NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2337 8.1476 120.2502 54.6473 32.7220 174.6244 2 K 4.3611 8.3332 126.5838 56.6244 33.1524 176.4516 3 G 3.8512 8.6841 111.3435 45.1371 0.0000 167.5754 4 D 4.3962 8.5652 131.0760 54.1442 41.1638 174.4359 5 T 3.8305 8.5958 123.8071 66.7807 68.5478 176.1534 6 K 3.7142 8.1898 120.8128 59.5332 32.0476 178.7258 7 V 3.8914 8.1265 117.9374 66.2802 31.6466 178.1866 8 I 3.7920 7.7929 119.2557 64.0113 36.8162 178.2727 9 N 4.2957 8.1145 117.8585 56.2929 38.3367 176.9960 10 Y 4.0744 7.9027 118.0855 61.0509 37.9425 178.5955 11 L 3.8613 8.2346 120.0012 58.0366 41.7758 179.4796 12 N 4.2958 8.0749 116.0960 55.9301 38.4048 177.5303 13 K 3.9053 7.9530 121.2876 59.3635 32.2959 178.9551 14 L 4.0180 8.0418 119.6824 57.5545 41.3864 179.1877 15 L 3.9671 7.6649 120.4726 58.0178 42.1339 179.2505 16 G 3.5869 7.9472 105.5962 47.8909 0.0000 175.2144 17 N 4.3508 8.0327 118.9980 56.1696 38.5255 177.3227 18 E 4.0602 8.1192 119.7386 59.4852 29.4451 179.2670 19 L 4.0226 8.1497 119.3494 57.9242 41.6269 180.1047 20 V 3.6201 7.8117 118.4180 64.6748 31.3736 178.3548 21 A 3.8562 7.8995 121.7427 54.7158 18.2279 179.6327 22 I 3.8417 8.0709 111.8400 64.2973 37.7368 178.3424 23 N 4.3724 7.9388 118.3459 56.0782 38.4314 177.2710 24 Q 3.8816 8.2692 121.1037 59.3764 29.1478 177.7977 25 Y 4.4351 8.0798 117.8887 60.9795 37.9276 178.1390 26 F 3.9921 8.5904 121.8714 60.9428 39.4610 177.1737 27 L 3.9874 8.0514 119.8851 58.3778 41.8666 178.4986 28 H 3.8051 8.2560 115.9411 58.7024 28.5756 177.2691 29 A 4.1683 8.0218 122.3660 55.7235 18.2134 180.0880 30 R 3.7655 7.6830 115.6872 59.0643 30.0960 179.3837 31 M 3.4477 7.6835 119.1085 57.9201 31.8234 178.6165 32 F 4.3724 7.4957 117.9126 60.4671 39.1885 177.2569 33 K 3.7945 8.2709 119.5743 59.9162 31.6903 177.7948 34 N 4.2569 7.6567 115.4068 56.7586 38.8415 176.1578 35 W 4.7948 7.6968 117.5255 57.6576 29.2575 177.2346 36 G 4.0739 8.8992 108.5618 45.4425 0.0000 173.6750 37 L 4.6387 7.9093 121.9218 52.9106 39.4500 177.0364 38 K 3.9371 8.1179 122.6780 59.3346 32.4838 178.3382 39 R 3.8580 8.2894 119.1694 59.4925 30.0148 178.6465 40 L 4.0517 7.7566 118.3318 57.4907 41.6003 178.8495 41 N 4.4506 8.1822 116.9860 56.8000 38.8328 176.5914 42 D 4.3521 8.2246 120.4481 57.4081 41.0494 179.1426 43 V 3.3209 7.6295 118.3555 66.0938 31.4323 177.8879 44 E 3.7981 8.1103 118.2618 59.4247 29.3892 178.9636 45 Y 3.8543 8.0980 119.5908 61.0193 38.9368 177.6379 46 H 4.0600 7.9324 119.0975 59.0339 29.7933 177.0809 47 E 3.6835 7.5976 120.2901 58.9633 29.0441 179.1178 48 S 4.0933 7.4027 113.2848 61.4483 62.4883 176.3382 49 I 3.6179 7.2283 122.1168 64.1273 36.6455 178.1971 50 D 4.1452 7.8362 119.7993 57.4474 40.6209 178.5265 51 E 4.0242 8.2587 119.1607 59.8592 29.3272 179.3643 52 M 4.0432 8.1693 118.5866 58.4466 31.9870 178.9484 53 K 4.0477 7.9230 118.3979 59.2416 32.2689 179.1485 54 H 4.1306 8.3503 116.7593 58.7914 28.6364 177.4526 55 A 4.2281 8.2836 122.6516 55.5153 18.2523 179.1583 56 D 4.3034 7.9371 116.3367 57.4271 41.1777 178.6853 57 R 3.8378 7.7569 118.2122 59.4252 30.0437 178.6263 58 Y 4.2683 7.5317 115.8574 61.2507 38.0131 178.4680 59 I 3.7993 8.0628 120.7831 64.7427 37.2214 178.3807 60 E 4.0702 8.2676 119.2209 59.1625 29.3202 179.3670 61 R 4.0020 8.1159 118.8780 59.5593 30.2282 178.5936 62 I 3.8002 8.3163 120.0607 64.5193 36.9715 178.4732 63 L 4.1120 8.0027 119.6174 57.5335 41.1834 179.3720 64 F 4.2854 8.1144 119.8301 61.3590 39.8064 176.9150 65 L 4.5679 7.9354 118.1452 54.5657 41.5066 176.6000 66 E 3.4985 7.8668 117.3269 57.8415 26.6399 173.4386 67 G 4.1439 8.3741 107.0470 43.4806 0.0000 172.2346 68 L 4.6287 8.0714 120.2598 52.1100 43.6053 174.3179 69 P 4.3965 0.0000 0.0000 62.7836 31.8202 175.6948 70 N 4.7213 9.2726 121.5123 52.4922 38.6487 173.9972 71 L 