NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 P 4.3972 0.0000 0.0000 62.5596 33.6654 176.7972 23 R 3.9307 7.5716 117.1440 53.5060 30.6863 174.2098 24 P 4.5950 0.0000 0.0000 61.1592 33.4802 173.8533 25 P 4.2933 0.0000 0.0000 62.5921 31.5808 176.4856 26 K 4.3902 8.3400 120.9141 55.0039 33.5908 175.4659 27 V 3.9792 8.4429 126.2470 64.4291 32.4329 176.4244 28 G 3.8912 7.7284 107.0143 44.8419 0.0000 173.6127 29 S 4.1982 8.7200 108.9256 58.9371 63.0397 175.0698 30 S 3.5075 7.4620 113.2314 59.9031 63.5725 172.9314 31 G 4.0430 8.2043 104.0134 44.9636 0.0000 172.7714 32 N 4.6444 8.0682 116.3876 53.3499 40.6099 174.8716 33 A 4.7215 8.5224 122.0504 49.5768 22.7576 175.5704 34 S 3.7584 8.2465 112.8027 58.1478 62.4804 174.7351 35 W 4.0326 8.5806 124.8811 58.8449 29.1073 175.9369 36 F 5.6695 7.7102 115.5425 55.0110 41.1889 175.8731 37 Q 4.8640 9.1298 118.9382 55.9488 28.9751 176.3598 38 A 4.3201 8.6020 122.0137 51.9289 19.5106 176.7047 39 I 4.6549 8.5282 112.8551 59.5734 40.1811 174.9169 40 K 5.3052 9.3539 123.3287 54.4160 35.5269 175.7516 41 A 3.5418 9.0035 126.3976 51.9106 18.5016 177.9578 42 K 4.1252 8.3608 119.8535 57.8200 33.0326 177.2323 43 K 4.6846 8.0965 118.5298 53.9549 35.8644 177.2065 44 L 4.1288 8.5207 119.8579 56.9889 41.6266 177.9774 45 N 5.0242 7.8111 114.7455 52.2936 37.6508 174.8121 46 S 4.1767 7.5868 114.0641 58.4842 63.2909 172.5527 47 P 4.5732 0.0000 0.0000 61.8830 31.8679 176.2282 48 Q 4.0354 8.3916 117.6805 55.3580 28.9238 174.5373 49 P 3.7122 0.0000 0.0000 62.7052 31.9886 175.4611 50 K 4.3509 8.4930 121.4681 54.5382 35.4247 175.4286 51 F 4.4319 8.4764 121.5428 55.6909 40.6492 174.6989 52 E 4.1769 9.0749 124.6889 58.2894 30.4840 178.5012 53 G 4.2553 7.6814 110.0137 45.1127 0.0000 174.7567 54 S 4.3128 9.2296 114.9414 60.6897 63.2887 176.7534 55 G 3.4761 8.2837 106.6708 45.0912 0.0000 172.7870 56 V 3.8553 7.4876 119.4255 59.9064 32.7804 174.0356 57 P 3.9101 0.0000 0.0000 62.1061 31.7841 175.9495 58 D 4.3927 8.4443 122.6224 54.9180 41.8397 176.3440 59 N 4.3879 8.2595 116.6882 53.4114 40.9204 174.5311 60 E 4.2604 8.9766 125.6722 57.3903 29.9438 178.1806 61 N 4.3639 8.3899 116.9790 55.0272 38.7921 175.1060 62 L 4.8052 7.3728 117.2964 52.5887 44.0693 176.5063 63 K 4.3297 8.9514 122.2381 55.4772 33.4222 177.8978 64 T 3.8404 8.6146 114.9528 65.5023 67.2589 176.1530 65 S 4.3573 8.0999 114.9802 60.7084 63.1305 175.1357 66 Q 4.6856 7.9711 117.8659 55.3240 29.1201 176.6200 67 Q 4.5501 7.9157 120.1936 54.1101 27.0542 174.0147 68 H 5.5332 7.4136 115.5200 54.1691 32.1020 174.8742 69 G 5.1674 8.6907 107.3985 46.3460 0.0000 171.1904 70 Y 5.0531 6.8811 118.0083 55.0418 42.0032 174.4371 71 W 5.2422 9.2170 121.1412 55.2969 31.4882 175.1267 72 R 5.2975 9.4852 125.2988 54.3475 32.5165 174.7057 73 R 3.2675 8.2365 127.3953 55.8891 30.9729 175.1476 74 Q 4.6110 8.9651 127.4731 53.9299 30.9740 174.7065 75 A 4.3422 8.5870 128.3970 52.3380 19.4523 176.5606 76 R 4.5902 7.7843 117.6382 54.5570 34.7422 174.2772 77 F 5.6022 8.6064 119.1615 56.0633 43.5890 173.6912 78 K 4.9144 8.9156 119.0016 54.7419 36.3138 173.8710 79 P 5.1237 0.0000 0.0000 60.9089 31.0148 177.8504 80 G 4.1200 8.2460 107.7066 45.8998 0.0000 173.4781 81 K 4.0692 8.4970 125.8438 57.9884 32.4312 175.7128 82 G 4.3745 8.5834 117.1834 45.0364 0.0000 173.7783 83 R 4.8218 6.5427 123.3869 56.0150 29.4221 174.6231 84 R 4.2520 8.2915 126.8455 56.7578 31.4905 175.8594 85 K 4.8576 8.8936 126.8404 53.9302 34.9399 173.8958 86 P 4.9850 0.0000 0.0000 62.4521 32.1522 175.7820 87 V 4.5198 8.0287 123.5386 58.8257 33.9338 173.9018 88 P 4.4390 0.0000 0.0000 62.7567 32.1024 176.0222 89 D 4.6672 8.8577 121.2130 54.9319 42.2378 175.2045 90 A 5.3662 8.7349 123.4101 50.1265 22.2001 175.5789 91 W 5.4265 9.2985 120.4718 55.1676 32.8921 174.2642 92 Y 5.1817 9.4939 121.5085 56.1566 41.0969 174.3692 93 F 3.9058 8.1786 124.9050 56.9527 40.6561 174.4232 94 Y 4.0522 6.6342 122.5958 55.5653 41.9818 174.6374 95 Y 4.5162 8.0560 120.5086 57.9493 39.6053 175.8871 96 T 4.4798 8.4712 118.6982 65.9038 69.1316 175.3721 97 G 4.2830 9.6480 113.3951 45.3466 