NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 I 4.1492 8.0244 121.4502 60.9811 39.3244 175.8534 4 K 4.2716 7.6080 120.1888 54.0927 34.8734 171.4739 5 E 4.2751 9.4653 128.6313 55.4058 31.4309 175.4493 6 L 4.3760 8.2598 125.2257 55.1078 42.9190 176.3975 7 H 4.5319 8.9594 121.0651 55.6684 29.7769 174.5414 8 V 4.6120 8.4613 124.3132 61.8389 32.6386 175.0954 9 K 4.6172 9.1569 127.5199 54.9053 35.2962 175.2268 10 T 4.9195 8.5219 122.1163 62.4350 69.6423 174.6374 11 V 4.3972 8.1543 124.6450 59.8751 35.4444 174.6652 12 K 4.7083 8.3658 121.4436 54.3569 33.9923 176.4849 13 R 4.3910 8.6964 120.6917 58.3220 30.3240 177.4809 14 G 3.8653 9.3779 109.8862 45.6160 0.0000 172.9645 15 E 4.2834 8.0580 121.3815 55.6205 31.5429 174.6364 16 N 5.3254 8.4403 119.0097 51.8629 41.2066 174.5241 17 V 4.5674 8.9337 121.5460 61.2557 35.3525 174.0619 18 T 4.9087 8.4590 116.5949 60.0706 71.2955 172.9093 19 M 4.7285 9.0238 124.6592 53.5710 34.9232 174.6723 20 E 5.2512 8.9769 122.5065 55.6559 31.7344 176.0479 21 C 5.0892 9.5216 121.8359 54.9373 47.7369 172.3417 22 S 5.0832 8.7323 119.9710 57.4603 63.2237 173.1402 23 M 4.1915 9.2201 127.2048 57.6699 33.2029 177.5844 24 S 4.5495 7.7671 112.5634 57.0002 62.0923 174.6066 25 K 4.3167 7.2652 113.4554 57.2946 33.2343 174.7263 26 V 4.0607 8.0695 117.2203 62.1695 32.3442 176.1675 27 T 3.9901 8.8640 122.9845 65.5886 68.8050 175.0998 28 N 4.7166 8.6979 123.6044 51.1258 40.3092 174.3176 29 K 3.3766 8.4922 126.2712 59.4921 32.1236 178.9695 30 N 4.7862 7.9604 113.0533 55.0082 38.8823 175.1060 31 N 4.6828 8.3157 116.1589 53.1396 39.3308 174.0062 32 L 4.8632 7.7063 121.9788 54.1647 43.7978 175.1545 33 A 5.2921 8.5502 124.6559 51.0118 23.2793 175.2899 34 W 5.2395 9.4253 121.4293 56.1859 31.1876 175.1972 35 Y 5.1634 9.8737 120.8835 56.2610 41.2844 174.6263 36 R 4.1265 8.9966 122.6063 54.2793 33.3579 173.7988 37 Q 4.6389 8.8185 128.9018 54.0937 30.9261 174.7748 38 S 4.1666 8.1428 122.9896 57.7444 64.4046 174.2538 39 F 4.4966 8.1464 121.9502 59.2779 39.0448 175.9369 40 G 3.9984 9.1818 112.4115 45.6722 0.0000 172.9850 41 K 4.6831 7.7516 117.7687 53.6278 35.2192 176.2945 42 V 3.7366 8.1871 120.7270 62.2677 32.0178 174.4273 43 P 4.6857 0.0000 0.0000 63.0431 32.0674 175.5853 44 Q 4.8802 8.7508 118.9674 53.8943 33.0690 174.2109 45 Y 3.2558 9.0705 123.8786 58.5851 38.9508 174.1734 46 F 4.7801 8.3784 127.1060 59.0742 41.9899 175.0329 47 V 4.4012 6.9381 116.9749 59.9108 34.4872 173.1742 48 R 5.3360 8.5197 119.9660 54.2823 32.7863 174.4903 49 Y 4.9600 8.9498 122.1220 58.3510 39.6185 174.7905 50 Y 4.6267 8.4255 126.7154 56.5186 42.4509 174.1676 51 S 4.1028 8.1659 123.1246 59.2508 63.6798 174.1224 52 S 4.2189 8.3958 116.7565 58.5947 62.7402 175.7891 53 N 4.3455 7.2619 120.4005 56.9683 38.9055 175.9976 54 S 4.3338 7.8542 111.4187 58.1675 63.8218 175.3880 55 G 4.2449 9.2415 110.0320 45.8734 0.0000 172.3881 56 Y 5.4825 6.9646 115.5813 55.9351 41.7146 174.4972 57 K 4.3634 9.0794 121.2388 54.7151 35.4101 175.6826 58 F 4.3860 9.0665 125.9668 56.9210 40.1492 175.0402 59 A 4.2815 8.9732 123.5896 52.8273 18.9204 178.5284 60 E 3.9858 9.3873 121.3963 59.8312 29.9709 179.8649 61 G 4.0504 7.9335 105.8660 44.4240 0.0000 173.6411 62 F 4.9000 7.7037 118.3044 57.0933 42.9670 173.8107 63 K 4.2377 7.3372 125.4272 56.0463 34.0109 175.1887 64 D 4.3597 6.0500 120.0765 52.8369 41.2039 177.1309 65 S 4.2757 8.4058 121.5372 60.3092 63.7140 175.4416 66 R 4.0316 8.3135 120.7287 58.3189 30.8778 176.1423 67 F 5.1063 7.8601 118.0609 56.2293 40.2739 175.3004 68 S 5.0093 9.1354 117.3676 57.3143 66.7160 171.9427 69 M 4.9366 8.0620 119.6403 53.5857 35.7418 175.6701 70 T 4.4632 8.8972 119.4290 62.2470 70.2951 173.6978 71 V 5.1289 8.4789 127.1310 61.3135 33.4740 174.4154 72 N 5.0073 8.9339 124.8253 52.3724 39.6250 174.3424 73 D 4.2729 8.8503 116.5214 57.1627 41.3767 176.9966 74 Q 4.5307 8.9201 118.2203 56.4190 31.0120 175.9286 75 K 5.1238 8.1256 116.7212 54.3449 36.0672 175.7103 76 F 5.7059 