NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.4410 8.3044 120.3360 55.2162 33.4315 174.1159 3 V 4.0561 8.1859 122.4490 59.9268 32.8066 173.5485 4 W 4.2522 9.0247 135.0000 56.9965 31.7518 175.0038 5 T 4.0141 7.8031 121.4181 61.4572 67.3315 172.2146 6 P 4.5561 0.0000 0.0000 63.1627 32.2474 175.6175 7 V 4.0444 7.4990 119.9372 62.7186 32.8744 175.3319 8 N 4.2083 8.7541 124.6725 54.7731 35.8111 173.4406 9 N 5.0158 7.5928 108.0169 53.0308 40.3713 174.0446 10 K 4.1661 8.3017 115.1867 56.2903 32.7354 176.2521 11 M 4.9395 8.3228 121.0047 53.8750 35.0106 175.1272 12 F 4.5909 7.9595 116.0444 57.3963 41.2896 177.1612 13 E 3.6155 8.4466 120.3279 57.1458 27.1553 175.0177 14 T 3.8788 8.2963 122.4574 66.2896 69.0573 174.1907 15 F 4.4677 9.0337 123.7088 57.7029 36.2447 176.6547 16 S 4.3881 8.2148 116.3368 60.8969 63.0201 174.6758 17 Y 4.3476 8.3113 116.5810 58.2071 38.1139 175.1055 18 L 4.6551 7.5937 120.1923 52.0513 43.4486 174.5299 19 P 4.3497 0.0000 0.0000 62.2309 31.4748 174.4300 20 P 4.1748 0.0000 0.0000 63.0358 31.6935 176.2462 21 L 3.9390 8.4063 123.1806 54.7105 42.0615 177.8945 22 T 4.2067 8.1962 114.3223 61.2555 71.0307 175.1897 23 D 4.3268 8.4604 120.2426 57.3444 40.7537 178.5790 24 E 3.9068 8.0928 119.4341 59.4028 29.8337 178.7718 25 Q 3.9056 8.0853 118.0857 58.8421 28.7371 178.7671 26 I 3.7254 8.0710 120.9320 64.4155 37.1418 178.1775 27 A 4.0550 8.3156 121.5713 55.3053 18.1650 179.5543 28 A 3.9654 8.2040 119.1431 55.4354 18.4333 179.9374 29 Q 4.1513 8.1092 116.3923 59.0598 28.7853 179.0792 30 V 3.7562 8.1405 119.4415 65.9736 31.5564 177.6999 31 D 4.3921 8.4236 118.8582 57.6981 40.8179 178.0611 32 Y 4.1615 8.2067 119.7876 60.8506 38.7163 178.0823 33 I 3.9135 8.1555 120.5856 64.8303 37.4145 178.5930 34 V 3.5614 7.9132 118.4806 65.8929 31.1348 177.9168 35 A 3.9341 8.3815 120.0278 54.5452 18.2833 178.3638 36 N 4.0947 7.1508 111.7352 52.2066 38.6504 175.8097 37 G 3.7454 7.2137 108.1672 45.9808 0.0000 174.0464 38 W 4.9371 7.5519 118.9945 56.0477 30.6889 176.3264 39 I 4.3862 8.7423 122.8315 59.4157 37.8074 174.0455 40 P 4.8504 0.0000 0.0000 62.9529 32.7557 175.2442 41 C 4.9849 8.9494 121.6873 58.3714 35.5854 172.4667 42 L 5.3463 8.7539 124.0447 53.2765 44.3838 175.1878 43 E 5.6433 9.2278 120.8773 54.9650 34.1668 174.5585 44 F 5.5922 9.2127 116.1759 55.9001 42.1739 173.0170 45 A 4.5224 8.3653 120.5269 50.0712 22.6493 176.2505 46 E 4.3416 8.6901 119.0694 55.8029 30.6242 177.8670 47 A 4.2950 8.7444 122.2521 55.6932 18.5208 179.6951 48 D 4.5904 8.2044 113.5922 56.3660 41.0567 177.1543 49 K 4.7091 8.2650 116.5489 55.1796 32.6090 176.5399 50 A 3.9980 7.7279 124.1193 52.9844 19.5858 177.9761 51 Y 4.6534 7.6032 112.2662 55.5455 40.0250 175.9107 52 V 3.8690 8.2855 122.8486 62.6768 31.6557 175.3417 53 S 4.7086 8.9174 115.9904 57.7582 66.2793 173.8183 54 N 5.2210 8.5346 113.2746 52.3344 40.2909 176.3524 55 E 3.9733 8.3695 120.3853 59.6930 29.4786 179.0656 56 S 4.1275 8.9599 114.5450 60.4148 62.9167 175.8694 57 A 2.5800 7.5073 123.4113 53.1914 17.7523 178.9687 58 I 3.5605 7.0625 116.5253 63.6851 38.0584 177.1030 59 R 4.2638 7.5557 116.2206 55.7363 30.4745 176.2451 60 F 5.0796 7.1715 118.0539 55.9008 41.4109 177.0922 61 G 4.0345 8.2422 116.5287 46.3218 0.0000 175.2684 62 S 4.6369 8.4344 113.6284 58.7517 62.3214 174.4342 63 V 4.4598 7.2717 107.1178 61.1694 33.0984 177.7382 64 S 4.4904 8.2554 115.4179 59.8138 63.5668 173.4179 65 C 3.9773 8.1433 118.8854 61.5377 27.9310 173.2508 66 L 3.5704 8.4248 124.0236 55.7209 38.9881 173.3783 67 Y 4.3633 7.6959 119.2386 55.8603 40.0920 174.4269 68 Y 4.7244 7.1773 123.3763 56.1237 42.2900 174.8117 69 D 