#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1li7 s LEU 2 N 0.00 4.38 -0.04 3.17 2.96 -1.26 -4.55 118.68 123.34 1li7 s LEU 2 Ca 0.00 2.63 0.05 0.00 -0.22 0.00 0.00 54.13 56.59 1li7 s LEU 2 Cb 0.00 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.11 1li7 s LEU 2 CO 0.00 -0.91 -0.19 -0.54 -1.32 0.00 0.00 176.35 173.38 1li7 s LYS 3 N 2.18 1.91 -0.11 1.98 1.02 0.31 -1.18 119.74 125.85 1li7 s LYS 3 Ca 0.75 -0.69 0.03 0.00 0.02 0.00 0.00 55.97 56.08 1li7 s LYS 3 Cb -0.43 -1.68 0.01 0.00 -0.52 0.00 0.00 37.83 35.20 1li7 s LYS 3 CO 0.33 0.31 -0.21 0.42 -0.92 0.00 0.00 175.35 175.28 1li7 s ILE 4 N -0.11 1.91 -0.11 2.17 1.01 -0.17 -0.45 121.20 125.45 1li7 s ILE 4 Ca -0.01 -0.91 -0.29 0.00 0.00 0.00 0.00 60.65 59.43 1li7 s ILE 4 Cb -0.11 -1.68 -0.04 0.00 0.01 0.00 0.00 42.46 40.64 1li7 s ILE 4 CO 0.02 0.52 1.63 0.12 0.00 0.00 0.00 174.94 177.24 1li7 s PHE 5 N 0.62 2.05 -0.36 3.97 5.36 -1.26 -1.26 117.98 127.09 1li7 s PHE 5 Ca -0.13 0.35 -0.12 0.00 -0.96 0.00 0.00 56.93 56.07 1li7 s PHE 5 Cb -0.17 -3.91 0.01 0.00 -0.34 0.00 0.00 43.02 38.61 1li7 s PHE 5 CO 0.03 -3.47 0.23 1.21 -1.46 0.00 0.00 175.22 171.77 1li7 s ASN 6 N 3.63 5.90 0.30 6.13 3.04 0.25 -4.67 114.94 129.52 1li7 s ASN 6 Ca 0.72 -0.71 0.04 0.00 0.04 0.00 0.00 52.86 52.95 1li7 s ASN 6 Cb -0.30 -2.09 0.65 0.00 -1.54 0.00 0.00 41.25 37.97 1li7 s ASN 6 CO 0.29 -0.32 1.82 0.74 -3.04 0.00 0.00 177.10 176.58 1li7 h THR 7 N 5.65 0.84 -0.48 -5.21 2.02 -1.66 0.84 112.91 114.91 1li7 h THR 7 Ca -0.29 -0.30 0.12 0.00 0.77 0.00 0.00 66.41 66.71 1li7 h THR 7 Cb 1.13 -0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 1li7 h THR 7 CO 0.67 0.16 0.34 0.25 0.37 0.00 0.00 175.52 177.31 1li7 h LEU 8 N 0.88 0.10 -1.20 2.58 5.85 -1.84 -2.38 115.31 119.31 1li7 h LEU 8 Ca 0.52 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.24 1li7 h LEU 8 Cb 0.65 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.66 1li7 h LEU 8 CO -0.29 0.06 0.00 0.35 -0.34 0.00 0.00 178.44 178.22 1li7 n THR 9 N -4.43 0.05 -4.02 1.05 -2.24 -0.08 -4.94 114.28 99.67 1li7 n THR 9 Ca 0.08 -0.52 -0.32 0.00 -2.27 0.00 0.00 64.05 61.01 1li7 n THR 9 Cb 0.48 1.03 0.01 0.00 -2.10 0.00 0.00 70.33 69.75 1li7 n THR 9 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1li7 n ARG 10 N 0.14 -4.74 -3.55 -0.78 0.00 0.27 -4.95 116.66 103.05 1li7 n ARG 10 Ca 0.02 0.52 -0.10 0.00 -0.00 0.00 0.00 57.85 58.29 1li7 n ARG 10 Cb 0.08 -5.37 -0.02 0.00 -0.00 0.00 0.00 32.46 27.16 1li7 n ARG 10 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 1li7 s GLN 11 N -6.73 1.39 0.18 2.89 -2.07 -1.17 -4.95 119.66 109.19 1li7 s GLN 11 Ca 0.70 -0.60 -0.30 0.00 -1.82 0.00 0.00 55.36 53.34 1li7 s GLN 11 Cb -0.36 0.58 -0.07 0.00 -1.09 0.00 0.00 33.01 32.06 1li7 s GLN 11 CO 0.86 -0.62 1.03 0.15 -1.32 0.00 0.00 175.29 175.40 1li7 s LYS 12 N -3.74 4.68 0.01 9.60 1.02 -1.26 -0.58 119.74 129.46 1li7 s LYS 12 Ca 0.04 1.61 0.02 0.00 0.02 0.00 0.00 55.97 57.65 1li7 s LYS 12 Cb -0.02 -3.30 -0.01 0.00 -0.52 0.00 0.00 37.83 33.98 1li7 s LYS 12 CO -0.07 0.21 -0.06 -1.21 -0.92 0.00 0.00 175.35 173.30 1li7 s GLU 13 N -0.50 0.43 0.03 1.68 2.02 -0.39 -4.87 118.70 117.10 1li7 s GLU 13 Ca 0.47 -0.33 -0.35 0.00 0.02 0.00 0.00 54.97 54.78 1li7 s GLU 13 Cb -0.27 -0.35 -0.14 0.00 0.10 0.00 0.00 34.13 33.47 1li7 s GLU 13 CO 0.33 0.09 1.67 -1.91 0.02 0.00 0.00 175.26 175.47 1li7 n GLU 14 N 2.55 1.98 -2.52 1.61 2.13 -1.26 -1.00 120.64 124.14 1li7 n GLU 14 Ca -0.16 0.72 -0.42 0.00 0.66 0.00 0.00 57.16 57.96 1li7 n GLU 14 Cb 0.57 -2.50 -0.03 0.00 0.27 0.00 0.00 31.44 29.76 1li7 n GLU 14 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 1li7 s PHE 15 N 2.20 3.34 -0.08 4.31 5.36 -0.33 -4.87 117.98 127.91 1li7 s PHE 15 Ca 0.86 1.35 -0.01 0.00 -0.96 0.00 0.00 56.93 58.17 1li7 s PHE 15 Cb -0.74 -3.35 0.03 0.00 -0.34 0.00 0.00 43.02 38.62 1li7 s PHE 15 CO 0.46 -0.97 -0.01 0.15 -1.46 0.00 0.00 175.22 173.39 1li7 s LYS 16 N 1.86 0.75 0.66 10.12 3.01 -1.26 -4.90 119.74 129.99 1li7 s LYS 16 Ca 0.55 0.02 -0.15 0.00 -1.01 0.00 0.00 55.97 55.38 1li7 s LYS 16 Cb -0.24 -1.13 0.00 0.00 -1.01 0.00 0.00 37.83 35.45 1li7 s LYS 16 CO 0.23 -0.32 1.11 -1.25 0.51 0.00 0.00 175.35 175.63 1li7 s PRO 17 N 1.93 2.79 0.27 -1.68 0.04 -1.26 -4.96 135.00 132.13 1li7 s PRO 17 Ca 0.05 1.37 0.06 0.00 0.04 0.00 0.00 61.00 62.52 1li7 s PRO 17 Cb -0.13 -1.95 0.38 0.00 0.04 0.00 0.00 34.50 32.84 1li7 s PRO 17 CO -0.06 -1.26 1.64 0.82 0.04 0.00 0.00 177.00 178.19 1li7 h ILE 18 N -0.02 1.35 -3.56 0.56 2.04 -1.98 -3.42 117.51 112.47 1li7 h ILE 18 Ca -0.47 -1.74 -0.46 0.00 1.00 0.00 0.00 64.86 63.19 1li7 h ILE 18 Cb 1.24 1.85 -0.33 0.00 -0.74 0.00 0.00 36.82 38.84 1li7 h ILE 18 CO 0.54 0.51 -0.79 -1.00 0.00 0.00 0.00 178.15 177.41 1li7 s HIS 19 N -3.95 1.10 0.14 1.37 3.76 -1.26 -5.11 115.29 111.34 1li7 s HIS 19 Ca -0.04 -0.35 -0.35 0.00 -0.15 0.00 0.00 55.06 54.18 1li7 s HIS 19 Cb 0.13 -0.84 -0.15 0.00 1.11 0.00 0.00 32.58 32.83 1li7 s HIS 19 CO 0.78 -0.19 1.41 0.00 -0.85 0.00 0.00 174.74 175.88 1li7 n ALA 20 N 3.71 0.11 -1.09 -1.40 0.00 -1.26 -1.96 120.51 118.63 1li7 n ALA 20 Ca -0.22 0.47 -0.03 0.00 0.00 0.00 0.00 53.44 53.66 1li7 n ALA 20 Cb 0.52 -2.19 -0.01 0.00 0.00 0.00 0.00 19.45 17.77 1li7 n ALA 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1li7 n GLY 21 N 2.72 0.46 3.09 0.00 0.00 -1.26 -4.98 105.19 105.21 1li7 n GLY 21 Ca 0.17 -0.09 -0.17 0.00 0.00 0.00 0.00 46.02 45.92 1li7 n GLY 21 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1li7 s GLU 22 N -1.66 0.71 -0.01 1.61 2.02 -0.83 0.49 118.70 121.03 1li7 s GLU 22 Ca 0.00 -0.66 0.00 0.00 0.02 0.00 0.00 54.97 54.33 1li7 s GLU 22 Cb 0.00 -0.64 0.01 0.00 0.10 0.00 0.00 34.13 33.60 1li7 s GLU 22 CO 0.00 0.15 0.00 0.08 0.02 0.00 0.00 175.26 175.52 1li7 s VAL 23 N -0.89 0.05 -0.18 2.63 1.01 -0.47 -4.47 120.40 118.07 1li7 s VAL 23 Ca -0.02 0.05 -0.02 0.00 0.00 0.00 0.00 61.98 61.99 1li7 s VAL 23 Cb -0.08 -0.11 -0.01 0.00 0.00 0.00 0.00 36.38 36.19 1li7 s VAL 23 CO 0.01 0.06 -0.09 -0.83 0.00 0.00 0.00 175.10 174.25 1li7 s GLY 24 N 0.46 1.57 -0.01 4.51 0.00 -1.26 -0.73 107.32 111.86 1li7 s GLY 24 Ca -0.04 -1.07 0.03 0.00 0.00 0.00 0.00 44.72 43.64 1li7 s GLY 24 CO -0.01 0.19 -0.09 -0.29 0.00 0.00 0.00 173.10 172.90 1li7 s MET 25 N 1.04 0.76 -0.10 2.90 1.75 -0.30 -1.93 119.30 123.42 1li7 s MET 25 Ca -0.00 -0.31 0.01 0.00 -1.25 0.00 0.00 55.69 54.14 1li7 s MET 25 Cb -0.15 -0.73 0.02 0.00 2.84 0.00 0.00 34.83 36.81 1li7 s MET 25 CO -0.01 0.18 -0.11 -0.47 -0.65 0.00 0.00 175.02 173.95 1li7 s TYR 26 N -0.13 1.62 0.11 4.11 5.04 -0.47 0.47 117.35 128.10 1li7 s TYR 26 Ca 0.02 -0.73 0.07 0.00 -2.44 0.00 0.00 57.07 53.99 1li7 s TYR 26 Cb -0.04 -1.23 -0.04 0.00 0.35 0.00 0.00 41.96 40.99 1li7 s TYR 26 CO -0.00 -0.43 -0.11 0.08 -1.34 0.00 0.00 175.55 173.75 1li7 s VAL 27 N 1.16 3.31 0.24 3.14 1.01 -0.11 0.86 120.40 130.01 1li7 s VAL 27 Ca -0.05 -1.32 -0.20 0.00 0.00 0.00 0.00 61.98 60.41 1li7 s VAL 27 Cb -0.14 -2.55 -0.08 0.00 0.00 0.00 0.00 36.38 33.60 1li7 s VAL 27 CO -0.03 0.09 0.75 0.00 0.00 0.00 0.00 175.10 175.92 1li7 n GLY 29 N 0.63 3.04 3.48 0.00 0.00 -1.25 -4.81 105.19 106.28 1li7 n GLY 29 Ca -0.01 -1.12 -0.27 0.00 0.00 0.00 0.00 46.02 44.62 1li7 n GLY 29 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1li7 s ILE 30 N 4.28 2.66 -0.13 -0.61 2.07 -1.24 -4.85 121.20 123.38 1li7 s ILE 30 Ca 0.00 -1.93 -0.25 0.00 -1.41 0.00 0.00 60.65 57.06 1li7 s ILE 30 Cb 0.00 -2.30 -0.02 0.00 0.13 0.00 0.00 42.46 40.27 1li7 s ILE 30 CO 0.00 -0.14 0.79 -0.89 -1.91 0.00 0.00 174.94 172.80 1li7 s THR 31 N -1.75 4.94 -1.23 4.00 2.01 -1.26 0.49 115.64 122.84 1li7 s THR 31 Ca 0.23 1.59 -0.13 0.00 0.31 0.00 0.00 61.69 63.68 1li7 s THR 31 Cb -0.08 -4.11 0.16 0.00 0.01 0.00 0.00 72.50 68.48 1li7 s THR 31 CO 0.12 0.11 1.53 0.55 -0.69 0.00 0.00 174.62 176.24 1li7 n VAL 32 N 4.40 4.24 0.00 3.82 3.14 -1.00 -4.31 118.33 128.62 1li7 n VAL 32 Ca 0.03 -4.63 0.00 0.00 -2.96 0.00 0.00 64.34 56.78 1li7 n VAL 32 Cb 0.50 -2.44 0.00 0.00 -1.06 0.00 0.00 33.84 30.83 1li7 n VAL 32 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1li7 n TYR 