NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 E 4.2848 8.4293 120.2263 56.5603 30.9320 175.5705 9 T 4.3813 7.9922 113.8823 59.2771 72.5301 174.0717 10 L 3.9882 9.0224 122.0285 57.9412 41.9172 180.6929 11 E 4.0060 8.2891 117.7408 59.5117 29.2357 179.0958 12 A 4.0004 7.8947 120.2093 55.3678 18.3862 179.6490 13 R 3.9582 8.3398 116.7162 59.5907 30.3386 178.9873 14 I 3.2935 8.8085 118.6351 64.3430 37.6340 177.7676 15 N 4.3296 8.5348 117.5445 55.9095 38.0726 177.1288 16 R 4.0860 7.4225 118.9613 58.7041 30.3908 177.9862 17 A 4.0597 8.0459 120.1068 53.8161 18.2084 178.0717 18 T 4.1249 7.2695 106.3130 60.9692 69.5622 173.1516 19 N 4.4064 7.4036 122.0943 53.5256 39.1544 174.2601 20 P 4.5337 0.0000 0.0000 65.3062 31.6298 177.4601 21 L 4.2556 8.5414 117.3825 56.2166 41.8732 177.1428 22 N 4.4825 7.9663 116.9239 53.5936 38.6545 175.4508 23 K 4.1433 8.7887 122.7655 58.3882 32.5935 176.0847 24 E 4.8174 7.6947 114.5962 54.8406 32.0555 174.5702 25 L 3.8842 8.5809 119.5678 55.2069 42.1858 178.5691 26 D 4.6473 7.9285 123.4425 52.2567 38.8563 176.4168 27 W 4.1637 8.0824 123.7336 59.2854 29.3924 177.2047 28 A 4.0703 8.2654 120.2124 55.4555 17.8103 179.6842 29 S 4.1723 8.6108 113.4666 61.4203 62.9170 176.8087 30 I 3.6035 7.8068 122.5676 64.7131 36.9386 178.3791 31 N 4.5918 8.7308 117.4438 56.1759 38.3688 177.8058 32 G 3.6876 8.0591 107.0989 47.7191 0.0000 175.5672 33 F 4.1628 8.3529 122.9141 61.2574 39.1633 176.7705 34 C 4.1499 7.9601 115.7016 59.6870 38.4947 175.5962 35 E 3.9782 8.2076 120.3731 59.4551 29.0682 179.1691 36 Q 4.1760 7.9504 119.8076 58.6849 28.9411 177.7329 37 L 3.8337 7.5018 120.3986 57.8913 40.3877 178.2129 38 N 4.6587 7.5196 115.1878 54.2243 39.4062 176.4850 39 E 4.2375 7.8322 116.5235 57.6319 29.3696 176.2911 40 D 4.8938 7.6164 117.8521 52.0543 44.1902 175.8690 41 F 4.4602 9.0836 119.6101 58.2506 38.1042 175.4153 42 E 3.8729 7.5493 121.1244 57.2934 30.2838 177.4817 43 G 3.7630 7.3149 106.3238 46.6189 0.0000 173.3798 44 P 4.3864 0.0000 0.0000 64.8836 31.5297 177.0073 45 P 4.2506 0.0000 0.0000 65.0921 31.2298 178.4686 46 L 4.0217 7.5582 118.7116 57.7836 41.9518 178.6820 47 A 4.2710 8.7960 121.6016 55.4316 18.3570 179.7407 48 T 3.7372 7.9310 107.9277 64.9019 68.7197 177.1158 49 R 4.1203 7.7592 120.4130 58.9600 30.1042 178.9213 50 L 4.1154 8.1168 119.0175 57.7133 41.5695 179.5324 51 L 4.0074 8.5405 119.1697 57.7476 41.2071 179.2888 52 A 3.9637 8.4778 120.8035 55.4939 18.0523 179.2322 53 H 4.1597 7.9705 115.4597 59.2909 30.2613 177.4320 54 K 4.0264 8.0612 120.3529 59.5107 31.6970 179.4613 55 I 3.8211 8.3657 119.2145 63.6014 36.9182 177.3963 56 Q 4.4721 7.1761 116.6914 54.6294 29.3246 175.4805 57 S 4.2516 7.4142 115.6088 57.4921 62.8908 172.9239 58 P 4.2885 0.0000 0.0000 64.9220 31.5241 176.7277 59 Q 4.2604 8.0270 118.1325 54.5996 27.6978 176.0565 60 E 3.8744 8.8127 123.7869 59.3937 29.7802 178.4235 61 W 4.8287 8.4533 127.4557 60.4426 30.5394 177.4911 62 E 3.9122 8.8273 120.9325 58.5347 29.1497 178.5256 63 A 4.0954 7.8292 120.3377 54.9857 18.5116 179.5195 64 I 3.6198 8.1100 118.7532 64.7777 37.2070 178.6633 65 Q 3.5428 7.3137 118.0177 58.7099 28.2988 178.8353 66 A 3.7968 7.7098 121.7596 55.1171 18.3066 179.7279 67 L 4.0361 7.9967 117.5599 58.1390 41.6378 179.8361 68 T 3.9361 7.8696 115.9509 66.3405 68.2896 177.0486 69 V 3.4967 7.7910 120.5566 65.8119 31.5822 177.8803 70 L 4.1499 8.1988 120.3104 58.0844 41.8330 178.5013 71 E 4.2159 8.6079 119.4199 59.7339 29.5871 178.9653 