NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1846 8.1633 120.2795 54.6656 33.0958 174.1953 2 K 3.9840 8.5035 126.3810 56.2572 32.4362 175.7422 3 G 3.9422 8.6749 113.6384 44.8238 0.0000 171.9415 4 D 4.5374 8.4782 119.8058 54.4020 41.8686 176.8036 5 T 3.8767 8.9935 123.1782 66.9552 68.4917 176.3891 6 K 3.8325 8.1416 120.7858 59.2060 32.2484 178.7561 7 V 3.9133 8.6285 118.8678 66.2046 31.4226 177.8849 8 I 3.7377 7.8393 119.4096 64.7126 36.9236 178.1028 9 N 4.2775 8.2158 117.0193 56.4102 38.3047 177.0884 10 Y 4.0696 8.0699 118.1304 61.1129 38.0215 178.5257 11 L 3.8679 8.4670 120.2252 58.0674 41.6749 179.4815 12 N 4.3746 8.5469 116.6705 56.0045 38.4155 177.4794 13 K 3.8690 8.1192 121.2998 59.3613 32.3139 178.9449 14 L 3.8095 8.1473 119.6832 57.5035 41.3718 178.9246 15 L 3.9892 7.7566 120.8173 58.2634 42.0155 179.0946 16 G 3.7112 8.1685 105.5534 48.1368 0.0000 175.2021 17 N 4.3468 8.0304 118.9841 56.0594 38.5797 177.3876 18 E 4.0034 8.3460 119.9116 59.3918 29.4181 179.3735 19 L 4.0085 8.1782 119.2705 57.6374 41.5494 179.8262 20 V 3.4779 7.6355 117.4040 65.9875 31.5400 177.9333 21 A 3.2434 7.8838 120.4803 54.7900 18.0928 179.3468 22 I 3.5585 8.0023 118.6277 64.8685 37.2302 178.3884 23 N 4.3576 7.7881 116.9107 56.3495 38.3299 177.4195 24 Q 3.8798 8.1892 121.2485 59.4784 29.0824 177.9063 25 Y 4.6093 8.2945 118.2477 60.8556 37.9758 178.0685 26 F 3.8010 8.4650 121.8532 61.0498 39.5327 176.9653 27 L 3.9595 8.2027 120.0062 58.5446 41.8489 178.5049 28 H 3.8379 8.3455 116.0481 58.6758 28.5608 177.4252 29 A 4.0667 8.0743 122.5966 55.5114 18.1767 179.8476 30 R 3.8593 7.6217 115.2468 58.5069 30.1348 179.2364 31 M 3.4556 7.7372 119.2519 58.1762 31.8320 178.3693 32 F 4.6374 7.5937 118.0390 60.6709 39.0246 177.7121 33 K 3.9309 8.2427 119.0815 59.5634 31.8209 178.1132 34 N 4.2451 7.9568 116.1469 56.6484 38.9088 176.1235 35 W 4.8287 7.9565 116.7950 57.0266 29.0522 177.1058 36 G 3.9817 8.5158 108.4420 46.0245 0.0000 174.3213 37 L 4.7303 8.1842 122.7225 52.6465 40.4380 177.0126 38 K 3.8669 8.1470 123.6875 59.6304 32.6116 177.6203 39 R 3.8955 8.1379 118.7933 59.4566 29.9042 178.5265 40 L 4.0491 7.7591 118.3849 57.5212 41.5643 178.6411 41 N 4.4373 8.3324 117.1057 56.8350 38.9097 176.5025 42 D 4.4008 8.2138 120.1405 57.4995 40.9594 179.0817 43 V 3.3691 7.6470 118.3678 65.9484 31.4753 177.6730 44 E 3.8554 8.5414 119.4713 59.3313 29.4836 178.1222 45 Y 3.9481 8.4200 120.0195 61.1085 38.9581 177.7796 46 H 4.0920 8.3945 116.7716 58.2534 28.7972 177.4537 47 E 3.8207 8.1429 121.8711 58.9759 29.4515 178.5601 48 S 4.2226 8.1787 113.3310 61.5634 62.4865 176.2004 49 I 3.5731 7.5770 122.4108 64.4479 36.7837 178.0844 50 D 4.2609 7.9412 119.5627 57.5205 40.5589 178.8235 51 E 4.0666 8.1919 118.6865 59.3168 29.3670 179.2817 52 M 4.0388 7.8653 119.0227 58.2511 31.9910 178.7707 53 K 3.9100 8.0900 118.6144 59.7690 32.2280 179.0806 54 H 4.0999 8.0476 116.1515 58.7819 28.6208 177.5996 55 A 4.2289 8.3644 122.8828 55.3504 18.1819 179.1109 56 D 4.3007 8.2886 116.4810 57.5898 41.3051 178.7236 57 R 3.8647 7.9327 118.4912 59.4162 30.0578 178.6631 58 Y 4.3181 7.8235 116.4001 61.1624 37.9184 178.5791 59 I 3.7581 8.2967 121.0978 64.6838 37.1916 178.3880 60 E 4.0438 8.3986 119.3043 59.2938 29.1644 179.4953 61 R 4.0275 8.2217 118.7788 59.5251 30.1522 178.5281 62 I 3.7645 8.4092 119.9872 64.4945 37.1234 178.4655 63 L 4.0032 8.1275 119.7020 57.7513 41.2547 179.2633 64 F 4.3451 8.4168 119.8368 61.2740 39.6823 176.4149 65 L 4.5190 8.1405 117.6773 53.9891 41.1762 177.3276 66 E 3.8520 7.9949 117.6436 57.2699 27.0652 174.5803 67 G 3.9343 7.9839 108.9411 44.1384 0.0000 173.6158 68 L 4.5353 8.0139 119.2251 51.9960 42.1139 175.0715 69 P 4.3610 0.0000 0.0000 62.5536 31.7646 175.9919 70 N 4.7064 9.6306 122.3252 