NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2047 8.1633 120.2857 54.6958 33.1590 174.2043 2 K 4.0261 8.4951 126.3514 56.1753 32.4613 175.7626 3 G 3.9408 8.6813 113.6933 44.8635 0.0000 171.9699 4 D 4.5565 8.4817 119.6454 54.4183 41.9403 176.9781 5 T 3.8691 8.9133 122.9555 66.9103 68.5931 176.6355 6 K 3.8576 8.1778 120.8130 59.0707 32.2106 178.9104 7 V 3.9074 8.5436 118.9527 66.1571 31.4329 177.9024 8 I 3.7411 7.7177 119.2905 64.6357 36.8824 178.0831 9 N 4.2347 8.2566 117.1024 56.4571 38.3438 177.0133 10 Y 4.0830 7.9598 117.9763 61.1691 38.0338 178.6544 11 L 3.9220 8.6218 120.1016 58.0050 41.6374 179.4834 12 N 4.3851 8.4524 116.6440 55.9534 38.4267 177.4813 13 K 3.8675 8.2609 121.5328 59.3944 32.3219 178.9217 14 L 3.8299 8.2289 119.6100 57.6366 41.3869 179.0462 15 L 4.0218 7.9072 120.6996 58.1402 41.9113 179.2396 16 G 3.6172 8.1644 105.7223 47.9086 0.0000 175.2688 17 N 4.3418 8.0148 119.0934 56.1443 38.6146 177.3627 18 E 4.0766 8.2886 119.8201 59.3878 29.4383 179.2736 19 L 4.0049 8.2179 119.2678 57.8160 41.6160 179.7905 20 V 3.5877 7.7781 117.6344 66.0879 31.5199 177.9166 21 A 3.8756 8.2269 120.5730 55.0444 18.1432 179.4797 22 I 3.7622 8.3797 118.6804 64.8677 37.1917 178.4486 23 N 4.3838 7.9104 117.1040 56.4003 38.3923 177.4284 24 Q 3.8399 8.3319 121.2408 59.3139 29.0426 177.8881 25 Y 4.3426 8.4795 118.3294 60.9096 37.9084 178.0137 26 F 3.8178 8.5836 121.7145 61.0942 39.5025 176.7668 27 L 3.9691 8.2695 120.0582 58.6112 41.8312 178.4582 28 H 3.8341 8.2470 115.7790 58.7980 28.6556 177.2008 29 A 4.1681 8.2748 122.7535 55.7630 18.1060 179.9612 30 R 3.9079 7.8261 115.5593 58.7634 30.1434 179.3054 31 M 3.5991 7.8273 119.2505 58.2105 31.8697 178.4148 32 F 4.5810 7.7074 118.2606 60.6514 39.1335 177.6659 33 K 3.9368 8.1378 119.0449 59.5448 31.7930 178.2623 34 N 4.2948 8.0627 116.2230 56.8408 38.9892 176.6247 35 F 4.7679 8.2302 118.0126 59.0638 38.9763 176.4917 36 G 3.9881 8.1113 106.2051 45.8442 0.0000 175.2139 37 L 4.4813 8.0700 122.2083 52.6133 38.2459 176.8963 38 K 3.8202 7.9489 122.9740 59.9155 32.6210 177.5368 39 R 3.9355 8.2775 118.9040 59.2487 29.9388 178.4512 40 L 4.1160 7.9209 118.9219 57.3175 41.4640 178.8395 41 N 4.5667 8.1767 116.7908 56.7653 39.0041 176.4851 42 D 4.3086 8.0649 120.2447 57.3836 41.0993 178.9876 43 V 3.3606 7.6025 118.3431 66.0844 31.4164 177.9761 44 E 3.8411 8.3852 118.4529 59.2190 29.2928 178.5743 45 Y 3.8197 8.1793 119.8480 61.1481 38.5407 178.0607 46 H 4.2020 8.3094 115.9943 57.8691 28.6998 177.1793 47 E 3.7631 7.5106 120.2996 58.1301 29.5263 178.3345 48 S 4.0764 7.8522 113.6623 61.5679 62.4349 176.2455 49 I 3.5596 7.3268 122.2738 64.3628 36.8499 177.8290 50 D 4.1987 7.4777 118.2379 57.5186 40.9854 178.3117 51 E 4.0820 8.1325 118.8563 59.2915 29.3159 179.2582 52 M 4.0579 7.9969 119.0942 58.3449 32.0422 178.6841 53 K 3.8829 8.0775 118.5781 59.8202 32.1746 179.1233 54 H 4.1116 8.0085 115.8781 58.7562 28.6182 177.5133 55 A 4.2348 8.3512 122.9100 55.4239 18.2129 178.9878 56 D 4.3131 8.3940 116.6547 57.7695 41.2473 178.8343 57 R 3.8895 7.8843 118.3410 59.3799 29.9766 178.6728 58 Y 4.3124 7.9170 116.4999 61.2680 37.9088 178.6859 59 I 3.7821 8.2880 121.0899 64.5793 37.1596 178.4347 60 E 4.0694 8.4437 119.4617 59.1761 29.1986 179.4278 61 R 4.0362 8.1655 118.8927 59.5091 30.1822 178.4959 62 I 3.7674 8.5278 119.9840 64.5489 37.1431 178.4000 63 L 4.0338 8.0451 119.6870 57.7120 41.2227 179.3551 64 F 4.3954 8.1830 119.6296 61.3245 39.7446 176.5431 65 L 4.5445 8.1584 117.7218 54.0463 41.1403 177.2405 66 E 3.8734 7.9999 117.6397 57.3892 27.0491 174.5955 67 G 3.9192 8.1495 108.8470 44.1657 0.0000 173.8239 68 L 4.5213 8.0006 119.1543 51.9933 41.8816 175.0545 69 P 4.3772 0.0000 0.0000 62.5572 31.7664 176.0444 70 N 4.7230 9.4277 122.1972 52.4126 38.7920 173.8604 71 L 4.6368 8.3421 124.1882 54.5645 