8.9413 123.6457 56.6698 38.7397 172.7618 77 D 5.2729 9.0117 121.5789 52.1650 44.0578 175.6702 78 L 4.4925 8.2757 125.2879 53.7622 43.5771 174.7129 79 N 5.2854 8.9808 124.3447 51.5532 41.4035 173.8450 80 I 4.5290 8.6915 123.5495 59.3731 40.4344 174.4106 81 I 4.5801 7.6958 127.5697 59.0346 38.6025 175.7100 82 G 3.5086 8.7024 115.4513 44.7454 0.0000 173.3058 83 A 4.2446 8.6365 122.6604 52.7130 19.8043 177.4868 84 R 4.7588 9.0031 120.1030 53.6988 33.6934 176.8280 85 E 2.5400 8.0901 119.8854 58.9209 29.6543 178.6696 86 D 4.4769 7.7130 116.8708 56.5234 40.9740 176.9489 87 D 4.7045 7.8301 118.4773 55.9375 41.1043 177.1816 88 G 4.0393 7.9798 108.9026 45.3206 0.0000 174.6404 89 G 2.6664 7.1481 108.5646 44.1108 0.0000 171.0089 90 E 5.0565 7.7593 119.3081 54.5859 33.1019 175.0561 91 Y 4.7935 8.7730 120.5235 56.0843 41.8092 174.5509 92 F 5.5454 9.3213 122.4059 55.8690 43.2676 172.9591 93 C 4.9874 9.2913 123.8133 54.7132 39.8136 172.7856 94 G 4.3227 9.2511 112.2514 44.9344 0.0000 170.7141 95 E 5.1309 8.7441 122.2078 53.7534 32.3387 175.1719 96 V 4.0238 8.2513 127.4684 62.9586 32.5076 175.2439 97 E 4.3346 9.3159 129.1749 55.0154 30.7182 175.6216 98 G 4.0298 9.3682 114.2255 46.8570 0.0000 172.6377 99 I 3.2076 7.5054 107.5468 61.7568 38.2742 174.3326 100 I 4.2811 7.2688 122.5772 59.9140 38.7977 174.4664 101 I 4.2919 8.1410 127.6072 59.9417 39.0254 174.5985 102 K 4.3953 8.5243 129.0379 54.6752 34.2909 175.1356 103 F 5.0728 8.6702 124.4063 56.6061 39.3740 175.9270 104 T 4.3329 9.1657 114.8012 62.6818 69.4525 174.3735 105 S 4.6905 7.7028 115.1419 58.0036 66.3733 173.4478 106 G 4.5327 8.3177 105.9741 45.9984 0.0000 171.9728 107 T 5.3539 9.2978 116.3906 61.6415 72.9102 173.1833 108 R 4.9686 8.9146 126.2913 54.9130 32.0802 174.5817 109 L 5.2280 9.4186 127.7004 53.1033 44.0315 175.4576 110 Q 5.0088 9.1140 122.5640 54.3467 31.5086 175.9614 111 F 4.6916 9.0515 120.0645 56.9174 39.2253 175.5841 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 3 I 8.02 4.15 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.06 0.91 0.00 0.00 4 K 7.61 4.27 0.00 1.74 1.65 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.57 1.57 7.81 5 E 9.47 4.28 0.00 1.98 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 2.31 2.35 0.00 6 L 8.26 4.38 0.00 1.64 1.68 1.12 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 7 H 8.96 4.53 0.00 3.14 3.27 0.00 5.60 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.46 4.61 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 0.81 0.00 0.00 0.98 0.00 0.00 9 K 9.16 4.62 0.00 1.63 1.58 0.00 1.69 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.31 1.39 7.81 10 T 8.52 4.92 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 1.15 0.00 0.00 11 V 8.15 4.40 1.81 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 -0.21 0.00 0.00 0.80 0.00 0.00 12 K 8.37 4.71 0.00 1.93 1.77 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.37 7.81 13 R 8.70 4.39 0.00 1.85 1.92 0.00 3.30 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.77 0.00 14 G 9.38 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 15 E 8.06 4.28 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 16 N 8.44 5.33 0.00 2.62 2.69 0.00 0.00 6.17 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 17 V 8.93 4.57 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 0.79 0.00 0.00 0.79 0.00 0.00 18 T 8.46 4.91 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 19 M 9.02 4.73 0.00 1.74 1.28 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 20 E 8.98 5.25 0.00 1.92 1.97 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 2.30 2.31 0.00 21 C 9.52 5.09 0.00 2.98 3.46 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 22 S 8.73 5.08 0.00 3.96 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 23 M 9.22 4.19 0.00 2.29 2.08 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 2.75 0.00 24 S 7.77 4.55 0.00 4.02 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 25 K 7.27 