52.4118 38.7379 173.9815 71 L 4.6082 8.2898 124.2096 54.5222 42.4764 177.5215 72 Q 4.0912 8.5109 122.0127 58.0327 29.3056 175.8269 73 D 4.6743 8.0767 117.3962 52.6286 41.9469 175.2364 74 L 4.5235 8.2903 125.7555 52.6934 43.7682 176.1861 75 G 3.8075 8.4620 115.3322 44.6820 0.0000 171.9974 76 K 4.0280 8.3067 120.6813 56.1411 32.4374 176.4927 77 L 4.2579 8.3023 126.2942 54.4698 42.3891 176.4824 78 N 4.8060 8.7748 120.1145 51.7061 39.1841 172.4925 79 I 4.2448 8.1186 124.3143 59.7484 38.1744 176.6451 80 G 4.0460 8.7659 114.6036 45.1540 0.0000 172.7764 81 E 4.7365 8.6041 117.6497 56.1906 31.0838 176.3890 82 D 4.9040 7.6990 117.9661 50.3090 44.0465 176.0472 83 V 4.0066 8.4219 118.9660 66.5413 31.3593 177.5202 84 E 3.8608 8.1932 118.1908 59.4055 29.5079 178.2216 85 E 3.9750 8.3985 118.8820 59.4441 29.6530 178.7553 86 M 4.0481 8.2462 118.7251 58.4240 32.0270 178.7312 87 L 4.1447 8.2109 119.1164 58.0095 41.7318 179.8217 88 R 3.9376 8.4160 118.3921 59.2397 29.9634 179.1510 89 S 4.1520 8.3401 113.0250 61.4080 62.3594 175.8359 90 D 4.6907 8.4397 121.7017 57.3651 40.5809 178.5007 91 L 3.9429 8.2346 120.5807 58.3109 42.1568 178.9351 92 A 4.0354 8.3347 120.8467 55.0175 18.2674 179.3938 93 L 3.9817 8.0963 118.9656 58.3643 42.1235 179.0919 94 E 4.1148 8.6251 118.8092 59.3700 29.4369 179.3109 95 L 4.0265 8.1664 119.0625 58.0237 41.8018 179.3201 96 D 4.5112 8.3725 118.9390 57.3552 40.6499 179.1816 97 G 3.6385 8.3542 106.0980 47.6344 0.0000 175.6961 98 A 4.0250 8.4734 123.5699 54.6237 18.4875 179.4495 99 K 3.8275 8.0216 118.1289 59.9540 32.3175 178.6977 100 N 4.3897 8.0846 116.3148 56.2671 38.4041 177.3079 101 L 4.0003 8.1652 120.4836 57.9692 41.7465 179.7829 102 R 3.9026 8.2402 118.0912 59.1755 30.0305 178.6781 103 E 3.8292 8.0228 118.2605 59.3194 29.6014 178.7598 104 A 2.8950 7.7127 120.6220 54.8199 18.3963 179.6365 105 I 3.7274 8.1238 118.9005 64.3659 36.9269 178.9131 106 G 3.5805 7.7637 105.5708 47.9675 0.0000 174.8946 107 Y 4.1296 7.9933 122.0488 60.1779 38.8768 177.3819 108 A 3.7942 8.2453 122.1590 55.2698 18.3861 179.0403 109 D 4.1259 7.8094 116.0510 57.4688 41.1300 178.5296 110 S 4.1682 7.4892 112.5456 60.1248 63.2420 175.6493 111 V 3.9904 6.8473 113.9696 60.7208 31.6344 175.5774 112 H 2.7771 7.0938 114.2662 56.6162 26.8976 176.4532 113 D 4.5211 7.2973 121.4017 53.6987 37.9628 176.1220 114 Y 4.3217 7.5037 121.3729 60.5617 38.4873 177.8195 115 V 3.7392 7.8849 113.2028 64.2429 31.7429 178.5093 116 S 4.1898 8.3383 114.9416 61.4907 62.5854 176.6040 117 R 3.8904 8.0261 121.3752 59.5597 29.7667 178.0542 118 D 4.3201 8.3462 117.8674 57.5638 41.2913 177.8237 119 M 4.0052 8.2199 118.7232 59.0221 32.1614 178.1811 120 M 4.1767 8.2425 118.8613 58.2859 32.0887 178.8444 121 I 3.7294 8.1759 120.5699 64.3012 37.2636 178.2105 122 E 3.9794 8.0074 119.2259 59.4898 29.2128 179.5385 123 I 3.5586 7.5657 119.2878 64.2098 37.0659 178.1811 124 L 3.9509 8.1645 121.4093 58.1177 41.9969 178.9805 125 R 3.9008 8.1497 118.6326 59.6287 30.1657 178.2704 126 D 4.4391 8.2057 118.6500 57.4168 40.7917 178.6901 127 E 4.1340 8.4580 119.3457 59.5122 29.4584 179.2374 128 E 4.2653 8.7569 119.2066 59.1862 29.4464 179.5746 129 G 3.6912 8.0909 105.5873 48.1210 0.0000 175.2886 130 H 4.4016 8.2105 120.3433 59.0248 29.8533 177.2560 131 I 3.6956 8.3265 122.1462 64.4804 36.9469 177.7706 132 D 4.3384 8.3695 118.7429 57.0751 40.9968 178.0593 133 W 4.1024 8.2677 128.7187 60.4798 30.7455 177.6501 134 L 3.7754 8.4074 119.0406 58.0235 41.1303 179.4055 135 E 3.9021 8.4493 118.5676 59.7221 29.3000 179.7074 136 T 3.7454 7.8904 115.5731 66.5489 68.5322 176.4965 137 E 3.6842 7.7317 120.5972 59.4187 29.0347 179.4647 138 L 3.7548 7.6840 118.7720 57.8563 41.5583 179.4151 139 D 4.3396 7.9707 118.7880 57.2913 40.6584 178.7588 