42.4563 177.4437 72 Q 4.1495 8.6037 122.2152 58.1063 29.4043 175.9591 73 D 4.6573 8.0483 116.9095 52.9972 41.8787 175.2657 74 L 4.5944 8.2893 125.3118 52.8115 44.1623 176.6120 75 G 3.8159 8.4307 115.4117 44.6033 0.0000 171.8422 76 K 4.0901 8.3251 120.7942 55.7962 32.4025 176.7402 77 L 4.1045 8.3672 126.8417 54.4145 42.2921 176.0389 78 N 4.8305 8.8487 121.1592 52.1169 40.2937 174.0229 79 I 3.9340 8.5798 126.6189 63.7126 37.9211 177.9681 80 G 4.1708 8.1270 102.6250 45.8162 0.0000 172.5027 81 E 4.5867 8.6719 117.2227 56.2778 31.9150 176.8019 82 D 5.0899 7.6785 117.1394 50.9002 43.3798 176.8214 83 V 3.9659 8.4448 119.2765 66.6520 31.2856 177.5378 84 E 3.8422 8.2065 117.9230 59.4960 29.5138 178.2024 85 E 3.9631 8.4043 119.3167 59.5377 29.6132 178.7203 86 M 4.0833 8.2829 117.1362 58.2394 31.3753 178.5934 87 L 4.1416 8.4386 120.5393 57.6372 41.7407 179.4743 88 R 3.8963 8.4238 119.0821 59.3633 30.0394 178.5627 89 S 4.0911 8.1289 113.1408 61.3486 62.3949 175.8124 90 D 4.2060 8.1587 121.6800 57.1308 40.4931 178.4585 91 L 3.9679 8.2076 120.6117 58.3077 42.1652 178.7975 92 A 3.9826 8.2488 120.8460 55.2472 18.2496 179.4027 93 L 3.9376 7.9072 118.6571 58.1289 42.0550 178.8425 94 E 4.0562 8.2541 119.4670 59.1411 29.7527 178.6800 95 L 4.0257 8.2321 119.3054 58.0491 41.8313 179.3187 96 D 4.5285 8.3421 118.9617 57.1660 40.7218 179.1051 97 G 3.6356 8.3305 106.2895 47.6370 0.0000 175.7101 98 A 4.0746 8.4355 123.5550 54.6080 18.4594 179.5565 99 K 3.8497 7.9813 117.8040 59.9689 32.2425 178.8113 100 N 4.4276 8.0785 116.2146 56.1808 38.3136 177.4513 101 L 3.9823 8.0512 120.4148 57.8840 41.6742 179.6419 102 R 3.8963 8.2099 118.1883 59.2594 29.8702 178.7858 103 E 3.8534 8.0968 118.4390 59.2398 29.6068 178.7057 104 A 2.8099 7.9577 121.0527 54.7716 18.4210 179.6187 105 I 3.7043 8.0303 118.7839 64.4957 36.9518 178.9004 106 G 3.5990 7.6041 105.1784 47.8371 0.0000 174.9065 107 Y 4.0903 7.6388 121.6101 60.3186 38.8858 177.3033 108 A 3.8070 8.1636 122.0369 55.2865 18.3814 179.0191 109 D 4.0688 7.8831 116.3581 57.4521 41.1137 178.5177 110 S 4.1771 7.5292 112.7698 60.0622 63.2902 175.6689 111 V 4.0185 6.8575 113.8777 60.7554 31.6527 175.6211 112 H 2.8039 7.1530 114.2922 56.5987 27.0234 176.4655 113 D 4.5543 7.4176 121.2067 53.5809 37.5657 176.2472 114 Y 4.3237 7.5023 121.4790 60.6349 38.4415 178.1943 115 V 3.7252 7.8928 119.9637 64.7228 31.7186 178.3541 116 S 4.1658 8.3595 115.8139 61.4463 62.6602 176.6871 117 R 3.8761 7.9921 121.2162 59.3871 29.9609 177.9594 118 D 4.3004 8.4224 118.0977 57.6183 41.2904 177.6685 119 M 3.9582 8.1706 118.6750 59.2628 32.0982 178.1772 120 M 4.1558 8.2506 118.6518 58.3828 32.0780 178.8585 121 I 3.7253 8.2867 120.5869 64.2430 37.2448 178.2912 122 E 3.9602 8.1114 119.2733 59.4887 29.2289 179.4762 123 I 3.5473 7.6241 119.7305 64.0905 37.1101 178.1542 124 L 3.9183 8.1528 121.4537 58.1755 41.9383 178.7915 125 R 3.8923 8.0562 118.5425 59.8233 30.0422 178.1226 126 D 4.3429 8.0896 118.3653 57.4151 40.7190 178.7219 127 E 3.9484 8.3539 119.3126 59.4328 29.3976 179.1539 128 E 4.1391 8.8003 119.2452 59.1853 29.4504 179.5670 129 G 3.7239 8.0631 105.7701 48.2847 0.0000 175.3702 130 H 4.4254 8.0889 118.8814 58.5460 28.6853 177.8073 131 I 3.8106 8.2750 121.9800 64.5640 37.0243 177.6652 132 D 4.3959 8.4649 118.9735 57.2531 40.9916 178.2681 133 W 4.1383 8.3669 128.4845 60.5082 30.8208 177.7410 134 L 3.7528 8.5609 119.2300 57.9216 41.1425 179.3965 135 E 3.9290 8.4976 118.6400 59.7134 29.3213 179.5904 136 T 3.7838 7.8483 115.5438 66.6401 68.5202 176.4174 137 E 3.7574 7.6809 120.3236 59.4643 29.2069 179.5462 138 L 3.7740 7.7206 118.7712 57.7806 41.5551 179.3967 139 D 4.2911 8.1416 118.9240 57.1076 40.6837 178.6075 140 L 3.9799 8.1202 119.9340 57.9056 41.6984 179.5098 141 I 3.4732 7.4832 119.5435 64.5033 36.7496 178.5565 142 Q 3.9362 