 0.0000 64.9155 31.2875 178.6931 57 E 4.0292 8.1598 116.8823 59.1428 29.6245 178.7770 58 A 4.0245 8.5951 121.1454 55.4715 18.4376 179.9121 59 S 4.1239 8.3435 113.4669 61.7258 62.8562 176.8688 60 A 4.0353 8.3345 123.5935 54.7368 18.0665 179.5835 61 F 4.0084 8.4362 119.3958 61.3105 39.5595 176.8878 62 K 3.7719 8.2168 119.3757 59.6377 31.8712 178.0514 63 K 3.7699 8.1498 119.4804 59.5873 32.0187 178.4241 64 K 3.8405 8.0721 119.5836 59.7713 31.8606 178.5107 65 M 3.8395 7.5773 117.6932 58.5422 31.8801 178.8667 66 V 3.7925 7.6956 112.3434 64.1032 31.5837 178.5907 67 E 4.0816 8.1214 117.6832 59.2523 29.4912 178.0133 68 N 4.4420 8.2156 114.7379 54.9042 38.9675 175.6490 69 A 4.7577 7.3988 119.9499 51.4704 18.9114 177.6905 70 K 4.2058 8.9017 120.6062 58.3061 33.7309 177.3120 71 K 4.6428 8.3239 118.8173 54.4763 35.8627 175.4703 72 I 5.0188 8.4236 125.0239 59.6204 40.3348 174.4430 73 E 5.1459 9.1576 124.0344 54.6156 34.2940 174.5525 74 V 4.5112 8.7766 122.0675 61.0192 34.5332 174.1115 75 E 5.1707 8.8939 127.8098 53.0400 32.0722 174.8575 76 F 4.5427 8.8650 125.7925 57.8798 39.9817 175.5055 77 D 4.9922 8.5698 121.1921 53.3056 43.2460 175.7379 78 K 4.3861 8.8787 117.3806 57.3559 33.4897 176.9348 79 G 4.1387 7.5693 109.3579 44.4806 0.0000 173.0601 80 Q 4.0853 7.9156 118.6181 56.6996 29.2796 176.9250 81 R 4.6691 8.5873 119.4719 56.3733 31.1761 175.9754 82 T 5.0611 7.4462 107.4233 59.8458 72.0554 173.5052 83 D 4.7838 8.5678 124.0149 51.8822 41.4034 176.9697 84 K 3.9903 8.2950 117.0248 59.2587 32.6157 177.0482 85 Y 4.3565 7.8978 115.8882 57.8445 38.1483 176.1208 86 G 3.9090 8.1332 108.0331 45.3907 0.0000 173.6689 87 R 4.2969 8.4726 119.8961 54.9587 31.6593 176.4201 88 G 3.5278 8.4799 111.8731 46.5300 0.0000 172.2406 89 L 5.2751 9.0803 125.7232 53.3860 42.6844 175.7136 90 A 4.5303 8.3108 124.8961 50.5051 23.5110 174.1546 91 Y 4.7282 8.5941 117.4681 57.5801 39.5986 174.9436 92 I 4.7768 8.1883 124.2530 59.7274 40.1259 174.0058 93 Y 5.1115 9.1756 124.1249 56.0544 41.2006 174.4861 94 A 4.9697 8.8292 124.7292 50.5596 22.1470 176.2863 95 D 4.3506 9.8133 124.1626 55.5193 39.1574 175.8074 96 G 4.0004 8.3509 104.1933 45.6509 0.0000 173.7749 97 K 4.5406 8.0338 120.6252 54.7217 33.8698 175.4333 98 M 3.8915 8.4454 123.2517 54.9240 33.1994 177.0771 99 V 3.5823 8.6644 127.0528 66.0500 31.6402 177.7033 100 N 4.2978 7.9803 115.7113 56.4205 38.5158 176.7066 101 E 3.9070 8.1079 119.7665 59.1980 29.7467 178.4580 102 A 4.0635 8.1097 120.6966 55.2182 18.4252 179.4601 103 L 3.7989 8.1916 117.5309 57.9770 41.6846 180.1076 104 V 3.8300 7.5012 119.3812 65.6286 31.3455 178.0592 105 R 4.0372 8.2699 117.3764 59.2004 29.9252 177.2689 106 Q 4.1750 7.8618 116.8087 55.2201 29.2533 175.4911 107 G 4.0520 8.1427 106.8047 47.6112 0.0000 174.6757 108 L 4.6621 7.8363 116.5311 53.8723 42.1192 176.2482 109 A 4.6989 7.5520 119.6546 50.9423 22.7127 175.8990 110 K 4.6269 8.7247 119.3515 54.5815 35.2204 176.1020 111 V 4.2945 9.1927 122.7856 63.0019 32.0294 175.7375 112 A 4.5534 8.4428 129.6823 50.4399 20.6658 176.5995 113 Y 4.1514 8.3098 116.6269 57.6483 38.5648 176.9536 114 V 3.7172 8.5305 122.6409 63.4647 32.3125 174.6331 115 Y 4.6091 8.5548 127.0239 56.6206 40.8568 175.4426 116 K 3.4463 9.3908 127.7366 57.4475 29.7184 176.7084 117 G 4.0541 8.4324 104.9085 45.6605 0.0000 174.8880 118 N 4.8555 7.8094 118.5523 51.9245 37.0934 174.2349 119 N 5.1440 8.1021 114.2586 52.2613 39.0289 177.1866 120 T 3.8453 8.6978 117.2862 67.2094 68.7552 174.8428 121 H 4.8663 8.1848 116.2530 55.6773 29.1877 176.4418 122 E 4.0128 8.3359 123.4653 59.6610 29.3815 179.0294 123 Q 3.9598 8.0348 117.5681 58.6734 28.8818 177.8551 124 L 3.9311 8.0332 120.9935 58.5597 41.9314 179.1051 125 L 4.0424 8.0349 118.4941 57.8071 41.5964 179.6587 126 R 3.9234 8.3098 118.2619 58.9432 30.0267 179.3660 127 K 3.8958 8.1883 118.1747 59.4069 32.1394 178.9981 128 A 3.9679 7.8413 120.9988 55.3677 18.2656 179.3630 129 E 3.8689 8.3101 117.4762 59.2251 29.6578 178.7511 130 A 3.7232 7.9404 120.8820 55.0068 18.4066 179.4400 131 Q 3.7248 7.8644 117.3302 