33 N 5.56 0.00 -3.60 1.45 0.18 -1.26 -4.81 117.16 114.68 1li7 n TYR 33 Ca 0.38 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 60.03 1li7 n TYR 33 Cb 0.42 0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 39.32 1li7 n TYR 33 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 1li7 s ASP 34 N -0.41 -0.39 0.24 9.48 3.68 -1.26 -5.01 116.67 123.00 1li7 s ASP 34 Ca 0.00 0.11 -0.31 0.00 2.13 0.00 0.00 52.55 54.48 1li7 s ASP 34 Cb 0.00 0.48 -0.13 0.00 -1.45 0.00 0.00 42.92 41.81 1li7 s ASP 34 CO 0.00 -0.71 1.40 0.18 0.13 0.00 0.00 175.17 176.17 1li7 n LEU 35 N 0.39 3.12 -4.77 -1.34 4.32 -1.26 -4.90 117.00 112.56 1li7 n LEU 35 Ca -0.18 1.14 -0.40 0.00 -0.02 0.00 0.00 56.01 56.55 1li7 n LEU 35 Cb 0.60 -1.43 -0.00 0.00 -1.62 0.00 0.00 43.42 40.97 1li7 n LEU 35 CO 0.19 -0.49 1.03 0.00 -1.22 0.00 0.00 177.39 176.90 1li7 s HIS 37 N -1.18 1.92 0.34 0.00 -3.43 -1.26 -1.85 115.29 109.82 1li7 s HIS 37 Ca 0.55 -0.19 0.33 0.00 -0.80 0.00 0.00 55.06 54.94 1li7 s HIS 37 Cb -0.42 -2.95 1.78 0.00 -1.43 0.00 0.00 32.58 29.56 1li7 s HIS 37 CO 0.55 -1.52 1.99 -0.84 -2.00 0.00 0.00 174.74 172.93 1li7 h ILE 38 N -0.40 0.00 0.08 -5.38 -2.65 -1.36 -1.41 117.51 106.39 1li7 h ILE 38 Ca -0.38 0.00 -0.21 0.00 1.03 0.00 0.00 64.86 65.30 1li7 h ILE 38 Cb 1.28 0.72 0.02 0.00 -2.05 0.00 0.00 36.82 36.79 1li7 h ILE 38 CO 0.44 0.00 -0.87 1.23 0.03 0.00 0.00 178.15 178.97 1li7 h GLY 39 N 0.00 0.51 1.03 0.16 0.00 -1.92 -2.00 103.07 100.84 1li7 h GLY 39 Ca 0.00 -1.04 -0.00 0.00 0.00 0.00 0.00 47.33 46.28 1li7 h GLY 39 CO 0.00 0.92 0.57 0.45 0.00 0.00 0.00 176.54 178.48 1li7 h HIS 40 N -0.06 1.25 0.03 5.60 -0.00 -1.65 -1.04 115.15 119.28 1li7 h HIS 40 Ca -0.13 -0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.23 1li7 h HIS 40 Cb 1.61 -0.41 0.00 0.00 -0.00 0.00 0.00 27.41 28.61 1li7 h HIS 40 CO 0.15 0.83 -0.02 0.78 -0.00 0.00 0.00 177.93 179.67 1li7 h GLY 41 N 1.31 -0.05 0.34 2.45 0.00 -1.38 -1.32 103.07 104.42 1li7 h GLY 41 Ca 0.34 0.02 0.04 0.00 0.00 0.00 0.00 47.33 47.73 1li7 h GLY 41 CO -0.06 -0.02 -0.22 -0.09 0.00 0.00 0.00 176.54 176.15 1li7 h ARG 42 N -0.07 -0.27 -0.66 4.80 1.12 -0.82 0.11 114.38 118.58 1li7 h ARG 42 Ca -0.00 0.02 0.12 0.00 -1.11 0.00 0.00 59.98 59.00 1li7 h ARG 42 Cb 0.06 0.06 -0.09 0.00 -0.01 0.00 0.00 29.97 29.99 1li7 h ARG 42 CO 0.01 -0.18 0.23 1.15 -3.11 0.00 0.00 179.97 178.06 1li7 h THR 43 N -0.28 0.69 0.00 0.20 2.02 -0.97 0.58 112.91 115.15 1li7 h THR 43 Ca 0.10 -0.13 -0.13 0.00 0.77 0.00 0.00 66.41 67.02 1li7 h THR 43 Cb 0.43 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 1li7 h THR 43 CO -0.29 0.07 -0.61 -0.26 0.37 0.00 0.00 175.52 174.80 1li7 h PHE 44 N 0.38 0.00 -0.10 3.16 0.04 -0.59 -2.16 116.94 117.67 1li7 h PHE 44 Ca 0.35 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.96 1li7 h PHE 44 Cb 0.50 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.64 1li7 h PHE 44 CO -0.19 0.61 -0.63 0.28 -0.60 0.00 0.00 178.31 177.78 1li7 h VAL 45 N 0.00 1.37 0.12 -0.55 2.07 -0.54 -1.38 116.25 117.33 1li7 h VAL 45 Ca -0.01 -1.98 -0.01 0.00 0.82 0.00 0.00 66.70 65.52 1li7 h VAL 45 Cb 1.41 1.98 0.00 0.00 -1.52 0.00 0.00 31.29 33.16 1li7 h VAL 45 CO 0.08 0.60 -0.06 0.00 0.02 0.00 0.00 177.57 178.21 1li7 h ALA 46 N 1.06 -0.16 0.00 1.67 0.00 -0.67 -1.25 119.26 119.91 1li7 h ALA 46 Ca -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1li7 h ALA 46 Cb 1.16 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1li7 h ALA 46 CO 0.11 -0.55 0.00 0.74 0.00 0.00 0.00 179.25 179.55 1li7 h PHE 47 N -0.24 0.00 -0.33 0.00 -1.00 -1.43 -2.14 116.94 111.80 1li7 h PHE 47 Ca -0.02 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.64 1li7 h PHE 47 Cb 0.20 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.74 1li7 h PHE 47 CO -0.04 0.00 -0.32 0.22 -1.61 0.00 0.00 178.31 176.56 1li7 h ASP 48 N 0.00 0.74 -0.36 2.17 1.82 -0.83 -0.62 116.42 119.34 1li7 h ASP 48 Ca 0.00 -0.30 -0.16 0.00 -0.39 0.00 0.00 57.03 56.18 1li7 h ASP 48 Cb 0.73 -0.21 -0.01 0.00 0.68 0.00 0.00 39.33 40.53 1li7 h ASP 48 CO 0.00 1.00 -0.41 0.58 -1.61 0.00 0.00 179.24 178.80 1li7 h VAL 49 N 0.60 1.27 -0.52 2.25 2.07 -0.79 -0.99 116.25 120.15 1li7 h VAL 49 Ca 0.07 -1.59 0.02 0.00 0.82 0.00 0.00 66.70 66.02 1li7 h VAL 49 Cb 0.83 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.99 1li7 h VAL 49 CO 0.07 0.53 0.32 0.58 0.02 0.00 0.00 177.57 179.09 1li7 h VAL 50 N 0.75 1.08 -0.45 2.57 2.07 -1.15 0.22 116.25 121.35 1li7 h VAL 50 Ca 0.05 -0.22 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 1li7 h VAL 50 Cb 1.01 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1li7 h VAL 50 CO 0.10 0.12 0.19 0.00 0.02 0.00 0.00 177.57 178.00 1li7 h ALA 51 N 1.22 0.58 -0.61 1.67 0.00 -0.97 -1.52 119.26 119.63 1li7 h ALA 51 Ca 0.20 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1li7 h ALA 51 Cb -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1li7 h ALA 51 CO -0.08 0.17 0.11 0.00 0.00 0.00 0.00 179.25 179.45 1li7 h ARG 52 N 0.58 1.00 -0.51 0.00 3.08 -0.67 -2.66 114.38 115.20 1li7 h ARG 52 Ca 0.15 -0.26 -0.09 0.00 0.07 0.00 0.00 59.98 59.85 1li7 h ARG 52 Cb 0.16 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 1li7 h ARG 52 CO -0.02 0.94 -0.04 -0.92 -1.07 0.00 0.00 179.97 178.86 1li7 h TYR 53 N 0.91 0.97 -0.46 3.04 3.20 -0.40 -0.36 116.97 123.87 1li7 h TYR 53 Ca 0.19 -0.16 -0.06 0.00 3.14 0.00 0.00 58.73 61.84 1li7 h TYR 53 Cb 0.41 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.41 1li7 h TYR 53 CO 0.03 0.90 0.05 -0.07 -1.64 0.00 0.00 178.16 177.43 1li7 h LEU 54 N 0.82 0.68 -0.44 2.82 3.38 -1.15 -0.86 115.31 120.55 1li7 h LEU 54 Ca 0.15 -0.14 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 1li7 h LEU 54 Cb 0.54 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1li7 h LEU 54 CO 0.03 0.72 -0.77 0.03 0.09 0.00 0.00 178.44 178.53 1li7 h ARG 55 N 0.69 0.14 -0.41 1.13 3.08 -1.19 -1.58 114.38 116.23 1li7 h ARG 55 Ca 0.15 -0.13 -0.03 0.00 0.07 0.00 0.00 59.98 60.04 1li7 h ARG 55 Cb 0.35 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1li7 h ARG 55 CO 0.01 0.84 0.16 0.35 -1.07 0.00 0.00 179.97 180.26 1li7 h PHE 56 N 0.08 0.64 0.00 3.04 3.57 -0.45 -2.23 116.94 121.59 1li7 h PHE 56 Ca -0.02 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.41 1li7 h PHE 56 Cb 1.35 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.90 1li7 h PHE 56 CO 0.02 0.56 -0.07 -0.07 -2.23 0.00 0.00 178.31 176.52 1li7 h LEU 57 N 0.52 0.00 0.00 0.59 3.38 -1.09 -3.46 115.31 115.25 1li7 h LEU 57 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1li7 h LEU 57 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1li7 h LEU 57 CO -0.01 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.20 1li7 n GLY 58 N -0.49 1.11 3.76 0.83 0.00 -0.84 -5.11 105.19 104.45 1li7 n GLY 58 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 1li7 n GLY 58 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1li7 s TYR 59 N -2.00 3.65 -0.51 1.61 1.51 -0.62 -4.94 117.35 116.05 1li7 s TYR 59 Ca 0.00 1.76 -0.24 0.00 -1.01 0.00 0.00 57.07 57.57 1li7 s TYR 59 Cb 0.00 -3.15 0.04 0.00 -0.11 0.00 0.00 41.96 38.74 1li7 s TYR 59 CO 0.00 -0.22 0.92 -1.59 -1.11 0.00 0.00 175.55 173.55 1li7 s LYS 60 N -1.59 3.40 -0.14 -0.62 0.00 0.18 -4.32 119.74 116.66 1li7 s LYS 60 Ca 0.46 -0.12 -0.07 0.00 0.00 0.00 0.00 55.97 56.25 1li7 s LYS 60 Cb -0.28 -4.00 -0.04 0.00 0.00 0.00 0.00 37.83 33.51 1li7 s LYS 60 CO 0.35 -1.37 0.11 -1.17 0.00 0.00 0.00 175.35 173.27 1li7 s LEU 61 N 3.82 4.17 -0.32 2.77 2.96 -1.26 -1.37 118.68 129.46 1li7 s LEU 61 Ca 0.32 0.33 0.01 0.00 -0.22 0.00 0.00 54.13 54.57 1li7 s LEU 61 Cb -0.12 -2.02 0.08 0.00 0.50 0.00 0.00 46.19 44.63 1li7 s LEU 61 CO 0.22 0.34 0.02 -0.75 -1.32 0.00 0.00 176.35 174.85 1li7 s LYS 62 N -0.59 2.05 -0.25 1.98 2.20 0.09 -4.96 119.74 120.25 1li7 s LYS 62 Ca 0.12 -1.55 -0.09 0.00 -0.36 0.00 0.00 55.97 54.09 1li7 s LYS 62 Cb -0.12 -3.19 -0.04 0.00 -1.51 0.00 0.00 37.83 32.98 1li7 s LYS 62 CO 0.02 -0.78 0.11 -0.47 -0.36 0.00 0.00 175.35 173.88 1li7 s TYR 63 N 1.10 3.15 -0.15 4.03 5.04 -1.26 -1.15 117.35 128.10 1li7 s TYR 63 Ca 0.01 -0.18 0.00 0.00 -2.44 0.00 0.00 57.07 54.46 1li7 s TYR 63 Cb -0.20 -2.27 -0.00 0.00 0.35 0.00 0.00 41.96 39.84 1li7 s TYR 63 CO -0.05 -0.23 -0.16 0.08 -1.34 0.00 0.00 175.55 173.86 1li7 s VAL 64 N 1.52 2.62 -0.20 3.14 1.01 0.18 0.11 120.40 128.78 1li7 s VAL 64 Ca 0.06 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.24 1li7 s VAL 64 Cb -0.15 -2.10 0.06 0.00 0.00 0.00 0.00 36.38 34.19 1li7 s VAL 64 CO 0.06 0.52 0.01 -0.60 0.00 0.00 0.00 175.10 175.09 1li7 s ARG 65 N 0.82 0.87 1.13 2.72 3.52 -0.94 -0.93 118.95 126.14 1li7 s ARG 65 Ca -0.05 -0.53 -0.19 0.00 -0.13 0.00 0.00 55.73 54.83 1li7 s ARG 65 Cb -0.15 -2.19 0.27 0.00 -1.56 0.00 0.00 34.95 31.31 1li7 s ARG 65 CO -0.00 -0.62 1.20 0.54 -0.81 0.00 0.00 175.30 175.61 1li7 s ASN 66 N 1.76 1.59 -0.07 -2.12 4.22 -1.23 -4.29 114.94 114.80 1li7 s ASN 66 Ca -0.02 0.43 -0.01 0.00 -2.14 0.00 0.00 52.86 51.12 1li7 s ASN 66 Cb -0.17 -0.54 0.03 0.00 1.28 0.00 0.00 41.25 41.85 1li7 s ASN 66 CO -0.07 -3.69 0.00 -0.63 -2.04 0.00 0.00 177.10 170.67 1li7 s ILE 67 N -3.37 0.34 -0.45 0.54 -1.09 -0.55 -3.65 121.20 112.97 1li7 s ILE 67 Ca 0.73 0.14 -0.28 0.00 -2.23 0.00 0.00 60.65 59.00 1li7 s ILE 67 Cb -0.06 -0.49 0.03 0.00 -1.58 0.00 0.00 42.46 40.35 1li7 s ILE 67 CO 0.55 0.25 1.09 -0.89 -1.23 0.00 0.00 174.94 174.71 1li7 s THR 68 N 1.91 4.31 -0.14 2.92 2.01 0.18 -2.95 115.64 123.87 1li7 s THR 68 Ca 0.04 1.24 0.18 0.00 0.31 0.00 0.00 61.69 63.45 1li7 s THR 68 Cb -0.12 -4.54 -0.11 0.00 0.01 0.00 0.00 72.50 67.74 1li7 s THR 68 CO -0.05 -0.88 0.86 0.47 -0.69 0.00 0.00 174.62 174.34 1li7 n ASP 69 N 7.55 0.86 -3.72 3.53 10.43 -1.26 -2.37 116.55 131.57 1li7 n ASP 69 Ca 0.11 0.37 -0.13 0.00 2.57 0.00 0.00 54.79 57.71 1li7 n ASP 69 Cb 0.49 0.20 -0.10 0.00 1.84 0.00 0.00 41.12 43.55 1li7 n ASP 69 CO 0.00 0.00 0.00 0.27 -1.07 0.00 0.00 177.20 176.40 1li7 s ILE 70 N -3.00 -0.00 -0.01 0.53 -5.25 -1.26 -4.94 121.20 107.27 1li7 s ILE 70 Ca -0.02 0.00 -0.29 0.00 -0.99 0.00 0.00 60.65 59.35 1li7 s ILE 70 Cb 0.09 -0.61 0.10 0.00 2.95 0.00 0.00 42.46 44.99 1li7 s ILE 70 CO 0.81 0.00 0.87 1.51 -1.79 0.00 0.00 174.94 176.34 1li7 s ASP 71 N 0.24 -0.39 0.14 4.36 3.84 -1.26 -4.71 116.67 118.89 1li7 s ASP 71 Ca -0.00 0.07 -0.31 0.00 -0.00 0.00 0.00 52.55 52.31 1li7 s ASP 71 Cb -0.03 0.40 -0.07 0.00 -1.38 0.00 0.00 42.92 41.83 1li7 s ASP 71 CO 0.00 -0.62 1.55 0.44 -0.00 0.00 0.00 175.17 176.55 1li7 h ASP 72 N 2.10 -1.86 -0.89 2.11 3.45 -1.99 -2.25 116.42 117.08 1li7 h ASP 72 Ca -0.23 0.26 0.19 0.00 0.43 0.00 0.00 57.03 57.69 1li7 h ASP 72 Cb 1.23 0.79 -0.17 0.00 -0.56 0.00 0.00 39.33 40.63 1li7 h ASP 72 CO 0.32 -0.36 -0.17 0.11 -1.57 0.00 0.00 179.24 177.57 1li7 h LYS 73 N -0.29 0.01 0.28 3.56 1.57 -1.98 -0.26 116.57 119.46 1li7 h LYS 73 Ca 0.11 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.88 1li7 h LYS 73 Cb 0.55 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1li7 h LYS 73 CO -0.69 0.01 -0.13 0.82 -0.57 0.00 0.00 179.45 178.89 1li7 h ILE 74 N 0.01 0.74 0.00 1.86 2.04 -1.76 -0.72 117.51 119.68 1li7 h ILE 74 Ca 0.45 -0.07 -0.04 0.00 1.00 0.00 0.00 64.86 66.19 1li7 h ILE 74 Cb 0.74 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 1li7 h ILE 74 CO -0.89 0.02 -0.21 0.16 0.00 0.00 0.00 178.15 177.23 1li7 h ILE 75 N -0.41 1.07 0.00 -0.67 -0.00 -1.42 -0.73 117.51 115.36 1li7 h ILE 75 Ca -0.04 -0.72 -0.00 0.00 -0.00 0.00 0.00 64.86 64.10 1li7 h ILE 75 Cb 0.31 1.40 0.00 0.00 -0.00 0.00 0.00 36.82 38.53 1li7 h ILE 75 CO 0.06 0.20 -0.00 0.11 -0.00 0.00 0.00 178.15 178.52 1li7 h LYS 76 N 0.00 -0.00 -0.71 0.16 1.79 -0.65 -2.90 116.57 114.25 1li7 h LYS 76 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1li7 h LYS 76 Cb 0.38 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.00 1li7 h LYS 76 CO 0.03 0.56 0.45 -0.09 -1.08 0.00 0.00 179.45 179.32 1li7 h ARG 77 N -0.56 0.95 -0.91 3.15 2.43 -0.87 -2.47 114.38 116.10 1li7 h ARG 77 Ca -0.00 -0.07 0.04 0.00 -0.81 0.00 0.00 59.98 59.14 1li7 h ARG 77 Cb 0.56 -0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 29.85 1li7 h ARG 77 CO 0.00 0.65 0.60 0.00 -1.51 0.00 0.00 179.97 179.71 1li7 h ALA 78 N 1.24 1.44 0.06 2.80 0.00 -1.18 -2.49 119.26 121.14 1li7 h ALA 78 Ca 0.26 -0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.88 1li7 h ALA 78 Cb -0.07 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.41 1li7 h ALA 78 CO -0.05 0.46 -1.07 -0.91 0.00 0.00 0.00 179.25 177.67 1li7 h ASN 79 N 1.12 0.47 0.67 0.00 2.35 -1.28 0.85 115.58 119.76 1li7 h ASN 79 Ca 0.37 -0.43 -0.08 0.00 -0.55 0.00 0.00 56.30 55.60 1li7 h ASN 79 Cb 0.06 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 1li7 h ASN 79 CO -0.12 1.27 -0.40 -0.33 -1.65 0.00 0.00 177.43 176.20 1li7 h GLU 80 N 0.15 0.00 -0.57 0.81 5.08 -1.30 -2.23 114.58 116.53 1li7 h GLU 80 Ca -0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1li7 h GLU 80 Cb 1.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.00 1li7 h GLU 80 CO 0.18 0.40 0.00 0.09 -1.00 0.00 0.00 179.01 178.68 1li7 n ASN 81 N -3.70 4.51 -4.28 1.42 4.13 -0.95 -4.95 115.26 111.43 1li7 n ASN 81 Ca -0.01 -2.48 -0.37 0.00 1.68 0.00 0.00 54.58 53.40 1li7 n ASN 81 Cb 0.49 -0.54 -0.03 0.00 -1.54 0.00 0.00 39.78 38.15 1li7 n ASN 81 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1li7 n GLY 82 N 0.86 -0.44 3.75 7.41 0.00 -0.84 -4.95 105.19 110.98 1li7 n GLY 82 Ca 0.24 0.12 -0.23 0.00 0.00 0.00 0.00 46.02 46.16 1li7 n GLY 82 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1li7 s GLU 83 N -6.98 2.65 0.11 1.61 2.12 0.29 -5.00 118.70 113.50 1li7 s GLU 83 Ca 0.76 -1.19 -0.30 0.00 0.36 0.00 0.00 54.97 54.59 1li7 s GLU 83 Cb -0.42 -2.40 -0.06 0.00 0.26 0.00 0.00 34.13 31.51 1li7 s GLU 83 CO 0.94 0.39 1.14 0.45 -0.54 0.00 0.00 175.26 177.65 1li7 s SER 84 N -3.70 7.17 0.11 -1.70 0.15 -1.26 -4.37 113.70 110.10 1li7 s SER 84 Ca 0.32 2.02 -0.34 0.00 0.70 0.00 0.00 55.95 58.65 1li7 s SER 84 Cb -0.07 -2.59 -0.13 0.00 -1.71 0.00 0.00 66.02 61.51 1li7 s SER 84 CO 0.23 -0.35 1.55 0.15 1.20 0.00 0.00 173.24 176.02 1li7 h PHE 85 N 6.09 -1.59 -0.19 3.44 3.57 -1.95 0.13 116.94 126.44 1li7 h PHE 85 Ca -0.43 0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.17 1li7 h PHE 85 Cb 1.21 0.70 -0.04 0.00 2.79 0.00 0.00 35.95 40.62 1li7 h PHE 85 CO 0.65 -0.57 -0.06 0.28 -2.23 0.00 0.00 178.31 176.39 1li7 h VAL 86 N -0.64 0.78 -0.50 1.41 2.07 -1.98 -1.86 116.25 115.53 1li7 h VAL 86 Ca 0.02 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.55 1li7 h VAL 86 Cb 0.71 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 1li7 h VAL 86 CO -0.39 0.00 0.33 0.00 0.02 0.00 0.00 177.57 177.53 1li7 h ALA 87 N 1.16 1.66 -0.29 1.67 0.00 -1.90 -1.44 119.26 120.13 1li7 h ALA 87 Ca 0.09 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1li7 h ALA 87 Cb 0.16 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1li7 h ALA 87 CO -0.20 0.31 -0.11 1.98 0.00 0.00 0.00 179.25 181.22 1li7 h MET 88 N 0.66 0.58 -0.29 0.00 -1.53 0.01 -2.48 114.93 111.87 1li7 h MET 88 Ca 0.19 -0.24 -0.17 0.00 -3.44 0.00 0.00 59.70 56.03 1li7 h MET 88 Cb -0.05 -0.02 -0.00 0.00 -0.55 0.00 0.00 31.60 30.98 1li7 h MET 88 CO -0.04 0.80 -0.51 -0.39 0.14 0.00 0.00 176.91 176.92 1li7 h VAL 89 N 0.33 1.28 -0.80 -5.77 -1.51 -1.00 -1.25 116.25 107.53 1li7 h VAL 89 Ca 0.07 -1.70 0.02 0.00 -1.23 0.00 0.00 66.70 63.86 1li7 h VAL 89 Cb 0.62 1.59 -0.04 0.00 -2.13 0.00 0.00 31.29 31.32 1li7 h VAL 89 CO 0.04 0.55 0.52 0.44 -1.23 0.00 0.00 177.57 177.89 1li7 h ASP 90 N 0.65 0.87 -0.40 4.19 3.45 -1.29 0.40 116.42 124.28 1li7 h ASP 90 Ca 0.03 -0.01 -0.08 0.00 0.43 0.00 0.00 57.03 57.39 1li7 h ASP 90 Cb 1.10 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 39.65 1li7 h ASP 90 CO 0.11 0.61 -0.07 -0.09 -1.57 0.00 0.00 179.24 178.23 1li7 h ARG 91 N 1.03 0.76 -0.28 3.56 2.43 -1.32 -2.30 114.38 118.26 1li7 h ARG 91 Ca 0.31 -0.28 -0.10 0.00 -0.81 0.00 0.00 59.98 59.11 1li7 h ARG 91 Cb -0.04 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 1li7 h ARG 91 CO -0.09 0.88 -0.24 0.52 -1.51 0.00 0.00 179.97 179.53 1li7 h MET 92 N 0.57 0.53 -0.34 0.20 2.86 -0.64 -0.68 114.93 117.43 1li7 h MET 