NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2787 8.1593 117.3740 63.5215 69.6065 173.6258 2 S 4.3599 8.4118 121.5062 55.9022 64.8579 172.7029 3 K 3.9937 9.3960 122.5237 59.7566 33.3351 179.7191 4 K 3.8155 8.3527 117.8168 59.7754 31.7404 178.8153 5 K 4.1238 7.4867 116.7215 59.1413 32.0370 177.7975 6 R 4.3666 8.0068 116.0319 56.5715 30.6135 177.8730 7 Q 4.1382 8.4254 120.0576 57.3207 28.4126 176.0087 8 R 3.9837 7.5742 118.8731 58.8786 30.0906 176.2665 9 G 4.1143 9.0233 111.9127 45.6283 0.0000 174.2483 10 S 4.1412 7.9600 113.1464 58.8371 63.4982 174.6691 11 R 4.1960 8.0916 125.6124 57.4156 29.2565 176.5960 12 T 4.3466 7.6452 104.6597 61.0988 69.3728 174.1992 13 H 4.7268 8.3764 117.3311 56.1027 26.9424 175.3867 14 G 3.8767 8.4396 103.5327 46.3876 0.0000 175.0960 15 G 3.9086 8.5748 106.9808 44.8219 0.0000 176.0602 16 G 3.9759 7.7005 108.1784 45.5375 0.0000 175.5742 17 S 4.2265 8.5409 119.3662 58.0435 62.6487 174.3452 18 H 4.3407 8.8487 122.0555 57.3573 28.2759 175.8357 19 K 4.0997 7.8655 119.1648 56.9216 31.8851 177.6307 20 N 4.3844 7.9316 117.7471 56.0124 39.2139 177.1651 21 R 4.3651 7.4645 118.6578 56.3040 29.0289 176.9792 22 R 4.5196 7.3725 121.4767 56.2136 30.8143 180.4528 23 G 4.0716 8.5847 122.8436 45.9145 0.0000 173.8186 24 A 4.2250 8.6168 120.4721 54.2542 18.3522 179.9432 25 G 3.5358 8.0584 104.3024 47.7990 0.0000 174.9002 26 H 4.4941 7.9476 118.9791 57.8418 30.0419 176.2758 27 R 4.4773 7.9978 117.9669 55.2138 30.6809 176.4619 28 G 3.8272 7.7982 106.6144 46.4450 0.0000 173.1779 29 G 4.1603 8.1866 104.6667 43.0872 0.0000 174.4009 30 R 4.0650 8.6974 121.7382 56.5753 31.5185 175.9275 31 G 4.0204 8.3540 114.7261 47.3553 0.0000 173.8743 32 D 4.6092 8.7683 124.6379 53.9614 40.6536 175.3251 33 A 3.8820 7.3075 122.3058 54.1545 18.7496 178.5022 34 G 3.7379 9.0765 109.9871 45.7284 0.0000 175.2804 35 R 3.9211 7.9502 116.5616 56.9102 29.3164 177.4958 36 D 4.8750 7.9123 115.8910 52.7409 42.8135 176.6989 37 K 4.2066 8.3143 117.0696 57.0560 31.8495 176.8692 38 H 4.5598 9.5528 124.5776 58.1861 29.9728 176.3709 39 E 4.6623 7.8198 120.8897 55.5587 30.2512 178.2748 40 F 4.8904 8.2091 115.6741 59.4576 38.2933 174.9936 41 H 3.6051 6.3413 116.4885 57.1118 28.5563 174.0899 42 N 4.2929 8.9700 120.3478 54.5405 35.9315 173.3398 43 H 4.9071 7.7031 114.3230 53.5299 31.2126 174.3213 44 E 4.1283 8.7253 123.7256 55.4247 29.9639 175.2167 45 P 4.4123 0.0000 0.0000 62.8392 31.7274 176.0765 46 L 4.1370 8.0457 119.1342 55.0592 42.2529 175.7197 47 G 4.0430 8.2372 105.9591 44.0416 0.0000 173.4440 48 K 4.5435 8.1488 118.7203 55.0108 34.0329 176.7668 49 S 4.3540 8.4060 115.0975 58.1629 65.1622 175.2695 50 G 4.0168 9.0966 118.5969 45.5366 0.0000 171.0978 51 F 5.0143 8.5657 114.0626 55.6908 41.0571 173.2669 52 K 4.2646 8.2604 118.6887 54.4669 35.4379 176.3744 53 R 4.5123 7.9705 120.7096 53.8380 31.7026 174.7672 54 P 4.2841 0.0000 0.0000 63.2803 31.6851 176.9746 55 Q 3.9172 8.9912 120.4242 59.2232 28.7190 178.6043 56 K 4.4037 7.9655 113.4619 57.0163 32.6408 176.9998 57 V 4.3042 7.9281 117.0182 62.9005 31.9685 174.9038 58 Q 4.5770 7.5812 117.3867 54.5104 30.1769 174.7992 59 E 4.4531 8.5738 120.8338 54.4550 31.8782 174.9103 60 E 4.3953 8.4908 125.0576 54.4117 31.2452 174.2703 61 A 4.0351 8.1900 129.4989 50.9057 19.8497 176.1792 62 A 4.3237 8.8610 126.2686 51.5602 19.6104 176.5722 63 T 5.5821 8.2267 112.3414 59.7187 72.1214 173.5430 64 I 4.4571 7.8008 120.5204 60.2927 41.7438 173.3624 65 D 5.2112 8.6414 128.4290 53.4212 42.3693 177.7661 66 V 3.6433 8.5011 116.2319 64.7329 31.5003 178.8178 67 R 3.8762 7.7786 118.1470 59.6033 29.5754 177.9216 68 E 3.8537 7.8362 117.2094 59.5076 29.9797 178.1898 69 I 3.7322 7.8150 119.0225 64.8090 37.0523 177.3064 70 D 4.3120 8.6510 118.4793 57.8078 40.8902 178.6156 71 E 4.1125 8.5276 117.2951 58.1684 28.6005 177.2038 72 N 5.0232 7.9072 116.8498 52.8540 40.0153 177.3914 73 V 3.2396 7.5366 113.3417 64.7425 31.8174 178.9071 74 T 3.8834 7.6669 108.0310 64.7837 68.4345 175.5019 75 L 4.0781 7.1528 121.1558 56.7354 42.1241 177.3511 76 L 4.4313 7.6161 120.2710 53.6352 41.4065 178.2023 77 A 4.0017 8.0863 122.4908 55.3793 18.6980 178.1996 78 A 4.4712 7.7670 117.4655 52.1519 18.8875 177.1751 79 D 4.5997 8.2692 