NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 90 K 4.4021 8.2993 120.1108 55.6686 33.3903 179.2908 91 F 4.3701 8.9000 120.5403 56.7997 38.1253 172.9184 92 C 4.3800 10.0635 124.7492 59.4352 32.2852 175.8782 93 S 4.3819 8.8921 124.8333 61.4661 62.3996 176.4059 94 F 4.0948 8.3107 123.0109 61.6220 39.3391 176.8241 95 C 4.1104 8.3854 115.8593 62.5382 28.0191 175.7991 96 K 3.3521 8.3152 121.4418 59.7585 31.5138 178.3618 97 H 4.0620 8.1051 117.1596 59.1266 29.8916 176.3475 98 N 4.3672 7.7581 115.8595 53.7377 38.3020 175.7523 99 G 3.7740 7.6179 108.6936 45.7154 0.0000 173.7970 100 E 4.1372 7.7736 118.7317 55.5341 30.1765 177.4857 101 T 4.1105 8.0872 111.0596 61.4729 70.8344 174.9135 102 E 2.0000 8.3717 121.4611 58.8235 29.3252 178.5854 103 A 3.8576 7.6874 119.3753 55.0447 18.7619 179.4384 104 V 3.7766 7.3586 116.7213 66.2745 31.7505 177.7885 105 Y 4.4538 7.9161 116.9891 58.9545 37.8545 176.5642 106 T 4.5255 7.4738 109.9991 61.5952 69.1285 175.4180 107 S 4.4519 7.7579 116.1946 59.5381 63.7542 173.4337 108 H 4.5288 7.2605 114.5110 54.7766 30.6566 172.6989 109 Y 4.6551 7.7968 118.2733 57.1611 39.0081 175.6786 110 L 4.2557 8.8758 125.0204 57.6293 42.4049 177.2344 111 K 5.0245 7.6673 114.9995 54.2950 35.8927 175.7156 112 N 4.8222 8.6922 120.2933 51.7887 38.3798 176.1980 113 R 3.9785 8.3556 114.1630 58.2873 29.5346 176.8890 114 D 4.5330 8.0526 117.6456 54.2679 40.8504 177.3809 115 G 3.9324 8.3218 107.9126 45.4160 0.0000 173.7489 116 D 4.6907 7.7868 119.9172 53.3048 41.8276 175.7674 117 V 4.2130 8.2970 123.9001 63.1457 31.8609 175.6932 118 M 4.3500 8.7054 126.8070 55.9175 33.6379 176.1586 119 C 3.9208 8.1348 119.6574 59.2229 31.7805 172.4674 120 P 4.2394 0.0000 0.0000 65.3175 31.3403 177.9149 121 Y 4.2310 7.7189 116.6563 60.9049 38.1733 177.2462 122 L 3.3308 7.7284 120.6693 57.9712 42.1227 178.9588 123 R 4.0779 7.9383 117.8242 58.9203 29.7113 178.3481 124 Q 4.2292 7.7220 116.1633 56.3353 29.4033 175.6166 125 Y 4.2972 7.5670 121.7901 57.0440 39.5051 174.4863 126 K 4.4989 7.5052 125.6679 54.2081 34.2130 175.8109 127 C 4.2433 8.5089 124.9915 58.7355 31.8627 172.7178 128 P 4.3558 0.0000 0.0000 65.1348 31.5840 177.7384 129 L 4.2199 8.0961 118.9044 57.0568 41.8191 177.2750 130 C 4.6271 8.0608 109.3614 57.0769 31.3026 174.8764 131 G 3.8160 8.2174 107.8690 45.1488 0.0000 173.5787 132 A 4.0332 7.5499 122.8450 52.7242 19.2551 177.1203 133 T 4.7854 8.2465 114.3137 61.9919 71.2810 174.0142 134 G 3.6687 8.4213 110.9360 46.4040 0.0000 176.4945 135 A 4.1268 8.5711 123.4267 54.3475 18.5000 178.7338 136 K 4.5546 7.6488 113.0206 55.8779 32.4529 176.7393 137 A 4.1508 7.7409 122.9628 52.8621 18.8244 176.9610 138 H 4.7328 7.9280 113.2901 54.8262 31.0252 173.9592 139 T 4.4543 8.3249 111.3645 60.8538 69.9636 175.7661 140 K 4.1220 8.7900 121.5979 59.9068 32.9420 178.9510 141 R 3.6849 8.1816 118.9054 58.9687 29.7385 176.7393 142 F 4.8184 7.9028 113.8239 57.2566 39.1679 175.2099 143 C 4.0420 7.8537 121.5661 58.1664 32.0042 171.7980 144 P 4.4336 0.0000 0.0000 62.9338 30.8700 176.2147 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 90 K 8.30 4.40 0.00 1.59 1.07 0.00 1.69 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.35 7.81 91 F 8.90 4.37 0.00 3.55 3.32 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 92 C 10.06 4.38 0.00 3.15 3.01 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 93 S 8.89 4.38 0.00 3.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 F 8.31 4.09 0.00 3.17 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 95 C 8.39 4.11 0.00 3.24 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 96 K 8.32 3.35 0.00 1.42 1.85 0.00 0.77 0.00 0.00 0.61 0.00 0.00 2.59 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.30 1.04 7.81 97 H 8.11 4.06 0.00 3.15 3.22 0.00 6.00 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 N 7.76 4.37 0.00 2.48 2.59 0.00 0.00 7.20 7.25 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 99 G 7.62 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 E 7.77 4.14 0.00 2.08 