NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 18 E 4.1241 8.4449 121.4651 55.0093 31.4939 172.3089 19 L 3.3758 7.9563 125.0669 52.9472 42.0605 173.3375 20 S 4.2247 8.6535 118.2955 58.5058 65.0758 174.7668 21 E 3.9247 8.6225 124.5870 59.3297 29.5141 178.7748 22 A 3.9985 7.9293 120.3868 55.2181 18.5024 179.3213 23 E 4.0145 8.1285 116.7139 59.1280 29.5504 179.3231 24 R 3.8410 8.0219 118.9293 59.4961 30.2064 178.6767 25 K 3.9429 8.3704 118.3150 59.3649 32.0198 179.1321 26 A 4.0266 8.0901 120.9881 55.3180 18.2745 179.9517 27 V 3.8734 7.9510 116.7520 66.3672 31.7262 178.3434 28 Q 4.1241 8.5109 117.7623 58.8070 28.2819 178.4769 29 A 4.1230 8.1546 121.3987 54.9129 18.7383 179.1327 30 M 4.0306 8.1560 116.9938 58.5998 32.3545 178.2695 31 W 4.1598 8.6279 128.5406 60.4463 30.7441 177.7072 32 A 4.0737 8.1087 120.5967 54.9531 17.4791 179.6964 33 R 3.7395 7.4608 116.7332 59.4459 30.3382 178.3228 34 L 3.6138 6.9676 118.2516 57.7595 41.3407 178.6972 35 Y 3.7573 7.5415 118.3948 59.7910 38.6682 176.8483 36 A 4.0251 7.3256 121.5411 54.0911 19.5683 177.8430 37 N 4.8408 7.4755 113.4781 52.3017 39.4779 175.7004 38 S 3.9637 7.7519 115.3511 61.7382 62.6987 174.7444 39 E 3.9353 7.8520 120.4041 59.5740 29.4117 178.9075 40 D 4.3335 7.9226 118.4743 57.1493 40.8328 178.8845 41 V 3.6840 7.8000 118.8448 65.9038 31.6094 178.2209 42 G 3.6739 8.1364 105.5131 47.9672 0.0000 175.8078 43 V 3.5950 7.8045 120.5085 65.5220 31.6276 177.9731 44 A 3.9602 8.0882 120.5747 55.1147 18.1611 179.5910 45 I 3.6425 8.0296 118.5875 64.6935 37.1447 178.7508 46 L 3.7611 7.9451 119.6972 57.4557 41.3408 179.7133 47 V 3.6256 7.9521 118.4161 65.9246 31.4375 177.9590 48 R 3.8780 7.8792 118.2746 59.4115 29.8307 178.0868 49 F 4.4794 8.3335 120.3745 61.7167 39.1393 177.2075 50 F 4.4681 7.9867 116.2450 60.3615 38.7294 177.7690 51 V 3.7647 7.9619 117.5325 66.1701 31.5199 177.6569 52 N 4.3548 8.1971 114.6705 54.2753 39.8735 175.5112 53 F 4.8796 8.0315 118.9410 53.7596 39.5086 173.3353 54 P 4.3736 0.0000 0.0000 65.7023 31.3660 177.9581 55 S 4.1781 8.3443 112.2693 61.4459 62.2464 176.3313 56 A 3.8393 8.3865 124.5854 54.8740 18.0320 179.6540 57 K 3.6105 8.0529 116.8485 59.4759 31.7754 179.4029 58 Q 3.8505 7.4324 117.7726 58.7746 28.5938 177.7969 59 Y 4.3753 7.2390 115.2805 58.4576 38.5695 175.7830 60 F 4.4644 7.5684 119.1891 54.2949 38.6862 176.0649 61 S 4.0316 8.3933 122.7083 61.3142 63.0755 176.3492 62 Q 4.2373 8.0547 118.2020 58.8014 28.5092 177.7773 63 F 4.9087 7.4442 112.8233 55.9680 38.5407 176.5711 64 K 3.9670 7.9900 122.3083 60.2367 32.5273 177.0225 65 H 4.6548 7.7232 114.6102 55.9757 29.5164 174.7822 66 M 4.2662 7.8226 120.8000 55.4790 32.4704 175.3734 67 E 4.4649 8.7069 124.3931 56.9126 32.3563 176.2023 68 D 4.5585 7.9403 118.8761 52.7697 42.0470 174.7663 69 P 4.2888 0.0000 0.0000 66.0868 30.9435 178.3927 70 L 3.9890 7.9683 118.0430 57.5987 41.9202 178.9180 71 E 4.1011 8.2385 118.1139 59.5440 29.5065 179.0089 72 M 3.9320 7.9571 118.9690 58.4214 31.8744 178.7279 73 E 4.0321 7.9652 115.8832 58.7416 29.8746 178.3768 74 R 4.3254 7.4772 116.7011 56.1163 31.8989 177.1692 75 S 4.4001 7.3752 115.7511 56.2109 60.6918 170.4696 76 P 4.4301 0.0000 0.0000 62.5069 31.8088 177.0244 77 Q 4.5333 8.7058 121.7084 55.7769 28.9281 176.7562 78 L 4.1624 7.9303 121.6629 58.2320 43.8299 178.6706 79 R 4.2825 7.1136 113.8949 56.9385 29.4848 178.0438 80 K 4.1612 9.0413 113.8449 57.2094 31.5974 175.9311 81 H 4.5332 8.5090 116.6965 57.3577 29.6625 176.7000 82 A 3.9784 7.9929 122.2956 56.1911 18.5464 179.4508 83 S 4.0993 8.0221 113.4658 61.9718 62.9568 177.1546 84 R 4.0460 8.2187 121.1982 59.0204 29.8086 178.7083 85 V 3.5956 8.1873 118.7203 66.3769 31.5201 178.0325 86 M 4.6019 8.5899 118.7403 58.2776 31.8173 179.1157 87 G 3.7147 