NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.2006 8.1693 122.4863 55.0904 42.2971 175.7784 2 S 4.6085 7.8940 120.9317 55.2624 67.3285 172.8652 3 A 3.9974 8.2382 122.8992 55.0475 18.3206 180.6766 4 D 4.2460 7.9180 117.5248 56.8985 39.6766 178.7670 5 Q 3.9580 7.9047 119.1557 58.3745 28.8996 178.5071 6 I 3.5869 7.6064 121.3717 64.1831 37.0826 178.6118 7 S 4.0980 8.1522 115.2593 61.5556 62.8648 176.6058 8 T 3.7664 7.6085 118.9488 66.5284 68.2288 176.7566 9 V 2.9359 7.4146 119.9246 65.6362 31.2284 178.0205 10 Q 4.1789 7.8341 117.1698 58.3780 28.4337 178.1558 11 A 4.0315 7.9503 121.3584 55.1320 18.3971 179.3429 12 S 4.3664 8.1469 111.6554 61.7178 62.6076 176.2449 13 F 4.6817 9.1646 123.7205 61.3431 38.8820 176.5439 14 D 4.3486 7.9496 117.1102 57.1103 41.0463 178.0885 15 K 4.1660 7.7612 117.0176 58.3770 32.2876 178.4805 16 V 4.4075 7.4968 110.4799 60.6907 32.7851 177.4527 17 K 3.6242 7.7069 117.5535 58.8467 32.5661 177.8486 18 G 3.8072 7.8933 106.9428 46.1393 0.0000 173.0128 19 D 5.0005 8.0315 119.5556 51.6753 41.5259 174.7676 20 P 4.2653 0.0000 0.0000 66.5551 31.2644 178.0907 21 V 3.7718 7.8259 117.4682 65.6567 31.6397 178.1270 22 G 3.7882 8.0849 106.3201 47.2069 0.0000 175.8336 23 I 3.0534 7.1020 122.2026 63.7789 37.0269 178.2172 24 L 3.5857 7.7643 121.2960 57.7995 41.7869 178.1198 25 Y 4.1101 8.4175 119.7796 60.8697 38.8081 178.1378 26 A 3.9022 8.0413 121.3407 55.0307 18.2832 179.8910 27 V 3.3365 7.4226 116.3033 66.2534 31.4326 178.2847 28 F 4.4854 7.9027 116.2711 60.6327 38.7403 177.3329 29 K 3.9519 7.9117 118.3691 59.2265 31.9988 178.5431 30 A 4.3815 7.6378 119.9885 53.9103 18.9749 176.9449 31 D 4.4571 7.9911 117.6500 51.3061 42.3857 173.6485 32 P 4.3334 0.0000 0.0000 65.1014 30.9459 178.0247 33 S 4.2595 8.2149 113.4082 60.8111 63.2616 176.2946 34 I 3.9865 7.8574 124.1504 64.6850 37.0308 177.6913 35 M 2.9210 7.8226 118.2742 58.3223 31.7061 177.6449 36 A 4.2030 7.8406 118.9157 54.0475 18.6032 178.8784 37 K 4.2614 7.8790 115.5395 56.5720 32.5465 176.7152 38 F 4.5657 7.9800 119.8783 55.7888 39.5262 176.8606 39 T 3.8465 8.4980 117.0488 64.6010 68.7142 175.5034 40 Q 4.0028 7.8673 121.7088 57.6960 29.3316 176.0507 41 F 5.0971 7.5800 114.0974 57.1863 41.0282 175.2481 42 A 4.0952 8.0819 124.3275 53.4517 18.5148 177.5891 43 G 3.9054 8.9156 108.9394 45.9288 0.0000 172.9397 44 K 4.5824 7.6751 118.0029 54.1575 35.4238 174.6575 45 D 4.7404 8.2432 118.8681 52.7687 42.3475 176.3456 46 L 3.9590 8.7300 128.4502 58.6505 41.8043 178.8234 47 E 4.0735 8.2985 116.6839 59.2681 29.4905 178.8470 48 S 4.3142 7.9057 114.5111 60.4617 63.3627 175.7908 49 I 4.0340 7.4936 114.4688 61.8911 37.6850 177.4166 50 K 2.4800 7.2699 121.5561 58.7542 31.9088 177.1935 51 G 3.9423 7.7185 104.9818 45.5619 0.0000 173.6268 52 T 4.5630 7.5667 110.9113 59.7444 72.1692 175.3593 53 A 4.1036 8.4360 123.2984 54.9051 18.4266 178.2571 54 P 4.3942 0.0000 0.0000 65.6969 31.4236 178.5672 55 F 4.2857 8.1714 119.3313 61.3602 39.2709 176.8595 56 E 4.0348 8.3813 118.6750 59.4420 29.5521 178.8787 57 T 3.8922 8.1231 115.8262 67.0715 68.5711 176.2644 58 H 4.2167 8.3321 117.7985 58.9438 28.7380 177.8091 59 A 3.9002 8.1944 122.6302 55.1323 18.1480 179.4918 60 N 4.3641 8.4363 115.2005 56.4171 38.6617 177.8870 61 R 4.0063 7.9882 119.1933 59.2701 30.2824 179.2417 62 I 3.9433 7.8676 119.4690 64.5571 37.3287 178.7478 63 V 3.9644 8.1942 119.1562 65.6407 31.4296 178.0787 64 G 3.8437 8.2688 105.9522 47.9561 0.0000 175.4100 65 F 4.2072 8.3790 122.4274 60.8082 39.4058 177.1153 66 F 3.9516 8.3679 120.2311 61.3051 39.0940 176.9671 67 S 3.9288 8.6535 113.1805 61.1783 62.0343 175.8292 68 K 3.6798 7.6851 121.9647 59.6594 31.5468 178.7996 69 I 3.7507 6.4063 120.1088 63.6024 37.3287 178.1128 70 I 3.4492 7.1385 120.8136 64.0639 36.5604 178.7426 71 G 3.6085 7.9111 105.9933 46.6775 0.0000 174.4987 72 E 4.4421 7.4114 117.8392 54.9293 30.0766 175.7059 