72 T 3.9969 8.1967 115.6722 67.0921 68.6339 176.1395 73 C 4.1283 8.3801 118.2751 60.0648 39.7941 176.1915 74 M 4.1986 7.9367 119.7277 58.3801 31.6443 178.6394 75 K 4.2343 7.7697 117.5058 59.7873 32.3293 179.3468 76 S 4.2407 8.0984 114.6143 60.8944 63.0711 174.9339 77 C 4.3876 7.5835 119.0472 59.6786 29.6420 174.8210 78 G 4.0885 7.9663 112.4283 45.3286 0.0000 176.3384 79 K 3.9537 8.6875 120.2381 59.1998 31.4276 178.9724 80 R 3.8898 8.0440 118.3571 59.4979 29.9975 178.3282 81 F 4.1791 7.9948 119.1462 61.3004 39.6310 176.6877 82 H 3.9185 8.1601 115.9117 59.3072 28.2759 177.3557 83 D 4.2401 8.0993 119.6946 57.1680 40.7613 178.1574 84 E 3.8622 7.2101 116.6323 59.1840 29.4131 179.0508 85 V 3.1476 6.8663 117.0616 64.9171 31.4985 177.2704 86 G 3.7126 7.3386 103.2660 44.1099 0.0000 173.3863 87 K 4.3794 6.9651 121.0714 54.6131 34.0603 177.8804 88 F 4.6583 8.2770 120.0345 60.4236 38.5678 177.7746 89 R 4.1129 8.2284 117.6547 58.8584 30.0407 177.0833 90 F 4.6403 7.9489 118.9527 60.0627 40.3127 177.4135 91 L 4.0953 8.5306 118.9914 57.9395 41.2978 179.2402 92 N 4.2588 8.7002 116.8896 56.3075 38.0083 177.1596 93 E 3.7963 7.8435 119.8214 59.4090 29.0848 179.4773 94 L 3.9173 7.4235 118.4290 57.6894 41.7306 179.4734 95 I 3.7648 7.8438 120.0796 64.2244 37.1205 178.6201 96 K 3.8794 8.0960 119.5640 59.1406 31.3038 179.5838 97 V 3.6871 7.4774 118.3098 65.2374 31.2342 177.7594 98 V 4.0709 7.3180 109.4585 61.6075 32.9261 175.9241 99 S 4.4586 8.5625 116.5812 56.7658 62.6989 172.7942 100 P 4.3331 0.0000 0.0000 65.7697 31.1506 177.6545 101 K 3.9340 7.9088 115.1758 58.2129 33.0278 176.4866 102 Y 4.5312 8.0104 120.9973 56.4430 39.5226 177.2966 103 L 4.0898 8.6608 123.6740 58.1723 42.5040 179.5614 104 G 4.0422 8.1363 108.2045 49.3024 0.0000 175.9452 105 S 4.0998 8.2328 115.3018 61.1782 62.8651 175.6182 106 R 4.4966 7.8794 116.6841 56.2152 29.7712 176.0295 107 T 4.6704 7.3962 114.3973 60.9947 71.2861 174.9474 108 S 4.2465 8.5120 120.8628 58.5259 64.5975 175.3863 109 E 3.9513 8.9559 124.6644 59.2815 29.1781 179.5916 110 K 3.9137 7.9837 119.2964 59.4627 32.3530 178.7552 111 V 3.5770 7.3610 117.1575 66.0100 31.5106 177.9150 112 K 3.9032 8.1539 118.1985 59.8599 31.9277 179.1203 113 N 4.4019 8.4990 116.7570 55.9295 38.3989 177.4566 114 K 4.1847 7.9553 122.5773 59.0468 32.3045 178.8893 115 I 3.6755 7.9563 120.1853 64.4957 37.0725 178.4912 116 L 4.2205 7.9758 119.7443 57.6279 41.3564 179.5226 117 E 3.9615 8.2401 118.7686 59.2562 29.5182 179.3186 118 L 3.5055 7.7031 118.8203 57.5057 41.4140 179.1814 119 L 3.5040 7.2921 117.7644 58.0701 42.0485 178.9096 120 Y 3.3373 7.4830 118.9963 60.3269 38.8819 178.0058 121 S 3.9190 8.0076 114.8778 60.4177 62.8415 175.9743 122 W 4.6166 7.4705 122.1454 59.2642 29.0458 178.5319 123 T 4.0293 7.3785 114.5371 65.9020 67.7831 176.2337 124 V 3.9034 7.2512 118.9607 65.2893 32.1474 177.8098 125 G 3.7852 7.7296 103.2865 46.1511 0.0000 173.6761 126 L 5.4394 8.4036 119.8943 51.4172 42.0663 175.7937 127 P 4.3291 0.0000 0.0000 65.6117 32.2327 178.3457 128 E 4.0582 8.2019 118.4068 59.2994 29.7835 176.6723 129 E 4.4088 7.9877 119.8406 54.9287 27.6546 177.2229 130 V 3.6307 7.9765 116.3333 64.4132 31.8360 177.8499 131 K 3.7543 7.8393 117.3443 59.4204 31.7918 178.9052 132 I 3.8125 7.4010 119.8281 64.6728 37.0449 178.2383 133 A 4.1346 8.0944 120.7733 55.1602 18.2244 179.1245 134 E 3.9504 8.5042 117.5315 59.3659 29.8716 178.8550 135 A 4.1178 8.5920 121.1099 55.5076 18.6147 178.9437 136 Y 4.1156 