8.2208 105.8213 47.7155 0.0000 175.8088 88 A 4.0464 8.1598 123.4089 54.7565 18.3568 179.7422 89 L 3.6828 8.0949 117.5506 57.8048 41.6342 179.0100 90 N 3.9565 8.4175 117.1143 57.1711 38.6523 176.9352 91 T 3.7767 7.7434 116.6621 66.3931 68.2404 176.8565 92 V 3.3981 7.0624 118.7636 65.9605 31.7793 177.9048 93 V 3.4591 7.2777 117.9505 65.9652 31.0750 177.6285 94 E 3.9931 8.0517 117.5810 58.0824 29.6469 177.3124 95 N 4.8979 7.5310 116.0889 52.9393 39.5759 176.8382 96 L 4.0412 7.4894 123.3775 57.6428 41.7946 178.0930 97 H 4.4934 8.1161 112.0173 56.4603 29.1825 175.1337 98 D 4.7647 7.8889 121.1169 50.7653 41.0534 173.5922 99 P 4.2554 0.0000 0.0000 65.3613 31.1932 177.2023 100 D 4.4314 7.9880 116.9382 55.7916 39.7497 178.3902 101 K 3.9758 8.1787 121.3026 59.2017 32.1739 179.2950 102 V 3.6044 7.6486 112.4456 64.4926 31.7152 178.5455 103 S 4.1784 8.1541 114.8851 61.2663 62.6786 176.7230 104 S 4.1000 7.7362 115.5312 60.9666 62.3174 176.1451 105 V 3.5683 7.5017 120.4372 66.2087 31.2775 178.0731 106 L 3.9700 7.9843 118.3652 57.5741 41.4610 179.1747 107 A 3.9290 7.8156 120.3754 55.0752 18.2656 179.5278 108 L 3.8521 7.8000 118.3609 58.0775 42.0761 178.9648 109 V 3.7732 7.8502 118.4765 66.3008 31.2890 178.3409 110 G 3.4684 8.0695 105.0801 47.6201 0.0000 175.9731 111 K 3.6643 8.0840 120.7832 58.9958 32.0105 179.1153 112 A 3.8811 7.8961 121.0419 55.7338 18.2014 179.3761 113 H 4.0975 8.0664 114.0138 58.3793 28.4280 177.9232 114 A 3.3971 7.6681 122.9799 54.6943 17.8771 179.2469 115 L 4.2961 8.1318 115.6220 56.2561 42.5163 178.3056 116 K 4.2438 7.8762 117.0798 58.7849 32.6367 177.7038 117 H 4.5581 7.9465 112.9520 55.4243 29.4584 175.1377 118 K 4.4103 7.9223 116.5169 56.4903 29.2821 175.4971 119 V 3.4195 7.6759 117.9476 61.4467 32.6953 175.3813 120 E 4.2127 8.9555 127.7207 55.7886 30.1150 176.5318 121 P 4.0406 0.0000 0.0000 65.3384 31.2087 179.1169 122 V 3.7824 7.7892 118.7982 64.8959 31.0810 177.6839 123 Y 4.1917 7.9846 117.0327 60.7137 37.5890 178.4515 124 F 3.8689 8.4410 119.2590 60.2896 39.1548 177.4175 125 K 3.4804 7.8205 118.7218 59.3101 32.0371 178.7958 126 I 3.5002 7.4959 120.0342 64.1809 36.9381 178.0873 127 L 3.4443 7.9897 121.4439 58.1977 41.6924 179.1772 128 S 4.2223 8.1427 115.1348 61.5308 62.7059 176.9582 129 G 3.6255 7.9863 108.1161 47.7199 0.0000 176.0129 130 V 3.7259 7.7972 120.1597 65.7227 31.5715 178.0090 131 I 3.7251 8.0438 119.9534 64.4618 36.9681 177.8860 132 L 4.0451 8.2864 121.1377 58.3351 41.9180 178.6433 133 E 3.9407 8.3635 119.0256 59.3528 29.6050 179.0121 134 V 3.5650 8.1265 118.5969 65.8812 31.5937 178.0422 135 V 3.5469 8.1493 118.2428 66.0568 31.0221 177.9102 136 A 3.9699 7.8013 119.3410 55.0749 18.2476 179.1960 137 E 4.0393 7.9359 116.4877 59.2799 29.6863 178.6259 138 E 4.0331 8.0076 117.0206 56.9582 30.3515 176.9521 139 F 4.6355 8.0210 117.8434 56.6441 39.7710 175.4054 140 A 4.4077 7.8512 124.5288 54.7511 18.0222 176.7133 141 S 5.0403 8.4627 124.9105 59.8416 60.0958 176.2054 142 D 4.8702 7.6239 118.1435 54.0376 41.1025 176.8021 143 F 5.1539 7.7928 118.9412 56.0492 39.5166 172.7533 144 P 4.5049 0.0000 0.0000 61.7596 33.9459 174.8601 145 P 4.0737 0.0000 0.0000 66.1155 31.1260 178.5185 146 E 3.9246 8.0312 117.2377 59.4315 29.6172 178.8366 147 T 4.0029 7.7442 115.5466 66.3102 68.5051 176.6230 148 Q 3.5285 7.6128 120.0043 58.9569 28.7254 179.1239 149 R 3.9031 8.0700 118.7446 59.1091 30.0871 178.9464 150 A 3.9877 8.0095 120.5028 55.0930 18.4645 179.4602 151 W 4.1375 8.8867 127.0221 60.6819 30.8163 178.0170 152 A 4.0697 8.6376 121.0479 54.9408 17.7549 179.7982 153 K 3.8949 8.0489 117.3269 59.4265 32.0425 179.2525 154 L 3.7251 7.6821 120.6869 57.9574 41.8946 178.9904 155 R 3.7353 7.8016 118.7737 59.3388 29.9471 178.7987 156 G 3.5753 7.9555 105.4699 