120.3067 56.2442 45.4136 175.8087 80 D 4.2455 7.6507 122.1462 49.0522 41.8754 175.4902 81 V 4.5103 8.2685 120.7938 61.1871 34.2755 174.7238 82 A 4.2276 8.1787 133.2067 51.6714 20.4321 176.9230 83 E 3.7996 8.9690 109.6724 59.4950 30.1348 174.0947 *89 F 4.6323 7.7597 114.2576 57.9205 41.0866 174.1183 90 R 5.1725 8.6497 120.0535 54.7518 32.5454 174.8274 91 V 4.4892 8.8215 125.8836 59.9240 35.0451 174.6247 92 D 4.6865 8.7459 124.0558 52.8484 40.8455 176.3352 93 V 3.5758 8.4076 128.4521 66.2920 31.6366 178.3855 94 R 4.1356 7.8771 117.3418 59.1828 29.8955 177.7651 95 D 4.6233 8.1237 116.2503 54.8486 41.2102 177.8599 96 V 4.0388 7.8430 118.8994 63.6834 32.5397 176.1785 97 V 3.5999 7.2610 117.0123 62.9834 32.1571 175.5310 98 E 4.1774 8.5941 126.2131 57.0550 30.3305 176.9928 99 E 3.7973 8.8131 117.2811 57.2564 26.9753 175.6534 100 A 4.3965 7.5826 118.8264 52.9572 18.4325 178.0625 101 D 4.7199 7.8628 117.5902 56.8654 42.2478 178.3728 102 D 4.4029 8.0345 114.5038 53.4241 39.2392 175.1897 103 A 4.7056 7.6478 123.3150 50.6720 20.6515 178.4294 104 D 4.3164 8.7161 122.5272 55.8427 41.7657 175.7755 105 Y 4.7837 6.4569 117.9907 56.9215 41.5396 172.2706 106 V 4.6654 8.7098 122.1102 61.7864 33.4844 174.5120 107 K 4.7532 9.5056 129.2716 54.5636 34.9800 174.6421 108 V 4.5392 8.3511 127.9344 61.9129 32.9966 174.6414 109 L 4.5796 9.2292 128.0220 52.6671 44.4463 176.7203 110 G 4.3883 8.2981 110.1835 45.0515 0.0000 172.5622 111 A 4.6638 8.4620 121.5959 51.7316 21.9619 178.0294 112 G 3.8899 8.9736 108.9183 44.2766 0.0000 171.9097 113 Q 4.5738 8.2069 117.7662 54.0217 31.5682 175.0833 114 V 4.3648 8.0067 117.3524 61.9154 33.2304 174.6726 115 R 4.4886 8.8001 125.0863 56.1310 30.2553 175.2594 116 H 5.2244 7.7980 114.3446 53.8291 33.3560 172.6479 117 E 4.8974 8.8561 117.7858 55.0037 30.1390 175.5394 118 L 5.1214 8.5652 124.3945 53.0503 45.6540 175.8840 119 T 4.9451 8.8687 119.4392 62.1427 70.7153 172.9867 120 L 5.2541 8.6987 127.3370 52.9740 44.5903 175.8440 121 I 5.4199 8.7012 123.6192 58.9858 39.6498 174.5996 122 A 4.8369 8.7291 127.3468 50.4348 22.1858 176.3134 123 D 4.4189 8.6881 118.4979 57.3267 42.1020 176.0583 124 D 4.6721 7.5619 116.0437 53.2234 45.0268 174.2716 125 F 5.4993 8.9574 120.5653 54.7999 43.4161 174.2614 126 S 4.7157 8.6226 115.3537 57.2287 65.4336 174.6920 127 E 4.0512 9.1716 120.4633 59.9250 29.2186 179.7381 128 G 3.7951 8.2557 104.5157 47.9669 0.0000 174.9830 129 A 4.0807 7.9466 122.7620 55.1438 18.3954 179.6992 130 R 3.8002 8.1577 116.3237 59.3788 30.1970 178.7513 131 E 3.9418 8.5436 118.4526 59.6946 29.4933 179.8255 132 K 3.8909 8.1057 117.8514 59.7092 32.2810 179.5511 133 V 3.6180 7.9889 118.3853 66.0164 31.3456 177.9535 134 E 4.7365 7.9487 119.8942 58.7382 29.2626 179.1047 135 G 4.1023 8.3919 104.6888 47.0505 0.0000 173.5091 136 A 4.5923 7.8486 123.3860 51.8141 19.6603 176.9397 137 G 4.1617 8.4491 105.3134 48.7898 0.0000 173.3753 138 G 4.8668 7.8135 105.2048 43.0973 0.0000 172.2877 139 S 5.0249 9.0677 113.0359 56.5821 67.0857 173.4125 140 V 4.5011 8.0883 119.7992 61.2204 33.8568 174.2186 141 E 4.5396 9.5045 128.8742 54.7472 31.3921 174.9281 142 L 5.0689 8.4099 126.9943 54.2764 43.4355 176.3819 143 T 4.1518 8.5863 123.0592 63.5141 69.6211 175.2629 144 D 4.3507 8.7816 121.9322 57.5415 41.0706 179.0876 145 L 3.9346 8.0033 119.8582 57.8499 42.4530 178.1283 146 G 3.8120 7.9522 107.1768 47.2058 0.0000 174.7068 147 E 4.4484 8.1054 120.4158 56.9377 29.2238 176.9731 148 E 4.7893 8.4036 114.4551 56.4006 30.1039 178.4910 149 R 4.5504 7.4169 116.4864 52.1348 30.8158 176.2436 150 Q 4.3046 7.8841 121.4151 56.8446 29.3080 173.1006 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 T 8.16 4.28 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 1.21 0.00 0.00 2 S 8.41 4.36 0.00 4.05 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 9.40 3.99 0.00 1.80 1.84 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.46 7.81 4 K 8.35 3.82 0.00 1.84 1.88 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.54 7.81 5 K 7.49 4.12 0.00 1.76 2.03 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.15 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.54 7.81 6 R 8.01 4.37 0.00 1.89 1.92 0.00 3.21 0.00 0.00 3.22 