59.3164 29.2419 177.9792 132 A 3.9526 7.8100 121.7900 55.3254 18.3358 179.6060 133 K 3.1919 7.5087 117.7266 59.1507 31.9002 179.0463 134 K 3.9008 7.7511 119.0161 59.1663 32.1447 177.6905 135 E 4.2234 7.9222 116.0745 55.2856 30.0472 176.4004 136 K 4.1497 7.6613 117.3321 55.9005 30.6157 174.6560 137 L 4.4449 8.1206 119.8722 55.2296 44.9339 175.9766 138 N 3.5279 8.8841 122.6990 53.9346 38.0365 177.3882 139 I 3.1554 5.8787 128.9120 64.5576 37.2279 176.4503 140 W 4.6979 8.0477 119.1839 56.5048 29.1118 176.6388 141 S 4.4363 8.3994 119.9833 58.4469 62.6825 173.9284 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 7 L 8.17 4.48 0.00 1.73 1.79 1.14 0.87 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 8 H 8.36 4.91 0.00 3.33 3.40 0.00 5.64 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.50 4.53 0.00 1.57 1.77 0.00 1.41 0.00 0.00 1.33 0.00 0.00 2.13 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.05 1.25 7.81 10 E 9.21 5.02 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.26 0.00 11 P 0.00 4.82 0.00 2.10 2.07 0.00 3.84 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 12 A 8.37 4.91 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 13 T 8.51 4.65 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 1.22 0.00 0.00 14 L 8.68 4.16 0.00 1.62 1.57 0.91 0.98 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 15 I 8.61 4.34 2.05 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.83 0.94 0.00 0.00 16 K 7.58 4.61 0.00 1.80 1.61 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.45 7.81 17 A 8.74 4.38 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 18 I 7.81 4.20 2.01 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 1.20 0.95 0.90 0.00 0.00 19 D 7.47 4.44 0.00 2.60 2.45 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 20 G 8.91 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 0.00 0.00 0.00 21 D 8.06 4.93 0.00 2.86 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 22 T 7.72 5.39 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 1.27 0.00 0.00 23 V 8.76 4.70 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 0.72 0.00 0.00 0.99 0.00 0.00 24 K 9.43 5.02 0.00 1.84 1.74 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.63 7.81 25 L 9.05 5.39 0.00 1.72 1.61 0.44 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 26 M 8.87 4.85 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.69 0.00 27 Y 9.09 4.93 0.00 3.17 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 K 9.18 3.40 0.00 1.59 1.66 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.99 0.21 7.81 29 G 8.39 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 0.00 0.00 0.00 30 Q 7.73 4.90 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 31 P 0.00 4.97 0.00 2.12 2.11 0.00 3.79 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 2.02 2.00 0.00 32 M 9.41 4.89 0.00 2.23 2.02 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.03 0.00 33 T 8.37 5.05 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 1.21 0.00 0.00 34 F 9.22 5.07 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 35 R 8.97 5.02 0.00 1.84 1.73 0.00 3.33 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 36 L 8.51 4.36 0.00 1.56 1.73 0.99 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.56 3.77 0.00 0.79 1.23 0.31 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.79 3.81 0.00 1.99 1.84 1.16 0.99 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 39 V 7.35 4.91 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 0.93 0.00 0.00 40 D 9.26 5.00 0.00 2.50 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.39 4.76 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 1.30 0.00 0.00 42 P 0.00 4.26 0.00 2.31 2.05 0.00 3.57 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 2.18 2.01 0.00 43 E 8.82 4.45 0.00 1.99 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 0.00 2.08 2.08 0.00 *53 K 8.43 4.16 0.00 1.89 1.90 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 1.54 7.81 54 Y 7.09 4.41 0.00 3.17 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 