NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4204 8.2649 122.4706 51.9324 20.3724 176.1835 3 T 4.1120 8.1591 117.5138 62.8885 69.8226 172.4778 4 K 5.3282 9.0603 125.5969 54.7984 37.1880 174.5121 5 A 5.3916 8.9381 123.4309 50.8260 23.4117 175.1272 6 V 5.0016 8.9410 117.5100 61.0055 35.4992 173.4716 7 C 4.8450 8.9226 121.9697 58.2767 35.1420 172.8311 8 V 4.4278 8.4775 126.7311 61.5668 32.3946 174.5167 9 L 4.5649 8.8264 130.0291 54.5707 42.7536 176.6894 10 K 4.8370 9.2554 122.5108 55.6280 37.2196 175.2771 11 G 4.2024 7.9742 106.9640 46.9233 0.0000 173.8470 12 D 4.5300 9.0961 119.1819 56.3951 41.2660 176.7936 13 G 4.3829 7.1944 106.3082 43.6449 0.0000 171.8970 14 P 4.2497 0.0000 0.0000 64.6329 31.8710 176.6992 15 V 4.0727 7.0252 121.0628 63.1364 31.8091 175.1367 16 Q 4.7329 8.3924 124.6209 55.3519 32.4613 173.2998 17 G 4.2003 7.8098 106.9614 46.4726 0.0000 171.7557 18 I 5.0807 7.7112 119.7284 59.3659 40.8079 175.1588 19 I 4.7115 8.7283 127.2068 59.5202 40.4404 174.4537 20 N 4.9079 8.8224 125.0533 51.5667 41.0299 174.0130 21 F 5.3474 8.9751 119.7649 56.0105 43.4387 174.4838 22 E 4.8953 9.4297 123.2370 55.7034 32.7354 173.6700 23 Q 4.9278 8.9879 130.2896 54.3421 30.1168 176.3505 24 K 4.0982 8.8990 127.4006 58.8194 32.6682 177.8094 25 E 4.7545 7.8173 117.1143 54.0693 33.3195 176.1608 26 S 3.9582 9.0377 118.0816 61.3706 62.7472 174.9799 27 N 4.6144 8.1764 114.9184 52.5132 37.6286 174.3356 28 G 4.1387 8.2907 109.5254 43.1785 0.0000 171.2719 29 P 4.7101 0.0000 0.0000 62.4413 32.9693 175.8441 30 V 4.5707 8.8272 121.3007 61.1730 33.6397 174.8034 31 K 4.6786 8.9687 128.4971 56.1468 33.5628 176.1582 32 V 4.9037 9.0265 125.2492 60.8031 33.9946 174.2861 33 W 5.5652 8.8855 124.1119 54.8568 32.2769 175.5145 34 G 3.7922 7.3420 106.2679 46.1502 0.0000 170.5933 35 S 4.8743 7.7479 114.7675 56.9958 65.7215 174.2684 36 I 4.8499 8.4688 128.5155 59.5945 39.7609 174.9538 37 K 4.8558 8.9758 124.3794 55.9886 36.6625 176.9086 38 G 3.7967 8.8782 106.2984 45.7809 0.0000 173.2784 39 L 4.4326 7.7708 119.9673 52.9913 42.8567 176.5208 40 T 4.2964 8.2770 112.8879 61.1253 69.4128 173.9062 41 E 4.0064 8.6845 125.9074 57.3296 30.6453 174.9548 42 G 3.8389 8.5081 110.8755 44.0003 0.0000 172.7152 43 L 4.6871 8.2455 119.6186 55.1236 42.8486 176.5653 44 H 5.0792 9.2627 118.7759 53.8193 33.4787 173.4798 45 G 4.0229 8.9824 110.1341 46.9020 0.0000 172.9510 46 F 5.0756 8.5168 125.0027 57.5979 41.7220 172.5420 47 H 5.2693 8.9242 122.5510 53.7236 33.6426 172.7132 48 V 4.4026 8.6491 121.6534 62.4478 32.8699 175.2930 49 H 5.1006 9.5849 126.1374 54.5985 30.6943 176.1317 50 E 3.7737 8.8714 121.5025 59.0999 29.5165 177.0315 51 F 5.0417 7.9851 118.5149 55.8750 40.7507 176.3783 52 G 3.9918 8.4990 113.0447 44.8545 0.0000 173.1272 53 D 4.7570 8.1197 119.1627 52.4224 42.8195 174.8186 54 N 5.2128 8.4290 122.6328 52.7193 39.2026 175.5596 55 T 3.6871 8.0333 112.7859 66.5917 69.1494 175.1620 56 A 4.6063 8.5613 125.7818 51.6122 19.8819 177.7757 57 G 3.9121 7.9042 111.1943 46.7208 0.0000 174.7074 58 C 4.3652 8.6486 115.3691 59.9558 37.0906 175.7086 59 T 3.7802 7.9236 117.2404 66.6463 67.7850 176.4175 60 S 4.1849 8.0774 115.4866 60.9998 63.1604 175.8419 61 A 4.4705 7.3995 124.6018 54.2737 18.1759 178.5254 62 G 4.2348 8.0399 105.4876 44.4476 0.0000 170.5389 63 P 4.7572 0.0000 0.0000 61.8716 34.1303 175.0023 64 H 4.1695 8.6422 116.5106 55.9603 29.3849 175.5335 65 F 4.2634 9.1050 126.1015 58.2785 40.0758 174.9083 66 N 5.1617 7.9404 125.5150 51.7850 39.0104 172.8018 67 P 4.1964 0.0000 0.0000 64.7793 32.3685 177.9653 68 L 4.3049 7.6243 117.0803 53.8911 41.8049 176.2560 69 S 3.6183 7.4362 