4.6901 8.3703 124.7553 54.5533 42.3953 177.3405 72 Q 4.2233 8.3720 122.2526 57.3363 29.7323 175.6684 73 D 4.6703 8.1004 117.7421 52.8941 41.7133 175.2165 74 L 4.6099 8.3537 126.0113 53.0877 44.1137 176.1833 75 G 3.9685 8.2043 113.7566 43.9729 0.0000 172.7897 76 K 4.1429 8.3396 118.8667 55.9040 32.5249 176.7239 77 L 4.3627 8.3923 124.0291 53.2964 42.7364 175.8264 78 N 4.7040 8.3897 122.7818 51.7526 38.1368 174.3741 79 I 3.7955 7.7424 126.0458 61.9430 37.9071 177.3167 80 G 4.2901 8.2225 108.2043 45.7649 0.0000 172.8329 81 E 4.7171 8.7829 119.9240 55.9482 30.8601 176.3599 82 D 4.9826 7.7981 118.9818 50.4338 43.8188 176.2956 83 V 4.0691 8.6396 121.6162 65.6770 31.0228 178.2083 84 E 3.8651 8.2270 119.3025 58.6995 29.5437 178.3437 85 E 3.9705 8.5142 119.4323 59.4594 29.7958 178.4934 86 M 4.2202 8.4788 119.1429 58.6761 32.0727 178.8049 87 L 4.2125 8.4256 119.2435 58.0149 41.7819 179.9067 88 R 4.0238 7.9058 118.0731 59.0244 29.9466 179.3424 89 S 4.1275 8.0540 114.7282 61.7709 62.9175 176.1775 90 D 4.2618 8.0961 121.5491 57.3921 40.5645 178.9331 91 L 3.9838 7.9997 120.3810 58.1203 42.1868 178.7898 92 A 3.9998 8.0984 120.7644 55.0316 18.3023 179.3632 93 L 3.8854 8.0088 118.7356 58.4203 42.2295 178.9960 94 E 4.0614 8.1462 118.4675 59.4506 29.4248 179.4594 95 L 4.0387 8.1394 118.9646 57.8654 41.6207 179.2612 96 D 4.4714 8.2916 118.9471 57.3152 40.7594 179.0798 97 G 3.6274 8.1854 105.9491 47.8381 0.0000 175.4120 98 A 4.0357 8.1459 123.4419 54.7734 18.0266 179.5881 99 K 3.8921 7.9444 117.5406 59.8588 32.2741 178.8577 100 N 4.4029 7.9763 116.4681 56.1114 38.3538 177.3576 101 L 3.9881 8.0167 120.5369 58.0254 41.8388 179.8460 102 R 3.8901 8.0493 117.8855 59.0324 29.8146 178.7815 103 E 3.8373 7.8963 118.6794 59.2546 29.7080 178.8128 104 A 2.8834 7.6227 120.7540 54.8155 17.8289 179.7085 105 I 3.7827 8.0027 118.7474 64.3624 37.0619 178.9536 106 G 3.6030 7.9383 106.2683 47.8032 0.0000 175.2617 107 Y 3.9317 7.7615 121.8855 60.3817 38.7832 177.6785 108 A 3.8823 7.9573 121.7095 55.1236 18.3272 179.1354 109 D 4.1432 7.6944 115.5589 57.6092 41.1370 178.4234 110 S 3.9652 7.3303 114.2155 61.4573 62.9706 176.5241 111 V 3.6509 6.9725 118.0811 61.6549 31.5629 176.3386 112 H 2.9856 7.2747 115.6641 56.7977 26.7824 176.1097 113 D 4.4920 7.5631 122.1202 53.4444 38.6245 176.1002 114 Y 4.3605 7.4924 121.8661 60.3586 38.3862 177.4720 115 V 3.7158 7.8728 119.0420 65.8449 31.8219 178.1715 116 S 4.2371 8.3337 115.0680 61.4122 62.8393 176.7193 117 R 4.0699 8.1179 118.6861 58.7508 29.0904 178.5679 118 D 4.2665 8.2146 119.3393 57.5258 41.3129 177.6045 119 M 3.9903 7.9471 118.6759 59.1352 32.1217 178.0938 120 M 4.1286 8.0120 118.4054 58.5327 32.1070 178.8835 121 I 3.7518 7.7615 119.4459 63.9991 37.0531 178.4603 122 E 3.9233 7.9334 119.8835 59.5906 29.3904 179.3979 123 I 3.6156 7.6619 119.8305 64.1954 37.0759 178.3385 124 L 4.0010 8.2752 121.6261 58.0076 41.6838 178.9518 125 R 3.9244 7.8343 118.0519 59.3349 30.2304 178.0641 126 D 4.4513 7.8028 118.9934 57.2703 40.8137 178.4156 127 E 3.9345 8.1984 119.0296 59.6170 29.4941 179.3529 128 E 4.2124 8.4670 118.1313 58.7874 29.2641 179.4324 129 G 3.7346 7.9662 106.1592 47.5686 0.0000 175.7920 130 H 4.5728 7.9961 118.0377 58.8640 28.8367 177.7189 131 I 3.8521 8.3510 122.1673 64.4230 36.9373 178.0211 132 D 4.3645 8.1176 118.6531 57.0231 41.0826 178.0990 133 W 4.1687 8.1806 128.9129 60.4268 30.7111 177.9878 134 L 3.6338 8.1477 118.7789 57.7603 40.9775 179.2658 135 E 3.9162 8.1649 118.4669 59.7695 29.5333 179.6423 136 T 3.8286 7.8935 115.5699 66.5362 68.4403 176.5187 137 E 3.7989 7.7633 120.3860 59.4957 29.4093 179.5358 138 L 3.8220 7.7857 118.7151 57.7044 41.5784 179.2977 139 D 4.4417 7.7610 119.0097 56.8602 40.8067 178.7321 140 L 4.0454 7.7017 119.3172 57.8144 41.6111 179.5680 141 I 