NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 K 4.2641 8.3144 119.9998 56.1238 34.7778 175.0592 8 V 4.1028 7.6252 119.2574 60.3546 33.3218 173.3509 9 L 4.6248 9.1623 130.2477 53.6949 43.4244 175.0267 10 K 4.4941 9.0452 127.4485 55.3619 33.8298 175.8617 11 I 4.8937 8.3845 125.4089 59.4843 39.8723 174.5110 12 Q 4.5687 9.1813 128.9560 54.2385 31.2532 174.0929 13 L 4.7703 8.5540 127.0048 54.1645 42.2036 176.8275 14 R 4.5164 9.0527 123.5771 56.3960 31.0609 176.5353 15 S 4.4989 7.5707 111.8454 57.1315 65.1130 176.0574 16 A 4.1162 8.6260 124.2829 54.7488 18.1976 178.9809 17 S 4.3171 8.3516 111.1827 59.9483 63.4042 174.9629 18 A 4.3309 7.6471 122.7571 52.3136 18.6676 176.6732 19 T 4.4565 8.0506 116.8860 61.0781 70.9568 174.7074 20 V 3.6490 8.2610 125.7319 62.2809 31.9167 173.8373 21 P 4.9737 0.0000 0.0000 62.7353 31.8525 175.7614 22 T 5.0712 8.6683 112.7143 59.7501 72.6886 173.3214 23 K 4.4643 8.6618 121.7758 56.1754 32.5268 177.9136 24 G 3.7023 8.7001 111.3168 47.7151 0.0000 173.2930 25 S 4.5142 7.4066 112.8653 56.9260 65.6383 175.0979 26 A 4.0276 8.5435 123.6138 54.7665 18.1710 178.4960 27 T 4.3609 7.6622 103.6303 61.1933 69.1539 174.7094 28 A 4.0387 7.2506 123.5734 52.3691 18.8697 178.5586 29 A 4.0505 8.5746 124.2336 54.0018 18.8923 178.2084 30 G 4.3120 7.4002 100.8991 43.5561 0.0000 172.9038 31 Y 4.4932 8.7577 120.6039 57.2131 39.0752 174.9322 32 D 4.6604 9.2492 124.4372 54.4998 42.2651 175.2053 33 I 4.7380 8.3059 124.0704 59.9294 39.3594 174.1772 34 Y 5.1659 8.6704 124.0295 55.8561 40.1829 175.5263 35 A 4.4646 9.1215 126.3213 52.4531 19.2702 178.0946 36 S 4.7710 8.9556 116.2628 58.6421 64.1450 174.0654 37 Q 4.6143 7.7156 120.9568 54.4343 31.9545 173.8365 38 D 4.7326 8.7109 125.4385 55.1800 41.7139 175.4890 39 I 4.4338 8.4719 120.1646 60.4569 42.0472 172.9572 40 T 5.0113 8.4573 123.9674 62.0090 70.7242 173.8896 41 I 4.3853 8.7893 127.4052 59.1880 38.9497 173.7195 42 P 4.8613 0.0000 0.0000 61.8898 32.6344 175.9475 43 A 4.1213 8.7403 125.6853 54.5676 18.6071 177.4622 44 M 3.3976 8.7430 119.9203 55.9263 31.1577 177.3074 45 G 4.4314 7.9418 107.6164 45.6659 0.0000 171.9055 46 Q 5.6807 8.1243 122.2207 55.4913 32.3749 174.7570 47 G 4.3024 8.4738 110.0556 45.0322 0.0000 170.8618 48 M 5.0541 8.4443 119.4531 53.2857 34.0586 176.0418 49 V 3.9494 8.9497 125.6873 62.1981 32.9622 175.6274 50 S 4.8764 8.8246 124.6087 58.9609 63.4961 174.9353 51 T 4.5441 8.7291 111.5603 60.5092 70.6654 173.7903 52 D 4.4779 8.9075 121.6873 55.0016 39.3492 172.5907 53 I 5.1155 7.6242 110.9032 59.3345 40.8451 174.4103 54 S 5.0720 8.8045 118.8441 56.9347 66.8098 172.9812 55 F 5.4643 7.8868 115.4318 55.9979 41.2890 173.8392 56 T 4.6667 8.9947 116.9257 61.7872 70.5643 174.5532 57 V 4.1675 8.6844 119.8561 60.3479 32.2729 174.7245 58 P 4.4569 0.0000 0.0000 62.3073 32.5792 176.3013 59 V 3.5718 8.3562 121.7491 64.9975 31.9679 176.3374 60 G 3.9633 9.4615 113.9740 45.6588 0.0000 172.0662 61 T 5.6773 7.7256 107.4389 58.7259 72.5002 172.0000 62 Y 4.9707 8.1742 118.3725 55.1674 42.4519 174.3878 63 G 4.1822 9.3176 107.9276 45.3157 0.0000 172.7789 64 R 5.1651 8.7515 128.3310 54.9236 31.7487 175.2561 65 I 4.6892 8.7920 128.7065 60.7089 37.6939 175.2116 66 A 5.0132 9.1243 129.4816 49.0175 22.5082 173.5140 67 P 4.6721 0.0000 0.0000 62.5655 32.7002 176.2095 68 R 4.2555 8.3761 120.2975 55.8362 31.2020 178.2110 69 S 4.2409 8.7265 118.8516 61.4459 62.8702 177.1678 70 G 3.5836 7.9538 108.1932 47.5457 0.0000 175.5385 71 L 3.8356 7.9355 120.7199 57.4857 41.6080 179.1411 72 A 4.1935 7.5827 121.9179 54.7280 18.1437 179.9260 73 V 3.4862 7.6830 115.1141 65.8587 31.7701 177.7874 74 K 4.3289 8.4727 116.5237 57.2239 32.5411 