113.6052 59.8696 60.6266 171.7495 70 R 4.5349 8.1530 118.7057 54.5623 32.5044 176.1861 71 K 4.5026 7.9465 118.1587 55.6887 33.3542 177.0234 72 H 3.9512 8.7886 122.7504 56.9030 30.6226 174.5224 73 G 3.8982 7.6204 108.8722 45.8938 0.0000 172.9441 74 G 4.0583 8.5814 109.1100 43.8677 0.0000 173.3665 75 P 4.3003 0.0000 0.0000 65.4823 31.4993 178.2155 76 K 4.1269 7.9811 117.3468 58.7932 32.3121 177.4127 77 D 4.4450 7.4739 117.9271 54.4764 41.3553 176.3194 78 E 3.9610 8.7909 124.4653 59.3013 29.8474 177.4256 79 E 4.2070 7.8606 121.6839 55.5775 27.8286 175.1628 80 R 4.6952 7.6206 119.4564 54.0452 33.1931 175.0944 81 H 4.4796 8.8916 115.9813 55.2500 29.4237 177.0459 82 V 3.4331 8.3521 122.8344 66.1185 31.3523 177.2225 83 G 3.8778 8.1858 106.3002 46.0893 0.0000 173.0825 84 D 4.8301 7.8804 120.6983 54.0111 39.2335 175.7316 85 L 4.5320 8.1857 122.0192 54.0130 43.1976 178.6364 86 G 4.0627 7.8530 109.3745 46.7078 0.0000 174.6580 87 N 5.6719 8.7445 120.9084 51.2762 41.7747 173.2626 88 V 4.4426 9.0374 113.5273 59.9185 35.5840 174.7428 89 T 4.9315 8.4015 120.0701 61.9132 70.8697 173.0395 90 A 5.0836 9.1254 129.0786 50.3233 21.2535 176.0542 91 D 4.7396 10.0771 123.5320 53.1600 41.4453 179.1698 92 K 4.6036 8.0111 117.1983 59.3788 32.7649 176.6631 93 D 4.5757 7.8914 115.9576 53.6507 39.4750 177.2947 94 G 4.3964 9.0125 108.8142 44.6739 0.0000 173.6902 95 V 4.3760 7.5589 120.1486 62.2440 33.3524 174.9401 96 A 4.7552 9.0248 128.2473 49.2729 21.4695 175.0304 97 D 4.8568 8.6601 122.6779 53.9084 40.6120 175.9185 98 V 3.6039 8.3039 123.6664 62.8662 32.8413 175.1771 99 S 5.0189 8.5694 122.2531 57.3556 63.2627 172.5256 100 I 4.6850 9.1958 126.3026 58.9999 40.5707 173.8769 101 E 5.0817 8.6273 124.2143 54.7066 32.3490 174.1354 102 D 5.0249 9.2646 125.4674 52.9009 44.8401 175.7989 103 S 4.8550 8.8551 117.6296 58.5833 65.0949 175.8809 104 V 3.8281 8.1319 119.9440 65.3960 31.6035 176.4683 105 I 4.0688 7.5617 111.3199 61.2288 38.1544 174.7856 106 S 4.6455 8.1998 113.7958 57.6415 65.0297 173.9930 107 L 4.7810 8.1659 124.6725 54.0675 41.4669 176.7848 108 S 4.5058 7.9199 110.9603 58.7500 66.5860 176.2363 109 G 3.8804 8.6131 109.2365 44.6058 0.0000 173.7682 110 D 4.3602 8.7982 118.1708 57.8196 41.2694 177.7691 111 H 4.8252 8.1115 112.6770 55.6624 28.8334 174.4329 112 C 4.2920 7.9757 121.5325 59.9251 31.4579 173.5653 113 I 3.7442 8.5449 120.8844 61.5197 38.0171 175.9966 114 I 3.7170 7.2695 123.1179 62.7285 37.3095 176.1988 115 G 3.8385 9.1151 113.3268 45.1238 0.0000 172.6207 116 R 4.6106 7.5186 118.3211 54.5009 33.8665 174.7381 117 T 4.8461 7.8068 115.7913 62.4317 70.3289 174.4477 118 L 4.6143 8.6226 128.6314 54.4885 44.2888 175.7299 119 V 4.8996 8.4501 124.6950 61.6840 34.9616 173.7896 120 V 4.9922 8.8491 127.9866 60.8715 33.7126 174.7298 121 H 5.0301 8.5332 118.9482 53.9372 31.6627 173.5877 122 E 4.0652 9.3206 121.2096 59.1060 29.4637 178.0370 123 K 4.5930 8.5936 117.8314 54.7171 35.0957 174.8070 124 A 4.6375 8.2624 121.8200 51.6793 20.1588 176.4289 125 D 4.9356 9.3086 122.1740 53.8341 41.8597 175.9609 126 D 4.6193 9.3754 125.1288 53.0289 39.5138 176.5082 127 L 3.4816 9.0557 117.9713 56.0665 39.6941 175.9371 128 G 4.0594 8.8560 106.4336 45.7284 0.0000 174.7712 129 K 4.4830 7.8683 118.5416 56.5111 32.1740 178.2501 130 G 3.7197 7.3731 110.7212 45.7956 0.0000 175.0511 131 G 4.0578 8.4306 107.4315 45.2414 0.0000 173.2898 132 N 4.7063 7.5319 115.7042 51.3824 39.0697 174.8178 133 E 4.0351 8.7331 118.2578 59.4082 29.8925 178.4593 134 E 3.9784 8.1805 118.5871 59.1152 29.4663 178.3981 135 S 4.0663 9.3116 114.1537 61.4162 62.3286 175.7426 136 T 4.1248 7.8848 117.1362 65.1984 