NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3474 8.2493 123.5825 52.5060 20.0652 176.3297 2 T 4.5010 8.2000 109.7672 60.8330 71.0807 172.6727 3 K 5.3332 8.3942 123.0139 54.6005 36.6582 176.3016 4 A 5.3259 9.2180 124.8871 50.6120 23.3606 175.1219 5 V 4.9125 8.7704 117.5731 60.6893 35.4843 173.4934 6 C 4.9732 9.0705 122.2360 58.0174 35.4815 172.5421 7 V 4.5876 8.4880 126.0138 61.6796 33.1083 174.0735 8 L 5.0216 8.8761 128.8178 53.3809 43.3633 175.8960 9 K 4.9891 9.3359 122.9771 55.1553 36.9499 176.4543 10 G 4.1628 8.0070 108.6029 44.3951 0.0000 171.8099 11 D 4.5101 8.8557 117.9221 55.9962 41.7824 177.0525 12 G 4.2244 7.6621 109.3768 44.3234 0.0000 171.8017 13 P 4.4536 0.0000 0.0000 62.9778 32.0931 176.0058 14 V 4.6213 7.8419 120.1542 62.9783 31.8392 174.8494 15 Q 5.2744 7.8143 124.9854 53.9531 32.7036 173.7209 16 G 4.2423 7.8051 105.6945 46.2824 0.0000 171.8671 17 I 5.1449 8.0387 120.0244 59.3692 40.8704 175.0615 18 I 4.6861 8.8177 127.5521 59.4638 40.3509 174.2195 19 N 4.9137 8.6398 125.1943 51.4507 40.6888 174.0083 20 F 5.3974 9.5427 121.9430 55.7645 42.9154 174.1118 21 E 5.1983 9.7689 123.3622 54.9129 32.7894 173.5304 22 Q 4.9067 9.5041 128.8917 54.4863 30.9244 176.1988 23 K 4.1253 8.9957 127.1095 58.4702 32.7804 177.6043 24 E 4.7846 7.8238 117.4509 54.0338 32.3672 177.1248 25 S 4.2048 8.8644 117.6069 60.4675 63.2535 174.6327 26 N 4.8105 8.2283 116.6830 52.3133 37.2756 174.2265 27 G 4.0575 7.8913 109.1539 43.2799 0.0000 171.7992 28 P 4.6561 0.0000 0.0000 62.8285 32.4015 175.8404 29 V 4.5487 8.9406 121.4133 61.4734 33.4103 174.7611 30 K 4.8264 9.5861 128.4558 55.8297 33.7941 175.9060 31 V 4.8443 9.4405 125.6316 60.8313 34.0631 174.2421 32 W 5.4016 8.2935 124.0354 54.9908 31.7242 175.2392 33 G 3.9803 7.5146 106.9326 46.2767 0.0000 170.8544 34 S 5.0797 7.8231 114.6266 56.8189 66.5409 174.3295 35 I 5.1649 8.8545 126.8356 59.3505 40.9108 174.6058 36 K 5.4238 8.8342 124.8800 54.6946 36.2549 176.9781 37 G 3.9750 8.9548 106.7331 45.4858 0.0000 173.4730 38 L 4.3976 7.4084 119.5495 53.3330 42.9076 176.3927 39 T 4.2610 8.2056 112.0069 61.0352 69.6232 173.9899 40 E 4.1264 8.7324 124.6524 57.5236 30.5129 174.9120 41 G 3.8803 8.5511 110.8805 44.1253 0.0000 172.0474 42 L 4.8952 8.2144 119.7176 54.3471 43.1930 176.3757 43 H 4.8888 9.1594 119.6493 53.6513 32.8800 173.2404 44 G 4.2137 8.9239 110.8160 47.1906 0.0000 172.3747 45 F 5.6927 9.2411 124.3494 56.9336 42.3920 172.9256 46 H 5.3171 9.0976 122.9558 53.8759 33.3786 172.9135 47 V 4.4289 8.5791 122.3827 62.6945 32.3027 174.7858 48 H 5.2499 9.3539 124.7939 53.8998 31.3914 175.1340 49 E 3.7843 8.9392 122.3468 58.9473 29.5042 177.1594 50 F 5.0380 8.3283 118.5944 54.9718 41.4497 176.9468 51 G 4.0339 8.5039 112.5062 44.8635 0.0000 173.6969 52 D 4.8299 8.0704 118.9816 52.6147 42.6094 174.8188 53 N 5.2660 8.4494 125.0992 53.0179 39.5169 176.9558 54 T 3.8664 8.5482 111.9773 64.1506 68.9118 174.0150 55 A 4.6408 7.9877 124.6121 51.3771 19.8526 176.4111 56 G 3.8532 8.0089 111.8249 46.2519 0.0000 173.7850 57 C 4.3673 8.5961 114.5329 60.1224 38.0151 176.0161 58 T 3.8090 7.8734 117.2889 66.5196 67.8744 176.1266 59 S 4.3357 7.8836 114.7853 60.1597 63.1289 175.8237 60 A 4.4408 7.3626 125.2967 54.3214 18.2243 178.4680 61 G 3.6560 8.0283 105.0092 44.3233 0.0000 170.8360 62 P 4.7234 0.0000 0.0000 61.8527 33.8261 175.1719 63 H 4.3274 8.6105 116.5584 56.1141 29.1478 175.5941 64 F 4.2138 9.0155 126.1021 58.9773 39.1648 174.2224 65 N 4.4653 8.2535 123.1712 51.7423 39.7514 172.2886 66 P 4.4032 0.0000 0.0000 64.4053 31.6468 177.1514 67 L 4.2809 7.0951 117.9609 56.5851 43.6824 177.1786 *68 S 4.2798 7.7467 115.5597 57.6891 63.9701 176.2222 *79 