177.0976 75 N 4.7584 7.7932 113.1019 51.8007 39.9946 174.5513 76 G 3.9143 8.0472 106.6590 46.4620 0.0000 173.2242 77 I 4.5880 7.2280 119.6341 60.1961 38.9889 174.7707 78 Q 4.6939 8.8248 126.3150 54.4716 32.8027 174.0531 79 T 4.5157 8.7374 115.7381 61.6591 70.1154 174.2345 80 G 4.0977 8.6548 111.8794 44.0733 0.0000 176.0800 81 A 3.6106 10.0732 124.7013 51.8408 18.3486 179.1256 82 G 3.8925 9.3065 112.3994 46.9511 0.0000 172.5232 83 V 4.4889 7.3674 119.5797 61.7303 31.9738 175.4583 84 V 4.1484 9.0666 130.5468 61.2335 32.5004 175.0419 85 D 4.8449 8.5481 128.2827 54.0571 41.5541 177.9024 86 R 4.0015 8.9266 121.5726 59.0970 30.2670 176.9708 87 D 4.7473 7.9923 114.7752 52.9342 39.7266 175.1543 88 Y 4.3525 7.9394 122.4477 57.8947 38.8398 175.1243 89 T 4.1217 7.8515 115.8446 60.9605 69.7400 174.1729 90 G 3.4067 5.7186 111.2870 44.3985 0.0000 172.8370 91 E 3.9294 8.3498 120.3148 56.2301 29.7586 176.3930 92 V 4.0374 8.5479 127.5182 62.6028 31.2636 175.2672 93 K 4.6887 8.5543 127.1976 55.0940 34.3740 176.2353 94 V 4.2604 8.2743 122.9305 61.2902 33.6707 174.7137 95 V 4.2955 8.2501 128.2864 62.1106 33.0042 174.2420 96 L 5.0129 8.6225 128.0976 52.9246 44.6693 175.3257 97 F 5.2011 9.2036 122.9177 56.0469 41.5138 174.4688 98 N 4.9912 9.3585 123.1322 52.4553 39.9264 174.0268 99 H 4.9621 8.9994 123.4178 55.9605 29.5363 175.7146 100 S 4.6290 7.9879 114.4464 57.1236 64.9019 174.1478 101 Q 4.3780 8.6202 116.5330 56.2122 28.6718 175.8502 102 R 4.7632 7.5723 117.7104 53.9289 32.4805 175.7393 103 D 4.6222 8.9326 123.4061 54.8351 41.9655 175.7323 104 F 4.9531 9.1693 125.3261 56.4426 41.0298 174.2201 105 A 4.4518 8.2217 128.7069 51.5066 19.4805 176.3164 106 I 4.4166 8.6482 122.7732 59.2786 40.9615 174.7906 107 K 5.0223 9.2057 125.6815 53.8968 34.9101 175.7177 108 K 3.9678 9.3692 124.4188 58.4661 32.3961 176.9084 109 G 4.1002 9.5154 115.3672 45.1887 0.0000 173.3911 110 D 4.7110 8.1187 120.1582 54.1665 42.2023 175.8737 111 R 4.4409 8.4511 120.9827 56.0577 30.4706 176.7194 112 V 4.4955 8.5481 114.9559 61.7170 34.6298 174.8547 113 A 4.6617 7.4301 119.8877 51.5973 21.9137 174.6069 114 Q 4.9245 8.6472 112.6867 55.0301 32.6181 173.5737 115 L 5.1654 9.1777 123.9846 53.5939 44.3851 174.9193 116 I 4.6525 8.5407 126.8755 59.5716 40.3113 175.1393 117 L 4.4964 8.5748 127.0962 53.8748 41.2840 174.9585 118 E 4.1863 8.3815 123.7663 55.3925 30.7095 176.3067 119 K 4.8246 8.6214 124.4821 56.3837 33.0553 176.2179 120 I 4.7392 8.3871 116.2479 59.3956 41.3393 175.0111 121 V 3.9569 8.4504 123.2530 62.3101 30.9285 175.1619 122 D 4.9122 8.6730 126.3276 53.1599 39.8842 176.0386 123 D 4.8955 7.6659 118.8060 52.8296 39.9812 175.8117 124 A 4.1063 8.2048 121.5427 53.6170 19.0527 177.5583 125 Q 4.5276 8.3584 119.4565 54.2505 30.2741 175.6513 126 I 4.1084 8.2414 124.1935 60.4236 38.0723 175.3485 127 V 4.3240 8.2413 124.4544 60.8548 33.8246 174.4244 128 V 4.2478 8.3568 126.6554 61.3651 32.6078 175.1466 129 V 4.6022 7.9449 119.3643 59.2842 35.0160 175.5157 130 D 4.5233 8.6949 122.1371 57.3013 40.9283 176.9133 131 S 4.6567 7.4292 110.0831 57.0915 65.5151 174.0847 132 L 4.1958 8.4071 120.4050 55.8946 42.0259 176.8786 133 E 4.2308 7.6559 123.7305 56.0831 29.5592 175.1311 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 7 K 8.31 4.26 0.00 1.89 2.03 0.00 1.53 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.44 7.81 8 V 7.63 4.10 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 0.75 0.00 0.00 0.94 0.00 0.00 9 L 9.16 4.62 0.00 1.55 1.42 0.69 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 10 K 9.05 4.49 0.00 1.76 1.73 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.42 7.81 11 I 8.38 4.89 1.86 