67.9283 174.7083 137 K 4.3779 8.0543 118.0678 57.0931 34.6283 177.1380 138 T 3.8800 7.6473 108.6491 61.1571 70.0452 175.8933 139 G 3.7763 7.9156 110.2990 44.9138 0.0000 173.3523 140 N 4.3100 7.8418 113.8110 54.1215 36.7441 174.8293 141 A 4.4793 7.4249 118.4883 51.3381 19.4526 179.8402 142 G 3.9565 7.9667 104.6179 44.5172 0.0000 173.1188 143 S 4.3926 8.4765 114.3285 58.5940 64.8313 173.7518 144 R 4.4227 8.2507 119.1637 54.9725 29.8246 176.8589 145 L 4.2570 8.5469 125.2618 57.2459 42.7350 177.2999 146 A 5.0355 7.7628 119.1321 50.8229 23.0059 173.5172 147 C 5.1948 9.3007 114.9221 54.8448 47.2112 172.7284 148 G 4.4729 8.4018 103.3768 46.0978 0.0000 172.9479 149 V 4.3827 8.3533 121.9960 62.3132 32.7432 175.5475 150 I 4.0133 8.9964 129.5658 61.0037 38.1304 175.3014 151 G 4.4982 9.0293 114.1016 43.9343 0.0000 171.9671 152 I 4.3479 8.3584 121.8760 61.0677 37.6482 175.4272 153 A 4.8196 8.2122 127.5443 49.6882 22.2028 176.1461 154 Q 4.0706 8.5021 118.6899 56.4454 29.2244 175.9027 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 2 A 8.26 4.42 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 3 T 8.16 4.11 4.28 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 1.22 0.00 0.00 4 K 9.06 5.33 0.00 1.71 1.73 0.00 1.88 0.00 0.00 1.98 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.49 7.81 5 A 8.94 5.39 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 6 V 8.94 5.00 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 0.81 0.00 0.00 0.92 0.00 0.00 7 C 8.92 4.85 0.00 3.11 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 8 V 8.48 4.43 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 0.93 0.00 0.00 0.92 0.00 0.00 9 L 8.83 4.56 0.00 1.78 1.60 1.04 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 10 K 9.26 4.84 0.00 1.60 1.63 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.39 7.81 11 G 7.97 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 0.00 0.00 0.00 0.00 12 D 9.10 4.53 0.00 2.68 2.75 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 0.00 0.00 0.00 0.00 13 G 7.19 4.38 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 0.00 14 P 0.00 4.25 0.00 2.18 2.18 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 15 V 7.03 4.07 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 0.79 0.00 0.00 0.94 0.00 0.00 16 Q 8.39 4.73 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.55 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 17 G 7.81 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 0.00 0.00 0.00 0.00 18 I 7.71 5.08 1.81 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 1.20 1.23 0.80 0.00 0.00 19 I 8.73 4.71 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.27 0.54 0.00 0.00 20 N 8.82 4.91 0.00 1.44 1.42 0.00 0.00 6.41 8.01 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 21 F 8.98 5.35 0.00 2.90 2.94 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 22 E 9.43 4.90 0.00 2.46 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 23 Q 8.99 4.93 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 24 K 8.90 4.10 0.00 1.81 1.88 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.47 1.48 7.81 25 E 7.82 4.75 0.00 1.97 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 2.30 2.29 0.00 26 S 9.04 3.96 0.00 3.98 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 27 N 8.18 4.61 0.00 2.85 2.96 0.00 0.00 5.84 7.00 0.00 0.00 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 G 8.29 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 29 P 0.00 4.71 0.00 2.13 2.09 0.00 3.76 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 30 V 8.83 4.57 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 