7.4097 117.3672 58.8877 28.6340 178.6366 143 K 4.1395 8.2028 119.0763 58.9811 32.2954 178.5249 144 M 4.3579 8.4441 114.8950 54.0512 32.4536 177.1640 145 G 4.1152 7.5740 105.8307 45.9759 0.0000 174.3252 146 L 3.9586 8.4766 121.7804 58.0994 42.1360 179.4013 147 Q 3.9969 8.0735 117.3316 59.3248 28.8431 178.6616 148 N 4.3752 8.1489 116.7974 56.2726 38.3642 176.7159 149 Y 3.9597 7.9884 120.2156 60.5873 39.1503 177.7784 150 L 4.0710 8.4024 120.2548 58.0532 41.6802 179.1873 151 Q 3.9181 8.1087 119.0378 59.2595 28.6804 177.9657 152 A 4.1618 7.5673 119.1042 53.4043 18.7074 178.2146 153 Q 4.3172 7.8614 116.2086 55.3908 29.1469 177.5847 154 I 3.8360 7.3340 121.9005 63.9873 37.3695 176.6723 155 R 4.5928 7.5235 117.2588 54.1003 31.7893 176.0445 156 E 4.1348 8.3682 118.7320 55.9506 30.5164 175.8705 157 E 4.0737 8.5193 122.0062 55.3718 30.4284 176.5871 *158 G 3.7286 8.6061 114.1820 45.8873 0.0000 172.1569 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 M 8.16 4.20 0.00 1.46 1.78 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 2 K 8.50 4.03 0.00 1.71 1.72 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.47 7.81 3 G 8.68 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.48 4.56 0.00 2.77 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.91 3.87 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 1.18 0.00 0.00 6 K 8.18 3.86 0.00 1.72 1.90 0.00 1.40 0.00 0.00 0.92 0.00 0.00 2.62 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.86 1.06 7.81 7 V 8.54 3.91 2.37 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 1.12 0.00 0.00 1.16 0.00 0.00 8 I 7.72 3.74 2.05 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 1.55 0.67 0.92 0.00 0.00 9 N 8.26 4.23 0.00 2.59 2.67 0.00 0.00 7.06 7.10 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 10 Y 7.96 4.08 0.00 3.21 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 11 L 8.62 3.92 0.00 2.00 1.77 1.10 0.81 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 12 N 8.45 4.39 0.00 2.89 2.81 0.00 0.00 6.66 8.97 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 13 K 8.26 3.87 0.00 1.77 1.95 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.44 1.45 7.81 14 L 8.23 3.83 0.00 0.91 1.20 0.95 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.91 4.02 0.00 1.67 1.83 1.03 1.14 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 16 G 8.16 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.01 4.34 0.00 2.98 2.92 0.00 0.00 7.08 7.82 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 18 E 8.29 4.08 0.00 2.26 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.90 0.00 19 L 8.22 4.00 0.00 1.93 1.73 0.95 1.15 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 20 V 7.78 3.59 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 1.10 0.00 0.00 0.94 0.00 0.00 21 A 8.23 3.88 1.47 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 22 I 8.38 3.76 2.11 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.76 0.91 0.00 0.00 23 N 7.91 4.38 0.00 2.85 2.86 0.00 0.00 6.74 7.95 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 24 Q 8.33 3.84 0.00 2.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.22 2.11 0.00 25 Y 8.48 4.34 0.00 3.23 2.86 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 26 F 8.58 3.82 0.00 3.42 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 27 L 8.27 3.97 0.00 1.97 1.60 0.90 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.25 3.83 0.00 3.53 3.19 0.00 5.72 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 29 A 8.27 4.17 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 30 R 7.83 3.91 0.00 1.80 1.93 0.00 3.33 0.00 0.00 3.12 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.82 0.00 31 M 7.83 3.60 0.00 1.36 1.72 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.33 0.00 32 F 7.71 4.58 0.00 3.32 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 33 K 8.14 3.94 0.00 2.01 1.95 0.00 1.56 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 34 N 8.06 4.29 0.00 2.73 2.77 0.00 0.00 7.32 7.57 0.00 0.00 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 F 8.23 4.77 0.00 3.33 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 36 G 8.11 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 37 L 8.07 4.48 0.00 2.12 1.63 1.