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.78 0.94 0.00 0.00 12 Q 9.18 4.57 0.00 2.07 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.89 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 13 L 8.55 4.77 0.00 1.57 1.60 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 14 R 9.05 4.52 0.00 1.74 1.95 0.00 3.15 0.00 0.00 3.26 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.77 0.00 15 S 7.57 4.50 0.00 3.94 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.63 4.12 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.35 4.32 0.00 3.83 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 18 A 7.65 4.33 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 19 T 8.05 4.46 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 0.55 0.00 0.00 20 V 8.26 3.65 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.92 0.00 0.00 21 P 0.00 4.97 0.00 1.85 2.18 0.00 3.69 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.01 0.00 22 T 8.67 5.07 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 1.35 0.00 0.00 23 K 8.66 4.46 0.00 1.61 1.65 0.00 1.47 0.00 0.00 1.58 0.00 0.00 2.13 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.79 0.69 7.81 24 G 8.70 3.70 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 0.00 0.00 0.00 25 S 7.41 4.51 0.00 3.94 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 26 A 8.54 4.03 1.28 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 27 T 7.66 4.36 4.20 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 1.18 0.00 0.00 28 A 7.25 4.04 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 29 A 8.57 4.05 1.23 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 0.00 0.00 30 G 7.40 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 0.00 0.00 0.00 0.00 31 Y 8.76 4.49 0.00 2.94 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 9.25 4.66 0.00 2.53 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 0.00 0.00 0.00 33 I 8.31 4.74 1.88 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.12 0.99 0.00 0.00 34 Y 8.67 5.17 0.00 2.81 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 35 A 9.12 4.46 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 36 S 8.96 4.77 0.00 3.90 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 37 Q 7.72 4.61 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.98 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 38 D 8.71 4.73 0.00 2.58 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 39 I 8.47 4.43 1.87 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 1.23 1.34 0.90 0.00 0.00 40 T 8.46 5.01 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 1.28 0.00 0.00 41 I 8.79 4.39 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.09 0.98 0.00 0.00 42 P 0.00 4.86 0.00 2.11 1.99 0.00 3.82 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 43 A 8.74 4.12 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 M 8.74 3.40 0.00 2.25 2.19 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.63 0.00 45 G 7.94 4.43 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 0.00 0.00 0.00 46 Q 8.12 5.68 0.00 2.27 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.18 2.03 0.00 47 G 8.47 4.30 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 0.00 48 M 8.44 5.05 0.00 1.87 1.98 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 2.47 2.43 0.00 49 V 8.95 3.95 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 0.96 0.00 0.00 0.95 0.00 0.00 50 S 8.82 4.88 0.00 3.84 3.78 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 51 T 8.73 4.54 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 1.33 0.00 0.00 52 D 8.91 4.48 0.00 2.84 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 53 I 7.62 5.12 2.