3.4962 7.1844 119.4326 64.1348 36.6906 178.3040 142 Q 3.8684 7.2141 118.0683 59.1256 28.9914 178.1069 143 K 4.1581 8.2508 118.8497 58.7867 32.3908 178.3754 144 M 4.3981 8.5473 114.9512 54.1871 32.5189 177.2936 145 G 4.0526 7.5097 105.5810 45.6218 0.0000 174.3957 146 L 4.0266 8.3522 120.6096 58.1360 42.1305 179.3608 147 Q 4.1012 8.0230 117.6267 58.9931 28.7443 178.2866 148 N 4.3854 8.1123 117.1637 56.2813 38.4820 176.6846 149 Y 3.9721 7.7702 119.8074 60.6496 39.1922 177.8855 150 L 4.1083 8.5704 120.2800 57.9180 41.9319 179.3103 151 Q 3.9884 8.2529 119.2153 58.8635 28.7477 177.3654 152 A 4.2206 7.6760 118.9137 53.0295 18.6088 178.0354 153 Q 4.4119 7.7200 116.5950 55.5793 30.1214 177.0729 154 I 4.1687 7.0656 110.9450 61.6996 37.7773 176.2370 155 R 4.6318 7.4348 119.9478 54.2770 33.7856 174.6092 156 E 4.1444 8.5921 120.3938 55.8407 30.6586 177.2354 157 E 4.0895 8.2979 121.4722 55.5573 31.5080 176.8413 *158 G 3.7265 8.6142 107.8199 46.0881 0.0000 172.6669 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 8.15 4.23 0.00 1.24 1.76 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 2 K 8.33 4.36 0.00 1.92 1.88 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.46 7.81 3 G 8.68 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 0.00 0.00 0.00 4 D 8.57 4.40 0.00 2.89 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.60 3.83 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 1.24 0.00 0.00 6 K 8.19 3.71 0.00 1.98 1.73 0.00 0.92 0.00 0.00 1.17 0.00 0.00 2.39 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.30 1.14 7.81 7 V 8.13 3.89 2.35 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 1.22 0.00 0.00 1.24 0.00 0.00 8 I 7.79 3.79 2.00 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 1.56 1.16 0.92 0.00 0.00 9 N 8.11 4.30 0.00 2.77 2.61 0.00 0.00 6.85 6.83 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 10 Y 7.90 4.07 0.00 3.19 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 8.23 3.86 0.00 2.05 1.75 1.09 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.07 4.30 0.00 2.89 2.81 0.00 0.00 6.69 6.73 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 13 K 7.95 3.91 0.00 1.78 2.02 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 14 L 8.04 4.02 0.00 1.55 0.86 0.96 0.64 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 15 L 7.66 3.97 0.00 1.70 1.76 1.09 0.91 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 16 G 7.95 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.03 4.35 0.00 3.03 2.91 0.00 0.00 7.06 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 8.12 4.06 0.00 2.32 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 2.75 2.85 0.00 19 L 8.15 4.02 0.00 1.85 1.73 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.81 3.62 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 0.85 0.00 0.00 0.90 0.00 0.00 21 A 7.90 3.86 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 22 I 8.07 3.84 1.92 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 1.53 1.00 1.00 0.00 0.00 23 N 7.94 4.37 0.00 2.96 2.91 0.00 0.00 6.68 7.18 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 24 Q 8.27 3.88 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.00 2.18 0.00 25 Y 8.08 4.44 0.00 3.26 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 26 F 8.59 3.99 0.00 3.35 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 27 L 8.05 3.99 0.00 1.88 1.63 0.90 0.95 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 28 H 8.26 3.81 0.00 3.59 3.28 0.00 5.89 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 8.02 4.17 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 30 R 7.68 3.77 0.00 1.75 1.89 0.00 3.17 0.00 0.00 2.96 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.74 0.00 31 M 7.68 3.45 0.00 0.85 1.51 