NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1545 8.1727 122.0490 56.2933 34.1081 174.0581 2 V 4.5183 8.1737 127.2010 60.7699 32.1680 174.5324 3 F 4.3151 9.9397 128.9336 57.5323 40.2186 174.9413 4 E 4.2896 8.8401 120.9415 55.5624 31.0604 176.9282 5 R 3.3199 8.9378 121.4859 60.6748 29.9467 179.5346 6 C 4.3325 8.0183 115.2564 59.6041 37.4439 175.6851 7 E 3.9036 8.0992 120.7005 59.2851 29.2476 178.4787 8 L 3.5336 7.9532 120.0304 57.8171 42.0278 178.6011 9 A 3.9300 7.8476 120.6821 55.4678 18.3380 179.9236 10 R 3.9069 8.0977 116.4183 59.5241 30.1298 179.5518 11 T 3.8410 7.7938 115.6738 66.6499 68.5155 176.8047 12 L 3.8665 8.0795 121.2545 57.4956 41.5593 179.5330 13 K 3.9169 8.0130 119.7483 59.5082 31.9437 178.9539 14 R 3.9750 7.7825 117.9194 58.8562 30.0233 177.4570 15 L 4.3688 7.4555 116.5098 53.9212 41.7976 176.6522 16 G 3.8397 7.7905 106.7952 47.1132 0.0000 175.2272 17 M 3.8728 7.7406 120.9459 56.2847 32.4990 175.8687 18 D 4.5615 7.9882 117.8627 55.9748 41.1462 175.8236 19 G 3.9480 9.3828 115.7248 45.3781 0.0000 171.3891 20 Y 4.2326 8.3246 122.0450 58.7069 38.9004 176.3710 21 R 3.6871 9.0578 127.0894 57.3252 27.7813 177.2328 22 G 3.8240 8.1810 103.0354 45.7371 0.0000 173.8868 23 I 4.1494 7.5637 121.8177 58.9579 38.3331 175.8543 24 S 4.6432 8.3233 120.2468 57.6621 64.0966 174.7766 25 L 4.1958 8.9593 123.7390 58.7525 41.7654 179.5124 26 A 4.2032 8.1458 119.8705 55.1725 18.3268 179.2188 27 N 4.4751 8.2002 115.3968 56.2508 38.6231 177.7064 28 W 4.2682 8.0631 119.9990 59.8417 29.1675 178.4230 29 M 4.1882 8.3883 118.8532 58.5238 31.4605 177.8683 30 C 3.1407 7.9785 118.5798 59.1284 44.6654 175.3594 31 L 3.9646 8.0866 121.5795 58.3101 41.7628 178.8695 32 A 4.1147 8.2988 120.6921 54.8148 18.3483 179.4438 33 K 2.8043 8.0759 118.2059 59.3130 32.0349 179.0195 34 W 4.3223 7.6182 116.9753 58.8259 29.1158 178.4198 35 E 4.3321 8.1949 118.5912 58.5810 28.9936 177.6617 36 S 4.5271 7.8548 109.7750 56.5452 64.4330 174.4859 37 G 3.1737 8.0488 108.6857 46.9631 0.0000 173.4878 38 Y 3.6452 7.6672 113.4296 58.5247 34.9882 168.4626 39 N 5.2781 7.6523 118.8443 52.0446 39.7479 175.9287 40 T 3.9967 9.0080 117.7017 64.0651 69.1659 175.9385 41 R 4.4905 7.9220 116.1163 55.5972 30.0951 176.1484 42 A 4.3000 7.6615 121.9579 52.9490 19.2294 177.1520 43 T 5.1393 8.3681 111.3800 60.1159 72.4329 173.0879 44 N 4.8958 8.6527 121.9834 52.4844 42.1663 172.4572 45 Y 4.5988 8.7952 127.8199 57.3551 40.8062 173.8802 46 N 4.6126 8.3194 124.7189 50.9841 37.6640 175.0846 47 A 3.6940 8.1974 127.6464 54.7836 18.9103 180.2452 48 G 3.8084 7.9888 104.0124 48.1528 0.0000 173.7452 49 D 4.6504 6.9612 112.2092 52.1034 40.4761 175.7893 50 R 3.9665 8.1273 116.1571 56.9048 28.1913 175.8533 51 S 4.9342 7.6254 112.2693 57.1621 66.1954 172.9370 52 T 5.0601 8.6653 116.1656 61.9587 72.7713 172.7170 53 D 5.4059 8.8636 125.3306 53.3218 43.1850 175.0716 54 Y 4.9213 9.3689 121.1758 57.4289 41.5729 177.0441 55 G 4.4962 9.0133 111.2713 46.1829 0.0000 173.5713 56 I 3.7087 8.1441 116.8233 62.7511 37.7264 176.6686 57 F 4.7108 7.9903 115.4253 56.2883 39.8181 175.2930 58 Q 3.6028 8.1398 119.2117 57.2116 26.6276 174.4259 59 S 4.6920 8.3068 113.8281 58.4978 64.8595 175.2180 60 N 5.4434 9.3398 123.5895 53.4000 39.7279 175.7203 61 S 4.6532 9.0320 120.2849 60.1494 63.3082 175.3529 62 R 3.7583 8.7372 122.3749 58.5268 30.4138 177.6618 63 Y 4.3309 7.5528 114.6852 57.9412 40.7239 177.1957 64 W 4.7081 8.2703 119.0425 57.7125 30.0108 173.5914 65 C 5.5972 7.9262 110.5622 53.4829 45.5730 171.7203 66 N 5.1701 8.9385 119.3320 52.0309 39.8888 174.6430 67 D 4.8394 8.4843 122.8217 52.1606 40.5969 178.0591 68 G 4.0663 8.4028 108.4232 46.0108 0.0000 174.7114 69 K 4.3994 7.9247 115.9818 56.7032 33.1149 175.9530 70 T 4.4345 7.6914 117.1651 61.5250 69.3058 172.9299 71 