140 L 3.9508 7.9706 119.7037 57.7491 41.5997 179.5807 141 I 3.3719 7.3731 119.7760 64.3636 36.7432 178.2817 142 Q 3.9177 7.3372 117.9007 58.9765 28.9542 177.8929 143 K 4.1463 8.0671 119.1836 58.6545 32.3171 178.2879 144 M 4.3822 8.3273 114.9693 53.9499 32.5197 177.2257 145 G 4.1074 7.5574 105.6864 45.9792 0.0000 174.3891 146 L 3.9539 8.4190 121.6564 58.0267 42.1856 179.2639 147 Q 3.9731 8.0994 117.4609 59.3523 28.7338 178.7485 148 N 4.3493 8.1368 116.6941 56.3159 38.3760 176.6766 149 Y 3.9247 7.9127 120.0837 60.6262 39.1517 177.8284 150 L 4.0357 8.4521 120.1861 57.9621 41.6486 179.2011 151 Q 3.8843 8.1059 119.1072 59.2085 28.7245 177.9874 152 A 4.0991 7.7559 119.5073 53.6920 18.6877 178.3252 153 Q 4.2270 7.8881 116.2882 55.9391 29.1956 177.3200 154 I 4.1447 7.3243 112.6095 61.5831 38.2320 176.1801 155 R 4.6598 7.5523 119.6600 53.8304 32.4426 175.4978 156 E 4.2450 8.5643 119.3872 55.9776 30.5749 175.6205 157 E 4.4962 8.4189 117.7911 54.3945 31.7155 176.2470 *158 G 3.7097 8.5929 110.1455 45.8776 0.0000 172.3663 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 4.18 0.00 1.41 1.79 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 2 K 8.50 3.98 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 2.88 0.00 0.00 0.00 0.00 1.39 1.46 7.81 3 G 8.67 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 4.54 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 8.99 3.88 4.24 0.00 0.00 0.00 0.00 0.00 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 8.14 3.83 0.00 1.71 2.06 0.00 1.38 0.00 0.00 1.41 0.00 0.00 2.54 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.30 0.96 7.81 7 V 8.63 3.91 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 1.11 0.00 0.00 1.16 0.00 0.00 8 I 7.84 3.74 2.06 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 0.60 0.91 0.00 0.00 9 N 8.22 4.28 0.00 2.62 2.66 0.00 0.00 7.09 6.96 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 10 Y 8.07 4.07 0.00 3.22 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 8.47 3.87 0.00 2.03 1.77 1.10 0.82 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 8.55 4.37 0.00 2.76 2.81 0.00 0.00 6.69 7.81 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 13 K 8.12 3.87 0.00 1.82 1.97 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.44 7.81 14 L 8.15 3.81 0.00 0.79 1.18 0.93 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.76 3.99 0.00 1.69 1.84 1.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.17 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 17 N 8.03 4.35 0.00 2.92 2.89 0.00 0.00 7.09 7.34 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 18 E 8.35 4.00 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.86 0.00 19 L 8.18 4.01 0.00 1.79 1.68 0.90 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.64 3.48 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 1.10 0.00 0.00 0.94 0.00 0.00 21 A 7.88 3.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.00 3.56 1.96 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 1.53 1.01 0.85 0.00 0.00 23 N 7.79 4.36 0.00 2.78 2.83 0.00 0.00 6.76 8.03 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 24 Q 8.19 3.88 0.00 2.02 1.98 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 2.59 2.22 0.00 25 Y 8.29 4.61 0.00 3.02 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.46 3.80 0.00 3.42 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 27 L 8.20 3.96 0.00 1.96 1.60 0.90 0.88 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 28 H 8.35 3.84 0.00 3.33 2.98 0.00 5.70 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 8.07 4.07 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 30 R 7.62 3.86 0.00 1.76 1.88 0.00 3.24 0.00 0.00 3.06 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.67 