47.5070 0.0000 175.2915 157 L 3.8220 7.9159 122.7288 58.0272 42.0554 179.2350 158 I 3.5661 7.7194 119.6217 64.6284 36.9932 177.9042 159 Y 4.2036 8.1507 120.3498 60.4661 38.5915 177.7560 160 S 3.9643 8.4094 116.6638 62.1417 62.9116 176.5842 161 H 4.1858 8.2728 118.5979 58.4925 28.3338 178.1545 162 V 3.4494 7.6609 120.2237 65.8952 31.3459 178.0802 163 T 3.4949 7.5963 115.4146 66.5712 68.2413 176.3449 164 A 3.9096 7.9285 122.2251 55.1352 18.1704 179.5870 165 A 3.9322 7.5443 118.0976 55.3353 18.2724 179.1709 166 Y 3.8566 8.0640 115.5123 61.0973 37.7938 178.6944 167 K 4.0859 8.2062 120.5568 59.2058 32.0396 178.4509 168 E 3.9291 8.1185 119.2508 58.4245 29.6089 177.9454 169 V 4.3351 7.3588 114.7498 60.8464 32.9319 174.2569 170 G 3.8064 7.5178 109.5154 46.3799 0.0000 173.8250 171 W 4.5780 8.5023 133.5405 57.7364 30.7985 176.0270 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 18 E 8.44 4.12 0.00 1.93 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 2.17 2.27 0.00 19 L 7.96 3.38 0.00 1.87 1.65 0.83 0.49 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 20 S 8.65 4.22 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 21 E 8.62 3.92 0.00 2.08 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 2.38 2.38 0.00 22 A 7.93 4.00 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 23 E 8.13 4.01 0.00 2.03 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 2.41 2.37 0.00 24 R 8.02 3.84 0.00 2.17 1.96 0.00 3.09 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 25 K 8.37 3.94 0.00 1.98 1.88 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.48 7.81 26 A 8.09 4.03 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 27 V 7.95 3.87 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 1.26 0.00 0.00 1.11 0.00 0.00 28 Q 8.51 4.12 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 29 A 8.15 4.12 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 30 M 8.16 4.03 0.00 2.37 2.13 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 31 W 8.63 4.16 0.00 3.71 3.28 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 32 A 8.11 4.07 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 33 R 7.46 3.74 0.00 1.68 1.67 0.00 3.33 0.00 0.00 3.54 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 34 L 6.97 3.61 0.00 1.15 1.00 -0.42 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 7.54 3.76 0.00 1.95 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 36 A 7.33 4.03 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 37 N 7.48 4.84 0.00 2.74 2.69 0.00 0.00 6.86 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 S 7.75 3.96 0.00 3.29 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 39 E 7.85 3.94 0.00 2.04 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 2.36 2.40 0.00 40 D 7.92 4.33 0.00 2.86 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.80 3.68 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 1.11 0.00 0.00 1.09 0.00 0.00 42 G 8.14 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 7.80 3.59 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 1.04 0.00 0.00 0.94 0.00 0.00 44 A 8.09 3.96 1.39 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 45 I 8.03 3.64 2.02 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 1.55 0.65 0.85 0.00 0.00 46 L 7.95 3.76 0.00 1.81 1.60 0.82 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.95 3.63 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 1.08 0.00 0.00 0.93 0.00 0.00 48 R 7.88 3.88 0.00 2.11 2.14 0.00 3.23 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.78 0.00 49 F 8.33 4.48 0.00 3.01 2.89 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 50 F 7.99 4.47 0.00 3.05 3.02 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 51 V 7.96 3.76 