NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 N 4.7372 8.4249 118.1278 52.7746 40.8514 174.5708 14 L 4.2542 7.7203 117.9665 54.0384 42.3487 175.4304 15 L 4.3690 8.7833 123.0531 54.3611 43.0043 176.1640 16 Y 4.2479 8.5487 123.8392 58.2565 39.3508 175.0520 17 T 4.1234 7.0980 118.6715 60.3477 70.4240 173.9005 18 R 3.8643 8.0297 124.7374 57.8842 30.4238 176.7373 19 N 4.2068 7.7462 117.8235 54.1063 38.9555 173.7600 20 D 4.7542 8.4922 124.3123 52.8772 39.9018 176.4963 21 V 3.5747 7.7280 119.6807 63.5483 31.9548 176.7623 22 S 4.3044 8.4954 121.2766 58.3203 64.8175 174.9896 23 E 3.8779 8.6891 123.4310 59.5850 29.3922 179.1692 24 S 4.0844 7.9808 112.5305 61.6236 62.5774 175.7556 25 D 4.3774 8.0999 121.5829 57.0606 40.4066 178.8576 26 K 3.9159 8.3255 119.3544 59.4455 32.1605 179.4326 27 K 3.9201 8.1023 118.2783 59.5127 32.0050 179.3035 28 A 4.0180 7.9734 120.9579 55.5524 18.2006 179.8865 29 T 3.9166 8.1154 114.3285 66.5424 68.4248 177.2262 30 V 3.5667 8.0762 120.5898 65.9560 31.5086 177.7267 31 E 3.9079 8.1504 118.9222 59.1508 29.4706 178.5475 32 L 3.9623 7.9728 120.3841 58.1179 42.1112 178.8604 33 L 4.2344 8.3475 119.2509 58.1750 41.6250 179.3838 34 N 4.3435 8.4999 116.5271 56.1467 38.0761 177.4319 35 R 3.9102 8.0379 120.3481 59.5493 30.0525 178.6868 36 Q 4.0293 7.9652 117.5051 58.7342 28.6274 178.5440 37 V 3.5488 8.0703 119.6517 66.1270 31.5218 178.0977 38 I 3.7382 7.9025 119.5894 64.5515 36.4945 178.4678 39 Q 4.0787 7.9495 117.9760 59.0170 28.5293 178.3443 40 F 3.9761 8.8151 120.3048 60.3308 38.8902 177.6332 41 I 3.7319 8.2726 119.8658 64.4303 36.9453 177.8746 42 D 4.3065 8.2218 118.8849 57.4194 40.9570 178.1355 43 L 3.8214 8.1819 121.0181 58.0676 41.8943 179.1027 44 S 4.0583 8.1194 115.4035 61.4462 62.6947 176.6731 45 L 3.9236 7.8857 121.6828 57.8048 41.4023 179.5312 46 I 3.3566 7.7455 119.7522 64.5350 36.9887 178.5688 47 T 3.8009 7.9792 116.6998 66.6148 68.2997 176.8783 48 K 3.2211 7.4544 119.9494 58.8864 31.6552 178.9806 49 Q 3.9585 7.4285 118.7910 59.2973 29.0270 178.3976 50 A 3.9993 7.6022 121.4453 55.2491 18.2222 178.7852 51 H 3.9037 7.6599 115.6391 59.5067 29.8429 177.1234 52 W 4.6650 7.7766 119.2683 59.0461 29.0310 177.4262 53 N 5.0206 8.0610 114.2574 52.2716 38.5814 174.3924 54 M 4.8092 7.4179 118.2512 54.6202 33.1401 175.4697 55 R 4.4679 9.0353 115.7669 55.8154 33.0704 173.5418 56 G 3.8742 8.8907 103.3852 43.9139 0.0000 172.5983 57 A 4.0738 8.5305 122.3961 53.9768 18.7376 177.2452 58 N 4.2856 9.0465 119.0629 54.7537 37.7406 175.6564 59 F 4.0813 8.1514 119.3240 61.1496 39.3113 176.9199 60 I 3.0763 7.7160 117.2277 63.8441 37.8317 177.5627 61 A 3.8357 7.6993 121.2186 54.8938 18.2770 179.6897 62 V 3.2502 7.3821 116.5963 66.0490 31.3641 177.4611 63 H 3.7844 7.7794 117.3739 59.5322 29.6769 176.6850 64 E 3.9265 7.9951 120.0389 59.3833 29.3055 178.8375 65 M 3.6381 7.9065 118.4841 58.6441 32.1595 178.3646 66 L 3.3346 7.4376 118.7446 57.3784 41.6238 179.2178 67 D 4.2214 7.6057 119.1926 57.0682 40.8053 178.9056 68 G 3.5624 7.7226 105.7427 47.7694 0.0000 175.5215 69 F 3.6901 7.6119 120.1255 60.0726 38.8553 177.6304 70 R 3.8948 8.0544 118.2507 59.8248 29.8829 178.5108 71 T 3.8705 7.8816 115.1871 66.7521 68.4081 176.4303 72 A 4.1314 8.0753 122.1852 55.0804 18.4048 179.5621 73 L 4.2392 8.5950 118.2725 58.4069 41.7501 179.9478 74 T 3.9337 8.2062 109.6933 64.6906 68.6161 175.9863 75 D 4.2944 8.2377 120.8264 57.5700 41.2515 178.0193 76 H 4.2110 8.4388 117.0153 58.8016 28.7046 177.8669 77 L 3.8410 8.3457 121.7998 58.5398 40.2899 178.8010 78 D 4.2941 8.2978 119.0830 57.5573 41.1894 178.3583 79 T 3.8356 7.8319 116.1448 66.8840 68.4757 176.5939 80 M 3.9150 8.1928 120.4027 58.2474 32.0410 178.5350 81 A 3.9685 8.2943 121.3110 55.4704 18.4915 179.6066 82 E 