92 Ca 0.10 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 57.52 1li7 h MET 92 Cb 0.58 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 1li7 h MET 92 CO 0.03 0.73 0.09 0.82 1.06 0.00 0.00 176.91 179.64 1li7 h ILE 93 N 0.47 1.22 -0.15 -1.22 2.04 -0.09 0.35 117.51 120.12 1li7 h ILE 93 Ca 0.07 -0.73 -0.08 0.00 1.00 0.00 0.00 64.86 65.12 1li7 h ILE 93 Cb 0.66 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 1li7 h ILE 93 CO 0.05 0.25 -0.25 0.00 0.00 0.00 0.00 178.15 178.20 1li7 h ALA 94 N 0.93 1.30 -0.39 1.87 0.00 -1.25 -0.73 119.26 120.98 1li7 h ALA 94 Ca 0.11 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 1li7 h ALA 94 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1li7 h ALA 94 CO 0.00 0.47 -0.20 1.49 0.00 0.00 0.00 179.25 181.01 1li7 h GLU 95 N 0.25 0.82 0.34 0.00 4.57 -0.67 -2.77 114.58 117.11 1li7 h GLU 95 Ca 0.04 -0.36 -0.02 0.00 -1.18 0.00 0.00 59.36 57.84 1li7 h GLU 95 Cb 0.58 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 1li7 h GLU 95 CO 0.04 0.99 -0.16 1.98 -1.18 0.00 0.00 179.01 180.68 1li7 h MET 96 N 0.62 -0.43 -0.99 1.92 1.85 0.20 -2.95 114.93 115.15 1li7 h MET 96 Ca 0.08 0.03 0.18 0.00 -0.61 0.00 0.00 59.70 59.38 1li7 h MET 96 Cb 0.76 0.10 -0.10 0.00 0.43 0.00 0.00 31.60 32.78 1li7 h MET 96 CO 0.06 -0.23 0.59 0.45 -0.40 0.00 0.00 176.91 177.38 1li7 h HIS 97 N -0.55 1.04 -0.18 1.39 3.86 -1.16 -1.44 115.15 118.11 1li7 h HIS 97 Ca -0.05 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.24 1li7 h HIS 97 Cb 0.41 -0.31 -0.04 0.00 1.06 0.00 0.00 27.41 28.52 1li7 h HIS 97 CO -0.03 0.25 -0.09 0.87 0.86 0.00 0.00 177.93 179.79 1li7 h LYS 98 N 0.77 -0.07 -0.10 2.45 1.57 -1.32 0.33 116.57 120.19 1li7 h LYS 98 Ca 0.56 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.34 1li7 h LYS 98 Cb 0.84 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.16 1li7 h LYS 98 CO -0.37 -0.05 0.05 -0.44 -0.57 0.00 0.00 179.45 178.07 1li7 h ASP 99 N -0.07 0.13 -0.14 0.86 3.32 -1.22 -1.51 116.42 117.79 1li7 h ASP 99 Ca 0.10 -0.09 0.02 0.00 0.02 0.00 0.00 57.03 57.08 1li7 h ASP 99 Cb 0.22 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1li7 h ASP 99 CO -0.23 0.18 0.02 -0.26 -1.72 0.00 0.00 179.24 177.23 1li7 h PHE 100 N 0.06 0.03 -0.89 4.55 0.04 -1.04 -1.91 116.94 117.78 1li7 h PHE 100 Ca 0.04 0.01 0.06 0.00 2.80 0.00 0.00 57.97 60.87 1li7 h PHE 100 Cb 0.08 0.01 -0.06 0.00 2.20 0.00 0.00 35.95 38.18 1li7 h PHE 100 CO -0.04 0.01 0.56 -0.44 -0.60 0.00 0.00 178.31 177.80 1li7 h ASP 101 N 0.07 0.89 -0.59 2.17 3.32 -0.27 -1.49 116.42 120.53 1li7 h ASP 101 Ca 0.06 0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.13 1li7 h ASP 101 Cb 0.06 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.40 1li7 h ASP 101 CO -0.09 0.58 0.39 0.00 -1.72 0.00 0.00 179.24 178.40 1li7 h ALA 102 N 1.41 0.75 0.00 3.45 0.00 -0.79 0.76 119.26 124.84 1li7 h ALA 102 Ca 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1li7 h ALA 102 Cb 0.15 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1li7 h ALA 102 CO -0.17 0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.55 1li7 n LEU 103 N -4.67 0.00 -3.30 0.00 4.77 -0.70 -4.80 117.00 108.30 1li7 n LEU 103 Ca 0.04 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.78 1li7 n LEU 103 Cb 0.02 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.14 1li7 n LEU 103 CO 0.35 0.00 0.05 -3.20 -1.33 0.00 0.00 177.39 173.26 1li7 n ASN 104 N -0.59 -5.58 -4.60 -1.43 5.15 0.26 -4.88 115.26 103.59 1li7 n ASN 104 Ca 0.03 -0.41 -0.42 0.00 -0.60 0.00 0.00 54.58 53.18 1li7 n ASN 104 Cb 0.01 -4.49 -0.05 0.00 -0.53 0.00 0.00 39.78 34.72 1li7 n ASN 104 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1li7 s ILE 105 N -3.17 4.76 0.54 -1.44 1.01 -0.65 -5.01 121.20 117.24 1li7 s ILE 105 Ca 0.42 1.04 -0.22 0.00 0.00 0.00 0.00 60.65 61.89 1li7 s ILE 105 Cb -0.20 -4.18 -0.05 0.00 0.01 0.00 0.00 42.46 38.05 1li7 s ILE 105 CO 0.52 -0.34 1.32 -0.76 0.00 0.00 0.00 174.94 175.68 1li7 s LEU 106 N 3.02 3.85 0.38 2.97 1.43 -1.26 -4.50 118.68 124.57 1li7 s LEU 106 Ca 0.32 2.68 -0.26 0.00 -1.03 0.00 0.00 54.13 55.84 1li7 s LEU 106 Cb -0.14 -4.30 -0.09 0.00 0.03 0.00 0.00 46.19 41.69 1li7 s LEU 106 CO 0.15 -1.51 1.22 -0.13 0.23 0.00 0.00 176.35 176.30 1li7 s ARG 107 N -2.92 4.14 1.06 1.70 1.81 -1.26 -5.01 118.95 118.47 1li7 s ARG 107 Ca 0.71 1.98 -0.12 0.00 -1.72 0.00 0.00 55.73 56.58 1li7 s ARG 107 Cb -0.38 -2.81 0.22 0.00 -0.45 0.00 0.00 34.95 31.52 1li7 s ARG 107 CO 0.45 -0.29 1.07 -2.14 -0.68 0.00 0.00 175.30 173.71 1li7 s PRO 108 N -2.11 -0.05 0.22 3.54 0.02 -1.26 -4.91 135.00 130.44 1li7 s PRO 108 Ca 0.54 0.78 0.04 0.00 0.02 0.00 0.00 61.00 62.38 1li7 s PRO 108 Cb -0.34 -1.66 0.19 0.00 0.02 0.00 0.00 34.50 32.71 1li7 s PRO 108 CO 0.44 -3.13 1.52 -0.44 -0.33 0.00 0.00 177.00 175.06 1li7 h ASP 109 N -2.19 0.25 -3.65 2.53 3.32 -0.72 -3.44 116.42 112.53 1li7 h ASP 109 Ca -0.56 -0.16 -0.26 0.00 0.02 0.00 0.00 57.03 56.07 1li7 h ASP 109 Cb 1.32 -0.07 -0.30 0.00 0.22 0.00 0.00 39.33 40.49 1li7 h ASP 109 CO 0.53 0.85 -0.72 -0.04 -1.72 0.00 0.00 179.24 178.14 1li7 s MET 110 N -3.61 -0.01 -0.50 3.56 -1.94 -1.09 -5.01 119.30 110.70 1li7 s MET 110 Ca -0.04 0.08 0.08 0.00 -1.71 0.00 0.00 55.69 54.10 1li7 s MET 110 Cb 0.12 -0.10 0.28 0.00 2.01 0.00 0.00 34.83 37.14 1li7 s MET 110 CO 0.80 -0.07 0.70 -1.91 -0.01 0.00 0.00 175.02 174.53 1li7 n GLU 111 N 3.52 1.73 -1.97 2.03 2.13 -1.26 -2.20 120.64 124.62 1li7 n GLU 111 Ca -0.18 -3.97 -0.36 0.00 0.66 0.00 0.00 57.16 53.30 1li7 n GLU 111 Cb 0.56 -1.79 0.04 0.00 0.27 0.00 0.00 31.44 30.51 1li7 n GLU 111 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1li7 s PRO 112 N -2.17 3.00 -0.01 5.31 0.04 -1.26 -4.68 135.00 135.22 1li7 s PRO 112 Ca 0.40 1.90 0.05 0.00 0.04 0.00 0.00 61.00 63.39 1li7 s PRO 112 Cb 0.21 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.73 1li7 s PRO 112 CO -0.08 -1.20 -0.16 1.03 0.04 0.00 0.00 177.00 176.63 1li7 s ARG 113 N -3.24 2.34 0.27 4.56 0.52 -1.26 -1.48 118.95 120.66 1li7 s ARG 113 Ca 0.76 -0.81 -0.01 0.00 -0.52 0.00 0.00 55.73 55.16 1li7 s ARG 113 Cb -0.32 -2.30 0.59 0.00 0.52 0.00 0.00 34.95 33.43 1li7 s ARG 113 CO 0.36 0.59 1.69 0.00 0.02 0.00 0.00 175.30 177.96 1li7 h ALA 114 N 5.03 1.19 -0.07 2.13 0.00 -1.91 0.92 119.26 126.56 1li7 h ALA 114 Ca -0.47 0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.62 1li7 h ALA 114 Cb 1.15 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1li7 h ALA 114 CO 0.49 -0.32 0.08 1.15 0.00 0.00 0.00 179.25 180.65 1li7 h THR 115 N 0.35 0.49 -0.01 0.00 2.02 -1.92 -0.89 112.91 112.95 1li7 h THR 115 Ca 0.48 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.66 1li7 h THR 115 Cb 0.86 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 1li7 h THR 115 CO -0.51 0.00 -0.03 1.41 0.37 0.00 0.00 175.52 176.76 1li7 n HIS 116 N -3.81 0.00 -1.76 3.16 8.25 0.31 -4.20 115.22 117.18 1li7 n HIS 116 Ca -0.01 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.50 1li7 n HIS 116 Cb 0.18 -0.01 0.16 0.00 1.12 0.00 0.00 29.99 31.43 1li7 n HIS 116 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1li7 n HIS 117 N 0.13 0.00 -0.33 4.41 8.25 -0.34 -4.75 115.22 122.60 1li7 n HIS 117 Ca 0.18 -1.22 -0.01 0.00 -0.26 0.00 0.00 57.72 56.41 1li7 n HIS 117 Cb 0.36 -0.22 0.11 0.00 1.12 0.00 0.00 29.99 31.37 1li7 n HIS 117 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1li7 h ILE 118 N 2.32 1.16 -0.07 1.59 5.03 -1.72 0.12 117.51 125.94 1li7 h ILE 118 Ca -0.05 -0.39 0.04 0.00 -0.12 0.00 0.00 64.86 64.33 1li7 h ILE 118 Cb 1.20 -0.09 -0.05 0.00 -3.03 0.00 0.00 36.82 34.86 1li7 h ILE 118 CO 0.02 0.21 -0.21 0.00 -0.68 0.00 0.00 178.15 177.49 1li7 h ALA 119 N 1.37 -0.22 -0.06 1.87 0.00 -1.93 0.22 119.26 120.51 1li7 h ALA 119 Ca 0.36 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.18 1li7 h ALA 119 Cb -0.02 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1li7 h ALA 119 CO -0.11 -0.69 -0.44 1.05 0.00 0.00 0.00 179.25 179.06 1li7 h GLU 120 N -0.30 0.14 -0.61 0.00 9.09 -1.82 -0.76 114.58 120.33 1li7 h GLU 120 Ca 0.08 -0.07 -0.04 0.00 0.05 0.00 0.00 59.36 59.38 1li7 h