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.47 0.99 0.00 0.00 54 S 8.80 5.07 0.00 3.82 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 55 F 7.89 5.46 0.00 3.01 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 56 T 8.99 4.67 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 1.31 0.00 0.00 57 V 8.68 4.17 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 0.87 0.00 0.00 1.07 0.00 0.00 58 P 0.00 4.46 0.00 2.09 1.98 0.00 3.62 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 59 V 8.36 3.57 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 0.79 0.00 0.00 0.95 0.00 0.00 60 G 9.46 3.96 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 0.00 0.00 0.00 61 T 7.73 5.68 4.30 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 1.26 0.00 0.00 62 Y 8.17 4.97 0.00 3.22 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 63 G 9.32 4.18 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 0.00 64 R 8.75 5.17 0.00 1.72 1.70 0.00 3.21 0.00 0.00 3.35 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 65 I 8.79 4.69 1.93 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.05 0.95 0.00 0.00 66 A 9.12 5.01 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 67 P 0.00 4.67 0.00 2.08 2.07 0.00 3.78 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 1.99 2.20 0.00 68 R 8.38 4.26 0.00 1.88 1.86 0.00 3.08 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 69 S 8.73 4.24 0.00 3.85 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 70 G 7.95 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 71 L 7.94 3.84 0.00 1.61 1.50 1.05 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 72 A 7.58 4.19 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 73 V 7.68 3.49 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 0.98 0.00 0.00 74 K 8.47 4.33 0.00 1.90 1.85 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.46 7.81 75 N 7.79 4.76 0.00 2.30 2.29 0.00 0.00 6.97 7.10 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 76 G 8.05 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 77 I 7.23 4.59 1.60 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.17 0.80 0.00 0.00 78 Q 8.82 4.69 0.00 2.21 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.01 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 79 T 8.74 4.52 4.25 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 1.24 0.00 0.00 80 G 8.65 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 0.00 0.00 0.00 0.00 81 A 10.07 3.61 0.96 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 0.00 0.00 82 G 9.31 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 83 V 7.37 4.49 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 0.39 0.00 0.00 0.84 0.00 0.00 84 V 9.07 4.15 2.43 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 0.87 0.00 0.00 1.04 0.00 0.00 85 D 8.55 4.84 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 86 R 8.93 4.00 0.00 1.86 2.04 0.00 3.49 0.00 0.00 3.33 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 87 D 7.99 4.75 0.00 2.84 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 88 Y 7.94 4.35 0.00 2.85 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.85 4.12 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 90 G 5.72 3.41 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 0.00 91 E 8.35 3.93 0.00 1.92 1.90 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 2.32 2.32 0.00 92 V 8.55 4.04 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 0.91 0.00 0.00 0.36 0.00 0.00 93 K 8.55 4.69 0.00 1.68 1.71 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.45 7.81 94 V 8.27 4.26 