3.9876 8.3452 116.7534 59.1006 29.4685 179.4895 83 R 3.9754 8.0342 119.0117 59.1961 30.0808 178.3521 84 A 3.9532 7.8960 120.6060 55.2212 18.3205 179.8494 85 V 3.9325 7.6569 117.9839 65.6759 31.3687 178.2011 86 Q 3.9692 8.2265 117.4141 58.5352 28.5639 177.9170 87 L 4.4102 7.3540 117.0881 54.4811 42.1130 177.5132 88 G 3.8551 8.4235 108.8123 45.0708 0.0000 174.1472 89 G 4.0409 8.0295 109.6843 44.3002 0.0000 172.7173 90 V 4.2282 7.9713 118.4339 60.6333 32.7104 174.9783 91 A 4.3417 8.5255 130.5945 51.7956 19.0314 176.1983 92 L 4.6975 8.8567 123.2455 53.2378 43.0736 177.2966 93 G 4.1893 8.4548 111.0919 44.9630 0.0000 172.7615 94 T 4.3423 7.7975 110.6432 60.7955 71.3196 175.2328 95 T 3.8701 8.4331 118.6358 67.1911 68.5288 176.7998 96 Q 4.0075 8.0167 119.3044 58.8315 28.7940 178.8563 97 V 3.5891 7.4859 117.9181 66.0731 31.5750 178.2246 98 I 3.7349 7.9595 119.7132 64.3865 36.7178 177.9509 99 N 4.3024 8.3081 117.2759 56.7556 38.8440 176.5942 100 S 4.2625 7.9724 113.5998 60.3856 62.6271 174.6721 101 K 4.4676 7.8102 117.9647 56.1705 33.6706 176.5284 102 T 3.9497 7.8961 114.5565 61.6856 67.5658 171.9804 103 P 4.5765 0.0000 0.0000 63.0310 32.1726 175.5999 104 L 4.3894 7.6758 120.4853 53.2445 42.5078 176.5786 105 K 3.9140 8.6163 124.6227 56.2429 32.6651 176.1577 106 S 4.0979 8.7527 119.5295 59.1066 62.7466 173.1710 107 Y 4.2181 8.6333 128.5294 56.1738 39.4270 172.7501 108 P 4.3793 0.0000 0.0000 62.9886 31.8948 176.1863 109 L 4.5497 8.4692 120.3743 55.1566 42.2474 176.6416 110 D 4.9357 7.9678 117.3065 52.6533 39.7791 175.5057 111 I 4.4690 7.4885 112.1029 60.2002 39.8206 174.7747 112 H 5.1630 8.3339 115.0464 55.4898 32.4053 174.0221 113 N 4.8271 8.1471 116.4489 53.2518 39.9040 175.6896 114 V 3.7036 8.5009 124.6157 66.6853 31.5867 178.5862 115 Q 4.0121 8.0873 116.8793 59.0113 28.6089 178.3946 116 D 4.3256 8.0457 119.4094 57.7282 40.9880 178.3098 117 H 4.3957 8.2060 117.9839 58.4023 28.6407 177.8606 118 L 4.1247 8.3536 121.0522 57.7080 41.3974 179.8260 119 K 4.0315 8.1354 118.5124 59.4976 31.9760 179.3465 120 E 4.0133 8.3434 118.8983 59.3537 29.3251 179.4285 121 L 4.2614 8.7801 119.2887 57.8031 41.6499 179.3436 122 A 4.0764 8.4834 121.1398 55.3075 18.3384 179.3948 123 D 4.3467 8.2189 117.3780 57.6705 40.9057 179.2919 124 R 4.0576 8.0521 118.1146 59.2927 30.2306 178.4817 125 Y 3.7734 8.9762 116.7216 61.0324 37.8384 178.7337 126 A 4.0799 8.4132 121.8103 54.9500 18.4787 179.8099 127 V 3.4870 7.6451 116.3459 66.2189 31.5601 178.5249 128 V 3.7552 7.9175 119.0065 65.2404 31.3108 177.7553 129 A 3.9094 8.4090 120.8239 55.4523 18.1470 179.4837 130 N 4.3297 8.6125 115.3192 56.2667 38.5276 177.5964 131 D 4.2850 8.2027 120.6854 57.4183 40.8652 179.2569 132 V 3.4456 8.0960 119.9649 64.4439 31.1662 178.3307 133 R 3.8391 7.7164 118.8578 59.3148 29.8626 178.3398 134 K 4.0581 7.8445 118.0193 59.3598 32.0236 179.2042 135 A 3.9784 7.7903 121.0622 54.7343 17.8389 179.4257 136 I 3.9326 7.2661 118.2008 65.0478 37.3925 178.5534 137 G 3.7409 7.6178 103.7279 47.3198 0.0000 175.2152 138 E 4.2157 8.0571 119.4420 57.5817 29.8541 177.2209 139 A 4.1421 7.5496 122.5168 52.4716 18.6542 177.3689 140 K 4.2954 8.6385 121.5867 56.7740 32.8220 176.7565 141 D 4.7468 7.5820 118.8005 51.7002 44.1412 175.5171 142 E 3.9302 8.7706 126.7448 59.5157 29.6124 178.9381 143 D 4.2778 7.9734 118.4534 57.6692 40.8792 178.8318 144 T 3.4563 8.0368 115.8718 66.4100 68.4213 176.4370 145 A 4.0232 8.0994 122.9439 55.3526 18.2812 179.2378 146 D 4.2477 8.2446 116.5074 57.3720 41.2792 178.3963 147 I 3.6101 7.6354 120.3462 64.5857 37.0957 178.4819 148 F 4.5667 8.0324 118.5383 60.7638 38.5672 178.0195 149 T 3.9014 8.1130 115.4207 66.5002 68.1433 176.5799 150 A 3.9518 8.2531 122.6569 55.1138 18.3141 179.5971 151 A 3.4159 8.0018 