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.22 0.00 32 F 7.50 4.37 0.00 3.25 3.22 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 0.00 33 K 8.27 3.79 0.00 2.09 1.91 0.00 1.66 0.00 0.00 1.50 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.43 7.81 34 N 7.66 4.26 0.00 2.70 2.64 0.00 0.00 7.38 8.11 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 35 W 7.70 4.79 0.00 3.77 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 36 G 8.90 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.91 4.64 0.00 2.14 1.67 1.04 1.19 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 8.12 3.94 0.00 1.79 1.85 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.53 1.51 7.81 39 R 8.29 3.86 0.00 2.02 2.07 0.00 3.06 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 40 L 7.76 4.05 0.00 1.50 0.90 1.03 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.18 4.45 0.00 3.16 3.07 0.00 0.00 7.17 8.35 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 42 D 8.22 4.35 0.00 2.92 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 43 V 7.63 3.32 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 -0.69 0.00 0.00 0.78 0.00 0.00 44 E 8.11 3.80 0.00 2.34 2.36 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 2.66 3.15 0.00 45 Y 8.10 3.85 0.00 3.01 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 46 H 7.93 4.06 0.00 3.20 3.16 0.00 5.83 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.60 3.68 0.00 1.16 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 1.82 1.78 0.00 48 S 7.40 4.09 0.00 4.00 3.97 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 0.00 0.00 0.00 49 I 7.23 3.62 1.87 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.63 0.85 0.00 0.00 50 D 7.84 4.15 0.00 2.71 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 51 E 8.26 4.02 0.00 2.19 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 2.71 2.82 0.00 52 M 8.17 4.04 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 53 K 7.92 4.05 0.00 1.92 1.80 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.61 7.81 54 H 8.35 4.13 0.00 3.46 3.47 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 8.28 4.23 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 56 D 7.94 4.30 0.00 2.75 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 57 R 7.76 3.84 0.00 2.00 1.64 0.00 3.12 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 1.54 1.60 0.00 58 Y 7.53 4.27 0.00 3.23 2.97 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 0.00 0.00 0.00 59 I 8.06 3.80 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.49 0.95 0.00 0.00 60 E 8.27 4.07 0.00 2.18 2.01 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 2.35 2.70 0.00 61 R 8.12 4.00 0.00 2.13 2.22 0.00 3.31 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.85 0.00 62 I 8.32 3.80 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.71 0.99 0.00 0.00 63 L 8.00 4.11 0.00 2.12 1.79 0.98 1.01 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 64 F 8.11 4.29 0.00 2.99 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 65 L 7.94 4.57 0.00 1.99 1.68 0.97 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.87 3.50 0.00 2.01 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 2.13 2.23 0.00 67 G 8.37 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 68 L 8.07 4.63 0.00 1.57 1.54 0.92 0.91 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 69 P 0.00 4.40 0.00 2.10 2.01 0.00 3.72 0.00 0.00 3.76 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 9.27 4.72 0.00 2.59 2.79 0.00 0.00 7.02 7.74 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 71 L 8.37 4.69 0.00 1.64 1.62 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.37 4.22 0.00 1.99 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 73 D 8.10 4.67 0.00 2.68 2.57 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 