8.4663 118.2463 60.9787 38.9135 177.9888 137 Q 3.9238 8.5774 120.7173 59.2502 29.0355 178.0218 138 M 3.9793 8.1265 119.1546 58.8098 32.3745 178.1188 139 L 3.9052 7.7574 118.8617 57.7064 41.3588 179.6559 140 K 4.0477 7.8805 121.0305 58.5961 31.9522 178.9839 141 K 4.0500 7.8707 117.6907 59.3282 32.8247 178.3669 142 Q 4.2155 8.0345 117.5923 56.4467 28.9640 176.1119 143 G 4.0623 7.8773 108.0469 45.5229 0.0000 175.0628 144 I 3.6280 7.6201 119.1816 63.5048 36.9206 175.6505 145 V 4.2098 7.6246 119.1367 60.6082 32.2365 175.8922 146 K 4.0324 8.6004 127.9780 59.0649 32.3158 177.5012 147 S 4.4587 7.2660 109.8672 57.0517 65.1226 174.1212 148 D 3.9428 8.3782 121.9297 53.2014 40.5785 174.9976 149 P 4.3520 0.0000 0.0000 62.9676 31.2734 176.1721 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 8 E 8.43 4.28 0.00 1.97 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 0.00 2.22 2.26 0.00 9 T 7.99 4.38 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 1.21 0.00 0.00 10 L 9.02 3.99 0.00 1.77 1.85 0.83 0.61 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 11 E 8.29 4.01 0.00 2.07 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 2.42 2.49 0.00 12 A 7.89 4.00 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 13 R 8.34 3.96 0.00 2.37 2.32 0.00 3.23 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 14 I 8.81 3.29 1.80 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 1.32 0.99 0.99 0.00 0.00 15 N 8.53 4.33 0.00 2.92 2.83 0.00 0.00 6.58 8.23 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 16 R 7.42 4.09 0.00 1.77 2.02 0.00 3.25 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 17 A 8.05 4.06 1.12 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 0.00 0.00 18 T 7.27 4.12 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 19 N 7.40 4.41 0.00 2.87 2.87 0.00 0.00 7.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 P 0.00 4.53 0.00 2.14 2.20 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 21 L 8.54 4.26 0.00 1.78 1.77 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 22 N 7.97 4.48 0.00 3.10 3.20 0.00 0.00 7.00 7.05 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 23 K 8.79 4.14 0.00 1.77 1.87 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.38 7.81 24 E 7.69 4.82 0.00 2.12 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 2.29 2.36 0.00 25 L 8.58 3.88 0.00 1.51 0.86 0.94 0.75 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 26 D 7.93 4.65 0.00 2.68 2.42 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 27 W 8.08 4.16 0.00 3.50 3.31 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 28 A 8.27 4.07 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 29 S 8.61 4.17 0.00 3.97 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 30 I 7.81 3.60 1.74 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.83 0.85 0.00 0.00 31 N 8.73 4.59 0.00 2.90 2.95 0.00 0.00 7.01 8.05 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 32 G 8.06 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.35 4.16 0.00 3.12 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 34 C 7.96 4.15 0.00 2.90 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 35 E 8.21 3.98 0.00 2.15 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 36 Q 7.95 4.18 0.00 2.17 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 2.24 2.50 0.00 37 L 7.50 3.83 0.00 1.64 1.30 0.82 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 38 N 7.52 4.66 0.00 2.73 