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 7 Q 8.43 4.14 0.00 1.97 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 6.96 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 8 R 7.57 3.98 0.00 1.79 1.91 0.00 3.35 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 9 G 9.02 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 0.00 0.00 0.00 10 S 7.96 4.14 0.00 3.97 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 R 8.09 4.20 0.00 1.97 2.11 0.00 3.20 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 12 T 7.65 4.35 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 1.31 0.00 0.00 13 H 8.38 4.73 0.00 3.22 3.38 0.00 5.71 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 14 G 8.44 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 0.00 0.00 0.00 15 G 8.57 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 16 G 7.70 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 0.00 0.00 0.00 17 S 8.54 4.23 0.00 3.87 3.74 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 18 H 8.85 4.34 0.00 3.30 3.39 0.00 5.57 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.87 4.10 0.00 1.70 1.80 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.28 1.31 7.81 20 N 7.93 4.38 0.00 2.76 2.62 0.00 0.00 6.95 8.10 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 21 R 7.46 4.37 0.00 1.77 1.89 0.00 3.17 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 22 R 7.37 4.52 0.00 1.74 0.92 0.00 3.26 0.00 0.00 3.20 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 23 G 8.58 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 0.00 0.00 0.00 24 A 8.62 4.22 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 25 G 8.06 3.54 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 0.00 0.00 0.00 26 H 7.95 4.49 0.00 3.03 3.50 0.00 5.93 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 27 R 8.00 4.48 0.00 1.94 1.94 0.00 3.31 0.00 0.00 3.23 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 28 G 7.80 3.83 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 0.00 0.00 0.00 29 G 8.19 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 30 R 8.70 4.07 0.00 1.91 1.83 0.00 3.34 0.00 0.00 3.35 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 31 G 8.35 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 32 D 8.77 4.61 0.00 2.74 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.31 3.88 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 34 G 9.08 3.74 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 0.00 0.00 0.00 35 R 7.95 3.92 0.00 1.70 2.03 0.00 3.03 0.00 0.00 3.29 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 36 D 7.91 4.88 0.00 2.75 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 37 K 8.31 4.21 0.00 1.83 1.73 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.38 1.39 7.81 38 H 9.55 4.56 0.00 3.31 3.46 0.00 5.46 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 7.82 4.66 0.00 1.90 1.88 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 2.17 1.92 0.00 40 F 8.21 4.89 0.00 3.17 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 H 6.34 3.61 0.00 2.91 3.08 0.00 5.84 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.97 4.29 0.00 2.84 2.88 0.00 0.00 6.93 8.16 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 43 H 7.70 4.91 0.00 3.33 3.23 0.00 5.86 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 44 E 8.73 4.13 0.00 1.98 1.91 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 2.33 2.31 0.00 45 P 0.00 4.41 0.00 2.18 2.09 0.00 3.79 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 2.01 2.02 0.00 46 L 8.05 4.14 0.00 1.66 1.64 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.24 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 48 K 8.15 4.54 0.00 1.76 1.75 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.41 7.81 49 S 8.41 4.35 0.00 3.79 3.71 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 50 G 9.10 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 51 F 8.57 5.01 0.00 3.13 2.91 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 52 K 8.26 4.26 0.00 1.66 1.59 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.75 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.22 1.36 7.81 53 R 7.97 4.51 0.00 1.71 1.84 0.00 3.29 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.28 0.00 54 P 0.00 4.28 0.00 2.22 2.22 0.00 3.76 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.04 0.00 55 Q 8.99 3.92 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 7.11 0.00 0.00 0.00 0.00 0.00 2.44 2.36 0.00 56 K 7.97 4.40 0.00 1.86 1.89 0.00 1.52 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.42 7.81 57 V 7.93 4.