NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.3284 8.2544 120.8600 55.9584 31.4252 174.8142 3 R 3.6405 8.8402 129.2051 56.9900 28.7264 176.9263 4 R 3.9471 9.2608 111.1825 56.2233 32.2724 176.4395 5 V 3.7428 8.2762 122.3915 62.8668 32.2902 174.7616 6 I 4.5574 8.1052 124.6538 59.4021 40.9063 176.6403 7 G 4.1433 8.0443 112.9402 45.9723 0.0000 173.8159 8 Q 4.7287 8.4312 125.7316 53.9969 31.5807 174.7045 9 R 4.3293 8.0975 119.0024 55.0980 30.9574 174.7780 10 K 4.1118 8.5049 126.4501 56.3886 32.8883 175.9343 11 I 4.5394 7.6024 123.4411 58.6886 40.3453 175.2671 12 L 3.8940 8.3939 124.0073 54.3285 41.9456 174.6841 13 P 3.9230 0.0000 0.0000 64.4643 31.1131 176.6869 14 D 4.4123 8.3893 118.8280 54.1907 38.8254 173.2209 15 P 4.6499 0.0000 0.0000 63.2430 30.6245 176.8030 16 K 4.5723 8.0196 116.6346 57.5046 36.3635 175.7753 17 F 4.5346 8.6958 114.9056 56.0715 40.9233 175.4898 18 G 4.5422 8.8285 108.8584 46.8709 0.0000 174.2784 19 S 4.6421 7.4296 116.3289 56.2102 64.3179 173.6960 20 E 3.9599 8.8416 127.7739 59.3732 28.8554 179.0607 21 L 3.9561 7.9571 118.9744 59.2211 40.1745 179.1138 22 L 3.7834 7.8347 120.1732 56.9271 42.1827 178.2754 23 A 4.0849 8.1443 121.3316 55.1383 18.3173 179.2809 24 K 3.9012 8.1842 117.5493 59.6762 31.6533 178.4813 25 F 4.0947 7.9986 119.6549 61.6457 39.0894 177.5963 26 V 3.5940 8.3022 112.2254 64.0790 31.0875 178.3329 27 N 4.2987 8.0163 115.9872 56.1259 38.4150 177.1205 28 I 3.7519 7.4705 119.8427 64.4199 37.3742 177.8650 29 L 4.1131 7.0405 118.2487 56.3991 41.9258 176.4851 30 M 4.0438 7.6178 119.4072 55.5406 32.4964 175.5168 31 V 4.4397 7.8989 125.0925 60.8264 34.4284 174.8790 32 D 4.4148 9.3325 118.9022 55.9027 38.1343 174.3826 33 G 3.9365 8.3287 103.0650 46.4645 0.0000 175.8650 34 K 4.3273 7.7524 120.5804 55.0093 28.9692 177.8267 35 K 3.9226 7.8235 122.2535 59.4902 32.5761 177.5517 36 S 4.1964 7.9744 114.3799 61.6959 63.2001 176.2966 37 T 3.8889 7.8927 119.2499 65.7821 68.5254 176.0641 38 A 4.0827 8.4183 123.1017 55.2349 18.5319 179.4305 39 E 4.1086 8.2312 116.1595 59.6777 29.0928 180.0013 40 S 4.3493 8.2826 115.0258 61.1633 62.2697 176.1762 41 I 3.7692 8.1981 122.4879 62.9247 37.2071 178.3953 42 V 3.6428 7.4995 119.0017 66.2828 31.1827 177.5296 43 Y 4.1204 7.8627 116.6903 61.0420 37.7066 178.1555 44 S 4.1882 7.8161 114.6194 62.1271 62.8696 176.7370 45 A 4.2206 7.9321 124.0866 53.6866 18.1645 179.5235 46 L 3.8609 7.8099 119.3126 58.5486 42.2215 179.0290 47 E 4.6453 9.2977 120.7414 58.9866 29.2949 179.4367 48 T 3.8631 8.4049 116.3635 66.7193 68.5265 176.4277 49 L 3.9796 7.9910 121.9025 57.9126 42.0279 178.8876 50 A 4.3265 7.8408 122.0986 54.9182 18.1552 179.4314 51 Q 3.9574 8.2849 117.2734 59.2653 29.1696 178.4009 52 R 4.1100 8.2055 119.0086 59.2187 30.3493 178.8512 53 S 4.3071 8.5487 112.6504 59.6892 63.1914 173.7216 54 G 4.2775 8.0712 112.5778 45.4790 0.0000 174.3182 55 K 4.2984 7.3048 117.5537 55.1399 34.0365 176.2544 56 S 4.4657 9.3083 114.7869 58.3655 62.8828 174.3301 57 E 3.9204 8.7026 122.7946 59.6969 28.8998 179.4869 58 L 3.9116 7.7038 119.2083 59.0950 40.2695 178.3413 59 E 4.2098 8.1065 119.9319 58.8305 29.4560 178.4759 60 A 4.0681 7.8902 120.9114 55.1426 18.6254 178.5781 61 F 3.9360 8.4448 120.1757 61.4070 39.2932 176.7009 62 E 3.7985 8.4612 118.4083 59.1001 29.4125 179.0350 63 V 3.9553 7.9561 118.5441 65.6319 31.7629 177.8261 64 A 4.1339 8.2444 120.1122 54.8161 18.1290 179.5266 65 L 3.7878 7.6084 117.8739 57.5822 41.4538 178.9970 66 E 3.9801 8.3147 119.1992 59.3952 29.4127 178.2833 67 N 4.8644 7.6449 113.5360 53.5288 38.6095 176.0145 68 V 4.4653 8.2681 