4.32 0.00 1.65 1.72 0.00 1.64 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.43 7.81 26 V 8.07 4.06 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 0.78 0.00 0.00 0.85 0.00 0.00 27 T 8.86 3.99 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 1.16 0.00 0.00 28 N 8.70 4.72 0.00 2.58 2.58 0.00 0.00 7.28 6.70 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 29 K 8.49 3.38 0.00 1.37 0.74 0.00 1.55 0.00 0.00 1.64 0.00 0.00 2.41 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.01 1.17 7.81 30 N 7.96 4.79 0.00 2.72 2.95 0.00 0.00 6.86 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 31 N 8.32 4.68 0.00 2.93 2.85 0.00 0.00 6.48 6.41 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 32 L 7.71 4.86 0.00 1.49 1.14 0.76 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.55 5.29 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 34 W 9.43 5.24 0.00 3.34 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 35 Y 9.87 5.16 0.00 3.25 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 R 9.00 4.13 0.00 0.78 0.99 0.00 2.21 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.50 0.00 37 Q 8.82 4.64 0.00 2.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.75 0.00 0.00 0.00 0.00 0.00 2.15 2.40 0.00 38 S 8.14 4.17 0.00 3.70 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.15 4.50 0.00 3.07 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 40 G 9.18 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.75 4.68 0.00 1.88 1.68 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.38 7.81 42 V 8.19 3.74 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 0.85 0.00 0.00 0.96 0.00 0.00 43 P 0.00 4.69 0.00 2.27 2.21 0.00 3.74 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 2.09 2.28 0.00 44 Q 8.75 4.88 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 45 Y 9.07 3.26 0.00 2.65 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 46 F 8.38 4.78 0.00 2.97 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 47 V 6.94 4.40 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 0.00 0.00 0.51 0.00 0.00 0.08 0.00 0.00 48 R 8.52 5.34 0.00 2.17 2.48 0.00 3.01 0.00 0.00 3.32 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.75 0.00 49 Y 8.95 4.96 0.00 2.55 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 50 Y 8.43 4.63 0.00 3.12 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.17 4.10 0.00 3.55 3.63 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 52 S 8.40 4.22 0.00 4.07 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 0.00 53 N 7.26 4.35 0.00 2.64 2.86 0.00 0.00 7.08 7.51 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 54 S 7.85 4.33 0.00 3.62 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 55 G 9.24 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 0.00 0.00 0.00 0.00 56 Y 6.96 5.48 0.00 2.98 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.08 4.36 0.00 1.13 1.46 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.67 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.17 7.81 58 F 9.07 4.39 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 59 A 8.97 4.28 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 60 E 9.39 3.99 0.00 2.04 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 0.00 2.40 2.35 0.00 61 G 7.93 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 F 7.70 4.90 0.00 2.98 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.34 4.24 0.00 1.48 1.52 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.68 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.23 1.26 7.81 64 D 6.05 4.36 0.00 2.16 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 0.00 0.00 0.00 65 S 8.41 4.28 0.00 3.97 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 66 R 8.31 4.03 0.00 1.77 1.98 0.00 3.33 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 67 F 7.86 5.11 0.00 2.88 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 68 S 9.14 5.01 0.00 3.88 3.66 