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.94 0.00 0.00 58 Q 7.58 4.58 0.00 2.20 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.60 6.37 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 59 E 8.57 4.45 0.00 1.91 1.78 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 2.46 2.26 0.00 60 E 8.49 4.40 0.00 1.95 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 2.18 2.20 0.00 61 A 8.19 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.86 4.32 1.23 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 0.00 0.00 63 T 8.23 5.58 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 1.21 0.00 0.00 64 I 7.80 4.46 1.85 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 1.33 1.20 0.88 0.00 0.00 65 D 8.64 5.21 0.00 2.74 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.50 3.64 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 0.83 0.00 0.00 0.99 0.00 0.00 67 R 7.78 3.88 0.00 1.85 2.08 0.00 3.09 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 1.63 1.77 0.00 68 E 7.84 3.85 0.00 2.03 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 2.31 2.34 0.00 69 I 7.82 3.73 2.02 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.45 0.90 0.00 0.00 70 D 8.65 4.31 0.00 2.82 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 71 E 8.53 4.11 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.62 0.00 72 N 7.91 5.02 0.00 2.68 2.71 0.00 0.00 6.83 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 V 7.54 3.24 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 0.00 0.00 0.52 0.00 0.00 0.32 0.00 0.00 74 T 7.67 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 1.17 0.00 0.00 75 L 7.15 4.08 0.00 1.82 1.77 0.99 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.62 4.43 0.00 1.88 1.65 0.89 0.72 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 77 A 8.09 4.00 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 78 A 7.77 4.47 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 D 8.27 4.60 0.00 2.72 2.60 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 80 D 7.65 4.25 0.00 3.00 2.66 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 0.00 0.00 0.00 0.00 81 V 8.27 4.51 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.94 0.00 0.00 82 A 8.18 4.23 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.97 3.80 0.00 1.99 1.93 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 2.25 1.95 0.00 *89 F 7.76 4.63 0.00 3.00 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 90 R 8.65 5.17 0.00 1.81 1.81 0.00 3.22 0.00 0.00 3.30 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 91 V 8.82 4.49 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 0.70 0.00 0.00 0.95 0.00 0.00 92 D 8.75 4.69 0.00 2.73 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 8.41 3.58 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 0.66 0.00 0.00 0.96 0.00 0.00 94 R 7.88 4.14 0.00 2.08 2.01 0.00 3.22 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 95 D 8.12 4.62 0.00 2.77 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 96 V 7.84 4.04 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 0.80 0.00 0.00 0.93 0.00 0.00 97 V 7.26 3.60 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 0.83 0.00 0.00 0.97 0.00 0.00 98 E 8.59 4.18 0.00 2.06 1.83 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 2.38 2.31 0.00 99 E 8.81 3.80 0.00 2.17 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 2.26 2.27 0.00 100 A 7.58 4.40 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 D 7.86 4.72 0.00 2.64 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 0.00 102 D 8.03 4.40 0.00 2.76 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.65 4.71 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 0.00 104 D 8.72 4.32 0.00 2.54 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 