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 0.92 0.00 0.00 0.98 0.00 0.00 95 V 8.25 4.30 1.91 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 0.28 0.00 0.00 0.84 0.00 0.00 96 L 8.62 5.01 0.00 1.56 1.49 1.01 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 97 F 9.20 5.20 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 98 N 9.36 4.99 0.00 2.73 2.90 0.00 0.00 6.87 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 H 9.00 4.96 0.00 3.15 3.30 0.00 5.71 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 7.99 4.63 0.00 3.91 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Q 8.62 4.38 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 102 R 7.57 4.76 0.00 1.73 1.87 0.00 3.20 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 103 D 8.93 4.62 0.00 2.60 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 0.00 104 F 9.17 4.95 0.00 3.01 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 0.00 105 A 8.22 4.45 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 0.00 106 I 8.65 4.42 1.91 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 0.98 0.31 0.88 0.00 0.00 107 K 9.21 5.02 0.00 1.59 1.67 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.46 7.81 108 K 9.37 3.97 0.00 1.67 1.77 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.25 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.49 7.81 109 G 9.52 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 0.00 0.00 0.00 0.00 110 D 8.12 4.71 0.00 2.72 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 R 8.45 4.44 0.00 1.56 1.56 0.00 2.92 0.00 0.00 3.01 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 1.50 0.00 112 V 8.55 4.50 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 0.77 0.00 0.00 0.96 0.00 0.00 113 A 7.43 4.66 1.28 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 0.00 114 Q 8.65 4.92 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 115 L 9.18 5.17 0.00 1.69 1.57 0.88 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.54 4.65 1.80 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 1.19 0.57 0.85 0.00 0.00 117 L 8.57 4.50 0.00 1.54 1.62 1.02 0.82 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 0.00 118 E 8.38 4.19 0.00 1.16 1.69 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 1.97 1.92 0.00 119 K 8.62 4.82 0.00 1.65 1.75 0.00 1.71 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.43 7.81 120 I 8.39 4.74 1.96 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.66 1.21 0.00 0.00 121 V 8.45 3.96 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 0.93 0.00 0.00 0.95 0.00 0.00 122 D 8.67 4.91 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 0.00 123 D 7.67 4.90 0.00 2.76 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 0.00 124 A 8.20 4.11 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 0.00 125 Q 8.36 4.53 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 126 I 8.24 4.11 1.87 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 1.30 0.48 0.91 0.00 0.00 127 V 8.24 4.32 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 0.80 0.00 0.00 0.93 0.00 0.00 128 V 8.36 4.25 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 0.88 0.00 0.00 0.93 0.00 0.00 129 V 7.94 4.60 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 0.81 0.00 0.00 0.97 0.00 0.00 130 D 8.69 4.52 0.00 2.66 2.73 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 0.00 131 S 7.43 4.66 0.00 3.92 3.78 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 0.00 132 L 8.41 4.20 0.00 1.66 1.76 0.92 0.83 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 0.00 133 E 7.66 4.23 0.00 1.90 1.79 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 2.22 2.26 0.00