73 L 3.8935 6.7152 119.3453 55.3128 42.0802 175.1212 74 P 4.6768 0.0000 0.0000 62.7908 31.8473 176.2672 75 N 4.6273 8.1296 120.2684 52.8819 37.1467 174.9493 76 I 4.2770 7.2782 112.5853 60.1411 39.0139 176.8596 77 E 3.9113 8.1638 121.7791 59.7130 29.4312 178.3094 78 A 4.0215 7.9422 120.0946 55.3528 18.4537 179.2297 79 D 4.5685 8.0620 116.9934 57.4038 40.8993 178.9572 80 V 3.7484 8.0210 118.9815 65.9483 31.5130 177.7864 81 N 4.3721 8.4919 116.3998 56.7597 38.4816 177.4108 82 T 3.9007 8.0796 116.9882 66.5828 68.5802 176.2475 83 F 4.1116 8.6457 122.7161 61.5061 39.3535 177.4104 84 V 3.3849 8.2796 117.6508 65.8460 31.1084 177.7470 85 A 4.0043 7.9250 119.8532 54.9907 18.2494 179.1881 86 S 4.2022 7.6638 110.9546 60.5603 63.7047 175.5189 87 H 4.3246 7.7930 118.7388 56.5122 29.2733 177.0173 88 K 3.8199 8.1164 122.3216 59.1500 31.8027 176.8374 89 P 4.3960 0.0000 0.0000 64.4317 31.4392 177.6786 90 R 4.2560 7.3660 115.8370 55.3308 30.1396 176.4600 91 G 3.8888 7.7592 106.1629 46.1248 0.0000 174.3889 92 V 3.6293 7.8782 119.0675 62.9608 32.1539 176.1064 93 T 4.5481 8.1879 117.0472 60.5054 72.1143 175.4664 94 H 3.9266 8.4710 118.3290 58.9513 28.6294 177.6915 95 D 4.4028 8.0848 120.2019 57.6574 40.6563 178.8224 96 Q 4.1321 8.1311 118.3185 58.9360 28.7028 178.7237 97 L 4.2568 8.2672 120.0811 58.1487 41.7267 179.4272 98 N 4.2602 8.6784 116.4929 56.1123 38.3361 177.2566 99 N 4.4373 8.3669 118.1990 55.7605 38.5267 177.1702 100 F 3.9459 8.6145 122.5661 61.2555 39.5283 177.0539 101 R 4.1470 8.2394 118.0333 59.5878 29.8380 178.2245 102 A 4.1041 8.2452 120.6631 55.1543 18.2913 179.8936 103 G 3.4180 8.4040 104.5501 47.7381 0.0000 175.6588 104 F 3.9473 8.2403 123.4912 61.0811 39.2957 177.4785 105 V 2.9618 7.8685 117.7987 65.5517 31.2593 177.8118 106 S 3.8761 8.0290 113.1126 61.4151 62.0922 175.4751 107 Y 3.8659 7.9290 122.1549 61.0687 38.5232 178.1293 108 M 3.8046 7.6419 119.5557 58.2082 31.6615 178.9865 109 K 3.7882 7.3738 117.6596 58.9766 32.2620 178.7166 110 A 4.0947 7.5527 119.1650 53.4870 18.7022 177.4447 111 H 4.5557 7.5556 112.0810 55.3111 30.7848 173.4698 112 T 4.6466 7.5808 107.9762 59.3957 71.6532 173.8704 113 D 4.5848 8.4184 121.4549 53.6301 39.8573 175.8787 114 F 4.6584 8.5598 126.3414 59.0927 39.2964 176.3971 115 A 4.1012 7.9105 120.2802 55.7321 18.0352 179.7774 116 G 3.6358 8.1810 102.1336 46.6248 0.0000 174.4409 117 A 4.6015 7.4150 120.9901 51.6183 19.5892 177.6756 118 E 3.2100 7.4973 119.4180 59.2161 29.6918 178.8064 119 A 3.9821 7.8864 120.1049 55.0246 18.5306 179.2579 120 A 3.8814 7.8809 118.8004 55.1462 18.4318 179.6835 121 W 4.4932 8.4733 117.8022 59.7942 29.0030 178.7892 122 G 3.8354 8.5838 105.6068 47.9754 0.0000 175.4066 123 A 4.0462 8.1861 123.7645 55.0477 18.3184 179.8177 124 T 3.7988 8.0511 114.0861 66.9624 68.4888 176.9439 125 L 4.3988 8.5709 121.0212 57.7313 41.7738 179.1749 126 D 4.4449 8.5995 119.2760 57.6130 40.8336 178.9532 127 T 3.8707 8.0584 116.1489 66.5446 68.5037 176.4363 128 F 4.1809 8.4583 122.6787 61.6135 39.3864 177.2681 129 F 3.7944 8.6091 117.7674 59.8417 38.3602 177.7610 130 G 3.7652 7.8408 105.0145 48.2967 0.0000 175.0268 131 M 4.2093 7.9244 120.2587 58.2550 32.2854 178.3343 132 I 3.7583 7.4812 119.9748 64.5370 37.1267 178.3241 133 F 4.5100 8.4083 116.9201 59.5494 38.8372 177.1450 134 S 4.4904 7.7795 113.0272 59.5530 63.3100 174.7300 135 K 4.5735 7.9229 119.8572 56.7069 34.2998 175.7589 136 M 4.3385 8.2944 120.6868 55.5777 31.1326 174.3909 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 L 8.17 4.20 0.00 1.57 1.66 0.85 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 2 S 7.89 4.61 0.00 4.09 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 A 8.24 4.00 1.30 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 0.00 0.00 4 D 7.92 4.25 0.00 2.88 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 5 Q 7.90 3.96 