119.2464 55.1621 18.4001 179.7709 152 S 3.9955 8.5172 112.1082 61.5410 62.4330 176.4693 153 R 3.8170 8.1140 120.8748 59.3828 29.7591 178.7942 154 D 3.6512 7.6054 118.2600 57.1056 40.6857 178.7932 155 L 3.7769 7.8186 119.7199 57.9170 41.5927 179.4479 156 D 4.3126 8.2775 119.1677 56.9626 40.6120 178.7483 157 K 4.0422 7.7600 120.2769 59.5970 32.1169 178.9780 158 F 3.9015 7.9214 118.5012 60.1785 38.5448 177.4082 159 L 3.9401 8.2972 120.4245 57.8547 41.8434 178.7895 160 W 4.3601 8.3248 128.2663 60.6698 30.4476 177.8092 161 F 3.9484 8.2419 116.6802 60.5691 38.6412 177.5240 162 I 3.8623 8.1609 119.4720 64.6251 36.9846 178.4078 163 E 4.0490 8.5475 119.6521 59.4871 29.0827 179.2243 164 S 4.3884 8.1385 113.3859 60.0781 63.0844 175.1247 165 N 4.6400 7.6326 117.9425 52.3651 38.9752 174.9170 166 I 4.2338 7.0211 122.8477 60.5811 38.0349 175.8472 167 E 4.1562 9.1780 124.2320 56.7156 29.2345 176.6599 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 13 N 8.42 4.74 0.00 2.74 2.96 0.00 0.00 6.98 6.97 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 14 L 7.72 4.25 0.00 1.62 1.60 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.78 4.37 0.00 1.49 1.62 0.93 0.75 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 16 Y 8.55 4.25 0.00 2.98 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 17 T 7.10 4.12 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 1.03 0.00 0.00 18 R 8.03 3.86 0.00 1.77 1.94 0.00 3.29 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 19 N 7.75 4.21 0.00 2.61 2.64 0.00 0.00 7.09 8.34 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 20 D 8.49 4.75 0.00 2.80 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 21 V 7.73 3.57 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 0.77 0.00 0.00 0.92 0.00 0.00 22 S 8.50 4.30 0.00 4.08 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 23 E 8.69 3.88 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 24 S 7.98 4.08 0.00 3.93 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 25 D 8.10 4.38 0.00 2.87 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 26 K 8.33 3.92 0.00 1.96 1.93 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.59 7.81 27 K 8.10 3.92 0.00 1.94 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.59 7.81 28 A 7.97 4.02 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 29 T 8.12 3.92 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 1.16 0.00 0.00 30 V 8.08 3.57 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 1.08 0.00 0.00 0.99 0.00 0.00 31 E 8.15 3.91 0.00 2.08 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 2.31 2.47 0.00 32 L 7.97 3.96 0.00 1.96 1.94 0.85 0.94 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 33 L 8.35 4.23 0.00 1.94 1.72 0.89 0.50 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 34 N 8.50 4.34 0.00 2.83 2.88 0.00 0.00 6.71 8.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.04 3.91 0.00 2.01 2.07 0.00 3.07 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 36 Q 7.97 4.03 0.00 2.23 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.55 0.00 0.00 0.00 0.00 0.00 2.30 1.84 0.00 37 V 8.07 3.55 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 1.20 0.00 0.00 0.97 0.00 0.00 38 I 7.90 3.74 1.90 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 1.60 0.58 0.93 0.00 0.00 39 Q 7.95 4.08 0.00 2.27 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.74 2.50 0.00 40 F 8.82 3.98 0.00 3.25 3.17 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 41 I 8.27 3.73 2.05 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 1.46 0.77 0.94 0.00 0.00 42 D 8.22 4.31 0.00 2.91 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 43 L 8.18 3.82 0.00 1.61 1.42 0.59 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.12 