0.00 31 M 7.74 3.46 0.00 1.01 1.63 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 2.46 2.19 0.00 32 F 7.59 4.64 0.00 3.29 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 33 K 8.24 3.93 0.00 2.07 1.89 0.00 1.66 0.00 0.00 1.48 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.42 7.81 34 N 7.96 4.25 0.00 2.66 2.65 0.00 0.00 7.35 8.66 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 35 W 7.96 4.83 0.00 3.75 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 36 G 8.52 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 0.00 0.00 0.00 37 L 8.18 4.73 0.00 1.90 1.62 1.21 0.58 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 38 K 8.15 3.87 0.00 2.02 1.81 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.57 7.81 39 R 8.14 3.90 0.00 2.12 1.99 0.00 3.55 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 40 L 7.76 4.05 0.00 1.68 1.08 1.09 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.33 4.44 0.00 3.10 3.01 0.00 0.00 7.20 7.90 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 42 D 8.21 4.40 0.00 2.89 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 43 V 7.65 3.37 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 -0.45 0.00 0.00 0.76 0.00 0.00 44 E 8.54 3.86 0.00 2.49 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 2.58 2.56 0.00 45 Y 8.42 3.95 0.00 2.92 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 46 H 8.39 4.09 0.00 3.26 3.27 0.00 5.67 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 47 E 8.14 3.82 0.00 2.10 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 48 S 8.18 4.22 0.00 4.09 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 49 I 7.58 3.57 1.82 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 0.92 0.41 0.83 0.00 0.00 50 D 7.94 4.26 0.00 2.99 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 51 E 8.19 4.07 0.00 2.02 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 2.72 2.51 0.00 52 M 7.87 4.04 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.53 0.00 53 K 8.09 3.91 0.00 1.88 1.81 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.63 7.81 54 H 8.05 4.10 0.00 3.41 3.31 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 8.36 4.23 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 56 D 8.29 4.30 0.00 2.92 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 57 R 7.93 3.86 0.00 1.82 1.76 0.00 3.13 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 58 Y 7.82 4.32 0.00 3.22 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 59 I 8.30 3.76 2.03 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 1.57 1.07 0.95 0.00 0.00 60 E 8.40 4.04 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 2.35 2.50 0.00 61 R 8.22 4.03 0.00 2.13 2.20 0.00 3.35 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.86 0.00 62 I 8.41 3.76 2.07 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 0.68 0.96 0.00 0.00 63 L 8.13 4.00 0.00 2.12 1.79 0.95 0.81 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 64 F 8.42 4.35 0.00 2.94 3.37 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 65 L 8.14 4.52 0.00 1.84 1.62 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.99 3.85 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 2.15 2.24 0.00 67 G 7.98 3.93 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 0.00 0.00 0.00 68 L 8.01 4.54 0.00 1.59 1.62 0.92 0.98 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 69 P 0.00 4.36 0.00 2.05 2.02 0.00 3.66 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 70 N 9.63 4.71 0.00 2.60 2.81 0.00 0.00 7.08 8.41 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 71 L 8.29 4.61 0.00 1.62 1.63 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.51 4.09 0.00 1.97 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 