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.95 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 6 I 7.61 3.59 1.91 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.03 0.78 0.00 0.00 7 S 8.15 4.10 0.00 4.01 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 8 T 7.61 3.77 4.31 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 1.12 0.00 0.00 9 V 7.41 2.94 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.09 0.00 0.00 0.13 0.00 0.00 10 Q 7.83 4.18 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 11 A 7.95 4.03 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 12 S 8.15 4.37 0.00 4.21 4.39 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 13 F 9.16 4.68 0.00 3.52 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 14 D 7.95 4.35 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 15 K 7.76 4.17 0.00 2.04 1.91 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.54 7.81 16 V 7.50 4.41 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.02 0.00 0.00 17 K 7.71 3.62 0.00 1.63 1.22 0.00 1.58 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.35 7.81 18 G 7.89 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 19 D 8.03 5.00 0.00 2.77 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 20 P 0.00 4.27 0.00 2.30 2.35 0.00 3.85 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 21 V 7.83 3.77 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 1.28 0.00 0.00 1.07 0.00 0.00 22 G 8.08 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 0.00 0.00 0.00 23 I 7.10 3.05 1.74 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 0.45 0.12 0.70 0.00 0.00 24 L 7.76 3.59 0.00 1.52 1.41 0.32 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 8.42 4.11 0.00 3.22 3.24 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 26 A 8.04 3.90 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.42 3.34 1.46 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 1.00 0.00 0.00 0.18 0.00 0.00 28 F 7.90 4.49 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 29 K 7.91 3.95 0.00 1.45 1.61 0.00 1.72 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.29 1.01 7.81 30 A 7.64 4.38 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 31 D 7.99 4.46 0.00 2.72 2.59 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 32 P 0.00 4.33 0.00 2.27 2.27 0.00 3.74 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 33 S 8.21 4.26 0.00 4.08 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 34 I 7.86 3.99 2.18 0.00 0.00 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 1.60 1.42 1.39 0.00 0.00 35 M 7.82 2.92 0.00 1.94 1.21 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 1.95 2.42 0.00 36 A 7.84 4.20 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 37 K 7.88 4.26 0.00 1.87 1.76 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.17 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.67 7.81 38 F 7.98 4.57 0.00 3.21 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 39 T 8.50 3.85 4.22 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 1.16 0.00 0.00 40 Q 7.87 4.00 0.00 1.80 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.87 0.00 0.00 0.00 0.00 0.00 2.12 2.07 0.00 41 F 7.58 5.10 0.00 3.08 2.88 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 42 A 8.08 4.10 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 43 G 8.92 3.91 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 0.00 0.00 0.00 44 K 7.68 4.58 0.00 1.87 1.79 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 45 D 8.24 4.74 0.00 2.71 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.73 3.96 0.00 1.80 1.68 1.10 0.73 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 47 E 8.30 4.07 0.00 2.28 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 2.37 2.38 0.00 48 S 7.91 4.31 0.00 4.01 3.90 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 49 I 7.49 4.03 1.87 