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 0.81 0.00 0.00 1.00 0.00 0.00 52 N 8.20 4.35 0.00 2.69 2.26 0.00 0.00 6.88 7.28 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 53 F 8.03 4.88 0.00 2.96 2.98 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 54 P 0.00 4.37 0.00 2.17 2.14 0.00 3.59 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 55 S 8.34 4.18 0.00 4.27 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 0.00 56 A 8.39 3.84 1.14 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 57 K 8.05 3.61 0.00 2.02 1.71 0.00 1.91 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.03 1.39 7.81 58 Q 7.43 3.85 0.00 1.50 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 59 Y 7.24 4.38 0.00 2.52 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.57 4.46 0.00 1.83 1.77 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 61 S 8.39 4.03 0.00 3.80 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 62 Q 8.05 4.24 0.00 2.40 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.98 0.00 0.00 0.00 0.00 0.00 2.10 2.61 0.00 63 F 7.44 4.91 0.00 3.08 3.19 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 0.00 0.00 0.00 0.00 64 K 7.99 3.97 0.00 1.85 2.00 0.00 1.53 0.00 0.00 1.54 0.00 0.00 2.70 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.03 1.08 7.81 65 H 7.72 4.65 0.00 3.14 3.37 0.00 5.90 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 66 M 7.82 4.27 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.52 0.00 67 E 8.71 4.46 0.00 1.97 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 2.21 2.42 0.00 68 D 7.94 4.56 0.00 2.71 2.69 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 69 P 0.00 4.29 0.00 2.29 2.30 0.00 3.75 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 70 L 7.97 3.99 0.00 1.78 1.76 0.91 0.97 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 71 E 8.24 4.10 0.00 2.18 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 2.39 2.39 0.00 72 M 7.96 3.93 0.00 1.97 2.23 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 2.79 2.43 0.00 73 E 7.97 4.03 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 2.51 2.35 0.00 74 R 7.48 4.33 0.00 1.95 2.00 0.00 3.30 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 75 S 7.38 4.40 0.00 3.83 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.43 0.00 2.27 2.09 0.00 3.85 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.02 0.00 77 Q 8.71 4.53 0.00 2.41 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.10 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 78 L 7.93 4.16 0.00 0.76 1.39 0.67 0.76 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 79 R 7.11 4.28 0.00 2.00 1.08 0.00 3.14 0.00 0.00 3.09 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 80 K 9.04 4.16 0.00 2.15 2.05 0.00 1.84 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.61 1.57 7.81 81 H 8.51 4.53 0.00 3.55 3.49 0.00 5.73 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 82 A 7.99 3.98 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 83 S 8.02 4.10 0.00 4.16 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 R 8.22 4.05 0.00 2.19 1.98 0.00 3.21 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 85 V 8.19 3.60 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 1.01 0.00 0.00 0.79 0.00 0.00 86 M 8.59 4.60 0.00 2.36 2.40 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.99 0.00 87 G 8.22 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 88 A 8.16 4.05 1.36 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 0.00 0.00 89 L 8.09 3.68 0.00 1.96 1.13 0.81 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 90 N 8.42 3.96 0.00 3.03 2.98 0.00 0.00 7.27 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 91 T 7.74 3.78 4.31 