2.83 0.00 0.00 6.84 7.54 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 39 E 7.83 4.24 0.00 2.00 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 0.00 2.30 2.40 0.00 40 D 7.62 4.89 0.00 2.72 2.34 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 41 F 9.08 4.46 0.00 3.18 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 42 E 7.55 3.87 0.00 1.46 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 0.00 1.97 2.03 0.00 43 G 7.31 3.76 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 0.00 0.00 0.00 44 P 0.00 4.39 0.00 2.14 2.19 0.00 3.54 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.24 0.00 45 P 0.00 4.25 0.00 2.10 2.05 0.00 3.75 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.37 0.00 46 L 7.56 4.02 0.00 1.65 1.78 0.93 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.80 4.27 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.93 3.74 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 0.58 0.00 0.00 49 R 7.76 4.12 0.00 2.22 2.07 0.00 3.15 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.89 0.00 50 L 8.12 4.12 0.00 2.02 1.79 1.06 0.69 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 51 L 8.54 4.01 0.00 1.94 1.94 1.16 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.48 3.96 1.45 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 53 H 7.97 4.16 0.00 3.19 3.52 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.06 4.03 0.00 1.90 1.74 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.64 1.52 7.81 55 I 8.37 3.82 1.91 0.00 0.00 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 1.55 0.70 0.90 0.00 0.00 56 Q 7.18 4.47 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.84 0.00 0.00 0.00 0.00 0.00 2.27 2.52 0.00 57 S 7.41 4.25 0.00 3.79 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 58 P 0.00 4.29 0.00 2.09 2.10 0.00 3.71 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 59 Q 8.03 4.26 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.63 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 60 E 8.81 3.87 0.00 2.08 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 2.49 2.47 0.00 61 W 8.45 4.83 0.00 3.34 3.07 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 62 E 8.83 3.91 0.00 1.99 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 2.21 2.22 0.00 63 A 7.83 4.10 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 64 I 8.11 3.62 1.96 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 1.81 1.33 1.05 0.00 0.00 65 Q 7.31 3.54 0.00 1.53 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 66 A 7.71 3.80 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 67 L 8.00 4.04 0.00 1.87 1.77 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 68 T 7.87 3.94 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 1.04 0.00 0.00 69 V 7.79 3.50 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 0.65 0.00 0.00 0.68 0.00 0.00 70 L 8.20 4.15 0.00 2.02 2.09 1.19 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 71 E 8.61 4.22 0.00 2.35 2.25 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 2.47 2.52 0.00 72 T 8.20 4.00 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 73 C 8.38 4.13 0.00 2.56 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 0.00 0.00 0.00 0.00 74 M 7.94 4.20 0.00 2.13 2.57 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 3.07 0.00 75 K 7.77 4.23 0.00 1.85 1.92 0.00 1.77 0.00 0.00 1.80 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.86 7.81 76 S 8.10 