4.4848 8.8964 123.2257 55.4679 41.9089 176.9113 70 N 4.7394 8.9454 117.0698 54.2440 35.8906 176.9128 71 R 3.9027 7.9775 118.8910 59.2904 30.3943 177.2036 72 Y 4.3704 7.6624 114.7069 57.9577 38.3236 175.2344 73 W 5.0876 8.6496 124.1951 55.3817 32.6445 174.6308 74 T 4.3077 8.1938 117.2137 62.7247 69.4240 174.6390 75 M 4.5340 8.5260 126.4695 55.2585 33.2150 175.2295 76 W 4.7737 9.5400 135.0000 56.2553 31.2450 176.7606 77 K 3.3915 8.5389 128.7528 57.6451 30.5135 177.6643 78 L 4.9269 8.2143 125.5342 52.6412 45.1115 173.9867 79 P 4.3028 0.0000 0.0000 63.6520 32.2890 177.4998 80 M 4.3069 8.6787 123.3281 53.7717 30.5223 176.0965 81 F 4.5412 7.3004 117.8950 59.0769 39.9654 176.5843 82 G 4.0077 9.1602 113.6012 45.3108 0.0000 172.8425 83 C 4.3380 7.9791 120.8689 59.5046 31.8354 173.2181 84 R 4.6121 8.6018 124.7886 55.6123 31.3983 174.3307 85 D 4.8144 7.9022 118.1405 51.1616 43.0755 174.3973 86 P 4.3258 0.0000 0.0000 66.1622 30.9569 177.7784 87 M 3.9877 8.2525 117.9482 58.9171 32.2070 178.3113 88 Q 4.0285 8.0111 117.5136 58.8077 28.8502 178.8989 89 V 3.6457 7.7315 118.8914 66.0540 31.7301 177.9984 90 L 4.0361 8.1884 118.9175 57.6104 41.3303 179.3299 91 R 3.8965 8.3728 119.1519 59.6762 29.9190 178.5109 92 E 4.0985 8.2040 117.8287 59.1572 29.4726 179.0875 93 I 3.6003 7.7155 120.0923 64.4617 37.1452 178.3830 94 V 3.4736 7.6502 118.3972 65.9337 31.3730 177.7878 95 A 3.9191 8.0074 120.5186 55.2840 18.2535 179.1604 96 C 2.0000 7.9001 118.0718 62.0600 30.9459 175.9812 97 T 3.7935 7.5537 111.4597 64.3239 68.0503 176.6517 98 K 3.9052 7.9242 121.2608 59.6990 32.7487 178.8206 99 A 4.0028 7.5649 121.0993 53.2200 19.8844 177.6182 100 F 4.6844 7.6749 115.7456 55.0326 39.0871 173.9435 101 P 4.4292 0.0000 0.0000 64.3334 31.9025 177.9148 102 D 4.5485 8.0423 116.4975 54.1935 41.2975 175.7323 103 A 4.7585 7.5192 121.4652 50.5115 20.9502 176.9404 104 Y 4.1868 8.5472 118.0241 57.9541 39.3511 175.3317 105 V 5.1832 8.9372 123.3446 61.1175 35.2039 174.3136 106 R 5.0146 9.5556 123.7960 54.2881 33.1453 173.7761 107 L 4.8360 8.1625 123.5852 53.8882 43.6793 175.7157 108 V 4.8084 8.7156 118.6805 59.4749 36.1970 174.2177 109 A 4.8543 8.1353 121.6623 50.5048 22.8449 175.1758 110 F 5.2760 8.9298 119.3953 55.7453 42.5692 174.1510 111 D 5.3459 8.9024 122.8028 52.7545 42.4056 176.5750 112 N 4.7593 9.1743 122.9101 54.0661 38.3696 176.1337 113 Q 4.2388 8.5434 118.5240 58.5756 29.1684 177.4515 114 K 4.0347 8.3916 115.2215 57.0405 32.9276 176.5111 115 Q 3.4384 8.0309 118.0496 55.7544 26.9231 172.5667 116 V 4.4659 7.8141 117.0985 60.0660 34.9587 173.9031 117 Q 4.3665 8.8251 123.6588 56.4920 29.2630 175.7545 118 I 4.3237 8.1990 118.1326 60.9320 39.2919 174.8697 119 M 4.6776 6.8694 119.2605 54.2685 34.5373 173.7320 120 G 4.2774 8.3176 104.9718 46.1761 0.0000 172.4609 121 F 5.0513 7.7047 116.0772 55.2656 41.6971 172.9937 122 L 4.6079 8.8795 122.9998 55.6175 41.9880 176.7907 123 V 4.5380 9.0624 118.4126 61.5161 34.0454 175.7310 124 Q 4.5424 7.8318 121.1452 54.6048 32.5983 173.1094 125 R 4.4674 8.2638 124.6429 53.0658 33.0706 173.9118 126 P 4.1781 0.0000 0.0000 62.9925 31.1788 176.0739 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 M 8.30 4.44 0.00 2.09 2.16 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 2.55 2.57 0.00 3 V 8.19 4.06 2.12 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 0.81 0.00 0.00 0.97 0.00 0.00 4 W 9.02 4.25 0.00 3.43 3.04 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 5 T 7.80 4.01 4.10 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 0.97 0.00 0.00 6 P 0.00 4.56 0.00 2.23 2.19 0.00 3.79 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 