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.30 0.98 0.00 0.00 50 K 7.27 2.48 0.00 1.54 1.57 0.00 1.30 0.00 0.00 1.40 0.00 0.00 2.72 0.00 0.00 2.25 0.00 0.00 0.00 0.00 1.10 1.06 7.81 51 G 7.72 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 52 T 7.57 4.56 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 1.26 0.00 0.00 53 A 8.44 4.10 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 54 P 0.00 4.39 0.00 2.52 2.28 0.00 3.69 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 2.26 2.25 0.00 55 F 8.17 4.29 0.00 3.02 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 56 E 8.38 4.03 0.00 2.18 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 2.36 2.57 0.00 57 T 8.12 3.89 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 58 H 8.33 4.22 0.00 3.58 3.52 0.00 5.81 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 59 A 8.19 3.90 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.44 4.36 0.00 3.07 2.93 0.00 0.00 7.00 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 61 R 7.99 4.01 0.00 2.16 2.06 0.00 3.14 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 62 I 7.87 3.94 1.98 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.41 1.13 0.00 0.00 63 V 8.19 3.96 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 1.29 0.00 0.00 0.97 0.00 0.00 64 G 8.27 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 0.00 0.00 0.00 65 F 8.38 4.21 0.00 3.29 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 66 F 8.37 3.95 0.00 3.11 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 67 S 8.65 3.93 0.00 4.32 4.15 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 68 K 7.69 3.68 0.00 1.71 1.48 0.00 1.65 0.00 0.00 1.45 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.30 1.36 7.81 69 I 6.41 3.75 1.28 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.95 0.18 0.00 0.00 70 I 7.14 3.45 1.25 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 -0.04 0.59 0.00 0.00 71 G 7.91 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 E 7.41 4.44 0.00 2.04 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 0.00 2.21 2.36 0.00 73 L 6.72 3.89 0.00 1.63 1.51 0.66 0.69 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 74 P 0.00 4.68 0.00 2.11 2.05 0.00 3.69 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.87 0.00 75 N 8.13 4.63 0.00 2.62 2.85 0.00 0.00 6.90 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 I 7.28 4.28 1.80 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 1.49 0.67 0.71 0.00 0.00 77 E 8.16 3.91 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 78 A 7.94 4.02 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 D 8.06 4.57 0.00 2.79 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 80 V 8.02 3.75 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 1.12 0.00 0.00 1.10 0.00 0.00 81 N 8.49 4.37 0.00 3.05 2.90 0.00 0.00 7.02 6.77 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 82 T 8.08 3.90 4.65 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 1.20 0.00 0.00 83 F 8.65 4.11 0.00 3.26 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 V 8.28 3.38 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.12 0.00 0.00 85 A 7.93 4.00 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 86 S 7.66 4.20 0.00 3.87 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 87 H 7.79 4.32 0.00 2.43 2.96 0.00 5.82 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 88 K 8.12 3.82 0.00 1.89 1.72 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.46 7.81 89 P 0.00 4.40 0.00 1.97 2.03 0.00 3.53 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 90 R 7.37 4.26 0.00 1.71 1.83 0.00 2.92 0.00 0.00 2.97 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 91 G 7.76 3.89 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 0.00 0.00 0.00 0.00 92 V 7.88 3.63 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 0.98 