116.1417 62.2259 32.7180 175.2327 69 R 4.3314 7.6680 117.3888 54.6942 29.9919 174.3282 70 P 4.7113 0.0000 0.0000 62.6415 32.4542 176.2889 71 T 4.1599 8.8006 117.4806 64.2149 67.8421 174.1465 72 V 5.1158 7.4024 111.5656 60.0944 36.1534 174.2612 73 E 4.8370 8.7244 118.2334 55.5805 33.0111 174.8922 74 V 4.4359 8.3313 114.1558 60.7820 33.0533 175.4368 75 K 4.6950 8.7458 123.2202 54.6249 35.8577 175.2015 76 S 4.9094 8.6969 121.3293 57.7285 63.3112 173.5134 77 R 4.3086 8.4991 126.5923 54.9307 32.0561 174.6728 78 R 4.1094 8.6399 128.1144 55.1285 29.2189 174.6555 79 V 3.9708 8.1087 123.5626 60.9940 31.8704 175.2526 80 G 3.4585 8.2885 118.7516 45.8075 0.0000 173.6953 81 G 3.8506 7.8958 104.4386 45.7123 0.0000 173.6030 82 S 4.4523 7.5541 115.3822 57.1130 62.6964 173.5818 83 T 4.6965 8.0150 119.5954 60.9271 66.8853 173.4810 84 Y 4.3380 7.6981 125.3696 58.3450 39.7919 176.7858 85 Q 4.9472 8.4769 124.5165 53.7300 27.5343 175.9276 86 V 4.1162 7.7529 120.0317 62.9802 32.9234 174.5022 87 P 5.0813 0.0000 0.0000 63.0306 32.9118 176.1437 88 V 4.1750 8.8055 117.4467 60.4478 34.8207 172.1590 89 E 4.3691 8.8783 123.2055 57.1792 29.9810 176.4803 90 V 4.3910 8.1566 114.6487 59.5519 33.6061 176.4169 91 R 4.0788 8.5718 123.5324 55.4674 30.4849 175.1139 92 P 4.2443 0.0000 0.0000 66.2965 30.8009 178.5984 93 V 3.8761 7.7608 113.6345 62.9849 31.4813 178.5889 94 R 3.8879 7.6274 117.5601 58.8830 29.7847 178.1771 95 R 3.8017 7.9667 118.9720 59.6146 29.9444 178.2730 96 N 4.2465 8.0310 115.9074 55.6420 37.5811 176.4995 97 A 3.9023 7.6322 123.0895 55.1020 18.4123 179.4347 98 L 3.3407 7.7768 116.9797 57.6548 41.4702 179.3826 99 A 3.8584 7.0594 120.4201 55.6361 18.2794 179.2922 100 M 4.0684 7.9568 116.4675 58.7022 32.0707 179.0818 101 R 3.8001 7.6393 117.9502 59.1917 30.2604 178.4784 102 W 4.4325 8.0391 118.6719 60.0191 29.0213 178.1104 103 I 3.7484 8.1676 119.9336 64.7483 36.5693 178.3635 104 V 3.5242 7.8084 118.3507 66.0183 31.1824 177.2091 105 E 3.9311 8.1340 117.5627 59.7538 29.7371 178.6816 106 A 4.1236 8.6187 120.4863 54.9011 18.3332 179.5449 107 A 4.0444 8.2965 119.7860 55.4802 18.3066 179.8953 108 R 4.0008 8.4956 115.8162 58.4797 29.8590 177.8532 109 K 4.5690 7.4033 115.0279 55.9671 32.6190 178.0378 110 R 3.5568 8.0897 122.8945 57.9668 29.9230 177.7905 111 G 4.0195 7.6329 104.5739 45.0756 0.0000 175.0680 112 D 4.6793 7.5086 119.2292 54.2668 41.5705 175.4556 113 K 4.2559 8.7071 118.9447 59.4615 33.1769 177.4151 114 S 4.8354 7.5186 113.8156 56.1255 67.4801 174.4749 115 M 3.9431 8.7438 123.2565 59.0028 31.7854 178.1819 116 A 3.9985 8.1477 120.1488 55.5207 18.3632 179.4090 117 L 3.9434 7.8673 116.0997 58.4382 41.8668 179.1985 118 R 4.0584 7.8135 116.9240 59.8251 29.9095 178.2832 119 L 3.9152 8.7324 119.3719 58.6905 42.2671 178.9175 120 A 4.0137 8.2091 119.9912 55.5873 18.4538 179.0778 121 N 4.2354 8.9411 114.3196 56.6923 38.8250 177.4729 122 E 4.0340 8.7566 120.3906 58.9960 29.4068 178.7859 123 L 4.0377 7.9856 119.0641 57.5392 41.8205 179.3142 124 S 4.2512 7.8943 114.7467 61.8024 62.9506 176.0565 125 D 5.1194 8.2212 122.4008 57.0306 40.4393 179.3672 126 A 3.9429 7.7017 120.1260 55.0929 18.1989 179.2874 127 A 3.9923 7.9250 118.6892 54.3156 18.5053 178.1284 128 E 4.4975 7.7856 113.3349 55.4881 30.1012 174.2974 129 N 4.6283 8.2253 117.7032 54.4863 35.7422 172.7771 130 K 4.4289 8.8494 119.6813 56.6610 36.1988 177.7144 131 G 3.8841 7.7215 104.4659 44.2104 0.0000 173.9573 132 T 3.8018 8.4626 110.1424 64.5376 68.2179 175.7334 133 A 4.3101 8.0893 123.3373 55.7980 18.2511 179.8849 134 V 4.3985 7.6357 110.7804 63.5211 31.5728 178.7917 