1.95 1.96 0.00 7 V 7.50 4.04 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 0.78 0.00 0.00 0.91 0.00 0.00 8 N 8.75 4.21 0.00 2.83 2.81 0.00 0.00 6.77 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 N 7.59 5.02 0.00 2.69 2.67 0.00 0.00 7.31 6.68 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 10 K 8.30 4.17 0.00 1.91 1.86 0.00 1.43 0.00 0.00 1.38 0.00 0.00 2.46 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.42 1.43 7.81 11 M 8.32 4.94 0.00 2.08 2.07 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 2.52 2.64 0.00 12 F 7.96 4.59 0.00 3.13 3.07 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 13 E 8.45 3.62 0.00 2.15 1.77 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 2.20 2.15 0.00 14 T 8.30 3.88 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 0.19 0.00 0.00 15 F 9.03 4.47 0.00 3.26 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.21 4.39 0.00 4.05 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 17 Y 8.31 4.35 0.00 3.01 3.19 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 18 L 7.59 4.66 0.00 1.82 1.60 0.92 0.88 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 19 P 0.00 4.35 0.00 2.16 2.07 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 20 P 0.00 4.17 0.00 2.05 2.08 0.00 3.68 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 2.04 2.15 0.00 21 L 8.41 3.94 0.00 1.59 1.47 0.49 0.47 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 22 T 8.20 4.21 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 1.18 0.00 0.00 23 D 8.46 4.33 0.00 2.70 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 24 E 8.09 3.91 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 2.34 2.38 0.00 25 Q 8.09 3.91 0.00 2.27 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 26 I 8.07 3.73 2.05 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.01 1.10 0.00 0.00 27 A 8.32 4.05 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 28 A 8.20 3.97 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 29 Q 8.11 4.15 0.00 2.56 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.38 1.90 0.00 30 V 8.14 3.76 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.11 0.00 0.00 31 D 8.42 4.39 0.00 2.99 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 32 Y 8.21 4.16 0.00 3.10 3.36 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 33 I 8.16 3.91 2.17 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.88 1.06 0.00 0.00 34 V 7.91 3.56 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 1.02 0.00 0.00 1.02 0.00 0.00 35 A 8.38 3.93 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 36 N 7.15 4.09 0.00 1.44 1.42 0.00 0.00 7.05 7.65 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 37 G 7.21 3.75 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 0.00 38 W 7.55 4.94 0.00 3.36 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 39 I 8.74 4.39 2.12 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.01 0.74 0.00 0.00 40 P 0.00 4.85 0.00 2.09 1.99 0.00 3.80 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 41 C 8.95 4.98 0.00 3.06 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 42 L 8.75 5.35 0.00 1.86 1.61 0.93 0.86 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 43 E 9.23 5.64 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 44 F 9.21 5.59 0.00 3.05 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.37 4.52 -0.18 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 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.69 4.34 0.00 2.20 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 2.32 2.31 0.00 47 A 8.74 4.29 