73 D 8.08 4.67 0.00 2.67 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 4.52 0.00 1.51 1.51 0.88 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.46 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 76 K 8.31 4.03 0.00 1.73 1.74 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.46 7.81 77 L 8.30 4.26 0.00 1.65 1.57 0.88 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.77 4.81 0.00 2.65 2.74 0.00 0.00 7.14 7.27 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 79 I 8.12 4.24 1.90 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 1.35 0.95 0.95 0.00 0.00 80 G 8.77 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 81 E 8.60 4.74 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 82 D 7.70 4.90 0.00 2.75 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 8.42 4.01 2.18 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 1.16 0.00 0.00 1.21 0.00 0.00 84 E 8.19 3.86 0.00 2.00 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 2.34 2.28 0.00 85 E 8.40 3.98 0.00 2.41 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 2.36 2.39 0.00 86 M 8.25 4.05 0.00 1.80 2.41 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.38 0.00 87 L 8.21 4.14 0.00 2.02 1.71 1.24 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.42 3.94 0.00 1.86 2.00 0.00 3.12 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 89 S 8.34 4.15 0.00 4.04 4.16 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 90 D 8.44 4.69 0.00 3.06 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 91 L 8.23 3.94 0.00 1.84 1.89 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.33 4.04 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 8.10 3.98 0.00 1.99 2.05 0.93 0.69 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 94 E 8.63 4.11 0.00 2.24 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 2.69 2.49 0.00 95 L 8.17 4.03 0.00 2.05 1.75 0.95 1.00 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 8.37 4.51 0.00 2.87 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 97 G 8.35 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 8.47 4.02 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 99 K 8.02 3.83 0.00 2.13 1.90 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.66 7.81 100 N 8.08 4.39 0.00 3.01 2.90 0.00 0.00 7.12 6.61 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 0.00 101 L 8.17 4.00 0.00 1.98 1.75 0.99 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.24 3.90 0.00 1.98 1.98 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 1.92 0.00 103 E 8.02 3.83 0.00 2.08 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 2.32 2.38 0.00 104 A 7.71 2.89 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.12 3.73 2.02 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 0.99 0.92 0.00 0.00 106 G 7.76 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 0.00 107 Y 7.99 4.13 0.00 3.15 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 0.00 108 A 8.25 3.79 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 7.81 4.13 0.00 2.86 2.80 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 0.00 110 S 7.49 4.17 0.00 4.00 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 6.85 3.99 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 0.50 0.00 0.00 0.60 0.00 0.00 112 H 7.09 2.78 0.00 3.15 3.27 0.00 5.84 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.30 4.52 0.00 2.63 2.46 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 0.00 114 Y 7.50 4.32 0.00 3.10 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 0.00 115 V 7.88 3.74 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 0.93 0.00 0.00 0.97 0.00 0.00 116 S 8.34 4.19 0.00 4.18 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 0.00 