GLU 120 Cb 0.41 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.48 1li7 h GLU 120 CO -0.24 0.56 0.21 0.82 0.05 0.00 0.00 179.01 180.41 1li7 h ILE 121 N 0.12 1.24 -0.18 -1.06 2.04 -0.31 -0.50 117.51 118.86 1li7 h ILE 121 Ca 0.01 -0.79 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 1li7 h ILE 121 Cb 0.83 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1li7 h ILE 121 CO 0.06 0.30 0.07 0.40 0.00 0.00 0.00 178.15 178.98 1li7 h ILE 122 N 0.86 1.16 0.22 -0.67 1.08 -0.19 -1.05 117.51 118.92 1li7 h ILE 122 Ca 0.20 -0.50 0.00 0.00 -0.39 0.00 0.00 64.86 64.18 1li7 h ILE 122 Cb 0.25 1.16 -0.02 0.00 -3.07 0.00 0.00 36.82 35.15 1li7 h ILE 122 CO -0.01 0.16 -0.24 1.05 -0.69 0.00 0.00 178.15 178.42 1li7 h GLU 123 N 0.13 -0.48 -0.91 2.37 9.09 -0.94 -0.20 114.58 123.63 1li7 h GLU 123 Ca 0.06 0.03 0.11 0.00 0.05 0.00 0.00 59.36 59.62 1li7 h GLU 123 Cb 0.18 0.11 -0.08 0.00 -1.65 0.00 0.00 28.75 27.31 1li7 h GLU 123 CO -0.00 -0.32 0.54 1.25 0.05 0.00 0.00 179.01 180.52 1li7 h LEU 124 N -0.50 0.77 -0.71 3.06 6.46 -1.03 -0.59 115.31 122.77 1li7 h LEU 124 Ca 0.00 0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.80 1li7 h LEU 124 Cb 0.47 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.28 1li7 h LEU 124 CO -0.06 0.41 0.38 0.74 -0.62 0.00 0.00 178.44 179.28 1li7 h THR 125 N 0.86 1.22 -0.37 1.05 2.02 -0.48 -1.95 112.91 115.26 1li7 h THR 125 Ca 0.45 -0.56 -0.09 0.00 0.77 0.00 0.00 66.41 66.99 1li7 h THR 125 Cb 0.47 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.16 1li7 h THR 125 CO -0.27 0.24 -0.13 -0.33 0.37 0.00 0.00 175.52 175.40 1li7 h GLU 126 N 0.97 0.65 -0.63 6.66 5.08 0.40 -2.27 114.58 125.45 1li7 h GLU 126 Ca 0.25 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.30 1li7 h GLU 126 Cb 0.05 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1li7 h GLU 126 CO -0.04 0.76 0.03 1.96 -1.00 0.00 0.00 179.01 180.72 1li7 h GLN 127 N 0.59 1.09 -0.09 2.33 1.08 -0.80 0.28 115.11 119.59 1li7 h GLN 127 Ca 0.10 -0.33 -0.08 0.00 -1.45 0.00 0.00 58.65 56.89 1li7 h GLN 127 Cb 0.57 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.88 1li7 h GLN 127 CO 0.04 1.04 -0.31 -0.07 -0.95 0.00 0.00 178.83 178.58 1li7 h LEU 128 N 1.00 0.16 0.04 1.46 3.38 -1.06 -0.36 115.31 119.93 1li7 h LEU 128 Ca 0.18 -0.05 -0.22 0.00 0.09 0.00 0.00 57.88 57.88 1li7 h LEU 128 Cb 0.53 -0.04 0.02 0.00 0.09 0.00 0.00 40.66 41.26 1li7 h LEU 128 CO 0.03 0.47 -0.87 0.40 0.09 0.00 0.00 178.44 178.56 1li7 h ILE 129 N 0.14 1.37 -0.72 1.22 2.04 -1.12 0.38 117.51 120.82 1li7 h ILE 129 Ca 0.02 -2.25 0.05 0.00 1.00 0.00 0.00 64.86 63.68 1li7 h ILE 129 Cb 0.62 2.64 -0.05 0.00 -0.74 0.00 0.00 36.82 39.28 1li7 h ILE 129 CO 0.05 0.67 0.43 0.00 0.00 0.00 0.00 178.15 179.29 1li7 h ALA 130 N 0.30 0.97 -0.44 1.87 0.00 -0.68 -2.77 119.26 118.52 1li7 h ALA 130 Ca -0.12 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.53 1li7 h ALA 130 Cb 1.57 -0.17 -0.13 0.00 0.00 0.00 0.00 17.79 19.06 1li7 h ALA 130 CO 0.17 0.14 0.33 1.63 0.00 0.00 0.00 179.25 181.52 1li7 n LYS 131 N -4.72 1.63 -0.77 0.00 5.02 -0.17 -4.89 118.16 114.26 1li7 n LYS 131 Ca 0.09 -1.38 0.00 0.00 -2.02 0.00 0.00 58.31 55.00 1li7 n LYS 131 Cb 0.16 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 1li7 n LYS 131 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1li7 n GLY 132 N 0.03 0.20 0.40 0.72 0.00 -1.04 -4.87 105.19 100.63 1li7 n GLY 132 Ca 0.27 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.40 1li7 n GLY 132 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1li7 n HIS 133 N -2.09 0.00 -3.83 1.61 8.25 0.06 -4.90 115.22 114.32 1li7 n HIS 133 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.34 1li7 n HIS 133 Cb 0.14 -0.03 -0.11 0.00 1.12 0.00 0.00 29.99 31.11 1li7 n HIS 133 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1li7 s ALA 134 N -2.53 -0.43 0.06 -1.41 0.00 -0.80 -2.08 121.76 114.57 1li7 s ALA 134 Ca 0.19 0.32 0.04 0.00 0.00 0.00 0.00 51.96 52.51 1li7 s ALA 134 Cb 0.18 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.10 1li7 s ALA 134 CO 0.59 -0.13 -0.11 1.52 0.00 0.00 0.00 175.76 177.63 1li7 s TYR 135 N -0.38 0.96 -0.19 0.00 -0.85 0.15 -4.39 117.35 112.66 1li7 s TYR 135 Ca -0.05 -0.50 -0.29 0.00 -0.52 0.00 0.00 57.07 55.71 1li7 s TYR 135 Cb -0.03 -0.55 -0.00 0.00 0.38 0.00 0.00 41.96 41.76 1li7 s TYR 135 CO 0.01 -0.01 1.09 0.08 -1.52 0.00 0.00 175.55 175.20 1li7 s VAL 136 N -1.47 4.58 1.13 -3.49 1.01 -1.26 0.70 120.40 121.60 1li7 s VAL 136 Ca -0.05 1.90 -0.13 0.00 0.00 0.00 0.00 61.98 63.70 1li7 s VAL 136 Cb -0.09 -4.22 0.26 0.00 0.00 0.00 0.00 36.38 32.33 1li7 s VAL 136 CO 0.01 -0.13 1.05 0.00 0.00 0.00 0.00 175.10 176.02 1li7 s ALA 137 N 3.04 -0.08 0.51 5.51 0.00 0.81 -4.84 121.76 126.71 1li7 s ALA 137 Ca 0.48 -0.28 0.22 0.00 0.00 0.00 0.00 51.96 52.37 1li7 s ALA 137 Cb -0.18 -3.18 1.41 0.00 0.00 0.00 0.00 23.12 21.18 1li7 s ALA 137 CO 0.11 -3.59 2.13 -0.44 0.00 0.00 0.00 175.76 173.97 1li7 h ASP 138 N -2.44 0.00 -0.33 0.00 3.32 -1.95 -1.52 116.42 113.49 1li7 h ASP 138 Ca -0.59 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.44 1li7 h ASP 138 Cb 1.34 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.87 1li7 h ASP 138 CO 0.53 0.07 0.03 -0.46 -1.72 0.00 0.00 179.24 177.68 1li7 n ASN 139 N -4.12 3.60 0.00 6.45 0.23 -1.26 -4.88 115.26 115.27 1li7 n ASN 139 Ca -0.03 -2.54 0.00 0.00 -0.53 0.00 0.00 54.58 51.48 1li7 n ASN 139 Cb 0.15 -0.61 0.00 0.00 -2.08 0.00 0.00 39.78 37.24 1li7 n ASN 139 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1li7 n GLY 140 N 0.29 2.21 3.74 4.83 0.00 -0.57 -4.83 105.19 110.87 1li7 n GLY 140 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1li7 n GLY 140 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1li7 s ASP 141 N -3.54 7.07 -0.19 1.61 1.11 -1.26 -4.66 116.67 116.81 1li7 s ASP 141 Ca 0.00 2.30 -0.23 0.00 0.18 0.00 0.00 52.55 54.80 1li7 s ASP 141 Cb 0.00 -2.61 -0.02 0.00 1.07 0.00 0.00 42.92 41.36 1li7 s ASP 141 CO 0.00 -0.36 0.72 -0.69 1.18 0.00 0.00 175.17 176.02 1li7 s VAL 142 N -0.32 4.95 0.03 -1.27 1.01 -0.17 0.28 120.40 124.91 1li7 s VAL 142 Ca 0.51 1.39 0.07 0.00 0.00 0.00 0.00 61.98 63.95 1li7 s VAL 142 Cb -0.34 -4.03 -0.03 0.00 0.00 0.00 0.00 36.38 31.98 1li7 s VAL 142 CO 0.39 0.06 -0.20 -0.04 0.00 0.00 0.00 175.10 175.31 1li7 s MET 143 N 2.08 2.05 -0.02 2.72 -1.94 0.22 -0.89 119.30 123.51 1li7 s MET 143 Ca 0.33 -0.98 -0.20 0.00 -1.71 0.00 0.00 55.69 53.13 1li7 s MET 143 Cb -0.16 -2.14 -0.05 0.00 2.01 0.00 0.00 34.83 34.48 1li7 s MET 143 CO 0.11 0.54 0.57 0.12 -0.01 0.00 0.00 175.02 176.35 1li7 s PHE 144 N -0.85 3.66 -0.33 -0.03 5.36 -0.34 0.35 117.98 125.79 1li7 s PHE 144 Ca 0.13 1.14 0.02 0.00 -0.96 0.00 0.00 56.93 57.26 1li7 s PHE 144 Cb -0.10 -2.59 0.09 0.00 -0.34 0.00 0.00 43.02 40.08 1li7 s PHE 144 CO 0.04 0.33 0.04 0.16 -1.46 0.00 0.00 175.22 174.33 1li7 s ASP 145 N -0.09 4.83 0.48 6.13 1.47 -0.88 -2.88 116.67 125.73 1li7 s ASP 145 Ca 0.30 -1.86 0.33 0.00 1.18 0.00 0.00 52.55 52.50 1li7 s ASP 145 Cb -0.18 -1.67 1.45 0.00 -0.34 0.00 0.00 42.92 42.19 1li7 s ASP 145 CO 0.16 -0.36 1.69 -0.37 0.68 0.00 0.00 175.17 176.97 1li7 h VAL 146 N 6.57 0.25 -0.57 2.11 -1.51 -1.89 -1.74 116.25 119.47 1li7 h VAL 146 Ca -0.11 -0.04 0.16 0.00 -1.23 0.00 0.00 66.70 65.48 1li7 h VAL 146 Cb 1.04 0.13 -0.02 0.00 -2.13 0.00 0.00 31.29 30.30 1li7 h VAL 146 CO 0.55 0.02 0.43 -0.65 -1.23 0.00 0.00 177.57 176.69 1li7 h PRO 147 N 0.11 0.00 0.00 5.19 0.11 -1.96 0.46 132.00 135.90 1li7 h PRO 147 Ca 0.74 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.85 1li7 h PRO 147 Cb 2.51 0.00 0.00 0.00 0.11 0.00 0.00 31.00 33.62 1li7 h PRO 147 CO -0.22 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.82 1li7 n THR 148 N -4.22 0.00 -3.67 -1.15 -2.24 -0.66 -4.67 114.28 97.67 1li7 n THR 148 Ca 0.11 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.51 1li7 n THR 148 Cb 0.67 -0.50 -0.10 0.00 -2.10 0.00 0.00 70.33 68.30 1li7 n THR 148 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1li7 s ASP 149 N -2.30 5.46 0.42 3.42 2.15 0.16 -4.96 116.67 121.01 1li7 s ASP 149 Ca 0.38 -2.21 0.23 