P 4.2973 0.0000 0.0000 63.6284 31.9290 176.0583 72 G 3.9461 8.5246 108.1347 46.3788 0.0000 173.1109 73 A 4.4982 7.8381 120.0919 50.6952 20.2259 177.8274 74 V 4.3758 8.2350 114.1948 59.7674 34.9797 176.1871 75 N 4.9155 8.0006 116.1577 51.7270 38.5306 174.1638 76 A 3.9377 8.5110 124.1761 55.2292 19.0619 178.5673 77 C 4.4899 8.4904 110.8248 57.4549 41.0768 173.0351 78 H 4.1273 7.9227 116.4292 56.4978 26.3097 174.2467 79 L 4.7997 8.2296 117.5558 52.9415 46.5051 176.6763 80 S 4.6396 8.3833 115.5453 58.0730 63.2640 176.0202 81 C 4.1657 8.7056 123.8979 59.5334 40.2323 176.4113 82 S 3.9092 7.7576 114.8168 61.1695 61.6776 175.8897 83 A 4.1109 7.8320 122.6106 54.4164 18.3510 178.5209 84 L 4.4678 7.7629 116.2438 55.0573 41.6041 177.6298 85 L 5.0186 7.5189 117.8810 54.5443 42.2299 176.6549 86 Q 4.3795 7.7739 117.8170 55.3885 29.5300 175.9528 87 D 4.4188 8.4940 119.3855 56.7754 41.1996 176.6047 88 N 4.6418 8.0370 118.2005 52.9326 39.2913 174.6439 89 I 4.2553 8.4282 118.8545 60.9949 38.0058 176.9290 90 A 3.9393 8.5616 125.2170 56.0447 18.1362 180.1559 91 D 4.2741 8.0715 116.3577 57.4397 40.9885 178.6220 92 A 4.0975 8.0210 120.8489 55.1896 18.3728 179.7618 93 V 3.4045 8.1905 116.8151 66.0345 31.5789 178.1059 94 A 3.8512 8.0545 120.6042 55.2654 18.1553 178.8554 95 C 4.2379 8.4294 116.8381 59.6822 38.1952 175.6101 96 A 3.9680 8.1059 122.4904 55.0913 17.6224 179.7655 97 K 3.8510 7.6772 116.2541 59.4583 32.4186 179.2323 98 R 4.0833 7.7019 118.7372 59.2627 29.8864 178.5887 99 V 2.6815 7.5213 118.0411 65.8378 31.1964 177.9241 100 V 3.9306 7.3854 108.3605 62.5930 31.6484 177.9049 101 R 4.1587 7.6802 117.3592 57.2072 30.5366 176.4767 102 D 4.7275 7.3296 119.3703 52.5243 41.8916 175.2848 103 P 4.2241 0.0000 0.0000 66.3651 31.1199 177.8297 104 Q 4.0158 8.1590 117.3689 56.5372 30.0043 177.1060 105 G 3.6923 7.8704 106.9206 46.1001 0.0000 176.4177 106 I 3.5183 7.7928 121.1023 63.3820 37.9016 177.8390 107 R 4.2073 7.3078 117.6403 57.9808 30.0117 177.4777 108 A 3.9030 7.7096 120.9346 54.1017 18.5646 177.5161 109 W 4.7139 8.0010 117.0033 55.3106 30.2109 177.2767 110 V 3.7035 8.8423 123.6038 66.1882 30.9229 177.5864 111 A 4.0629 8.3401 119.9201 54.9240 18.0662 179.1707 112 W 4.0238 8.3044 126.5434 60.7315 30.5518 178.4235 113 R 3.6460 8.1420 116.3440 59.3077 29.6634 178.3808 114 N 4.3549 7.8065 114.6448 55.6058 38.6903 176.8767 115 R 4.0537 7.8999 116.9269 56.0232 31.5796 176.2354 116 C 4.5776 7.6952 115.4025 57.7354 42.6388 174.3882 117 Q 3.2988 6.5174 118.8773 57.4276 28.6430 175.5264 118 N 4.1880 8.7270 119.9274 54.1079 36.1806 173.6480 119 R 4.4887 7.3753 115.7844 54.0751 33.0360 175.4816 120 D 4.5849 8.4197 118.6882 53.9274 40.2528 175.9416 121 V 4.5307 8.1948 119.1926 61.3768 32.5569 178.3353 122 R 4.0240 8.1174 121.8012 59.5420 29.4726 178.3837 123 Q 3.9625 8.2454 116.7167 59.9381 27.8704 178.7719 124 Y 4.1002 7.9252 117.3506 59.8759 38.3109 176.9703 125 V 4.3942 7.8450 110.8249 60.6623 33.2813 175.5781 126 Q 4.1791 7.4416 120.2360 57.3740 28.7707 177.1703 127 G 3.9612 8.9240 110.2778 45.9610 0.0000 174.5538 128 C 4.4107 8.0447 115.9019 56.9695 40.5790 174.1140 129 G 3.8588 8.1979 107.2601 46.5955 0.0000 174.1009 130 V 4.0082 7.8393 118.0740 61.0913 32.1163 175.7797 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 K 8.17 4.15 0.00 1.99 1.62 0.00 1.28 0.00 0.00 1.04 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.85 1.12 7.81 2 V 8.17 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 0.90 0.00 0.00 0.94 0.00 0.00 3 F 9.94 4.32 0.00 2.85 2.82 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 4 E 8.84 4.29 0.00 1.90 1.85 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 2.30 2.23 0.00 5 R 8.94 3.32 0.00 1.91 1.91 0.00 3.44 0.00 0.00 3.45 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 