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 1.18 0.00 0.00 92 V 7.06 3.40 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 0.59 0.00 0.00 0.84 0.00 0.00 93 V 7.28 3.46 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 0.86 0.00 0.00 0.08 0.00 0.00 94 E 8.05 3.99 0.00 2.07 1.89 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 2.29 2.34 0.00 95 N 7.53 4.90 0.00 2.83 2.75 0.00 0.00 6.86 7.40 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 96 L 7.49 4.04 0.00 1.52 1.69 0.89 1.13 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 97 H 8.12 4.49 0.00 3.23 3.39 0.00 5.46 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 D 7.89 4.76 0.00 2.76 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 99 P 0.00 4.26 0.00 2.17 2.10 0.00 3.61 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 2.10 2.15 0.00 100 D 7.99 4.43 0.00 2.92 2.89 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 0.00 101 K 8.18 3.98 0.00 2.03 1.97 0.00 1.50 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.49 7.81 102 V 7.65 3.60 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 0.79 0.00 0.00 0.92 0.00 0.00 103 S 8.15 4.18 0.00 3.84 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 S 7.74 4.10 0.00 3.86 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 0.00 105 V 7.50 3.57 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 0.93 0.00 0.00 0.94 0.00 0.00 106 L 7.98 3.97 0.00 1.75 1.65 0.79 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 107 A 7.82 3.93 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 0.00 108 L 7.80 3.85 0.00 1.94 1.65 0.91 0.62 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 0.00 109 V 7.85 3.77 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.05 0.00 0.00 110 G 8.07 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 K 8.08 3.66 0.00 1.73 1.76 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.30 7.81 112 A 7.90 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 0.00 113 H 8.07 4.10 0.00 3.59 3.64 0.00 5.82 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 0.00 114 A 7.67 3.40 0.29 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 0.00 115 L 8.13 4.30 0.00 1.62 1.71 0.88 1.07 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 0.00 116 K 7.88 4.24 0.00 1.80 1.79 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.50 7.81 117 H 7.95 4.56 0.00 3.01 3.15 0.00 5.86 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 0.00 118 K 7.92 4.41 0.00 2.12 2.24 0.00 1.88 0.00 0.00 2.39 0.00 0.00 3.02 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.55 1.51 7.81 119 V 7.68 3.42 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 0.61 0.00 0.00 0.38 0.00 0.00 120 E 8.96 4.21 0.00 2.37 2.16 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 3.00 2.85 0.00 121 P 0.00 4.04 0.00 1.66 0.49 0.00 3.59 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.34 0.00 122 V 7.79 3.78 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 0.57 0.00 0.00 0.83 0.00 0.00 123 Y 7.98 4.19 0.00 3.21 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 0.00 124 F 8.44 3.87 0.00 3.38 3.20 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 0.00 125 K 7.82 3.48 0.00 0.79 1.65 0.00 1.53 0.00 0.00 1.67 0.00 0.00 2.74 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.25 1.10 7.81 126 I 7.50 3.50 2.00 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 1.01 0.74 0.03 0.00 0.00 127 L 7.99 3.44 0.00 0.79 1.26 -0.05 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.14 4.22 0.00 4.02 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 0.00 129 G 7.99 3.63 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 0.00 0.00 0.00 130 V 7.80 3.73 2.29 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 1.26 0.00 0.00 1.33 