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 69 M 8.06 4.94 0.00 1.22 0.57 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.90 0.00 70 T 8.90 4.46 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 1.25 0.00 0.00 71 V 8.48 5.13 2.34 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 1.31 0.00 0.00 1.22 0.00 0.00 72 N 8.93 5.01 0.00 3.02 2.98 0.00 0.00 6.56 7.35 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 73 D 8.85 4.27 0.00 2.73 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.92 4.53 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.71 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 75 K 8.13 5.12 0.00 1.60 2.09 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.59 7.81 76 F 8.94 5.71 0.00 2.96 3.06 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 77 D 9.01 5.27 0.00 2.62 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 78 L 8.28 4.49 0.00 0.53 0.82 0.35 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.98 5.29 0.00 2.54 2.58 0.00 0.00 6.35 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 80 I 8.69 4.53 1.56 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.15 0.46 0.53 0.00 0.00 81 I 7.70 4.58 1.80 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 1.04 1.79 0.92 0.00 0.00 82 G 8.70 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 0.00 0.00 0.00 83 A 8.64 4.24 1.53 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 0.00 0.00 0.00 84 R 9.00 4.76 0.00 1.72 1.68 0.00 3.09 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.48 0.00 85 E 8.09 2.54 0.00 1.65 1.71 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 2.24 2.06 0.00 86 D 7.71 4.48 0.00 2.67 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 87 D 7.83 4.70 0.00 3.05 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 88 G 7.98 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 89 G 7.15 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 7.76 5.06 0.00 1.47 1.61 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 2.28 2.23 0.00 91 Y 8.77 4.79 0.00 2.85 2.84 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 92 F 9.32 5.55 0.00 2.73 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 93 C 9.29 4.99 0.00 1.23 2.32 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 0.00 94 G 9.25 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 0.00 0.00 0.00 0.00 95 E 8.74 5.13 0.00 1.87 1.66 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 2.09 2.09 0.00 96 V 8.25 4.02 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 0.76 0.00 0.00 0.90 0.00 0.00 97 E 9.32 4.33 0.00 1.94 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 98 G 9.37 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 99 I 7.51 3.21 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.50 0.90 0.00 0.00 100 I 7.27 4.28 1.93 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.91 0.84 0.00 0.00 101 I 8.14 4.29 1.58 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 0.96 0.38 0.43 0.00 0.00 102 K 8.52 4.40 0.00 1.56 1.59 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.77 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.26 1.46 7.81 103 F 8.67 5.07 0.00 2.84 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 0.00 104 T 9.17 4.33 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 1.17 0.00 0.00 105 S 7.70 4.69 0.00 4.08 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 0.00 106 G 8.32 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 0.00 0.00 0.00 0.00 107 T 9.30 5.35 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 1.29 0.00 0.00 108 R 8.91 4.97 0.00 2.02 1.89 0.00 3.41 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.83 0.00 109 L 9.42 5.23 0.00 1.72 1.56 0.81 0.76 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 0.00 110 Q 9.11 5.01 0.00 2.10 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.27 0.00 111 F 9.05 4.69 0.00 3.14 3.10 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