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.95 3.82 0.00 2.04 1.83 0.00 1.59 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.57 7.81 39 R 8.28 3.94 0.00 2.11 1.99 0.00 3.49 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 40 L 7.92 4.12 0.00 1.69 1.02 1.09 0.21 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 41 N 8.18 4.57 0.00 3.10 3.01 0.00 0.00 7.24 8.49 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 42 D 8.06 4.31 0.00 2.88 2.74 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 43 V 7.60 3.36 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 -0.56 0.00 0.00 0.73 0.00 0.00 44 E 8.39 3.84 0.00 2.31 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 2.60 3.15 0.00 45 Y 8.18 3.82 0.00 2.92 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 46 H 8.31 4.20 0.00 3.23 3.23 0.00 5.66 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.51 3.76 0.00 1.53 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 1.85 0.00 48 S 7.85 4.08 0.00 3.90 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 49 I 7.33 3.56 1.68 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.58 0.84 0.00 0.00 50 D 7.48 4.20 0.00 2.88 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.13 4.08 0.00 2.24 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 0.00 2.67 2.82 0.00 52 M 8.00 4.06 0.00 2.05 2.24 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.56 0.00 53 K 8.08 3.88 0.00 1.90 1.83 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.64 7.81 54 H 8.01 4.11 0.00 3.56 3.34 0.00 5.65 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 55 A 8.35 4.23 1.47 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 56 D 8.39 4.31 0.00 2.88 2.86 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 57 R 7.88 3.89 0.00 1.82 1.78 0.00 3.14 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 58 Y 7.92 4.31 0.00 3.23 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 59 I 8.29 3.78 2.05 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.77 0.95 0.00 0.00 60 E 8.44 4.07 0.00 2.04 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 2.35 2.62 0.00 61 R 8.17 4.04 0.00 2.14 2.23 0.00 3.35 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.87 0.00 62 I 8.53 3.77 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.75 0.97 0.00 0.00 63 L 8.05 4.03 0.00 2.11 1.80 0.95 1.10 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 64 F 8.18 4.40 0.00 3.01 3.34 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 65 L 8.16 4.54 0.00 1.80 1.61 1.03 0.55 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 66 E 8.00 3.87 0.00 2.07 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 2.16 2.27 0.00 67 G 8.15 3.92 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 0.00 0.00 0.00 68 L 8.00 4.52 0.00 1.60 1.63 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.38 0.00 2.06 2.03 0.00 3.66 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 2.06 2.12 0.00 70 N 9.43 4.72 0.00 2.59 2.80 0.00 0.00 7.08 7.73 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 71 L 8.34 4.64 0.00 1.63 1.64 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.60 4.15 0.00 1.97 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.49 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 73 D 8.05 4.66 0.00 2.68 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.29 4.59 0.00 1.52 1.50 0.91 