6 C 8.02 4.33 0.00 3.00 3.11 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 7 E 8.10 3.90 0.00 2.06 2.25 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 2.61 2.43 0.00 8 L 7.95 3.53 0.00 1.36 1.37 -0.13 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.85 3.93 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 10 R 8.10 3.91 0.00 2.00 1.99 0.00 3.13 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.79 3.84 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 1.18 0.00 0.00 12 L 8.08 3.87 0.00 1.72 1.57 0.94 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.01 3.92 0.00 1.94 1.91 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.45 7.81 14 R 7.78 3.98 0.00 1.98 2.07 0.00 3.30 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 15 L 7.46 4.37 0.00 1.66 1.54 0.83 0.85 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 16 G 7.79 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 17 M 7.74 3.87 0.00 1.23 1.91 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.20 0.00 18 D 7.99 4.56 0.00 2.67 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 19 G 9.38 3.95 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 0.00 0.00 0.00 20 Y 8.32 4.23 0.00 3.35 3.17 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 21 R 9.06 3.69 0.00 1.89 1.84 0.00 3.26 0.00 0.00 2.99 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 1.27 0.00 22 G 8.18 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 0.00 0.00 0.00 23 I 7.56 4.15 1.84 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.59 -0.27 0.00 0.00 24 S 8.32 4.64 0.00 4.07 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 25 L 8.96 4.20 0.00 2.08 1.82 0.98 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.15 4.20 1.51 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 27 N 8.20 4.48 0.00 2.81 2.71 0.00 0.00 6.90 7.81 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 28 W 8.06 4.27 0.00 3.52 3.12 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 29 M 8.39 4.19 0.00 2.20 2.36 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.91 0.00 30 C 7.98 3.14 0.00 2.52 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 31 L 8.09 3.96 0.00 1.89 1.87 0.62 -0.42 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 32 A 8.30 4.11 1.40 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 0.00 0.00 33 K 8.08 2.80 0.00 1.52 1.73 0.00 0.66 0.00 0.00 1.14 0.00 0.00 2.56 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.03 0.21 7.81 34 W 7.62 4.32 0.00 3.35 3.26 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 35 E 8.19 4.33 0.00 2.03 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 2.58 2.43 0.00 36 S 7.85 4.53 0.00 4.07 4.13 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 37 G 8.05 3.17 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 38 Y 7.67 3.65 0.00 3.21 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 39 N 7.65 5.28 0.00 2.84 2.81 0.00 0.00 7.00 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 40 T 9.01 4.00 4.46 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 1.49 0.00 0.00 41 R 7.92 4.49 0.00 2.01 2.10 0.00 3.09 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 42 A 7.66 4.30 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 43 T 8.37 5.14 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 1.37 0.00 0.00 44 N 8.65 4.90 0.00 3.04 2.66 0.00 0.00 6.82 7.55 0.00 0.00 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 Y 8.80 4.60 0.00 3.06 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 N 8.32 4.61 0.00 2.63 2.57 0.00 0.00 6.61 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 47 A 8.20 3.69 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 48 G 7.99 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 