4.24 0.00 3.77 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 77 C 7.58 4.39 0.00 2.88 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 78 G 7.97 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 79 K 8.69 3.95 0.00 1.84 1.81 0.00 1.74 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.67 1.54 7.81 80 R 8.04 3.89 0.00 1.89 2.00 0.00 3.31 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 81 F 7.99 4.18 0.00 2.94 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 82 H 8.16 3.92 0.00 3.18 3.34 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 D 8.10 4.24 0.00 2.62 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.21 3.86 0.00 1.83 1.43 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 2.29 2.15 0.00 85 V 6.87 3.15 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 0.18 0.00 0.00 -0.35 0.00 0.00 86 G 7.34 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 0.00 0.00 0.00 87 K 6.97 4.38 0.00 1.87 1.70 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.48 7.81 88 F 8.28 4.66 0.00 3.13 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 89 R 8.23 4.11 0.00 1.86 2.03 0.00 3.24 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.75 0.00 90 F 7.95 4.64 0.00 3.08 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 91 L 8.53 4.10 0.00 1.99 1.93 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.70 4.26 0.00 2.75 2.76 0.00 0.00 6.94 7.70 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 93 E 7.84 3.80 0.00 1.68 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 2.38 2.43 0.00 94 L 7.42 3.92 0.00 1.81 1.71 1.26 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.84 3.76 1.90 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 1.55 0.72 0.88 0.00 0.00 96 K 8.10 3.88 0.00 1.76 1.73 0.00 1.51 0.00 0.00 1.43 0.00 0.00 2.68 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.61 1.21 7.81 97 V 7.48 3.69 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 1.03 0.00 0.00 0.94 0.00 0.00 98 V 7.32 4.07 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 0.82 0.00 0.00 1.02 0.00 0.00 99 S 8.56 4.46 0.00 3.98 4.18 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 0.00 100 P 0.00 4.33 0.00 2.04 2.10 0.00 3.75 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 101 K 7.91 3.93 0.00 0.79 1.26 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.29 1.37 7.81 102 Y 8.01 4.53 0.00 3.18 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 0.00 103 L 8.66 4.09 0.00 2.13 1.77 0.99 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 104 G 8.14 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 0.00 105 S 8.23 4.10 0.00 3.87 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 0.00 106 R 7.88 4.50 0.00 1.83 1.94 0.00 3.11 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 107 T 7.40 4.67 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 1.22 0.00 0.00 108 S 8.51 4.25 0.00 4.12 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 0.00 109 E 8.96 3.95 0.00 2.01 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 2.41 2.33 0.00 110 K 7.98 3.91 0.00 1.85 1.92 0.00 1.80 0.00 0.00 1.80 0.00 0.00 3.11 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.53 7.81 111 V 7.36 3.58 2.22 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 1.06 0.00 0.00 0.96 0.00 0.00 112 K 8.15 3.90 0.00 1.85 1.87 0.00 1.73 0.00 0.00 1.66 0.00 0.00 3.20 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.56 1.51 7.81 113 N 8.50 4.40 0.00 