117 R 8.03 3.89 0.00 1.91 2.20 0.00 3.33 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 1.70 1.68 0.00 118 D 8.35 4.32 0.00 2.98 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 0.00 119 M 8.22 4.01 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 120 M 8.24 4.18 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.84 0.00 121 I 8.18 3.73 1.88 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 1.54 0.90 0.92 0.00 0.00 122 E 8.01 3.98 0.00 2.09 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 2.32 2.50 0.00 123 I 7.57 3.56 1.93 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.55 0.72 0.00 0.00 124 L 8.16 3.95 0.00 1.85 1.85 0.95 1.08 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 8.15 3.90 0.00 2.08 2.12 0.00 3.16 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 126 D 8.21 4.44 0.00 3.01 2.80 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 0.00 127 E 8.46 4.13 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.57 0.00 128 E 8.76 4.27 0.00 2.03 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 2.37 2.53 0.00 129 G 8.09 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 H 8.21 4.40 0.00 3.38 3.56 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 0.00 131 I 8.33 3.70 2.06 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 1.45 0.68 0.94 0.00 0.00 132 D 8.37 4.34 0.00 2.95 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 0.00 133 W 8.27 4.10 0.00 3.52 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 8.41 3.78 0.00 2.01 1.70 1.19 1.16 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 0.00 135 E 8.45 3.90 0.00 2.10 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 2.31 2.49 0.00 136 T 7.89 3.75 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 1.14 0.00 0.00 137 E 7.73 3.68 0.00 1.49 1.57 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 1.47 1.47 0.00 138 L 7.68 3.75 0.00 1.69 1.60 0.87 0.85 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 0.00 139 D 7.97 4.34 0.00 2.77 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.97 3.95 0.00 1.84 1.82 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.37 3.37 1.71 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 -0.27 0.71 0.00 0.00 142 Q 7.34 3.92 0.00 2.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 143 K 8.07 4.15 0.00 1.74 1.83 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.47 7.81 144 M 8.33 4.38 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.86 0.00 145 G 7.56 4.11 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 0.00 0.00 0.00 146 L 8.42 3.95 0.00 1.74 1.66 0.94 0.70 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 8.10 3.97 0.00 2.13 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 2.44 2.46 0.00 148 N 8.14 4.35 0.00 2.96 2.88 0.00 0.00 6.67 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 7.91 3.92 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 8.45 4.04 0.00 1.99 1.68 1.03 0.99 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 0.00 151 Q 8.11 3.88 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 152 A 7.76 4.10 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 0.00 153 Q 7.89 4.23 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 154 I 7.32 4.14 1.87 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 1.56 1.19 0.90 0.00 0.00 155 R 7.55 4.66 0.00 1.77 1.84 0.00 3.19 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 156 E 8.56 4.24 0.00 2.07 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 2.27 2.29 0.00 157 E 8.42 4.50 0.00 2.07 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 2.18 2.27 0.00 *158 G 8.59 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 * Residues marked with a * may have inaccurate shift predictions.