0.00 0.00 0.00 49 D 6.96 4.65 0.00 2.67 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 50 R 8.13 3.97 0.00 2.04 2.18 0.00 3.13 0.00 0.00 3.20 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.53 0.00 51 S 7.63 4.93 0.00 3.94 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 52 T 8.67 5.06 4.08 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 0.68 0.00 0.00 53 D 8.86 5.41 0.00 2.70 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 54 Y 9.37 4.92 0.00 2.99 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 55 G 9.01 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.14 3.71 1.69 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.63 0.22 0.00 0.00 57 F 7.99 4.71 0.00 3.21 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 58 Q 8.14 3.60 0.00 2.51 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 6.83 0.00 0.00 0.00 0.00 0.00 2.51 2.68 0.00 59 S 8.31 4.69 0.00 4.10 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 60 N 9.34 5.44 0.00 3.09 3.02 0.00 0.00 6.97 7.63 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 61 S 9.03 4.65 0.00 4.07 4.40 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 62 R 8.74 3.76 0.00 1.50 1.13 0.00 2.54 0.00 0.00 2.91 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.14 0.00 63 Y 7.55 4.33 0.00 1.61 1.72 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 64 W 8.27 4.71 0.00 3.65 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 65 C 7.93 5.60 0.00 3.18 3.23 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 66 N 8.94 5.17 0.00 2.79 2.70 0.00 0.00 7.11 8.98 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 67 D 8.48 4.84 0.00 2.88 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 68 G 8.40 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 0.00 0.00 0.00 69 K 7.92 4.40 0.00 1.92 1.93 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.47 7.81 70 T 7.69 4.43 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 1.15 0.00 0.00 71 P 0.00 4.30 0.00 2.02 1.97 0.00 3.82 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 72 G 8.52 3.95 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 0.00 0.00 0.00 73 A 7.84 4.50 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 74 V 8.23 4.38 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 0.66 0.00 0.00 0.89 0.00 0.00 75 N 8.00 4.92 0.00 2.72 2.64 0.00 0.00 6.75 7.81 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 76 A 8.51 3.94 1.30 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 77 C 8.49 4.49 0.00 3.29 3.24 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 78 H 7.92 4.13 0.00 3.32 3.36 0.00 5.63 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.23 4.80 0.00 1.70 1.50 0.97 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.38 4.64 0.00 3.83 3.69 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 81 C 8.71 4.17 0.00 2.24 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 82 S 7.76 3.91 0.00 3.81 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 83 A 7.83 4.11 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 84 L 7.76 4.47 0.00 1.93 1.82 1.13 0.64 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 85 L 7.52 5.02 0.00 1.77 1.71 1.09 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.77 4.38 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.46 7.12 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 87 D 8.49 4.42 0.00 2.63 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 88 N 8.04 4.64 0.00 2.69 2.75 0.00 0.00 6.96 7.94 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 89 I 8.43 4.26 1.81 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.69 1.01 0.00 0.00 90 A 8.56 3.94 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 91 D 8.07 4.27 0.00 2.72 