135 K 3.7823 7.6032 119.8734 59.2713 32.1465 178.4028 136 K 3.4142 8.5171 121.0768 59.5474 31.8558 178.0672 137 R 3.7011 7.2245 118.5329 59.8762 29.9600 178.2733 138 E 3.9690 7.9015 117.6688 59.4210 29.2282 179.1420 139 D 4.2810 8.4796 119.2111 57.3233 41.1193 178.7570 140 V 3.6885 8.0916 119.1023 66.2802 31.1821 177.8620 141 H 4.3535 8.1955 115.8694 58.8641 27.9600 177.9955 142 R 3.7597 7.9330 120.1343 58.9219 29.5218 178.5038 143 M 3.8436 7.9118 118.1045 58.5251 32.2768 176.5277 144 A 4.3529 7.2141 118.0833 52.1224 21.3501 175.5199 145 E 3.8757 8.7778 122.9608 57.7055 28.9008 176.2592 146 A 4.1454 7.3672 119.0180 53.8130 18.7375 177.4765 147 N 4.4921 7.4400 111.6993 51.9707 40.5769 176.0584 148 K 4.0176 7.8810 120.3250 58.6711 32.4516 178.2368 149 A 3.9604 7.6919 120.5712 55.3589 18.3649 178.6280 150 F 4.4736 8.1642 114.0540 58.5200 39.2129 176.6439 151 A 3.5979 7.5790 122.3364 52.8352 17.9425 175.9476 152 H 4.3745 7.9405 110.5459 55.2418 29.0028 173.5358 153 Y 4.0254 7.4661 123.0179 59.6393 37.8594 170.1551 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 2 R 8.25 4.33 0.00 1.79 1.96 0.00 3.20 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 3 R 8.84 3.64 0.00 1.89 1.65 0.00 3.47 0.00 0.00 3.23 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 4 R 9.26 3.95 0.00 1.84 1.87 0.00 3.26 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 5 V 8.28 3.74 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 0.76 0.00 0.00 0.93 0.00 0.00 6 I 8.11 4.56 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 1.35 0.90 0.91 0.00 0.00 7 G 8.04 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.43 4.73 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.86 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 9 R 8.10 4.33 0.00 1.71 1.80 0.00 3.24 0.00 0.00 3.15 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 10 K 8.50 4.11 0.00 1.76 1.70 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.60 7.81 11 I 7.60 4.54 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.75 0.92 0.00 0.00 12 L 8.39 3.89 0.00 1.62 1.63 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 3.92 0.00 2.36 2.25 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 14 D 8.39 4.41 0.00 3.03 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 15 P 0.00 4.65 0.00 2.31 2.21 0.00 4.01 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 2.34 2.45 0.00 16 K 8.02 4.57 0.00 1.40 2.03 0.00 1.38 0.00 0.00 0.72 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.33 7.81 17 F 8.70 4.53 0.00 3.42 3.02 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 18 G 8.83 4.54 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 0.00 19 S 7.43 4.64 0.00 4.23 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 20 E 8.84 3.96 0.00 2.05 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 2.43 2.41 0.00 21 L 7.96 3.96 0.00 1.95 1.98 0.99 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.83 3.78 0.00 1.36 1.70 0.26 0.47 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 23 A 8.14 4.08 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 24 K 8.18 3.90 0.00 1.88 1.89 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.46 7.81 25 F 8.00 4.09 0.00 3.40 3.35 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 26 V 8.30 3.59 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 0.71 0.00 0.00 1.09 0.00 0.00 27 N 8.02 4.30 0.00 2.78 2.85 0.00 0.00 7.04 7.48 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 28 I 7.47 3.75 1.74 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.66 0.80 0.00 0.00 29 L 7.04 