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 0.00 0.00 0.00 0.00 0.00 48 D 8.20 4.59 0.00 2.70 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 8.27 4.71 0.00 1.55 1.70 0.00 1.68 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.41 7.81 50 A 7.73 4.00 0.46 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 0.00 0.00 51 Y 7.60 4.65 0.00 2.86 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 52 V 8.29 3.87 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 0.62 0.00 0.00 0.79 0.00 0.00 53 S 8.92 4.71 0.00 4.08 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 54 N 8.53 5.22 0.00 2.76 2.84 0.00 0.00 6.82 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.37 3.97 0.00 2.03 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 2.42 2.49 0.00 56 S 8.96 4.13 0.00 3.89 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 57 A 7.51 2.58 1.11 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 58 I 7.06 3.56 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.81 0.87 0.00 0.00 59 R 7.56 4.26 0.00 1.88 1.99 0.00 3.19 0.00 0.00 3.21 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 60 F 7.17 5.08 0.00 2.98 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 61 G 8.24 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.43 4.64 0.00 3.86 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 63 V 7.27 4.46 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 0.66 0.00 0.00 0.48 0.00 0.00 64 S 8.26 4.49 0.00 4.12 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 65 C 8.14 3.98 0.00 2.96 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 66 L 8.42 3.57 0.00 1.77 1.75 0.95 1.01 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 67 Y 7.70 4.36 0.00 2.90 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 7.18 4.72 0.00 2.81 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 69 D 8.90 4.48 0.00 2.87 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 70 N 8.95 4.74 0.00 3.09 3.13 0.00 0.00 6.93 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 R 7.98 3.90 0.00 1.51 1.71 0.00 3.09 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 72 Y 7.66 4.37 0.00 3.04 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 73 W 8.65 5.09 0.00 3.08 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 74 T 8.19 4.31 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 75 M 8.53 4.53 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.79 0.00 76 W 9.54 4.77 0.00 3.66 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.54 3.39 0.00 1.67 0.87 0.00 1.69 0.00 0.00 1.53 0.00 0.00 2.73 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.79 0.21 7.81 78 L 8.21 4.93 0.00 1.60 1.58 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.30 0.00 0.70 1.88 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.17 0.00 80 M 8.68 4.31 0.00 2.04 2.01 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 2.70 2.54 0.00 81 F 7.30 4.54 0.00 3.09 2.98 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 82 G 9.16 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 0.00 0.00 0.00 83 C 7.98 4.34 0.00 3.03 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 84 R 8.60 4.61 0.00 1.80 1.86 0.00 3.21 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.76 0.00 85 D 7.90 4.81 0.00 2.64 2.52 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 0.00 0.00 0.00 0.00 86 P 0.00 4.33 0.00 2.33 2.34 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 87 M 8.25 3.99 0.00 2.36 2.13 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.76 0.00 88 Q 8.01 4.03 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 