R 4.1520 8.1005 119.7258 56.6047 30.6094 175.1270 *80 H 4.5826 8.1903 114.1014 53.8277 28.8975 175.4618 81 V 3.5119 8.1903 122.1817 66.3144 31.3277 177.9935 82 G 3.7980 8.2952 106.1584 48.1578 0.0000 172.5196 83 D 4.7254 8.0348 120.4980 54.0027 40.7688 175.1684 84 L 4.5465 8.3121 125.8381 53.6042 42.4630 178.9216 85 G 3.8986 8.9135 108.7504 46.7905 0.0000 173.8696 86 N 5.6770 8.6540 120.9354 51.4802 42.2737 173.7839 87 V 4.3674 8.6756 113.7509 59.9201 35.6000 174.9783 88 T 4.9765 8.1758 118.0787 61.8489 71.4812 172.9638 89 A 4.8063 9.4608 130.5274 50.9057 20.8454 177.5409 90 D 4.6331 8.6107 122.6019 52.3064 41.4131 176.9314 91 K 4.3474 8.4967 116.4423 59.5742 32.6322 176.8693 92 D 4.6891 8.2311 118.0129 54.1371 41.1608 177.0139 93 G 4.3269 8.0768 105.6657 45.1407 0.0000 173.4111 94 V 4.6583 8.0892 120.4367 60.9470 33.5027 174.2993 95 A 5.4729 9.0010 130.6538 49.7778 20.8085 175.0062 96 D 5.0182 8.6466 122.9222 53.4825 42.5738 176.2231 97 V 4.3211 8.6795 123.3302 61.1401 34.2850 174.6787 98 S 4.9092 8.4957 122.5005 57.6198 64.4320 172.8940 99 I 4.7785 9.4102 128.4452 59.4107 41.3635 174.0654 100 E 5.1058 8.9092 126.4650 54.5194 31.6405 174.3939 101 D 4.9338 9.3180 126.1947 52.5251 44.7112 175.8207 102 S 4.8052 8.8683 119.5862 58.4191 63.6913 174.3570 103 V 4.2109 8.1962 120.8916 64.3222 32.5815 176.6354 104 I 4.0847 7.8424 110.9584 60.9669 38.3383 174.6442 105 S 4.7044 8.4389 114.5163 56.9889 65.4706 174.3389 106 L 4.3633 9.1539 123.8948 54.8402 41.6135 176.2662 107 S 4.4730 7.7802 113.1001 57.7329 66.8188 174.8776 108 G 3.8384 8.4749 107.3699 45.7024 0.0000 173.8957 109 D 4.4483 8.7916 117.5956 56.8832 41.7381 177.6294 110 H 5.0448 8.1162 114.8452 55.4515 29.0308 173.7437 111 C 4.5310 7.9525 121.0969 59.9437 31.6920 173.5219 112 I 3.7482 8.1554 119.5196 60.6033 38.2636 175.6811 113 I 3.7794 7.3617 122.8806 63.2567 37.2109 176.0576 114 G 3.8269 9.2729 114.0829 45.0005 0.0000 172.6765 115 R 4.9424 7.5687 119.0350 54.8169 33.6018 174.5506 116 T 5.0014 7.7963 115.2003 62.1335 70.6572 174.2243 117 L 4.4714 8.5105 129.0911 54.4624 43.9311 175.5302 118 V 4.9696 9.0722 125.8191 61.1114 35.1508 174.1752 119 V 4.9787 8.5879 128.0799 60.9335 32.8432 175.4961 120 H 5.0224 9.2643 123.6537 54.9498 29.6297 175.4641 121 E 4.1675 9.5358 122.0747 59.3442 29.6540 177.1937 122 K 4.7574 7.9929 117.5402 53.9701 35.2492 175.6044 123 A 4.4572 8.5531 124.6754 52.4946 18.7668 177.7924 124 D 4.4830 9.5299 122.6749 54.5048 39.0799 175.9992 *141 G 3.8003 7.8399 111.9107 44.1229 0.0000 169.6847 142 S 4.3217 7.9763 114.1868 58.7670 64.3974 173.7526 143 R 4.5396 8.2761 119.1484 54.9179 30.1337 176.7395 144 L 4.2483 8.6020 125.0428 57.4833 42.7044 177.3701 145 A 5.0194 7.7851 118.0559 51.3870 22.8521 173.8187 146 C 5.5569 8.2047 114.0225 55.4407 45.1195 172.7217 147 G 4.8356 7.9720 102.0407 46.0310 0.0000 173.0359 148 V 4.3747 8.4821 122.9793 62.2914 32.6635 175.6049 149 I 4.0384 9.3345 130.2897 61.2447 37.8993 175.3231 150 G 4.4324 9.0316 114.6203 43.8148 0.0000 172.2042 151 I 4.1925 8.3850 122.1477 61.3059 37.5111 175.4349 152 A 4.8228 8.5399 128.3072 49.5852 22.0856 176.1483 153 Q 4.0671 8.5192 118.8457 56.4456 29.1938 176.0952 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 A 8.25 4.35 1.26 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 2 T 8.20 4.50 4.41 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 1.24 0.00 0.00 3 K 8.39 5.33 0.00 1.73 1.75 0.00 1.70 0.00 0.00 1.92 0.00 0.00 3.09 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.53 1.48 7.81 4 A 9.22 5.33 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 5 V 8.77 4.91 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 