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.02 4.10 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 93 V 8.19 3.40 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 0.71 0.00 0.00 0.94 0.00 0.00 94 A 8.05 3.85 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 95 C 8.43 4.24 0.00 3.15 3.30 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 96 A 8.11 3.97 0.88 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 97 K 7.68 3.85 0.00 1.65 1.49 0.00 1.28 0.00 0.00 0.70 0.00 0.00 2.24 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.30 0.97 7.81 98 R 7.70 4.08 0.00 1.95 2.16 0.00 3.28 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.94 0.00 99 V 7.52 2.68 1.85 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 -0.24 0.00 0.00 -0.69 0.00 0.00 100 V 7.39 3.93 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 1.04 0.00 0.00 1.40 0.00 0.00 101 R 7.68 4.16 0.00 2.12 2.04 0.00 3.24 0.00 0.00 3.30 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 102 D 7.33 4.73 0.00 2.98 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 0.00 103 P 0.00 4.22 0.00 2.15 2.20 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 2.01 0.00 104 Q 8.16 4.02 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.80 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.87 3.69 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 0.00 0.00 0.00 106 I 7.79 3.52 1.01 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.54 0.00 0.00 107 R 7.31 4.21 0.00 1.99 2.04 0.00 3.24 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.57 0.00 108 A 7.71 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.00 4.71 0.00 3.52 3.13 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 0.00 110 V 8.84 3.70 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.34 4.06 1.51 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 0.00 112 W 8.30 4.02 0.00 3.45 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.14 3.65 0.00 2.08 1.98 0.00 3.55 0.00 0.00 3.62 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.10 0.00 114 N 7.81 4.35 0.00 2.55 2.72 0.00 0.00 6.97 7.63 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 0.00 115 R 7.90 4.05 0.00 1.08 0.78 0.00 2.83 0.00 0.00 2.84 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.11 0.00 116 C 7.70 4.58 0.00 1.81 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 0.00 117 Q 6.52 3.30 0.00 0.93 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.79 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 118 N 8.73 4.19 0.00 2.81 2.83 0.00 0.00 6.87 7.66 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 0.00 119 R 7.38 4.49 0.00 1.86 1.82 0.00 3.23 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.58 0.00 120 D 8.42 4.58 0.00 2.65 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 0.00 121 V 8.19 4.53 2.36 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 0.81 0.00 0.00 1.05 0.00 0.00 122 R 8.12 4.02 0.00 1.90 2.03 0.00 3.30 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 123 Q 8.25 3.96 0.00 2.06 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.90 0.00 0.00 0.00 0.00 0.00 2.18 1.60 0.00 124 Y 7.93 4.10 0.00 3.21 3.16 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 0.00 125 V 7.85 4.39 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 1.03 0.00 0.00 1.05 0.00 0.00 126 Q 7.44 4.18 0.00 1.88 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.69 0.00 0.00 0.00 0.00 0.00 2.58 2.46 0.00 127 G 8.92 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 0.00 128 C 8.04 4.41 0.00 3.10 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 0.00 129 G 8.20 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 0.00 0.00 0.00 130 V 7.84 4.01 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 0.74 0.00 0.00 0.96 0.00 0.00