0.00 0.00 0.00 0.00 74 L 8.35 4.61 0.00 1.57 1.51 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.20 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.34 4.14 0.00 1.75 1.76 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.45 7.81 77 L 8.39 4.36 0.00 1.61 1.56 0.91 0.99 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 78 N 8.39 4.70 0.00 2.64 2.74 0.00 0.00 7.22 7.94 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 79 I 7.74 3.80 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.92 0.95 0.00 0.00 80 G 8.22 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.78 4.72 0.00 2.04 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 2.31 2.41 0.00 82 D 7.80 4.98 0.00 2.87 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 V 8.64 4.07 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 1.10 0.00 0.00 1.11 0.00 0.00 84 E 8.23 3.87 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 2.25 2.22 0.00 85 E 8.51 3.97 0.00 2.47 2.17 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 2.34 2.37 0.00 86 M 8.48 4.22 0.00 1.80 2.42 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.42 0.00 87 L 8.43 4.21 0.00 1.87 1.74 1.18 0.93 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 88 R 7.91 4.02 0.00 1.99 1.99 0.00 3.12 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 1.64 1.76 0.00 89 S 8.05 4.13 0.00 4.16 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 90 D 8.10 4.26 0.00 3.09 2.90 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 91 L 8.00 3.98 0.00 1.93 1.87 0.98 1.03 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 92 A 8.10 4.00 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 93 L 8.01 3.89 0.00 1.87 1.80 0.89 0.65 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 94 E 8.15 4.06 0.00 2.34 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 0.00 2.59 2.71 0.00 95 L 8.14 4.04 0.00 2.06 1.73 0.96 0.96 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 96 D 8.29 4.47 0.00 2.87 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 G 8.19 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 98 A 8.15 4.04 1.42 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 0.00 0.00 99 K 7.94 3.89 0.00 1.98 2.04 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.50 7.81 100 N 7.98 4.40 0.00 2.94 2.89 0.00 0.00 7.05 8.09 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 0.00 101 L 8.02 3.99 0.00 1.91 1.73 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.05 3.89 0.00 1.86 1.97 0.00 3.14 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.93 0.00 103 E 7.90 3.84 0.00 2.02 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 2.28 2.36 0.00 104 A 7.62 2.88 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.00 3.78 1.85 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 1.47 1.14 0.92 0.00 0.00 106 G 7.94 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 7.76 3.93 0.00 3.04 2.97 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 0.00 0.00 0.00 108 A 7.96 3.88 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 0.00 109 D 7.69 4.14 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 7.33 3.97 0.00 3.54 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 0.00 111 V 6.97 3.65 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 0.62 0.00 0.00 0.82 0.00 0.00 112 H 7.27 2.99 0.00 3.14 3.23 0.00 5.84 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.56 4.49 0.00 2.60 2.48 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 0.00 114 Y 7.49 4.36 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 7.87 3.72 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 1.09 0.00 0.00 0.99 0.00 0.00 116 S 8.33 4.24 0.00 4.10 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.12 4.07 