0.00 0.43 0.00 0.00 52.55 51.37 1li7 s ASP 149 Cb 0.21 -1.91 1.23 0.00 -0.30 0.00 0.00 42.92 42.15 1li7 s ASP 149 CO 0.42 -0.55 1.72 -0.65 -0.17 0.00 0.00 175.17 175.94 1li7 h PRO 150 N 7.93 0.26 -0.93 4.34 0.11 -1.83 -1.97 132.00 139.92 1li7 h PRO 150 Ca -0.12 -0.02 -0.54 0.00 0.11 0.00 0.00 66.00 65.44 1li7 h PRO 150 Cb 1.03 -0.06 -0.29 0.00 0.11 0.00 0.00 31.00 31.80 1li7 h PRO 150 CO 0.76 0.17 0.60 0.25 -0.21 0.00 0.00 178.00 179.57 1li7 n THR 151 N -4.63 3.26 -2.83 -1.15 -2.24 -1.26 -5.00 114.28 100.44 1li7 n THR 151 Ca 0.29 -2.42 -0.41 0.00 -2.27 0.00 0.00 64.05 59.24 1li7 n THR 151 Cb 1.08 -0.71 -0.04 0.00 -2.10 0.00 0.00 70.33 68.56 1li7 n THR 151 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1li7 s TYR 152 N -3.48 3.71 0.00 4.78 5.04 -0.74 -3.14 117.35 123.52 1li7 s TYR 152 Ca 0.58 1.62 0.00 0.00 -2.44 0.00 0.00 57.07 56.83 1li7 s TYR 152 Cb 0.48 -2.99 0.00 0.00 0.35 0.00 0.00 41.96 39.80 1li7 s TYR 152 CO 0.06 0.14 0.00 0.41 -1.34 0.00 0.00 175.55 174.81 1li7 n GLY 153 N 2.60 0.60 0.23 8.97 0.00 -1.26 -4.78 105.19 111.55 1li7 n GLY 153 Ca 0.02 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 1li7 n GLY 153 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1li7 h VAL 154 N 0.00 1.20 -0.59 1.61 3.04 -1.93 2.09 116.25 121.67 1li7 h VAL 154 Ca 0.00 -0.56 -0.02 0.00 -1.01 0.00 0.00 66.70 65.11 1li7 h VAL 154 Cb 0.00 0.60 -0.03 0.00 -2.01 0.00 0.00 31.29 29.85 1li7 h VAL 154 CO 0.00 0.22 0.30 0.25 -1.01 0.00 0.00 177.57 177.33 1li7 h LEU 155 N 0.71 0.76 0.00 3.16 5.85 -1.92 -3.17 115.31 120.70 1li7 h LEU 155 Ca 0.18 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1li7 h LEU 155 Cb 0.12 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1li7 h LEU 155 CO -0.02 0.66 -1.68 -1.54 -0.34 0.00 0.00 178.44 175.52 1li7 n SER 156 N -4.55 0.27 -2.32 1.25 3.41 -1.19 -4.69 113.62 105.80 1li7 n SER 156 Ca 0.04 0.02 -0.02 0.00 -0.26 0.00 0.00 58.87 58.65 1li7 n SER 156 Cb 0.11 1.54 -0.01 0.00 -0.26 0.00 0.00 64.21 65.59 1li7 n SER 156 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1li7 n ARG 157 N -2.31 -2.82 0.00 4.33 1.74 0.71 -5.12 116.66 113.18 1li7 n ARG 157 Ca -0.02 2.33 0.00 0.00 -0.77 0.00 0.00 57.85 59.39 1li7 n ARG 157 Cb 0.55 -4.02 0.00 0.00 -1.02 0.00 0.00 32.46 27.97 1li7 n ARG 157 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1li7 n GLN 158 N 0.79 0.00 -0.32 5.56 1.13 -1.07 -5.02 117.38 118.45 1li7 n GLN 158 Ca -0.13 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.05 1li7 n GLN 158 Cb 0.20 0.00 0.34 0.00 0.11 0.00 0.00 30.24 30.89 1li7 n GLN 158 CO 0.00 0.00 0.00 1.57 -1.44 0.00 0.00 177.06 177.19 1li7 h LYS 175 N 0.00 0.73 -0.06 -1.09 -0.00 -1.92 -3.51 116.57 110.72 1li7 h LYS 175 Ca 0.00 -0.04 -0.04 0.00 -0.00 0.00 0.00 60.65 60.56 1li7 h LYS 175 Cb 0.00 -0.17 0.00 0.00 -0.00 0.00 0.00 32.23 32.06 1li7 h LYS 175 CO 0.00 0.49 -0.13 0.00 -0.00 0.00 0.00 179.45 179.81 1li7 h ARG 176 N 0.76 0.20 -5.12 0.07 3.08 -1.98 -3.42 114.38 107.97 1li7 h ARG 176 Ca 0.51 -0.13 -0.64 0.00 0.07 0.00 0.00 59.98 59.79 1li7 h ARG 176 Cb 0.79 0.02 -0.33 0.00 0.08 0.00 0.00 29.97 30.52 1li7 h ARG 176 CO -0.28 0.72 -0.86 1.21 -1.07 0.00 0.00 179.97 179.69 1li7 s ASN 177 N -6.05 2.78 0.35 7.04 2.47 -1.26 -5.01 114.94 115.26 1li7 s ASN 177 Ca -0.15 -0.50 0.12 0.00 0.42 0.00 0.00 52.86 52.74 1li7 s ASN 177 Cb 0.03 -1.27 0.64 0.00 -1.45 0.00 0.00 41.25 39.20 1li7 s ASN 177 CO 0.73 0.11 1.24 1.55 -3.72 0.00 0.00 177.10 177.01 1li7 h PRO 178 N 6.89 0.00 0.00 0.43 0.13 -2.03 0.84 132.00 138.27 1li7 h PRO 178 Ca -0.24 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.80 1li7 h PRO 178 Cb 1.22 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 1li7 h PRO 178 CO 0.48 0.00 -1.45 -1.33 -0.23 0.00 0.00 178.00 175.48 1li7 n MET 179 N -2.06 0.63 -1.52 0.86 2.81 -1.26 -4.93 117.12 111.65 1li7 n MET 179 Ca -0.01 0.09 -0.41 0.00 -1.81 0.00 0.00 57.70 55.56 1li7 n MET 179 Cb 0.40 -1.74 0.01 0.00 -0.71 0.00 0.00 33.22 31.18 1li7 n MET 179 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1li7 n ASP 180 N -2.69 0.02 -4.24 7.83 8.00 0.29 -4.86 116.55 120.91 1li7 n ASP 180 Ca -0.07 0.96 -0.17 0.00 0.71 0.00 0.00 54.79 56.22 1li7 n ASP 180 Cb 0.71 -1.22 -0.11 0.00 -0.02 0.00 0.00 41.12 40.49 1li7 n ASP 180 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1li7 s PHE 181 N -1.39 1.32 0.21 1.24 -0.12 -1.14 -4.57 117.98 113.54 1li7 s PHE 181 Ca 0.64 -0.61 -0.30 0.00 -0.05 0.00 0.00 56.93 56.61 1li7 s PHE 181 Cb -0.58 -0.69 -0.09 0.00 -0.63 0.00 0.00 43.02 41.03 1li7 s PHE 181 CO 0.57 0.12 1.32 0.08 -0.05 0.00 0.00 175.22 177.25 1li7 s VAL 182 N -2.47 3.13 -0.15 -2.49 1.01 -1.26 -1.20 120.40 116.97 1li7 s VAL 182 Ca 0.10 0.95 0.05 0.00 0.00 0.00 0.00 61.98 63.08 1li7 s VAL 182 Cb -0.03 -3.61 -0.13 0.00 0.00 0.00 0.00 36.38 32.62 1li7 s VAL 182 CO 0.02 0.15 -0.07 0.18 0.00 0.00 0.00 175.10 175.38 1li7 n LEU 183 N 2.47 1.80 -3.66 3.92 4.77 -0.07 -4.74 117.00 121.50 1li7 n LEU 183 Ca 0.06 -0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 55.86 1li7 n LEU 183 Cb 0.42 -0.22 -0.12 0.00 -2.33 0.00 0.00 43.42 41.17 1li7 n LEU 183 CO 0.58 0.59 -0.11 0.86 -1.33 0.00 0.00 177.39 177.99 1li7 s TRP 184 N -2.32 -0.49 -0.13 -1.77 -0.11 -1.04 -4.17 118.94 108.91 1li7 s TRP 184 Ca -0.16 1.06 -0.06 0.00 1.22 0.00 0.00 56.10 58.17 1li7 s TRP 184 Cb 0.05 0.02 -0.04 0.00 -1.50 0.00 0.00 33.47 32.00 1li7 s TRP 184 CO 0.43 -0.39 0.08 -1.59 -4.62 0.00 0.00 176.95 170.86 1li7 s LYS 185 N 2.46 3.44 0.31 5.86 0.00 -0.54 -1.00 119.74 130.26 1li7 s LYS 185 Ca 0.01 -0.27 -0.29 0.00 0.00 0.00 0.00 55.97 55.42 1li7 s LYS 185 Cb -0.12 -3.08 -0.10 0.00 0.00 0.00 0.00 37.83 34.53 1li7 s LYS 185 CO -0.09 0.62 1.36 -1.64 0.00 0.00 0.00 175.35 175.60 1li7 s MET 186 N -0.61 4.31 0.39 1.78 1.00 -1.26 -0.78 119.30 124.12 1li7 s MET 186 Ca 0.11 2.27 -0.21 0.00 0.00 0.00 0.00 55.69 57.87 1li7 s MET 186 Cb -0.12 -3.08 -0.10 0.00 0.00 0.00 0.00 34.83 31.53 1li7 s MET 186 CO 0.02 -0.29 0.91 -1.12 0.00 0.00 0.00 175.02 174.54 1li7 s SER 187 N -0.18 6.98 0.38 3.03 0.01 0.03 -4.79 113.70 119.16 1li7 s SER 187 Ca 0.52 1.64 0.08 0.00 1.31 0.00 0.00 55.95 59.50 1li7 s SER 187 Cb -0.41 -2.52 -0.02 0.00 0.21 0.00 0.00 66.02 63.29 1li7 s SER 187 CO 0.51 -0.27 0.39 -0.54 0.41 0.00 0.00 173.24 173.74 1li7 s LYS 188 N -2.92 2.71 0.21 12.44 1.02 -1.26 -4.94 119.74 127.00 1li7 s LYS 188 Ca 0.58 -1.35 -0.30 0.00 0.02 0.00 0.00 55.97 54.92 1li7 s LYS 188 Cb -0.11 -2.52 -0.09 0.00 -0.52 0.00 0.00 37.83 34.58 1li7 s LYS 188 CO 0.16 -0.08 1.41 -1.83 -0.92 0.00 0.00 175.35 174.08 1li7 s GLU 189 N -4.13 4.30 0.00 1.68 4.04 -1.26 -3.04 118.70 120.30 1li7 s GLU 189 Ca 0.47 2.21 0.00 0.00 0.04 0.00 0.00 54.97 57.68 1li7 s GLU 189 Cb -0.06 -3.15 0.00 0.00 0.02 0.00 0.00 34.13 30.94 1li7 s GLU 189 CO 0.29 -0.39 0.00 0.41 -1.84 0.00 0.00 175.26 173.73 1li7 n GLY 190 N 2.52 0.90 3.10 -3.83 0.00 -1.26 -5.09 105.19 101.53 1li7 n GLY 190 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.99 1li7 n GLY 190 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1li7 s GLU 191 N -0.86 0.63 1.01 1.61 -1.05 -1.17 -4.98 118.70 113.88 1li7 s GLU 191 Ca 0.00 -1.04 -0.13 0.00 -0.15 0.00 0.00 54.97 53.65 1li7 s GLU 191 Cb 0.00 -0.10 0.14 0.00 -0.44 0.00 0.00 34.13 33.73 1li7 s GLU 191 CO 0.00 -0.02 0.75 -2.30 0.95 0.00 0.00 175.26 174.64 1li7 n PRO 192 N 0.66 -1.01 -3.56 -4.83 -0.02 -1.26 -4.80 135.00 120.18 1li7 n PRO 192 Ca -0.17 -0.25 -0.08 0.00 -2.02 0.00 0.00 63.50 60.97 1li7 n PRO 192 Cb 0.58 -2.09 -0.04 0.00 -0.02 0.00 0.00 33.50 31.94 1li7 n PRO 192 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1li7 s SER 193 N -2.30 -0.31 0.03 2.55 1.04 -1.26 -4.76 113.70 108.68 1li7 s SER 193 Ca 0.63 0.19 0.04 0.00 0.48 0.00 0.00 55.95 57.28 1li7 s SER 193 Cb -0.21 0.29 -0.02 0.00 0.10 0.00 0.00 66.02 66.18 1li7 s SER 193 CO 0.63 -0.40 -0.11 0.26 0.98 0.00 0.00 173.24 174.60 1li7 s TRP 194 N -1.97 0.99 0.60 5.02 0.51 0.21 -4.85 118.94 119.45 1li7 s TRP 194 Ca 0.03 -0.34 -0.18 0.00 -2.12 0.00 0.00 56.10 53.49 1li7 s TRP 194 Cb -0.01 -0.59 -0.03 0.00 -0.81 