55 G 8.03 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 56 P 0.00 4.29 0.00 2.16 2.11 0.00 3.55 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 2.07 2.15 0.00 57 E 8.16 4.03 0.00 2.36 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 0.00 2.51 2.48 0.00 58 A 8.60 4.02 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 59 S 8.34 4.12 0.00 3.90 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 60 A 8.33 4.04 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 F 8.44 4.01 0.00 3.25 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.22 3.77 0.00 2.00 2.11 0.00 1.58 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.69 1.52 7.81 63 K 8.15 3.77 0.00 1.90 2.03 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.63 7.81 64 K 8.07 3.84 0.00 1.88 1.75 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.43 7.81 65 M 7.58 3.84 0.00 1.85 2.01 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.18 0.00 66 V 7.70 3.79 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 0.91 0.00 0.00 1.00 0.00 0.00 67 E 8.12 4.08 0.00 2.11 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 2.33 2.26 0.00 68 N 8.22 4.44 0.00 2.73 2.84 0.00 0.00 7.01 7.37 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 69 A 7.40 4.76 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.90 4.21 0.00 1.87 1.94 0.00 1.52 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.58 1.45 7.81 71 K 8.32 4.64 0.00 1.72 1.70 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.42 5.02 2.01 0.00 0.00 0.83 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 1.37 0.84 0.00 0.00 73 E 9.16 5.15 0.00 1.90 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 2.22 0.00 74 V 8.78 4.51 1.80 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 0.05 0.00 0.00 0.06 0.00 0.00 75 E 8.89 5.17 0.00 2.23 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 0.00 2.46 2.36 0.00 76 F 8.87 4.54 0.00 3.05 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.57 4.99 0.00 2.73 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 78 K 8.88 4.39 0.00 1.90 1.97 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.18 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.42 7.81 79 G 7.57 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 80 Q 7.92 4.09 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.68 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 81 R 8.59 4.67 0.00 1.75 1.62 0.00 3.16 0.00 0.00 3.20 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.74 0.00 82 T 7.45 5.06 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 1.18 0.00 0.00 83 D 8.57 4.78 0.00 2.79 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 84 K 8.30 3.99 0.00 1.61 1.83 0.00 1.23 0.00 0.00 1.54 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.89 0.23 7.81 85 Y 7.90 4.36 0.00 3.15 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 8.13 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 0.00 0.00 0.00 87 R 8.47 4.30 0.00 2.07 1.80 0.00 3.11 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 88 G 8.48 3.53 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 0.00 0.00 0.00 89 L 9.08 5.28 0.00 1.58 1.64 1.03 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.31 4.53 0.81 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 0.00 0.00 91 Y 8.59 4.73 0.00 3.13 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 92 I 8.19 4.78 1.76 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.82 0.80 0.00 0.00 93 Y 9.18 5.11 0.00 2.87 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.83 4.97 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 D 9.81 4.35 0.00 2.83 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 96 G 8.35 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 97 K 8.03 4.54 0.00 1.78 1.75 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.58 1.51 7.81 98 M 8.45 3.89 0.00 1.85 1.56 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 2.14 0.00 99 V 8.66 3.58 2.07 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 