89 V 7.73 3.65 2.23 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 1.10 0.00 0.00 0.97 0.00 0.00 90 L 8.19 4.04 0.00 1.75 1.72 0.95 0.74 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 91 R 8.37 3.90 0.00 1.98 2.19 0.00 3.13 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 92 E 8.20 4.10 0.00 2.28 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 0.00 2.64 2.67 0.00 93 I 7.72 3.60 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 1.34 1.04 0.86 0.00 0.00 94 V 7.65 3.47 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 1.05 0.00 0.00 0.94 0.00 0.00 95 A 8.01 3.92 1.56 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 96 C 7.90 2.00 0.00 1.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 T 7.55 3.79 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 1.12 0.00 0.00 98 K 7.92 3.91 0.00 1.82 1.90 0.00 1.44 0.00 0.00 1.67 0.00 0.00 3.27 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.38 1.63 7.81 99 A 7.56 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 0.00 100 F 7.67 4.68 0.00 2.83 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 0.00 101 P 0.00 4.43 0.00 2.12 2.11 0.00 3.27 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.04 4.55 0.00 2.71 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 0.00 103 A 7.52 4.76 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 0.00 104 Y 8.55 4.19 0.00 2.45 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 0.00 105 V 8.94 5.18 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 0.86 0.00 0.00 0.88 0.00 0.00 106 R 9.56 5.01 0.00 1.84 1.96 0.00 2.36 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.40 0.00 107 L 8.16 4.84 0.00 1.53 0.80 0.89 0.60 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 0.00 108 V 8.72 4.81 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 0.44 0.00 0.00 0.44 0.00 0.00 109 A 8.14 4.85 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 0.00 110 F 8.93 5.28 0.00 3.01 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 0.00 111 D 8.90 5.35 0.00 2.39 2.45 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 0.00 112 N 9.17 4.76 0.00 2.93 3.05 0.00 0.00 6.30 7.39 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 0.00 113 Q 8.54 4.24 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 114 K 8.39 4.03 0.00 1.76 1.87 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.47 7.81 115 Q 8.03 3.44 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.69 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 116 V 7.81 4.47 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 0.49 0.00 0.00 0.92 0.00 0.00 117 Q 8.83 4.37 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.85 0.00 0.00 0.00 0.00 0.00 2.20 2.00 0.00 118 I 8.20 4.32 0.93 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.17 0.57 0.00 0.00 119 M 6.87 4.68 0.00 2.18 2.33 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.81 0.00 120 G 8.32 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 0.00 0.00 0.00 0.00 121 F 7.70 5.05 0.00 3.23 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 0.00 122 L 8.88 4.61 0.00 1.68 1.67 0.80 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.06 4.54 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 0.66 0.00 0.00 0.91 0.00 0.00 124 Q 7.83 4.54 0.00 2.01 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.85 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 125 R 8.26 4.47 0.00 1.58 1.67 0.00 3.29 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.51 0.00 126 P 0.00 4.18 0.00 2.00 1.90 0.00 2.20 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.44 0.00