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 2.33 2.24 0.00 101 T 8.09 4.11 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 1.18 0.00 0.00 102 E 8.37 2.00 0.00 1.79 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 1.75 2.16 0.00 103 A 7.69 3.86 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 0.00 104 V 7.36 3.78 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 1.24 0.00 0.00 0.99 0.00 0.00 105 Y 7.92 4.45 0.00 3.36 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 0.00 106 T 7.47 4.53 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 1.24 0.00 0.00 107 S 7.76 4.45 0.00 4.06 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 0.00 108 H 7.26 4.53 0.00 3.23 3.23 0.00 5.52 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 0.00 109 Y 7.80 4.66 0.00 3.11 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 0.00 110 L 8.88 4.26 0.00 1.75 1.69 0.99 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 111 K 7.67 5.02 0.00 1.69 1.62 0.00 1.71 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.35 7.81 112 N 8.69 4.82 0.00 3.01 3.03 0.00 0.00 6.74 7.26 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 0.00 113 R 8.36 3.98 0.00 1.90 2.05 0.00 3.00 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 114 D 8.05 4.53 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.32 3.93 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 0.00 0.00 0.00 116 D 7.79 4.69 0.00 2.86 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.30 4.21 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 0.97 0.00 0.00 118 M 8.71 4.35 0.00 2.04 2.31 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.79 0.00 119 C 8.13 3.92 0.00 3.10 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 0.00 120 P 0.00 4.24 0.00 1.81 1.95 0.00 3.54 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.83 0.00 121 Y 7.72 4.23 0.00 3.48 3.38 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 0.00 122 L 7.73 3.33 0.00 0.50 1.30 0.39 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 123 R 7.94 4.08 0.00 1.85 1.93 0.00 3.19 0.00 0.00 3.10 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 124 Q 7.72 4.23 0.00 2.27 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.85 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 125 Y 7.57 4.30 0.00 2.88 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 0.00 126 K 7.51 4.50 0.00 1.50 1.53 0.00 1.72 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.26 1.28 7.81 127 C 8.51 4.24 0.00 2.91 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 0.00 128 P 0.00 4.36 0.00 2.23 2.14 0.00 3.93 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 129 L 8.10 4.22 0.00 1.71 1.79 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 130 C 8.06 4.63 0.00 3.07 3.04 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 0.00 131 G 8.22 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 0.00 132 A 7.55 4.03 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 0.00 133 T 8.25 4.79 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 134 G 8.42 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.57 4.13 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 0.00 136 K 7.65 4.55 0.00 1.91 1.86 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.37 7.81 137 A 7.74 4.15 1.27 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 0.00 138 H 7.93 4.73 0.00 3.37 3.31 0.00 5.53 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 0.00 139 T 8.32 4.45 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 140 K 8.79 4.12 0.00 2.03 2.25 0.00 1.57 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.57 1.46 7.81 141 R 8.18 3.68 0.00 1.61 1.51 0.00 2.70 0.00 0.00 2.85 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.41 0.00 142 F 7.90 4.82 0.00 3.13 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 C 7.85 4.04 0.00 3.08 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 0.00 144 P 0.00 4.43 0.00 2.09 1.96 0.00 3.70 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 2.04 2.06 0.00