0.81 0.00 0.00 0.93 0.00 0.00 6 C 9.07 4.97 0.00 3.10 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.49 4.59 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 0.93 0.00 0.00 0.92 0.00 0.00 8 L 8.88 5.02 0.00 1.64 1.60 1.04 0.55 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 9 K 9.34 4.99 0.00 1.61 1.62 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 G 8.01 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 0.00 0.00 0.00 0.00 11 D 8.86 4.51 0.00 2.68 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 12 G 7.66 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 0.00 0.00 0.00 13 P 0.00 4.45 0.00 2.18 2.16 0.00 3.77 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 2.10 1.94 0.00 14 V 7.84 4.62 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 0.85 0.00 0.00 0.92 0.00 0.00 15 Q 7.81 5.27 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.61 0.00 0.00 0.00 0.00 0.00 2.48 2.18 0.00 16 G 7.81 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 17 I 8.04 5.14 1.82 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 1.20 1.24 0.82 0.00 0.00 18 I 8.82 4.69 1.85 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 1.25 1.39 0.44 0.00 0.00 19 N 8.64 4.91 0.00 1.44 1.44 0.00 0.00 6.41 8.01 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 20 F 9.54 5.40 0.00 2.80 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 21 E 9.77 5.20 0.00 2.44 2.15 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 2.33 2.40 0.00 22 Q 9.50 4.91 0.00 2.16 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.60 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 23 K 9.00 4.13 0.00 1.81 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.47 1.49 7.81 24 E 7.82 4.78 0.00 1.99 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 0.00 2.29 2.26 0.00 25 S 8.86 4.20 0.00 3.98 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 26 N 8.23 4.81 0.00 2.82 2.91 0.00 0.00 5.90 7.00 0.00 0.00 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 G 7.89 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 0.00 0.00 0.00 28 P 0.00 4.66 0.00 2.13 2.10 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 29 V 8.94 4.55 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 1.35 0.00 0.00 1.09 0.00 0.00 30 K 9.59 4.83 0.00 1.94 1.82 0.00 1.49 0.00 0.00 1.45 0.00 0.00 2.70 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 1.43 7.81 31 V 9.44 4.84 2.18 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 0.56 0.00 0.00 1.13 0.00 0.00 32 W 8.29 5.40 0.00 3.51 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 33 G 7.51 3.98 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 0.00 0.00 0.00 34 S 7.82 5.08 0.00 3.90 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 35 I 8.85 5.16 1.81 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.43 0.93 0.00 0.00 36 K 8.83 5.42 0.00 1.71 1.87 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.29 1.18 7.81 37 G 8.95 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 0.00 0.00 0.00 38 L 7.41 4.40 0.00 1.83 1.58 0.73 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.21 4.26 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 1.24 0.00 0.00 40 E 8.73 4.13 0.00 2.11 1.89 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 2.38 2.51 0.00 41 G 8.55 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 42 L 8.21 4.90 0.00 1.47 1.56 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.16 4.89 0.00 3.02 3.33 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.92 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 0.00 0.00 0.00 45 F 9.24 5.69 0.00 2.98 