0.97 0.00 0.00 0.90 0.00 0.00 100 N 7.98 4.30 0.00 2.85 2.91 0.00 0.00 6.75 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 0.00 101 E 8.11 3.91 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 102 A 8.11 4.06 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.19 3.80 0.00 1.89 1.74 1.02 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.50 3.83 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.99 0.00 0.00 105 R 8.27 4.04 0.00 1.83 2.09 0.00 3.33 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 106 Q 7.86 4.18 0.00 1.84 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 1.65 2.13 0.00 107 G 8.14 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 0.00 0.00 0.00 0.00 108 L 7.84 4.66 0.00 1.40 1.55 0.42 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.55 4.70 1.20 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 0.00 0.00 110 K 8.72 4.63 0.00 1.70 1.92 0.00 1.55 0.00 0.00 1.53 0.00 0.00 2.36 0.00 0.00 2.22 0.00 0.00 0.00 0.00 1.13 1.19 7.81 111 V 9.19 4.29 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 0.76 0.00 0.00 1.02 0.00 0.00 112 A 8.44 4.55 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 0.00 113 Y 8.31 4.15 0.00 3.11 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 0.00 114 V 8.53 3.72 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 0.88 0.00 0.00 1.04 0.00 0.00 115 Y 8.55 4.61 0.00 3.08 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 0.00 116 K 9.39 3.45 0.00 1.63 1.57 0.00 1.41 0.00 0.00 1.26 0.00 0.00 2.58 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.30 0.53 7.81 117 G 8.43 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 0.00 0.00 0.00 0.00 118 N 7.81 4.86 0.00 2.95 2.84 0.00 0.00 6.69 8.12 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 0.00 119 N 8.10 5.14 0.00 2.88 3.03 0.00 0.00 6.11 7.22 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 0.00 120 T 8.70 3.85 4.37 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 0.98 0.00 0.00 121 H 8.18 4.87 0.00 2.98 3.10 0.00 5.62 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.34 4.01 0.00 2.18 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 2.34 2.40 0.00 123 Q 8.03 3.96 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.60 0.00 0.00 0.00 0.00 0.00 2.46 2.36 0.00 124 L 8.03 3.93 0.00 1.75 1.88 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.03 4.04 0.00 1.79 1.73 1.07 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.31 3.92 0.00 1.96 1.96 0.00 3.27 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.82 0.00 127 K 8.19 3.90 0.00 1.99 1.82 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.60 7.81 128 A 7.84 3.97 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 0.00 129 E 8.31 3.87 0.00 2.17 2.07 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 2.13 2.57 0.00 130 A 7.94 3.72 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 0.00 131 Q 7.86 3.72 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 132 A 7.81 3.95 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 0.00 133 K 7.51 3.19 0.00 0.79 1.37 0.00 0.93 0.00 0.00 1.08 0.00 0.00 2.72 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.02 0.42 7.81 134 K 7.75 3.90 0.00 1.76 1.88 0.00 1.80 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.42 7.81 135 E 7.92 4.22 0.00 2.08 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 2.30 2.47 0.00 136 K 7.66 4.15 0.00 1.87 1.87 0.00 1.67 0.00 0.00 1.52 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.32 7.81 137 L 8.12 4.44 0.00 1.92 1.56 0.91 0.48 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 0.00 138 N 8.88 3.53 0.00 2.69 1.42 0.00 0.00 7.14 7.32 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 0.00 139 I 5.88 3.16 1.09 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.20 0.13 0.00 0.00 140 W 8.05 4.70 0.00 3.55 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 0.00 141 S 8.40 4.44 0.00 3.97 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 * Residues marked with a * may have inaccurate shift predictions.