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.43 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 0.00 0.00 0.00 76 K 8.33 4.09 0.00 1.72 1.73 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.45 7.81 77 L 8.37 4.10 0.00 1.64 1.55 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.85 4.83 0.00 2.62 2.68 0.00 0.00 7.18 7.33 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 79 I 8.58 3.93 1.88 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 1.34 0.94 0.93 0.00 0.00 80 G 8.13 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 0.00 0.00 0.00 0.00 81 E 8.67 4.59 0.00 1.98 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 2.25 2.29 0.00 82 D 7.68 5.09 0.00 2.84 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 83 V 8.44 3.97 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 1.26 0.00 0.00 1.22 0.00 0.00 84 E 8.21 3.84 0.00 2.01 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 2.32 2.26 0.00 85 E 8.40 3.96 0.00 2.28 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 2.33 2.34 0.00 86 M 8.28 4.08 0.00 2.21 1.79 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.91 0.00 87 L 8.44 4.14 0.00 2.02 1.77 1.26 0.63 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 88 R 8.42 3.90 0.00 2.11 1.93 0.00 3.09 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 89 S 8.13 4.09 0.00 4.07 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 90 D 8.16 4.21 0.00 3.11 2.74 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 91 L 8.21 3.97 0.00 1.82 1.89 0.98 0.89 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 92 A 8.25 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 L 7.91 3.94 0.00 1.86 1.81 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.25 4.06 0.00 2.47 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 0.00 2.50 2.53 0.00 95 L 8.23 4.03 0.00 2.08 1.73 0.96 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.34 4.53 0.00 2.85 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 97 G 8.33 3.64 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 0.00 0.00 0.00 98 A 8.44 4.07 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.98 3.85 0.00 2.06 2.02 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.51 7.81 100 N 8.08 4.43 0.00 2.88 2.92 0.00 0.00 7.11 6.02 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 0.00 101 L 8.05 3.98 0.00 2.02 1.74 0.98 0.82 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 0.00 102 R 8.21 3.90 0.00 1.98 1.99 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.97 0.00 103 E 8.10 3.85 0.00 2.19 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 2.35 2.38 0.00 104 A 7.96 2.81 1.08 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 0.00 0.00 105 I 8.03 3.70 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.11 0.91 0.00 0.00 106 G 7.60 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 7.64 4.09 0.00 3.07 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 0.00 108 A 8.16 3.81 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 0.00 109 D 7.88 4.07 0.00 2.86 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 0.00 110 S 7.53 4.18 0.00 3.97 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 0.00 111 V 6.86 4.02 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 0.54 0.00 0.00 0.66 0.00 0.00 112 H 7.15 2.80 0.00 3.15 3.31 0.00 5.84 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 0.00 113 D 7.42 4.55 0.00 2.64 2.47 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 0.00 114 Y 7.50 4.32 0.00 3.09 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 0.00 115 V 7.89 3.73 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 0.91 0.00 0.00 0.98 0.00 0.00 116 S 8.36 4.17 0.00 4.19 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 0.00 117 R 7.99 3.88 0.00 1.91 2.21 0.00 3.32 