4.06 0.00 4.04 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 45 L 7.89 3.92 0.00 1.83 1.70 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.75 3.36 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 1.46 0.85 0.58 0.00 0.00 47 T 7.98 3.80 4.32 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 1.22 0.00 0.00 48 K 7.45 3.22 0.00 1.17 0.74 0.00 1.26 0.00 0.00 0.82 0.00 0.00 2.66 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.10 1.34 7.81 49 Q 7.43 3.96 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.97 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 50 A 7.60 4.00 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 51 H 7.66 3.90 0.00 2.85 3.11 0.00 5.95 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 52 W 7.78 4.66 0.00 3.55 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 53 N 8.06 5.02 0.00 2.93 2.96 0.00 0.00 6.73 7.75 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 54 M 7.42 4.81 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.91 0.00 55 R 9.04 4.47 0.00 1.79 1.83 0.00 2.67 0.00 0.00 3.07 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 56 G 8.89 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.53 4.07 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 N 9.05 4.29 0.00 2.97 2.87 0.00 0.00 6.83 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 59 F 8.15 4.08 0.00 3.28 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 60 I 7.72 3.08 1.96 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 1.56 0.96 0.89 0.00 0.00 61 A 7.70 3.84 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 62 V 7.38 3.25 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 0.84 0.00 0.00 0.82 0.00 0.00 63 H 7.78 3.78 0.00 2.10 2.82 0.00 6.00 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 64 E 8.00 3.93 0.00 1.89 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 2.33 0.00 65 M 7.91 3.64 0.00 1.75 1.79 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.36 0.00 66 L 7.44 3.33 0.00 1.61 1.43 0.77 0.61 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 67 D 7.61 4.22 0.00 2.64 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 68 G 7.72 3.56 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 0.00 0.00 0.00 69 F 7.61 3.69 0.00 2.99 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 70 R 8.05 3.89 0.00 1.83 2.00 0.00 3.14 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 1.53 1.69 0.00 71 T 7.88 3.87 4.41 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 1.24 0.00 0.00 72 A 8.08 4.13 1.75 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 0.00 0.00 73 L 8.60 4.24 0.00 1.91 1.85 0.82 0.32 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 74 T 8.21 3.93 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 1.29 0.00 0.00 75 D 8.24 4.29 0.00 2.91 2.85 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 76 H 8.44 4.21 0.00 3.42 3.28 0.00 5.67 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.35 3.84 0.00 1.91 2.01 0.95 1.06 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 78 D 8.30 4.29 0.00 2.93 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 79 T 7.83 3.84 4.36 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 1.16 0.00 0.00 80 M 8.19 3.91 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.45 0.00 81 A 8.29 3.97 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 82 E 8.35 3.99 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 2.31 2.44 0.00 83 R 8.03 3.98 0.00 1.92 1.97 0.00 3.18 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.57 0.00 84 A 7.90 3.95 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 85 V 7.66 3.93 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 1.40 0.00 0.00 0.97 0.00 