4.11 0.00 1.30 1.47 0.79 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 30 M 7.62 4.04 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.46 0.00 31 V 7.90 4.44 2.05 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 0.77 0.00 0.00 0.92 0.00 0.00 32 D 9.33 4.41 0.00 2.83 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 33 G 8.33 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 34 K 7.75 4.33 0.00 1.99 1.78 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.66 7.81 35 K 7.82 3.92 0.00 1.82 1.83 0.00 1.72 0.00 0.00 1.89 0.00 0.00 3.00 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.65 1.52 7.81 36 S 7.97 4.20 0.00 4.11 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 37 T 7.89 3.89 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 1.22 0.00 0.00 38 A 8.42 4.08 1.33 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 39 E 8.23 4.11 0.00 2.24 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 2.32 2.56 0.00 40 S 8.28 4.35 0.00 4.14 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 41 I 8.20 3.77 1.96 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 1.43 1.42 0.93 0.00 0.00 42 V 7.50 3.64 1.94 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 1.05 0.00 0.00 0.83 0.00 0.00 43 Y 7.86 4.12 0.00 3.12 3.14 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 0.00 0.00 0.00 0.00 44 S 7.82 4.19 0.00 3.98 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 45 A 7.93 4.22 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 46 L 7.81 3.86 0.00 2.05 1.75 0.73 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 47 E 9.30 4.65 0.00 2.01 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 2.67 2.45 0.00 48 T 8.40 3.86 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 1.24 0.00 0.00 49 L 7.99 3.98 0.00 1.75 1.84 0.98 1.21 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 50 A 7.84 4.33 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 51 Q 8.28 3.96 0.00 2.05 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.92 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 52 R 8.21 4.11 0.00 1.99 1.98 0.00 3.23 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 53 S 8.55 4.31 0.00 3.99 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 54 G 8.07 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 55 K 7.30 4.30 0.00 2.23 1.97 0.00 1.34 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.39 7.81 56 S 9.31 4.47 0.00 3.91 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 57 E 8.70 3.92 0.00 1.74 1.70 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 2.35 2.66 0.00 58 L 7.70 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.67 0.00 67 N 7.64 4.86 0.00 2.97 2.83 0.00 0.00 6.39 7.56 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 68 V 8.27 4.47 2.19 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 1.08 0.00 0.00 0.99 0.00 0.00 69 R 7.67 4.33 0.00 1.91 1.88 0.00 3.20 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 70 P 0.00 4.71 0.00 2.39 2.57 0.00 3.89 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.68 0.00 71 T 8.80 4.16 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 1.03 0.00 0.00 72 V 7.40 5.12 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 nan 0.00 0.00 0.92 0.00 0.00 73 E 8.72 4.84 0.00 2.13 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 2.24 2.34 0.00 74 V 8.33 4.44 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 0.70 0.00 0.00 0.98 0.00 0.00 75 K 8.75 4.69 0.00 1.78 1.62 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.54 7.81 76 S 8.70 4.91 0.00 4.02 