0.00 0.00 131 I 8.04 3.73 2.17 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 1.49 0.53 1.27 0.00 0.00 132 L 8.29 4.05 0.00 1.98 1.98 1.26 1.34 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 0.00 133 E 8.36 3.94 0.00 2.20 2.14 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 2.35 2.48 0.00 134 V 8.13 3.57 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 0.93 0.00 0.00 1.00 0.00 0.00 135 V 8.15 3.55 1.49 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 -0.20 0.00 0.00 0.60 0.00 0.00 136 A 7.80 3.97 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 0.00 137 E 7.94 4.04 0.00 2.06 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 2.33 2.53 0.00 138 E 8.01 4.03 0.00 1.39 1.19 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 0.00 2.10 2.40 0.00 139 F 8.02 4.64 0.00 3.01 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 0.00 140 A 7.85 4.41 1.36 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 0.00 0.00 141 S 8.46 5.04 0.00 4.00 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 0.00 142 D 7.62 4.87 0.00 2.74 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 0.00 143 F 7.79 5.15 0.00 3.00 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 0.00 144 P 0.00 4.50 0.00 2.27 2.16 0.00 3.87 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 2.05 2.06 0.00 145 P 0.00 4.07 0.00 2.13 2.11 0.00 3.55 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 2.09 2.12 0.00 146 E 8.03 3.92 0.00 2.05 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 2.37 2.45 0.00 147 T 7.74 4.00 4.31 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 1.40 0.00 0.00 148 Q 7.61 3.53 0.00 2.01 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.46 0.00 149 R 8.07 3.90 0.00 1.84 1.98 0.00 3.12 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 150 A 8.01 3.99 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 0.00 151 W 8.89 4.14 0.00 3.68 3.48 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 0.00 152 A 8.64 4.07 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 K 8.05 3.89 0.00 1.95 1.82 0.00 1.76 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.43 7.81 154 L 7.68 3.73 0.00 1.48 1.29 0.63 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 155 R 7.80 3.74 0.00 1.70 1.95 0.00 3.16 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 156 G 7.96 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 7.92 3.82 0.00 1.84 1.65 0.79 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 158 I 7.72 3.57 1.94 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.68 0.91 0.00 0.00 159 Y 8.15 4.20 0.00 2.89 2.92 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 0.00 0.00 0.00 160 S 8.41 3.96 0.00 4.05 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 0.00 161 H 8.27 4.19 0.00 3.19 3.26 0.00 5.80 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 V 7.66 3.45 1.70 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 0.09 0.00 0.00 0.59 0.00 0.00 163 T 7.60 3.49 4.03 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 0.00 0.00 0.95 0.00 0.00 164 A 7.93 3.91 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 0.00 165 A 7.54 3.93 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 0.00 166 Y 8.06 3.86 0.00 2.99 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 0.00 167 K 8.21 4.09 0.00 1.86 1.93 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.47 7.81 168 E 8.12 3.93 0.00 2.14 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 2.30 2.29 0.00 169 V 7.36 4.34 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 0.90 0.00 0.00 0.94 0.00 0.00 170 G 7.52 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 0.00 171 W 8.50 4.58 0.00 3.49 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