1.23 0.00 0.00 1.09 0.00 0.00 31 K 8.97 4.68 0.00 1.91 1.81 0.00 1.56 0.00 0.00 1.47 0.00 0.00 2.93 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.49 1.42 7.81 32 V 9.03 4.90 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 0.67 0.00 0.00 1.00 0.00 0.00 33 W 8.89 5.57 0.00 3.49 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 34 G 7.34 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 35 S 7.75 4.87 0.00 3.89 3.65 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 36 I 8.47 4.85 1.77 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.33 0.86 0.00 0.00 37 K 8.98 4.86 0.00 1.70 1.83 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.29 1.41 7.81 38 G 8.88 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 39 L 7.77 4.43 0.00 1.88 1.51 0.81 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.28 4.30 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 1.27 0.00 0.00 41 E 8.68 4.01 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.47 0.00 42 G 8.51 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.25 4.69 0.00 1.50 1.59 0.91 0.93 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 44 H 9.26 5.08 0.00 3.10 3.15 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.98 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 46 F 8.52 5.08 0.00 2.98 3.01 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 47 H 8.92 5.27 0.00 3.03 3.03 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.65 4.40 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 0.95 0.00 0.00 0.90 0.00 0.00 49 H 9.58 5.10 0.00 3.16 3.41 0.00 5.69 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.87 3.77 0.00 1.64 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 1.47 2.08 0.00 51 F 7.99 5.04 0.00 3.25 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 52 G 8.50 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 0.00 0.00 0.00 53 D 8.12 4.76 0.00 2.62 2.78 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 0.00 0.00 0.00 54 N 8.43 5.21 0.00 2.79 2.69 0.00 0.00 7.65 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 55 T 8.03 3.69 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 1.19 0.00 0.00 56 A 8.56 4.61 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 57 G 7.90 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 58 C 8.65 4.37 0.00 2.96 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 59 T 7.92 3.78 4.25 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 1.23 0.00 0.00 60 S 8.08 4.18 0.00 4.00 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 0.00 61 A 7.40 4.47 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 62 G 8.04 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 0.00 0.00 0.00 0.00 63 P 0.00 4.76 0.00 2.08 2.23 0.00 3.63 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 64 H 8.64 4.17 0.00 2.84 3.22 0.00 5.73 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 F 9.10 4.26 0.00 2.84 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 66 N 7.94 5.16 0.00 2.57 2.42 0.00 0.00 6.94 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 67 P 0.00 4.20 0.00 2.08 1.96 0.00 3.13 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.20 0.00 68 L 7.62 4.30 0.00 1.56 1.67 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.44 3.62 0.00 3.92 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 70 R 8.15 4.53 0.00 1.87 2.01 0.00 3.29 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 71 K 7.95 4.50 0.00 1.54 1.70 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.50 7.81 72 H 8.79 3.95 0.00 3.15 3.24 0.00 5.98 