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 77 R 8.50 4.31 0.00 1.84 1.78 0.00 3.38 0.00 0.00 3.19 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 78 R 8.64 4.11 0.00 1.85 1.83 0.00 3.35 0.00 0.00 3.16 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 79 V 8.11 3.97 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 0.76 0.00 0.00 0.86 0.00 0.00 80 G 8.29 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 0.00 0.00 0.00 81 G 7.90 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 82 S 7.55 4.45 0.00 3.42 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 83 T 8.01 4.70 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 1.21 0.00 0.00 84 Y 7.70 4.34 0.00 2.57 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 0.00 0.00 0.00 0.00 85 Q 8.48 4.95 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.03 0.00 0.00 0.00 0.00 0.00 2.52 2.21 0.00 86 V 7.75 4.12 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 1.04 0.00 0.00 0.99 0.00 0.00 87 P 0.00 5.08 0.00 2.12 2.05 0.00 3.97 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 88 V 8.81 4.17 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 0.66 0.00 0.00 0.91 0.00 0.00 89 E 8.88 4.37 0.00 1.94 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 2.23 2.23 0.00 90 V 8.16 4.39 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 0.73 0.00 0.00 1.02 0.00 0.00 91 R 8.57 4.08 0.00 1.91 1.87 0.00 3.19 0.00 0.00 3.39 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 92 P 0.00 4.24 0.00 2.25 2.25 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 93 V 7.76 3.88 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 1.33 0.00 0.00 0.92 0.00 0.00 94 R 7.63 3.89 0.00 1.99 1.98 0.00 3.09 0.00 0.00 3.04 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 95 R 7.97 3.80 0.00 2.04 2.09 0.00 3.14 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.82 0.00 96 N 8.03 4.25 0.00 3.01 3.03 0.00 0.00 5.98 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 97 A 7.63 3.90 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 98 L 7.78 3.34 0.00 1.15 0.16 0.80 0.80 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 99 A 7.06 3.86 1.32 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 0.00 100 M 7.96 4.07 0.00 2.23 2.31 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.95 0.00 101 R 7.64 3.80 0.00 1.77 1.84 0.00 3.10 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.64 0.00 102 W 8.04 4.43 0.00 3.62 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 0.00 103 I 8.17 3.75 2.19 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 1.48 1.03 1.04 0.00 0.00 104 V 7.81 3.52 2.01 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 0.88 0.00 0.00 0.69 0.00 0.00 105 E 8.13 3.93 0.00 2.37 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 0.00 2.39 2.44 0.00 106 A 8.62 4.12 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 0.00 107 A 8.30 4.04 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.50 4.00 0.00 1.89 2.03 0.00 3.08 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 109 K 7.40 4.57 0.00 1.83 1.76 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.33 7.81 110 R 8.09 3.56 0.00 1.87 1.98 0.00 3.33 0.00 0.00 3.39 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 111 G 7.63 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 0.00 0.00 0.00 112 D 7.51 4.68 0.00 2.67 2.64 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 0.00 113 K 8.71 4.26 0.00 1.75 1.85 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.45 7.81 114 S 7.52 4.84 0.00 3.82 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 