0.00 0.00 0.96 0.00 0.00 93 T 8.19 4.55 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 1.27 0.00 0.00 94 H 8.47 3.93 0.00 2.97 3.05 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 95 D 8.08 4.40 0.00 2.74 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 96 Q 8.13 4.13 0.00 2.39 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.61 2.46 0.00 97 L 8.27 4.26 0.00 2.25 2.11 1.16 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.68 4.26 0.00 3.04 2.88 0.00 0.00 7.06 7.78 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 99 N 8.37 4.44 0.00 3.04 2.92 0.00 0.00 6.51 7.52 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 0.00 100 F 8.61 3.95 0.00 3.35 3.43 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.24 4.15 0.00 1.49 1.89 0.00 2.84 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 102 A 8.25 4.10 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 0.00 103 G 8.40 3.42 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 0.00 104 F 8.24 3.95 0.00 2.79 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 0.00 105 V 7.87 2.96 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 0.91 0.00 0.00 1.07 0.00 0.00 106 S 8.03 3.88 0.00 3.96 3.95 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 0.00 107 Y 7.93 3.87 0.00 2.94 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 0.00 108 M 7.64 3.80 0.00 1.41 1.08 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.64 0.00 109 K 7.37 3.79 0.00 1.64 1.72 0.00 1.55 0.00 0.00 1.63 0.00 0.00 3.10 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.43 0.80 7.81 110 A 7.55 4.09 1.10 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 0.00 0.00 111 H 7.56 4.56 0.00 2.60 3.05 0.00 5.60 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 T 7.58 4.65 4.33 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 1.26 0.00 0.00 113 D 8.42 4.58 0.00 2.69 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 0.00 114 F 8.56 4.66 0.00 3.03 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 0.00 115 A 7.91 4.10 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 0.00 116 G 8.18 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 0.00 117 A 7.41 4.60 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 0.00 118 E 7.50 3.21 0.00 1.88 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 2.32 2.35 0.00 119 A 7.89 3.98 1.31 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 0.00 0.00 120 A 7.88 3.88 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 0.00 121 W 8.47 4.49 0.00 3.57 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 0.00 122 G 8.58 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 0.00 0.00 0.00 123 A 8.19 4.05 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 0.00 124 T 8.05 3.80 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 125 L 8.57 4.40 0.00 2.04 2.18 1.32 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.60 4.44 0.00 3.00 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 0.00 127 T 8.06 3.87 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 128 F 8.46 4.18 0.00 2.89 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 0.00 129 F 8.61 3.79 0.00 3.16 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 G 7.84 3.77 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 0.00 0.00 0.00 131 M 7.92 4.21 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 132 I 7.48 3.76 1.77 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.04 1.15 0.00 0.00 133 F 8.41 4.51 0.00 2.87 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 0.00 134 S 7.78 4.49 0.00 4.03 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 0.00 135 K 7.92 4.57 0.00 1.91 1.91 0.00 1.80 0.00 0.00 1.92 0.00 0.00 3.15 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.53 7.81 136 M 8.29 4.34 0.00 2.10 1.97 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 2.58 2.79 0.00