0.00 105 Y 6.46 4.78 0.00 3.00 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 0.00 106 V 8.71 4.67 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 0.86 0.00 0.00 0.94 0.00 0.00 107 K 9.51 4.75 0.00 2.02 1.68 0.00 1.91 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.50 7.81 108 V 8.35 4.54 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.73 0.00 0.00 109 L 9.23 4.58 0.00 1.72 1.56 0.92 0.68 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 0.00 110 G 8.30 4.39 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 0.00 111 A 8.46 4.66 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.97 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 0.00 113 Q 8.21 4.57 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 114 V 8.01 4.36 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 0.97 0.00 0.00 0.95 0.00 0.00 115 R 8.80 4.49 0.00 1.62 1.79 0.00 3.10 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.51 0.00 116 H 7.80 5.22 0.00 3.00 3.29 0.00 5.69 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 E 8.86 4.90 0.00 2.02 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 0.00 2.31 2.29 0.00 118 L 8.57 5.12 0.00 1.64 1.64 0.99 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 119 T 8.87 4.95 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 1.23 0.00 0.00 120 L 8.70 5.25 0.00 1.84 1.86 1.07 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 121 I 8.70 5.42 1.94 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 1.18 2.06 0.98 0.00 0.00 122 A 8.73 4.84 0.55 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 0.00 0.00 123 D 8.69 4.42 0.00 2.81 2.60 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 0.00 124 D 7.56 4.67 0.00 2.42 2.26 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 0.00 125 F 8.96 5.50 0.00 2.84 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 S 8.62 4.72 0.00 3.93 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 0.00 127 E 9.17 4.05 0.00 2.05 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 0.00 2.42 2.42 0.00 128 G 8.26 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 0.00 129 A 7.95 4.08 1.54 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 0.00 0.00 130 R 8.16 3.80 0.00 2.05 1.94 0.00 3.16 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 1.44 1.64 0.00 131 E 8.54 3.94 0.00 1.99 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 2.34 2.51 0.00 132 K 8.11 3.89 0.00 2.02 1.87 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.65 7.81 133 V 7.99 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 1.11 0.00 0.00 1.05 0.00 0.00 134 E 7.95 4.74 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 135 G 8.39 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 0.00 0.00 0.00 136 A 7.85 4.59 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 0.00 137 G 8.45 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 0.00 138 G 7.81 4.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 S 9.07 5.02 0.00 3.78 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 0.00 140 V 8.09 4.50 1.65 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 -1.11 0.00 0.00 0.54 0.00 0.00 141 E 9.50 4.54 0.00 2.06 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 2.23 2.21 0.00 142 L 8.41 5.07 0.00 1.65 1.60 1.32 1.08 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 0.00 143 T 8.59 4.15 4.36 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 1.26 0.00 0.00 144 D 8.78 4.35 0.00 2.71 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 0.00 145 L 8.00 3.93 0.00 1.61 1.85 1.02 1.01 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 0.00 146 G 7.95 3.81 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 0.00 147 E 8.11 4.45 0.00 2.06 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 2.35 2.47 0.00 148 E 8.40 4.79 0.00 1.79 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 2.21 2.50 0.00 149 R 7.42 4.55 0.00 1.74 1.82 0.00 3.31 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.71 0.00 150 Q 7.88 4.30 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.65 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 * Residues marked with a * may have inaccurate shift predictions.