0.00 115 M 8.74 3.94 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.69 0.00 116 A 8.15 4.00 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 0.00 117 L 7.87 3.94 0.00 1.87 1.74 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 118 R 7.81 4.06 0.00 2.05 2.19 0.00 3.16 0.00 0.00 3.24 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 119 L 8.73 3.92 0.00 1.76 1.80 1.15 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.21 4.01 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.94 4.24 0.00 2.85 2.90 0.00 0.00 6.79 8.29 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 0.00 122 E 8.76 4.03 0.00 2.22 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 2.33 2.42 0.00 123 L 7.99 4.04 0.00 1.90 1.71 1.00 0.75 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 0.00 124 S 7.89 4.25 0.00 4.03 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 0.00 125 D 8.22 5.12 0.00 2.95 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 0.00 126 A 7.70 3.94 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.92 3.99 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 0.00 128 E 7.79 4.50 0.00 2.08 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 0.00 2.23 2.22 0.00 129 N 8.23 4.63 0.00 2.82 2.86 0.00 0.00 6.54 7.77 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 0.00 130 K 8.85 4.43 0.00 1.72 1.78 0.00 2.08 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.51 7.81 131 G 7.72 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 0.00 132 T 8.46 3.80 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 1.17 0.00 0.00 133 A 8.09 4.31 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 0.00 134 V 7.64 4.40 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 1.27 0.00 0.00 0.96 0.00 0.00 135 K 7.60 3.78 0.00 1.70 1.81 0.00 1.61 0.00 0.00 1.48 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.37 7.81 136 K 8.52 3.41 0.00 1.28 1.03 0.00 1.13 0.00 0.00 1.09 0.00 0.00 2.60 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.30 0.21 7.81 137 R 7.22 3.70 0.00 2.00 2.09 0.00 3.28 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.87 0.00 138 E 7.90 3.97 0.00 2.04 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 2.33 2.49 0.00 139 D 8.48 4.28 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 0.00 140 V 8.09 3.69 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 1.11 0.00 0.00 0.87 0.00 0.00 141 H 8.20 4.35 0.00 3.36 3.30 0.00 5.67 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 R 7.93 3.76 0.00 2.07 1.94 0.00 3.10 0.00 0.00 3.06 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 143 M 7.91 3.84 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.63 0.00 144 A 7.21 4.35 1.33 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 0.00 145 E 8.78 3.88 0.00 2.20 2.01 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 2.23 2.31 0.00 146 A 7.37 4.15 1.32 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 0.00 147 N 7.44 4.49 0.00 2.94 2.70 0.00 0.00 6.47 7.56 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 0.00 148 K 7.88 4.02 0.00 1.84 1.90 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.38 7.81 149 A 7.69 3.96 0.99 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 0.00 0.00 150 F 8.16 4.47 0.00 3.03 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 0.00 151 A 7.58 3.60 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 0.00 152 H 7.94 4.37 0.00 3.20 3.54 0.00 5.69 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Y 7.47 4.03 0.00 3.20 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