0.0000 172.5585 98 T 4.6188 7.7107 108.3908 60.4193 72.0748 174.5078 99 G 3.2849 8.4335 110.0377 43.8397 0.0000 172.2088 100 P 4.0588 0.0000 0.0000 64.8279 31.4684 177.1366 101 A 4.5404 7.8628 120.7009 51.3506 19.6243 178.7105 102 A 4.2128 7.8986 126.0332 57.0596 18.5766 180.6085 103 D 4.5655 7.9290 113.5689 56.1630 41.2741 176.8192 104 L 4.4013 7.7149 119.3924 54.3949 42.5684 176.3876 105 N 4.6883 8.8882 119.1566 51.5595 39.7173 174.8754 106 W 2.5400 8.2351 130.7166 58.6195 30.8789 176.3635 107 G 3.3260 5.3800 113.9057 44.7569 0.0000 173.2177 108 D 4.3102 6.9945 120.1762 54.0670 41.1041 176.3040 109 S 4.1879 8.5882 118.6324 59.1070 63.1065 173.2986 110 Q 4.4080 8.2918 122.3536 55.0213 31.6735 172.5412 111 D 4.5246 8.9003 125.2985 56.0849 41.7095 176.0927 112 G 3.8813 9.3144 113.5277 45.8153 0.0000 171.9507 113 I 5.0694 7.7274 119.0492 59.1134 40.1364 175.0865 114 V 4.3761 9.0214 127.5030 60.7531 33.8312 174.5440 115 W 4.8705 8.6673 128.0597 56.4831 29.8951 176.1702 116 V 5.0210 9.4247 116.4768 60.0960 35.5481 174.4532 117 A 5.2132 8.3601 123.0536 50.7678 22.4831 176.4209 118 A 4.2325 8.9231 123.4961 51.2155 20.0268 177.2544 119 K 3.9185 8.5459 121.0351 58.2564 32.4826 177.3889 120 G 3.8975 8.9172 114.2240 44.8805 0.0000 173.3621 121 A 4.1806 7.6457 122.6887 52.2301 19.0284 177.1381 122 D 4.5341 8.5979 121.9061 52.5642 40.7610 177.3529 123 V 3.0532 7.7946 118.1969 62.0789 31.3231 177.3337 124 K 4.2981 8.0456 119.5867 56.5764 32.8288 177.1067 125 S 4.1637 8.4217 116.3807 58.1349 63.2707 173.3551 126 R 4.7018 8.4207 124.8720 53.9519 30.6687 176.3466 127 S 4.2681 8.5990 117.9063 58.8430 63.3735 173.6803 128 N 5.0047 8.2271 116.4956 53.2677 38.9493 175.8881 129 Q 4.0625 8.1472 117.5840 55.1955 30.2630 177.8900 130 G 4.0148 8.1325 106.0528 45.5052 0.0000 171.7278 131 T 4.2983 8.2498 108.5507 59.5925 72.6502 173.1793 132 R 2.9345 7.4366 122.0873 54.4150 31.5824 174.5842 133 D 5.1692 8.7182 126.8549 52.3787 41.6913 175.0204 134 P 4.6234 0.0000 0.0000 64.8698 31.6985 177.0096 135 D 4.5499 8.2386 118.3413 55.6334 41.1831 177.0436 136 K 4.2661 8.1144 117.5278 56.5722 33.9519 176.6441 137 F 4.9435 7.8118 115.0393 55.4664 42.3008 174.5365 138 D 4.7046 8.6626 124.1962 53.4332 41.7227 176.1051 139 Q 4.2971 8.4568 118.8162 57.1147 29.7761 175.0150 140 Y 4.4672 9.0308 119.4838 55.8667 40.2338 173.5772 141 P 4.8673 0.0000 0.0000 62.7394 32.3600 175.9879 142 L 4.0128 8.7521 123.5211 53.8902 42.6543 176.8782 143 R 4.5851 7.7295 121.0489 54.4379 32.8567 174.4369 144 F 5.0802 8.3947 121.0039 55.2063 39.3047 175.8339 145 S 4.3136 9.0729 121.3692 60.9755 63.0857 175.6088 146 D 4.8686 7.9357 114.9507 53.9335 41.3090 176.2491 147 G 4.2655 8.5521 107.4680 45.5798 0.0000 173.8897 148 G 3.5959 7.8433 111.4888 42.7231 0.0000 170.8411 149 P 3.5183 0.0000 0.0000 61.4436 32.3940 175.2194 150 D 4.4670 7.6439 118.9535 52.7118 39.8613 177.3522 151 G 3.7742 8.3522 106.7291 47.1867 0.0000 174.0688 152 N 4.4103 9.0477 117.8256 54.1207 38.7671 174.3505 153 F 5.1615 7.7138 116.6699 55.7075 42.6005 174.3097 154 R 4.6522 9.1763 117.2844 55.3923 33.2365 173.3784 155 W 5.2454 7.4698 114.1581 55.6398 30.5561 174.0833 156 D 4.5473 8.9146 121.7245 53.9506 41.0704 176.2595 157 F 4.3216 8.7498 125.5709 58.1305 39.9846 174.4760 158 I 4.2235 7.3422 128.0875 58.6136 38.6145 173.8119 159 P 4.0674 0.0000 0.0000 63.0185 32.0095 176.7211 160 L 4.1293 8.4819 119.8034 56.0406 40.3197 174.0819 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 22 P 0.00 4.40 0.00 2.06 2.14 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 23 R 7.57 3.93 0.00 1.88 1.86 0.00 3.21 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 24 P 0.00 4.60 0.00 2.17 2.07 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 25 P 0.00 4.29 0.00 2.06 2.03 0.00 3.61 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 26 K 8.34 4.39 0.00 1.64 1.68 0.00 1.64 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.44 7.81 27 V 8.44 3.98 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 0.86 0.00 0.00 0.93 0.00 0.00 28 G 7.73 