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 73 G 7.62 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 0.00 0.00 0.00 74 G 8.58 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 75 P 0.00 4.30 0.00 2.22 2.24 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 2.04 0.00 76 K 7.98 4.13 0.00 1.77 1.92 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.47 7.81 77 D 7.47 4.44 0.00 2.83 2.58 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 78 E 8.79 3.96 0.00 1.92 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 2.27 2.28 0.00 79 E 7.86 4.21 0.00 1.92 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 2.26 2.31 0.00 80 R 7.62 4.70 0.00 1.82 1.88 0.00 3.36 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 81 H 8.89 4.48 0.00 3.53 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.35 3.43 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 0.67 0.00 0.00 0.52 0.00 0.00 83 G 8.19 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 84 D 7.88 4.83 0.00 2.83 2.78 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 0.00 0.00 0.00 85 L 8.19 4.53 0.00 1.73 1.80 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 86 G 7.85 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 87 N 8.74 5.67 0.00 2.61 2.72 0.00 0.00 6.53 7.68 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 88 V 9.04 4.44 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 -0.08 0.00 0.00 0.80 0.00 0.00 89 T 8.40 4.93 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 90 A 9.13 5.08 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 10.08 4.74 0.00 2.70 2.79 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 92 K 8.01 4.60 0.00 1.79 1.83 0.00 1.76 0.00 0.00 1.92 0.00 0.00 3.06 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.43 1.43 7.81 93 D 7.89 4.58 0.00 2.76 2.75 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 0.00 0.00 0.00 0.00 94 G 9.01 4.40 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 0.00 95 V 7.56 4.38 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 0.89 0.00 0.00 0.92 0.00 0.00 96 A 9.02 4.76 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 D 8.66 4.86 0.00 2.56 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 98 V 8.30 3.60 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 0.78 0.00 0.00 0.66 0.00 0.00 99 S 8.57 5.02 0.00 3.91 3.72 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 0.00 100 I 9.20 4.69 1.99 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 1.17 0.72 1.00 0.00 0.00 101 E 8.63 5.08 0.00 1.94 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 0.00 2.21 2.32 0.00 102 D 9.26 5.02 0.00 2.87 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 S 8.86 4.86 0.00 3.89 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 0.00 104 V 8.13 3.83 2.20 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 0.78 0.00 0.00 0.94 0.00 0.00 105 I 7.56 4.07 1.96 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 1.05 0.00 0.00 106 S 8.20 4.65 0.00 3.89 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 0.00 107 L 8.17 4.78 0.00 1.82 1.64 1.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 108 S 7.92 4.51 0.00 3.91 3.78 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 0.00 0.00 0.00 109 G 8.61 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 0.00 110 D 8.80 4.36 0.00 2.66 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 0.00 111 H 8.11 4.83 0.00 3.20 3.37 0.00 5.78 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 C 7.98 4.29 0.00 3.21 2.87 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 0.00 113 I 8.54 3.74 1.65 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.21 1.02 0.00 0.00 114 I 7.27 3.72 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.38 0.83 0.00 0.00 115 G 9.12 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 R 7.52 4.61 0.00 1.62 1.78 0.00 2.21 0.00 0.00 2.