2.79 2.87 0.00 0.00 6.70 8.53 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 0.00 114 K 7.96 4.18 0.00 2.01 2.02 0.00 1.58 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.40 7.81 115 I 7.96 3.68 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.40 0.92 0.00 0.00 116 L 7.98 4.22 0.00 1.88 1.81 0.97 1.05 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 0.00 117 E 8.24 3.96 0.00 2.15 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 0.00 2.34 2.61 0.00 118 L 7.70 3.51 0.00 1.22 0.63 0.98 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 119 L 7.29 3.50 0.00 1.62 1.84 1.05 1.09 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 0.00 120 Y 7.48 3.34 0.00 2.61 2.95 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 0.00 121 S 8.01 3.92 0.00 3.98 4.08 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 0.00 122 W 7.47 4.62 0.00 3.57 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 0.00 123 T 7.38 4.03 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 1.24 0.00 0.00 124 V 7.25 3.90 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 0.77 0.00 0.00 0.41 0.00 0.00 125 G 7.73 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.40 5.44 0.00 1.71 1.46 0.47 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 4.33 0.00 2.17 2.18 0.00 3.82 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 1.97 1.98 0.00 128 E 8.20 4.06 0.00 2.06 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 2.38 2.38 0.00 129 E 7.99 4.41 0.00 2.08 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 2.23 2.28 0.00 130 V 7.98 3.63 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 0.99 0.00 0.00 0.89 0.00 0.00 131 K 7.84 3.75 0.00 1.52 0.88 0.00 0.61 0.00 0.00 1.35 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.23 1.16 7.81 132 I 7.40 3.81 2.07 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.62 1.20 0.00 0.00 133 A 8.09 4.13 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 0.00 134 E 8.50 3.95 0.00 2.38 2.39 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 2.43 2.45 0.00 135 A 8.59 4.12 1.66 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 0.00 0.00 136 Y 8.47 4.12 0.00 3.22 3.12 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 0.00 137 Q 8.58 3.92 0.00 2.40 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 138 M 8.13 3.98 0.00 2.30 2.05 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.72 0.00 139 L 7.76 3.91 0.00 1.73 1.63 0.99 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 140 K 7.88 4.05 0.00 1.55 1.79 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.37 7.81 141 K 7.87 4.05 0.00 1.95 1.90 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.65 1.56 7.81 142 Q 8.03 4.22 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.49 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 143 G 7.88 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 0.00 144 I 7.62 3.63 1.97 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 1.30 0.56 0.96 0.00 0.00 145 V 7.62 4.21 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 0.88 0.00 0.00 0.83 0.00 0.00 146 K 8.60 4.03 0.00 1.74 1.82 0.00 1.88 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.46 7.81 147 S 7.27 4.46 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 0.00 148 D 8.38 3.94 0.00 2.30 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 0.00 149 P 0.00 4.35 0.00 2.17 2.01 0.00 3.43 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00