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 29 S 8.72 4.20 0.00 3.96 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 30 S 7.46 3.51 0.00 3.91 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 31 G 8.20 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 32 N 8.07 4.64 0.00 2.89 2.66 0.00 0.00 6.75 6.87 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 33 A 8.52 4.72 1.05 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 34 S 8.25 3.76 0.00 3.09 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 35 W 8.58 4.03 0.00 2.80 2.38 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 36 F 7.71 5.67 0.00 2.87 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 37 Q 9.13 4.86 0.00 2.19 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.95 0.00 0.00 0.00 0.00 0.00 2.59 2.22 0.00 38 A 8.60 4.32 0.65 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 0.00 0.00 39 I 8.53 4.65 1.89 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.83 0.24 0.00 0.00 40 K 9.35 5.31 0.00 1.91 1.78 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.51 7.81 41 A 9.00 3.54 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 42 K 8.36 4.13 0.00 1.46 1.77 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.35 7.81 43 K 8.10 4.68 0.00 1.65 1.70 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.25 1.45 7.81 44 L 8.52 4.13 0.00 1.63 1.74 0.93 0.95 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 45 N 7.81 5.02 0.00 2.79 2.85 0.00 0.00 6.07 7.64 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 46 S 7.59 4.18 0.00 3.75 3.59 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 47 P 0.00 4.57 0.00 2.04 2.02 0.00 3.66 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 2.01 2.06 0.00 48 Q 8.39 4.04 0.00 1.67 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.94 0.00 0.00 0.00 0.00 0.00 2.29 2.18 0.00 49 P 0.00 3.71 0.00 0.49 0.49 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.44 0.00 50 K 8.49 4.35 0.00 1.52 1.54 0.00 1.54 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.22 1.20 7.81 51 F 8.48 4.43 0.00 2.87 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 52 E 9.07 4.18 0.00 1.93 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 2.30 2.36 0.00 53 G 7.68 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 0.00 0.00 0.00 0.00 54 S 9.23 4.31 0.00 4.06 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 55 G 8.28 3.48 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 0.00 56 V 7.49 3.86 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 0.69 0.00 0.00 1.06 0.00 0.00 57 P 0.00 3.91 0.00 0.49 0.62 0.00 2.20 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.28 0.00 58 D 8.44 4.39 0.00 2.42 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 59 N 8.26 4.39 0.00 2.99 2.73 0.00 0.00 7.16 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 60 E 8.98 4.26 0.00 1.96 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 2.30 2.31 0.00 61 N 8.39 4.36 0.00 2.65 2.71 0.00 0.00 6.78 7.44 0.00 0.00 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 L 7.37 4.81 0.00 1.57 1.48 0.63 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.95 4.33 0.00 1.81 1.71 0.00 1.63 0.00 0.00 1.54 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.39 7.81 64 T 8.61 3.84 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 1.20 0.00 0.00 65 S 8.10 4.36 0.00 4.03 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 66 Q 7.97 4.69 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.26 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 67 Q 7.92 4.55 0.00 2.29 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.65 0.00 0.00 0.00 0.00 0.00 2.57 2.45 0.00 68 H 7.41 5.53 0.00 3.53 3.35 0.00 5.56 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 69 G 8.69 5.17 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 0.00 0.00 0.00 70 Y 6.88 5.05 0.00 2.15 1.43 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 71 W 9.22 5.24 0.00 3.44 3.52 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 72 R 9.49 5.30 0.00 2.18 2.05 0.00 3.13 