0.00 2.14 2.33 0.00 2.91 0.00 0.00 3.15 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.93 0.00 118 D 8.21 4.27 0.00 3.00 2.90 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 0.00 119 M 7.95 3.99 0.00 2.29 2.03 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 120 M 8.01 4.13 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.81 0.00 121 I 7.76 3.75 2.01 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 0.92 0.00 0.00 122 E 7.93 3.92 0.00 2.21 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 2.54 0.00 123 I 7.66 3.62 1.93 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.86 0.74 0.00 0.00 124 L 8.28 4.00 0.00 1.85 1.82 0.94 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 125 R 7.83 3.92 0.00 2.04 2.12 0.00 3.32 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 126 D 7.80 4.45 0.00 2.97 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 0.00 127 E 8.20 3.93 0.00 2.14 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 2.52 2.55 0.00 128 E 8.47 4.21 0.00 2.26 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 2.48 0.00 129 G 7.97 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 0.00 130 H 8.00 4.57 0.00 3.65 3.63 0.00 5.65 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 0.00 131 I 8.35 3.85 2.09 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 1.50 0.83 0.97 0.00 0.00 132 D 8.12 4.36 0.00 2.96 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 0.00 133 W 8.18 4.17 0.00 3.44 3.44 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 0.00 134 L 8.15 3.63 0.00 1.86 1.73 1.18 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.16 3.92 0.00 2.17 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 2.65 0.00 136 T 7.89 3.83 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 0.00 137 E 7.76 3.80 0.00 1.57 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 7.79 3.82 0.00 1.66 1.62 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 139 D 7.76 4.44 0.00 2.83 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 7.70 4.05 0.00 2.08 1.85 0.94 0.69 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 0.00 141 I 7.18 3.50 1.54 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.06 0.67 0.00 0.00 142 Q 7.21 3.87 0.00 2.01 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.99 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 143 K 8.25 4.16 0.00 1.78 1.84 0.00 1.72 0.00 0.00 1.92 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.42 7.81 144 M 8.55 4.40 0.00 2.15 2.21 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 2.64 2.94 0.00 145 G 7.51 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 0.00 0.00 0.00 146 L 8.35 4.03 0.00 1.74 1.67 0.94 0.70 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 0.00 147 Q 8.02 4.10 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 148 N 8.11 4.39 0.00 2.95 2.89 0.00 0.00 6.77 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 7.77 3.97 0.00 3.10 3.21 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 0.00 150 L 8.57 4.11 0.00 2.01 1.71 1.14 0.76 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 0.00 151 Q 8.25 3.99 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 152 A 7.68 4.22 1.22 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 0.00 0.00 0.00 153 Q 7.72 4.41 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 154 I 7.07 4.17 1.88 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 1.21 0.97 0.00 0.00 155 R 7.43 4.63 0.00 1.73 1.79 0.00 3.19 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 156 E 8.59 4.14 0.00 2.08 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 2.25 2.34 0.00 157 E 8.30 4.09 0.00 1.95 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 2.29 2.26 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.