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.31 0.00 117 T 7.81 4.85 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 1.21 0.00 0.00 118 L 8.62 4.61 0.00 1.83 1.56 0.58 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 119 V 8.45 4.90 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 0.86 0.00 0.00 0.77 0.00 0.00 120 V 8.85 4.99 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 0.87 0.00 0.00 0.96 0.00 0.00 121 H 8.53 5.03 0.00 3.24 3.54 0.00 5.66 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 9.32 4.07 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 123 K 8.59 4.59 0.00 1.78 1.75 0.00 1.90 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.42 7.81 124 A 8.26 4.64 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 0.00 125 D 9.31 4.94 0.00 2.78 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 0.00 126 D 9.38 4.62 0.00 2.95 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 0.00 127 L 9.06 3.48 0.00 1.83 1.77 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.86 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 0.00 129 K 7.87 4.48 0.00 1.78 1.83 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.50 7.81 130 G 7.37 3.72 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 0.00 0.00 0.00 131 G 8.43 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 0.00 132 N 7.53 4.71 0.00 2.84 2.86 0.00 0.00 5.97 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 0.00 133 E 8.73 4.04 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 2.37 2.36 0.00 134 E 8.18 3.98 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 135 S 9.31 4.07 0.00 4.17 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 0.00 136 T 7.88 4.12 4.47 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 1.20 0.00 0.00 137 K 8.05 4.38 0.00 1.80 1.70 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.31 7.81 138 T 7.65 3.88 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 1.22 0.00 0.00 139 G 7.92 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 140 N 7.84 4.31 0.00 3.07 2.91 0.00 0.00 6.85 6.89 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 0.00 141 A 7.42 4.48 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 0.00 142 G 7.97 3.96 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 0.00 0.00 0.00 143 S 8.48 4.39 0.00 3.94 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 0.00 144 R 8.25 4.42 0.00 1.66 1.85 0.00 3.18 0.00 0.00 3.13 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.59 0.00 145 L 8.55 4.26 0.00 1.54 1.69 0.91 0.68 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 0.00 146 A 7.76 5.04 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 0.00 147 C 9.30 5.19 0.00 3.05 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 0.00 148 G 8.40 4.47 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 0.00 149 V 8.35 4.38 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 0.77 0.00 0.00 0.95 0.00 0.00 150 I 9.00 4.01 1.74 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.58 0.48 0.00 0.00 151 G 9.03 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 0.00 0.00 0.00 0.00 152 I 8.36 4.35 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.54 0.91 0.00 0.00 153 A 8.21 4.82 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 0.00 0.00 0.00 0.00 0.00 154 Q 8.50 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00