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 73 R 8.24 3.27 0.00 0.67 1.12 0.00 3.23 0.00 0.00 2.90 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.68 0.00 74 Q 8.97 4.61 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.73 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 75 A 8.59 4.34 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 76 R 7.78 4.59 0.00 1.58 1.69 0.00 3.13 0.00 0.00 3.43 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 77 F 8.61 5.60 0.00 2.86 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 78 K 8.92 4.91 0.00 1.84 1.90 0.00 1.34 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.42 7.81 79 P 0.00 5.12 0.00 2.12 2.11 0.00 3.55 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.84 0.00 80 G 8.25 4.12 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 0.00 0.00 0.00 81 K 8.50 4.07 0.00 1.77 1.79 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.45 7.81 82 G 8.58 4.37 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 0.00 83 R 6.54 4.82 0.00 2.06 1.84 0.00 3.11 0.00 0.00 3.08 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.28 0.00 84 R 8.29 4.25 0.00 1.73 1.81 0.00 2.89 0.00 0.00 2.49 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 85 K 8.89 4.86 0.00 1.99 1.73 0.00 1.91 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.54 7.81 86 P 0.00 4.99 0.00 2.08 2.13 0.00 3.51 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 87 V 8.03 4.52 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 0.70 0.00 0.00 0.93 0.00 0.00 88 P 0.00 4.44 0.00 2.02 2.17 0.00 3.68 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 89 D 8.86 4.67 0.00 2.88 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 90 A 8.73 5.37 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 91 W 9.30 5.43 0.00 3.21 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.49 5.18 0.00 3.08 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 93 F 8.18 3.91 0.00 1.51 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 0.00 0.00 0.00 94 Y 6.63 4.05 0.00 1.43 2.24 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 95 Y 8.06 4.52 0.00 3.11 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 96 T 8.47 4.48 4.62 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 1.57 0.00 0.00 97 G 9.65 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 98 T 7.71 4.62 4.37 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 1.38 0.00 0.00 99 G 8.43 3.28 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 0.00 100 P 0.00 4.06 0.00 1.86 1.99 0.00 2.57 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.82 0.00 101 A 7.86 4.54 0.62 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 0.00 0.00 102 A 7.90 4.21 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 0.00 103 D 7.93 4.57 0.00 2.65 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 0.00 104 L 7.71 4.40 0.00 1.90 1.81 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 105 N 8.89 4.69 0.00 2.85 2.66 0.00 0.00 6.74 7.32 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 0.00 106 W 8.24 2.54 0.00 2.96 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 0.00 107 G 5.38 3.33 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 0.00 108 D 6.99 4.31 0.00 2.82 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 0.00 109 S 8.59 4.19 0.00 3.86 3.83 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 0.00 110 Q 8.29 4.41 0.00 2.07 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.83 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 111 D 8.90 4.52 0.00 2.69 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 0.00 112 G 9.31 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 0.00 0.00 0.00 113 I 7.73 5.07 1.81 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.75 -0.02 0.00 0.00 114 V 9.02 4.38 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 1.25 0.00 0.00 0.81 0.00 0.00 115 W 8.67 4.87 0.00 2.45 1.74 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 0.00 116 V 9.42 5.02 2.35 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 0.24 0.00 0.00 