0.00 86 Q 8.23 3.97 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 87 L 7.35 4.41 0.00 1.70 1.65 0.87 1.28 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 88 G 8.42 3.86 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 0.00 0.00 0.00 89 G 8.03 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 0.00 0.00 0.00 90 V 7.97 4.23 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 0.84 0.00 0.00 0.93 0.00 0.00 91 A 8.53 4.34 1.24 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 0.00 0.00 0.00 92 L 8.86 4.70 0.00 1.63 1.61 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.45 4.19 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 0.00 94 T 7.80 4.34 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 1.22 0.00 0.00 95 T 8.43 3.87 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 1.24 0.00 0.00 96 Q 8.02 4.01 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.92 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 97 V 7.49 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 1.04 0.00 0.00 0.94 0.00 0.00 98 I 7.96 3.73 1.89 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 1.43 0.50 0.93 0.00 0.00 99 N 8.31 4.30 0.00 2.75 2.86 0.00 0.00 7.22 7.38 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 0.00 100 S 7.97 4.26 0.00 4.00 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 0.00 101 K 7.81 4.47 0.00 1.86 1.81 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.48 7.81 102 T 7.90 3.95 4.34 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 1.27 0.00 0.00 103 P 0.00 4.58 0.00 2.21 2.14 0.00 3.81 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 104 L 7.68 4.39 0.00 1.87 1.67 0.91 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.62 3.91 0.00 1.73 1.75 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.45 7.81 106 S 8.75 4.10 0.00 3.90 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 0.00 107 Y 8.63 4.22 0.00 3.13 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 0.00 108 P 0.00 4.38 0.00 2.04 1.88 0.00 2.32 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.64 0.00 109 L 8.47 4.55 0.00 1.69 1.81 0.98 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 110 D 7.97 4.94 0.00 2.75 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 7.49 4.47 1.71 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.42 0.80 0.00 0.00 112 H 8.33 5.16 0.00 3.26 3.35 0.00 6.10 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.15 4.83 0.00 2.92 2.78 0.00 0.00 6.74 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 0.00 114 V 8.50 3.70 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.13 0.00 0.00 115 Q 8.09 4.01 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.69 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 116 D 8.05 4.33 0.00 2.79 2.64 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 0.00 117 H 8.21 4.40 0.00 3.48 3.46 0.00 5.83 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 0.00 118 L 8.35 4.12 0.00 1.85 1.73 0.93 1.11 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 0.00 119 K 8.14 4.03 0.00 1.96 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.62 7.81 120 E 8.34 4.01 0.00 2.03 1.84 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 2.41 2.16 0.00 121 L 8.78 4.26 0.00 1.91 1.74 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.48 4.08 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 0.00 123 D 8.22 4.35 0.00 2.94 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 0.00 124 R 8.05 4.06 0.00 2.00 2.01 0.00 3.58 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 125 Y 8.98 3.77 0.00 3.14 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 0.00 126 A 8.41 4.08 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 0.00 127 V 