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 46 H 9.10 5.32 0.00 3.15 2.92 0.00 5.85 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.58 4.43 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 0.94 0.00 0.00 0.83 0.00 0.00 48 H 9.35 5.25 0.00 3.03 3.40 0.00 5.68 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.94 3.78 0.00 1.70 1.12 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 1.47 2.13 0.00 50 F 8.33 5.04 0.00 3.10 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 51 G 8.50 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 52 D 8.07 4.83 0.00 2.63 2.81 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 53 N 8.45 5.27 0.00 2.78 2.74 0.00 0.00 6.81 7.05 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 54 T 8.55 3.87 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 1.23 0.00 0.00 55 A 7.99 4.64 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 56 G 8.01 3.85 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 0.00 0.00 0.00 57 C 8.60 4.37 0.00 2.95 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 58 T 7.87 3.81 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 1.23 0.00 0.00 59 S 7.88 4.34 0.00 4.13 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 60 A 7.36 4.44 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 61 G 8.03 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 0.00 0.00 0.00 62 P 0.00 4.72 0.00 2.09 2.21 0.00 3.64 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 63 H 8.61 4.33 0.00 2.93 3.20 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.02 4.21 0.00 2.79 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 65 N 8.25 4.47 0.00 2.64 2.47 0.00 0.00 6.95 7.71 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 66 P 0.00 4.40 0.00 2.11 1.97 0.00 3.06 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 1.66 1.51 0.00 67 L 7.10 4.28 0.00 1.70 1.66 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 *68 S 7.75 4.28 0.00 3.60 3.68 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 0.00 0.00 0.00 0.00 *79 R 8.10 4.15 0.00 1.94 2.03 0.00 2.99 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 *80 H 8.19 4.58 0.00 2.86 2.98 0.00 7.20 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.19 3.51 1.49 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 0.82 0.00 0.00 0.49 0.00 0.00 82 G 8.30 3.80 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 0.00 0.00 0.00 83 D 8.03 4.73 0.00 2.77 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 84 L 8.31 4.55 0.00 1.76 1.83 0.78 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.91 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 86 N 8.65 5.68 0.00 2.57 2.75 0.00 0.00 6.59 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 87 V 8.68 4.37 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 -0.44 0.00 0.00 0.72 0.00 0.00 88 T 8.18 4.98 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 1.23 0.00 0.00 89 A 9.46 4.81 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 90 D 8.61 4.63 0.00 2.90 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 91 K 8.50 4.35 0.00 1.86 2.11 0.00 1.05 0.00 0.00 0.61 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.48 7.81 92 D 8.23 4.69 0.00 2.78 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 93 G 8.08 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 0.00 0.00 0.00 0.00 94 V 8.09 4.66 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 0.99 0.00 0.00 1.01 0.00 0.00 95 A 9.00 5.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.65 5.02 0.00 2.54 2.61 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 97 V 8.68 4.32 1.98 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 0.84 0.00 0.00 0.61 0.00 0.00 98 S 8.50 4.91 0.00 3.90 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 9.41 4.78 2.