1.28 0.00 0.00 117 A 8.36 5.21 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 0.00 0.00 0.00 0.00 0.00 0.00 118 A 8.92 4.23 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 0.00 119 K 8.55 3.92 0.00 1.74 1.76 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.45 7.81 120 G 8.92 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 0.00 0.00 0.00 121 A 7.65 4.18 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 0.00 122 D 8.60 4.53 0.00 2.62 2.53 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 0.00 123 V 7.79 3.05 1.43 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 -0.63 0.00 0.00 0.58 0.00 0.00 124 K 8.05 4.30 0.00 1.84 1.83 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.29 7.81 125 S 8.42 4.16 0.00 3.97 4.02 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 0.00 0.00 0.00 126 R 8.42 4.70 0.00 1.84 1.97 0.00 3.49 0.00 0.00 3.41 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.58 0.00 127 S 8.60 4.27 0.00 3.75 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 0.00 128 N 8.23 5.00 0.00 2.63 2.79 0.00 0.00 6.90 7.69 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 0.00 129 Q 8.15 4.06 0.00 1.93 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.10 0.00 0.00 0.00 0.00 0.00 1.68 1.46 0.00 130 G 8.13 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 0.00 131 T 8.25 4.30 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 1.31 0.00 0.00 132 R 7.44 2.93 0.00 0.67 1.37 0.00 3.53 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.06 0.00 133 D 8.72 5.17 0.00 2.86 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 0.00 134 P 0.00 4.62 0.00 2.20 2.13 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 135 D 8.24 4.55 0.00 2.86 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 0.00 136 K 8.11 4.27 0.00 1.64 1.31 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.46 7.81 137 F 7.81 4.94 0.00 3.15 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 0.00 138 D 8.66 4.70 0.00 2.51 2.53 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 0.00 139 Q 8.46 4.30 0.00 2.31 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 140 Y 9.03 4.47 0.00 2.93 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 0.00 141 P 0.00 4.87 0.00 1.94 2.03 0.00 3.83 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 142 L 8.75 4.01 0.00 1.20 0.72 0.52 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 143 R 7.73 4.59 0.00 1.68 1.82 0.00 3.34 0.00 0.00 3.48 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 144 F 8.39 5.08 0.00 3.26 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 0.00 145 S 9.07 4.31 0.00 3.93 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 0.00 146 D 7.94 4.87 0.00 2.78 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 0.00 147 G 8.55 4.27 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 0.00 148 G 7.84 3.60 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 0.00 0.00 0.00 149 P 0.00 3.52 0.00 1.61 0.89 0.00 3.26 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.47 0.00 150 D 7.64 4.47 0.00 2.78 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 0.00 151 G 8.35 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 0.00 152 N 9.05 4.41 0.00 2.78 2.44 0.00 0.00 6.70 7.87 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 0.00 153 F 7.71 5.16 0.00 3.02 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 0.00 154 R 9.18 4.65 0.00 1.63 1.86 0.00 2.74 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.60 0.00 155 W 7.47 5.25 0.00 3.39 3.40 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 0.00 156 D 8.91 4.55 0.00 2.79 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 0.00 157 F 8.75 4.32 0.00 2.95 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 0.00 158 I 7.34 4.22 1.73 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 1.42 1.00 0.81 0.00 0.00 159 P 0.00 4.07 0.00 2.07 2.14 0.00 3.60 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 2.10 2.32 0.00 160 L 8.48 4.13 0.00 1.84 2.03 0.90 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00