7.65 3.49 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 0.97 0.00 0.00 0.98 0.00 0.00 128 V 7.92 3.76 1.73 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 0.72 0.00 0.00 0.75 0.00 0.00 129 A 8.41 3.91 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 0.00 130 N 8.61 4.33 0.00 2.75 2.86 0.00 0.00 7.11 8.05 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 0.00 131 D 8.20 4.28 0.00 2.89 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 0.00 132 V 8.10 3.45 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 0.99 0.00 0.00 0.81 0.00 0.00 133 R 7.72 3.84 0.00 1.98 1.96 0.00 3.24 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 134 K 7.84 4.06 0.00 1.88 1.79 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.42 7.81 135 A 7.79 3.98 0.57 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 0.00 0.00 136 I 7.27 3.93 2.01 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 1.64 0.81 0.96 0.00 0.00 137 G 7.62 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 0.00 0.00 0.00 138 E 8.06 4.22 0.00 2.11 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 2.30 2.54 0.00 139 A 7.55 4.14 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 0.00 140 K 8.64 4.30 0.00 1.76 1.86 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.43 7.81 141 D 7.58 4.75 0.00 2.68 2.40 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 0.00 142 E 8.77 3.93 0.00 2.06 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 143 D 7.97 4.28 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 0.00 144 T 8.04 3.46 4.19 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 0.57 0.00 0.00 145 A 8.10 4.02 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 0.00 146 D 8.24 4.25 0.00 2.84 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 0.00 147 I 7.64 3.61 1.64 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.37 0.74 0.00 0.00 148 F 8.03 4.57 0.00 3.17 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 0.00 149 T 8.11 3.90 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 1.20 0.00 0.00 150 A 8.25 3.95 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 A 8.00 3.42 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 0.00 152 S 8.52 4.00 0.00 3.92 4.01 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 0.00 153 R 8.11 3.82 0.00 1.96 1.88 0.00 3.15 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 154 D 7.61 3.65 0.00 2.50 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 L 7.82 3.78 0.00 1.61 1.60 0.59 0.83 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 0.00 156 D 8.28 4.31 0.00 2.71 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 0.00 157 K 7.76 4.04 0.00 1.76 1.56 0.00 1.57 0.00 0.00 1.54 0.00 0.00 2.82 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.87 1.39 7.81 158 F 7.92 3.90 0.00 2.81 1.59 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 0.00 159 L 8.30 3.94 0.00 1.90 1.94 1.06 1.08 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 0.00 160 W 8.32 4.36 0.00 3.44 3.51 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 0.00 161 F 8.24 3.95 0.00 3.20 3.08 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 0.00 162 I 8.16 3.86 1.96 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.98 0.92 0.00 0.00 163 E 8.55 4.05 0.00 2.10 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 2.38 2.57 0.00 164 S 8.14 4.39 0.00 3.57 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 0.00 165 N 7.63 4.64 0.00 2.77 2.78 0.00 0.00 6.99 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 0.00 166 I 7.02 4.23 2.02 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 1.31 0.66 0.98 0.00 0.00 167 E 9.18 4.16 0.00 1.95 1.86 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 2.34 2.25 0.00