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.87 1.01 0.00 0.00 100 E 8.91 5.11 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 2.22 2.31 0.00 101 D 9.32 4.93 0.00 2.86 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 0.00 102 S 8.87 4.81 0.00 3.90 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 0.00 103 V 8.20 4.21 2.27 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 0.81 0.00 0.00 0.96 0.00 0.00 104 I 7.84 4.08 1.93 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.80 1.03 0.00 0.00 105 S 8.44 4.70 0.00 3.85 3.82 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 0.00 0.00 0.00 106 L 9.15 4.36 0.00 1.89 1.71 1.03 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.78 4.47 0.00 3.88 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 0.00 108 G 8.47 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 0.00 109 D 8.79 4.45 0.00 2.66 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.12 5.04 0.00 3.27 3.40 0.00 5.70 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.95 4.53 0.00 3.05 2.95 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 0.00 112 I 8.16 3.75 1.56 0.00 0.00 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 1.27 0.18 0.90 0.00 0.00 113 I 7.36 3.78 1.77 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 1.17 0.39 0.88 0.00 0.00 114 G 9.27 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 0.00 0.00 0.00 115 R 7.57 4.94 0.00 1.57 1.81 0.00 2.21 0.00 0.00 2.39 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.30 0.00 116 T 7.80 5.00 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 1.22 0.00 0.00 117 L 8.51 4.47 0.00 1.81 1.55 0.39 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 118 V 9.07 4.97 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 0.72 0.00 0.00 0.74 0.00 0.00 119 V 8.59 4.98 2.28 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 0.78 0.00 0.00 1.03 0.00 0.00 120 H 9.26 5.02 0.00 3.12 3.36 0.00 5.67 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.54 4.17 0.00 2.09 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 2.38 2.35 0.00 122 K 7.99 4.76 0.00 1.87 1.70 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.78 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.44 0.99 7.81 123 A 8.55 4.46 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 0.00 124 D 9.53 4.48 0.00 2.85 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 *141 G 7.84 3.80 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 0.00 0.00 0.00 142 S 7.98 4.32 0.00 4.03 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 0.00 143 R 8.28 4.54 0.00 1.67 1.85 0.00 3.18 0.00 0.00 3.21 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.60 0.00 144 L 8.60 4.25 0.00 1.77 1.69 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.79 5.02 1.21 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 0.00 0.00 146 C 8.20 5.56 0.00 3.00 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 0.00 147 G 7.97 4.84 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 0.00 148 V 8.48 4.37 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 0.84 0.00 0.00 0.99 0.00 0.00 149 I 9.33 4.04 1.78 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 1.02 0.47 0.42 0.00 0.00 150 G 9.03 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 0.00 151 I 8.38 4.19 1.85 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 1.25 0.54 0.91 0.00 0.00 152 A 8.54 4.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 8.52 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.