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 118 D 8.42 4.30 0.00 2.98 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 M 8.17 3.96 0.00 2.26 2.04 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 120 M 8.25 4.16 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.81 0.00 121 I 8.29 3.73 2.00 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 1.53 0.83 0.91 0.00 0.00 122 E 8.11 3.96 0.00 2.17 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 2.32 2.34 0.00 123 I 7.62 3.55 1.92 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.56 0.74 0.00 0.00 124 L 8.15 3.92 0.00 1.84 1.85 0.95 1.16 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 0.00 125 R 8.06 3.89 0.00 2.00 2.15 0.00 3.15 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 126 D 8.09 4.34 0.00 2.98 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 0.00 127 E 8.35 3.95 0.00 2.13 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 2.62 2.55 0.00 128 E 8.80 4.14 0.00 2.10 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 2.36 2.36 0.00 129 G 8.06 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 0.00 130 H 8.09 4.43 0.00 3.54 3.56 0.00 5.66 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 0.00 131 I 8.27 3.81 2.10 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 1.50 0.93 0.97 0.00 0.00 132 D 8.46 4.40 0.00 2.90 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 0.00 133 W 8.37 4.14 0.00 3.54 3.49 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 0.00 134 L 8.56 3.75 0.00 2.10 1.76 1.36 1.29 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 0.00 135 E 8.50 3.93 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 136 T 7.85 3.78 4.21 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 0.00 0.00 0.00 1.16 0.00 0.00 137 E 7.68 3.76 0.00 1.56 1.64 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 1.47 1.47 0.00 138 L 7.72 3.77 0.00 1.73 1.61 0.88 0.80 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 0.00 139 D 8.14 4.29 0.00 2.76 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 0.00 140 L 8.12 3.98 0.00 1.87 1.85 0.95 0.82 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 0.00 141 I 7.48 3.47 1.72 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.02 0.72 0.00 0.00 142 Q 7.41 3.94 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.97 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 143 K 8.20 4.14 0.00 1.68 1.86 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.61 7.81 144 M 8.44 4.36 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.84 0.00 145 G 7.57 4.12 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 0.00 146 L 8.48 3.96 0.00 1.75 1.68 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 147 Q 8.07 4.00 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 148 N 8.15 4.38 0.00 2.97 2.88 0.00 0.00 6.68 7.48 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 0.00 149 Y 7.99 3.96 0.00 3.01 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 0.00 150 L 8.40 4.07 0.00 2.03 1.70 1.07 0.75 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 0.00 151 Q 8.11 3.92 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 152 A 7.57 4.16 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 7.86 4.32 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.76 0.00 0.00 0.00 0.00 0.00 1.97 2.14 0.00 154 I 7.33 3.84 1.97 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 1.30 0.44 0.90 0.00 0.00 155 R 7.52 4.59 0.00 1.77 1.83 0.00 3.19 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 156 E 8.37 4.13 0.00 2.08 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 2.26 2.28 0.00 157 E 8.52 4.07 0.00 1.95 1.90 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 2.27 2.30 0.00 *158 G 8.61 3.73 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.