0.00 0.00 33.47 32.03 1li7 s TRP 194 CO -0.03 0.00 1.19 -1.25 -0.51 0.00 0.00 176.95 176.35 1li7 s PRO 195 N -1.04 2.93 0.03 4.98 0.04 -1.26 -1.71 135.00 138.97 1li7 s PRO 195 Ca -0.01 1.76 -0.27 0.00 0.04 0.00 0.00 61.00 62.52 1li7 s PRO 195 Cb -0.07 -1.93 0.09 0.00 0.04 0.00 0.00 34.50 32.63 1li7 s PRO 195 CO 0.01 -1.22 0.81 -1.54 0.04 0.00 0.00 177.00 175.10 1li7 s SER 196 N -1.73 -0.43 0.00 6.66 1.04 -1.17 -4.90 113.70 113.17 1li7 s SER 196 Ca 0.76 0.06 0.00 0.00 0.48 0.00 0.00 55.95 57.25 1li7 s SER 196 Cb -0.29 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.28 1li7 s SER 196 CO 0.34 -0.70 0.67 -2.65 0.98 0.00 0.00 173.24 171.88 1li7 n PRO 197 N -0.16 0.00 0.00 4.02 -0.02 -1.26 -0.64 135.00 136.94 1li7 n PRO 197 Ca -0.12 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 1li7 n PRO 197 Cb 0.62 -1.52 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 1li7 n PRO 197 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1li7 n TRP 198 N -1.17 0.00 0.00 6.00 8.01 -1.26 -5.11 117.44 123.91 1li7 n TRP 198 Ca 0.00 -0.48 0.00 0.00 -1.31 0.00 0.00 57.50 55.71 1li7 n TRP 198 Cb 0.02 -0.05 0.00 0.00 -2.01 0.00 0.00 31.31 29.28 1li7 n TRP 198 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1li7 n GLY 199 N -0.48 0.93 3.71 6.99 0.00 0.19 -4.94 105.19 111.59 1li7 n GLY 199 Ca 0.00 -2.18 -0.42 0.00 0.00 0.00 0.00 46.02 43.42 1li7 n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1li7 s ALA 200 N -1.24 3.57 0.08 4.61 0.00 -1.26 -3.04 121.76 124.48 1li7 s ALA 200 Ca 0.00 1.04 -0.08 0.00 0.00 0.00 0.00 51.96 52.92 1li7 s ALA 200 Cb 0.00 -3.54 0.03 0.00 0.00 0.00 0.00 23.12 19.61 1li7 s ALA 200 CO 0.00 -0.66 0.40 0.41 0.00 0.00 0.00 175.76 175.92 1li7 n GLY 201 N 3.50 1.08 3.55 0.00 0.00 -0.69 -0.79 105.19 111.83 1li7 n GLY 201 Ca 0.12 -1.02 -0.26 0.00 0.00 0.00 0.00 46.02 44.86 1li7 n GLY 201 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1li7 s ARG 202 N -2.02 1.82 0.00 1.61 0.52 0.04 -0.62 118.95 120.30 1li7 s ARG 202 Ca 0.09 -1.99 0.00 0.00 -0.52 0.00 0.00 55.73 53.31 1li7 s ARG 202 Cb -0.01 -1.47 0.00 0.00 0.52 0.00 0.00 34.95 33.99 1li7 s ARG 202 CO 0.02 -0.01 0.00 -2.30 0.02 0.00 0.00 175.30 173.03 1li7 n PRO 203 N -0.83 0.00 0.00 3.54 -0.02 -1.26 -1.47 135.00 134.96 1li7 n PRO 203 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1li7 n PRO 203 Cb 0.66 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.14 1li7 n PRO 203 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1li7 n GLY 204 N 0.00 0.00 1.65 -1.23 0.00 -1.26 -3.08 105.19 101.26 1li7 n GLY 204 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1li7 n GLY 204 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1li7 n TRP 205 N 0.00 0.00 -0.06 1.61 -0.00 -1.26 -4.51 117.44 113.22 1li7 n TRP 205 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.50 57.38 1li7 n TRP 205 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 31.31 31.25 1li7 n TRP 205 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 1li7 h HIS 206 N 0.00 0.36 -0.68 5.87 -0.00 -1.91 -2.48 115.15 116.31 1li7 h HIS 206 Ca 0.00 -0.08 -0.00 0.00 -0.00 0.00 0.00 60.37 60.29 1li7 h HIS 206 Cb 0.00 -0.09 -0.03 0.00 -0.00 0.00 0.00 27.41 27.29 1li7 h HIS 206 CO 0.00 0.58 0.40 0.97 -0.00 0.00 0.00 177.93 179.89 1li7 h ILE 207 N 0.04 1.19 -0.24 2.45 6.09 -1.85 -3.10 117.51 122.08 1li7 h ILE 207 Ca 0.04 -0.43 0.03 0.00 -1.37 0.00 0.00 64.86 63.13 1li7 h ILE 207 Cb 0.46 0.24 -0.05 0.00 0.47 0.00 0.00 36.82 37.94 1li7 h ILE 207 CO 0.02 0.20 -0.39 -0.08 -3.07 0.00 0.00 178.15 174.83 1li7 h GLU 208 N 0.93 -0.30 -0.64 2.19 4.81 -1.78 -2.38 114.58 117.41 1li7 h GLU 208 Ca 0.24 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.51 1li7 h GLU 208 Cb -0.03 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.39 1li7 h GLU 208 CO -0.05 -0.20 0.41 0.00 -0.73 0.00 0.00 179.01 178.45 1li7 h SER 210 N 0.84 0.59 -0.25 0.00 0.02 -1.48 -1.06 113.55 112.20 1li7 h SER 210 Ca 0.24 0.06 -0.09 0.00 -0.84 0.00 0.00 61.79 61.16 1li7 h SER 210 Cb -0.06 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 1li7 h SER 210 CO -0.07 0.31 -0.19 0.00 -1.14 0.00 0.00 176.83 175.74 1li7 h ALA 211 N 1.48 0.37 -0.27 3.77 0.00 -1.36 -3.12 119.26 120.12 1li7 h ALA 211 Ca 0.41 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1li7 h ALA 211 Cb 0.45 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1li7 h ALA 211 CO -0.29 0.30 -0.15 0.52 0.00 0.00 0.00 179.25 179.63 1li7 h MET 212 N 0.30 0.59 -0.24 0.00 2.07 -1.16 -3.26 114.93 113.23 1li7 h MET 212 Ca 0.05 -0.27 -0.17 0.00 -2.07 0.00 0.00 59.70 57.24 1li7 h MET 212 Cb 0.73 -0.01 -0.00 0.00 -1.87 0.00 0.00 31.60 30.45 1li7 h MET 212 CO 0.05 0.84 -0.54 -2.95 1.07 0.00 0.00 176.91 175.38 1li7 h ASN 213 N 0.32 0.79 -0.07 1.22 7.08 -1.30 -2.79 115.58 120.83 1li7 h ASN 213 Ca 0.06 -0.42 0.02 0.00 -3.08 0.00 0.00 56.30 52.88 1li7 h ASN 213 Cb 0.67 -0.23 -0.00 0.00 -2.08 0.00 0.00 38.32 36.69 1li7 h ASN 213 CO 0.04 1.17 0.07 0.00 -2.08 0.00 0.00 177.43 176.63 1li7 h LYS 215 N 0.00 0.42 0.00 0.00 -0.00 -1.58 -0.34 116.57 115.07 1li7 h LYS 215 Ca 0.04 -0.71 -0.04 0.00 -0.00 0.00 0.00 60.65 59.93 1li7 h LYS 215 Cb 0.18 0.26 -0.01 0.00 -0.00 0.00 0.00 32.23 32.66 1li7 h LYS 215 CO -0.00 1.34 -0.52 1.96 -0.00 0.00 0.00 179.45 182.23 1li7 h GLN 216 N -0.11 0.00 0.00 0.07 1.08 -1.11 -3.39 115.11 111.64 1li7 h GLN 216 Ca -0.21 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.99 1li7 h GLN 216 Cb 1.91 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.34 1li7 h GLN 216 CO 0.21 0.14 -0.10 1.28 -0.95 0.00 0.00 178.83 179.40 1li7 n LEU 217 N -2.99 0.00 0.00 1.46 4.77 0.17 -5.06 117.00 115.34 1li7 n LEU 217 Ca 0.01 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 1li7 n LEU 217 Cb 0.61 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 1li7 n LEU 217 CO 0.38 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1li7 n GLY 218 N 0.73 1.77 0.33 -0.72 0.00 -0.14 -4.62 105.19 102.54 1li7 n GLY 218 Ca 0.00 -1.86 0.16 0.00 0.00 0.00 0.00 46.02 44.32 1li7 n GLY 218 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1li7 h ASN 219 N 0.00 0.00 -3.22 1.61 -0.26 -1.89 -3.38 115.58 108.45 1li7 h ASN 219 Ca 0.00 0.00 -0.55 0.00 -0.56 0.00 0.00 56.30 55.19 1li7 h ASN 219 Cb 0.00 0.00 -0.36 0.00 -1.06 0.00 0.00 38.32 36.90 1li7 h ASN 219 CO 0.00 0.00 -0.82 -2.28 -1.06 0.00 0.00 177.43 173.27 1li7 s HIS 220 N -4.64 1.74 0.08 1.19 2.46 -1.26 -4.32 115.29 110.54 1li7 s HIS 220 Ca -0.05 -0.86 -0.06 0.00 0.47 0.00 0.00 55.06 54.56 1li7 s HIS 220 Cb 0.15 -1.33 -0.02 0.00 -0.13 0.00 0.00 32.58 31.25 1li7 s HIS 220 CO 0.55 -0.51 0.11 -0.59 -2.47 0.00 0.00 174.74 171.83 1li7 s PHE 221 N 1.35 0.29 0.07 3.88 -0.71 -0.95 -5.05 117.98 116.86 1li7 s PHE 221 Ca -0.00 -0.76 -0.35 0.00 -1.04 0.00 0.00 56.93 54.77 1li7 s PHE 221 Cb -0.14 -0.18 -0.19 0.00 -1.21 0.00 0.00 43.02 41.31 1li7 s PHE 221 CO -0.06 -0.49 1.54 -0.44 -1.34 0.00 0.00 175.22 174.43 1li7 h ASP 222 N 2.89 -1.20 -4.39 1.98 3.32 -1.87 -2.91 116.42 114.25 1li7 h ASP 222 Ca -0.34 0.07 -0.58 0.00 0.02 0.00 0.00 57.03 56.19 1li7 h ASP 222 Cb 1.18 0.35 -0.29 0.00 0.22 0.00 0.00 39.33 40.78 1li7 h ASP 222 CO 0.60 -0.73 -0.85 -0.63 -1.72 0.00 0.00 179.24 175.91 1li7 s ILE 223 N -5.78 1.54 -0.10 0.35 1.01 -0.82 -0.46 121.20 116.93 1li7 s ILE 223 Ca -0.18 -0.84 -0.00 0.00 0.00 0.00 0.00 60.65 59.63 1li7 s ILE 223 Cb 0.03 -1.28 0.02 0.00 0.01 0.00 0.00 42.46 41.24 1li7 s ILE 223 CO 0.57 0.43 -0.08 -2.28 0.00 0.00 0.00 174.94 173.58 1li7 s HIS 224 N -0.46 1.41 0.53 3.97 2.46 -0.46 -1.37 115.29 121.37 1li7 s HIS 224 Ca 0.07 -0.67 0.06 0.00 0.47 0.00 0.00 55.06 54.99 1li7 s HIS 224 Cb -0.08 -1.18 0.03 0.00 -0.13 0.00 0.00 32.58 31.23 1li7 s HIS 224 CO -0.01 -0.47 0.38 0.20 -2.47 0.00 0.00 174.74 172.38 1li7 s GLY 225 N 1.58 2.37 0.00 1.59 0.00 0.25 -1.09 107.32 112.03 1li7 s GLY 225 Ca 0.02 -1.32 0.00 0.00 0.00 0.00 0.00 44.72 43.43 1li7 s GLY 225 CO -0.06 -1.93 0.00 0.61 0.00 0.00 0.00 173.10 171.71 1li7 n GLY 226 N -1.71 3.54 3.73 0.20 0.00 -0.88 -2.59 105.19 107.47 1li7 n GLY 226 Ca -0.02 -1.05 -0.32 0.00 0.00 0.00 0.00 46.02 44.63 1li7 n GLY 226 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1li7 s GLY 227 N 0.00 1.82 0.47 -0.02 0.00 -1.26 -1.54 107.32 106.80 1li7 s GLY 227 Ca 0.00 0.49 0.17 0.00 0.00 0.00 0.00 44.72 45.38 1li7 s GLY 227 CO 0.00 0.87 2.01 1.48 0.00 0.00 0.00 173.10 177.46 1li7 h SER 228 N -1.15 0.21 -0.09 1.64 4.64 -0.76 -1.15 113.55 116.90 1li7 h SER 228 Ca -0.44 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 60.91 1li7 h SER 228 Cb 1.25 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1li7 h SER 228 CO 0.48 0.13 0.08 -2.24 -0.87 0.00 0.00 176.83 174.41 1li7 h ASP 229 N 0.24 0.00 1.01 4.97 2.03 -1.90 -1.79 116.42 120.98 1li7 h ASP 229 Ca 0.22 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.52 1li7 h ASP 229 Cb 0.58 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.08 1li7 h ASP 229 CO -0.04 0.00 -0.13 0.18 -1.03 0.00 0.00 179.24 178.22 1li7 n LEU 230 N -4.12 0.31 0.09 0.15 4.77 -0.43 -4.37 117.00 113.40 1li7 n LEU 230 Ca -0.01 0.41 -0.15 0.00 -0.03 0.00 0.00 56.01 56.24 1li7 n LEU 230 Cb 0.18 -0.40 -0.09 0.00 -2.33 0.00 0.00 43.42 40.79 1li7 n LEU 230 CO 0.30 -0.02 0.51 -0.03 -1.33 0.00 0.00 177.39 176.82 1li7 h MET 231 N 0.00 -0.64 -5.27 3.23 4.05 -1.43 0.13 114.93 115.00 1li7 h MET 231 Ca 0.00 0.04 -0.65 0.00 -0.28 0.00 0.00 59.70 58.82 1li7 h MET 231 Cb 0.57 0.15 -0.24 0.00 -0.80 0.00 0.00 31.60 31.28 1li7 h MET 231 CO 0.00 -0.43 -0.71 0.12 0.23 0.00 0.00 176.91 176.13 1li7 s PHE 232 N -5.45 2.95 0.00 1.39 5.36 -1.26 -1.68 117.98 119.28 1li7 s PHE 232 Ca -0.15 -0.48 0.00 0.00 -0.96 0.00 0.00 56.93 55.34 1li7 s PHE 232 Cb 0.05 -1.94 0.00 0.00 -0.34 0.00 0.00 43.02 40.80 1li7 s PHE 232 CO 0.54 -0.15 0.00 -2.30 -1.46 0.00 0.00 175.22 171.85 1li7 n PRO 233 N 3.68 0.00 0.00 10.12 -0.02 -1.26 -4.88 135.00 142.64 1li7 n PRO 233 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 1li7 n PRO 233 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 1li7 n PRO 233 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1li7 n HIS 234 N 0.00 0.00 -0.16 6.00 -0.00 -1.24 0.68 115.22 120.49 1li7 n HIS 234 Ca 0.00 0.00 -0.02 0.00 0.46 0.00 0.00 57.72 58.16 1li7 n HIS 234 Cb 0.00 -0.12 0.19 0.00 -0.12 0.00 0.00 29.99 29.94 1li7 n HIS 234 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1li7 h HIS 235 N 0.00 0.91 -0.79 1.57 3.86 -0.72 -0.68 115.15 119.30 1li7 h HIS 235 Ca 0.00 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.13 1li7 h HIS 235 Cb 0.00 -0.28 -0.04 0.00 1.06 0.00 0.00 27.41 28.16 1li7 h HIS 235 CO -0.22 0.71 0.40 1.49 0.86 0.00 0.00 177.93 181.17 1li7 h GLU 236 N 0.88 1.12 0.00 2.45 4.57 -0.96 -1.54 114.58 121.09 1li7 h GLU 236 Ca 0.21 -0.15 -0.10 0.00 -1.18 0.00 0.00 59.36 58.14 1li7 h GLU 236 Cb 0.19 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.56 1li7 h GLU 236 CO -0.02 0.85 -0.45 -0.91 -1.18 0.00 0.00 179.01 177.29 1li7 h ASN 237 N 1.10 0.00 -0.20 1.04 2.35 0.77 -1.37 115.58 119.27 1li7 h ASN 237 Ca 0.27 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 56.00 1li7 h ASN 237 Cb 0.08 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 1li7 h ASN 237 CO -0.04 0.45 0.02 -0.33 -1.65 0.00 0.00 177.43 175.88 1li7 h GLU 238 N 0.00 0.34 -0.53 0.81 5.08 -0.41 0.02 114.58 119.89 1li7 h GLU 238 Ca -0.00 -0.10 0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1li7 h GLU 238 Cb 0.86 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.03 1li7 h GLU 238 CO 0.06 0.52 0.29 0.82 -1.00 0.00 0.00 179.01 179.70 1li7 h ILE 239 N 0.12 0.99 0.06 3.13 2.04 -1.08 0.26 117.51 123.03 1li7 h ILE 239 Ca 0.06 -0.19 0.03 0.00 1.00 0.00 0.00 64.86 65.75 1li7 h ILE 239 Cb 0.35 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.77 1li7 h ILE 239 CO 0.01 0.10 -0.31 0.00 0.00 0.00 0.00 178.15 177.95 1li7 h ALA 240 N 1.27 -0.49 -0.10 1.87 0.00 -0.86 0.14 119.26 121.08 1li7 h ALA 240 Ca 0.23 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1li7 h ALA 240 Cb 0.10 0.53 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1li7 h ALA 240 CO -0.14 -0.84 0.03 1.96 0.00 0.00 0.00 179.25 180.26 1li7 h GLN 241 N -0.50 0.16 -0.11 0.00 4.20 -0.56 -2.70 115.11 115.60 1li7 h GLN 241 Ca 0.05 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.70 1li7 h GLN 241 Cb 0.56 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.31 1li7 h GLN 241 CO -0.22 0.32 -0.03 0.77 -0.67 0.00 0.00 178.83 179.00 1li7 h SER 242 N -0.04 0.21 -0.01 1.46 0.02 -0.39 -2.46 113.55 112.35 1li7 h SER 242 Ca 0.03 -0.37 -0.16 0.00 -0.84 0.00 0.00 61.79 60.45 1li7 h SER 242 Cb 0.23 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1li7 h SER 242 CO -0.00 0.53 -0.53 0.71 -1.14 0.00 0.00 176.83 176.41 1li7 h THR 243 N -0.11 1.31 -0.31 -2.27 1.35 -1.08 -2.59 112.91 109.21 1li7 h THR 243 Ca 0.03 -1.76 0.00 0.00 -0.55 0.00 0.00 66.41 64.13 1li7 h THR 243 Cb 0.44 1.73 0.00 0.00 -1.73 0.00 0.00 68.15 68.59 1li7 h THR 243 CO 0.01 0.55 0.00 0.00 -0.25 0.00 0.00 175.52 175.83 1li7 n ALA 245 N 0.41 1.97 -3.14 0.00 0.00 -0.92 -4.81 120.51 114.02 1li7 n ALA 245 Ca 0.10 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.42 1li7 n ALA 245 Cb 0.27 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.62 1li7 n ALA 245 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1li7 s HIS 246 N -1.58 -0.11 0.06 0.00 3.76 -0.99 -4.82 115.29 111.61 1li7 s HIS 246 Ca 0.00 0.22 -0.31 0.00 -0.15 0.00 0.00 55.06 54.82 1li7 s HIS 246 Cb 0.00 0.03 -0.08 0.00 1.11 0.00 0.00 32.58 33.64 1li7 s HIS 246 CO 0.00 -0.26 1.70 0.16 -0.85 0.00 0.00 174.74 175.49 1li7 s ASP 247 N -0.88 6.58 0.00 1.40 -4.77 -1.26 -4.53 116.67 113.21 1li7 s ASP 247 Ca -0.10 2.50 0.00 0.00 -3.30 0.00 0.00 52.55 51.66 1li7 s ASP 247 Cb -0.05 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 39.22 1li7 s ASP 247 CO 0.02 -0.92 0.00 0.61 0.70 0.00 0.00 175.17 175.58 1li7 n GLY 248 N 4.08 -0.91 3.71 2.12 0.00 -1.26 -4.99 105.19 107.93 1li7 n GLY 248 Ca 0.16 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 1li7 n GLY 248 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1li7 s GLN 249 N 0.00 4.16 0.00 1.61 -0.21 -1.26 -4.76 119.66 119.20 1li7 s GLN 249 Ca 0.00 2.51 0.00 0.00 0.02 0.00 0.00 55.36 57.89 1li7 s GLN 249 Cb 0.00 -3.31 0.00 0.00 1.00 0.00 0.00 33.01 30.70 1li7 s GLN 249 CO 0.00 -0.74 0.00 0.98 -2.12 0.00 0.00 175.29 173.41 1li7 n TYR 250 N 4.69 0.00 -4.89 0.91 -0.00 -1.26 -4.09 117.16 112.52 1li7 n TYR 250 Ca 0.16 0.00 -0.31 0.00 -0.00 0.00 0.00 57.90 57.74 1li7 n TYR 250 Cb 0.38 0.00 -0.14 0.00 -0.00 0.00 0.00 39.34 39.58 1li7 n TYR 250 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 1li7 s VAL 251 N 0.09 2.70 -0.02 2.97 1.01 -1.26 -2.23 120.40 123.66 1li7 s VAL 251 Ca 0.00 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 60.95 1li7 s VAL 251 Cb 0.00 -2.07 -0.26 0.00 0.00 0.00 0.00 36.38 34.05 1li7 s VAL 251 CO 0.00 0.48 0.76 0.78 0.00 0.00 0.00 175.10 177.12 1li7 h ASN 252 N 5.03 0.32 -3.26 3.32 2.35 -1.32 -3.46 115.58 118.56 1li7 h ASN 252 Ca -0.46 -0.50 -0.50 0.00 -0.55 0.00 0.00 56.30 54.29 1li7 h ASN 252 Cb 1.15 -0.10 -0.36 0.00 0.05 0.00 0.00 38.32 39.05 1li7 h ASN 252 CO 0.48 1.43 -0.79 -0.31 -1.65 0.00 0.00 177.43 176.59 1li7 s TYR 253 N -2.61 1.25 -0.18 1.19 1.51 0.39 -4.99 117.35 113.91 1li7 s TYR 253 Ca -0.10 -0.54 -0.08 0.00 -1.01 0.00 0.00 57.07 55.34 1li7 s TYR 253 Cb 0.07 -1.06 -0.04 0.00 -0.11 0.00 0.00 41.96 40.81 1li7 s TYR 253 CO 0.83 -0.41 0.08 -1.58 -1.11 0.00 0.00 175.55 173.37 1li7 s TRP 254 N 1.50 3.30 -0.10 2.71 0.52 -1.26 -1.36 118.94 124.25 1li7 s TRP 254 Ca 0.00 0.15 0.02 0.00 0.02 0.00 0.00 56.10 56.29 1li7 s TRP 254 Cb -0.13 -2.09 0.01 0.00 -1.15 0.00 0.00 33.47 30.11 1li7 s TRP 254 CO -0.05 0.21 -0.16 -1.64 0.02 0.00 0.00 176.95 175.32 1li7 s MET 255 N 0.31 2.29 -0.15 4.98 -1.94 -0.25 -1.80 119.30 122.74 1li7 s MET 255 Ca 0.05 -0.60 0.00 0.00 -1.71 0.00 0.00 55.69 53.43 1li7 s MET 255 Cb -0.12 -1.88 0.03 0.00 2.01 0.00 0.00 34.83 34.86 1li7 s MET 255 CO -0.00 -0.00 -0.13 -1.01 -0.01 0.00 0.00 175.02 173.86 1li7 s HIS 256 N 0.81 2.12 0.55 -0.03 3.76 -1.25 -2.07 115.29 119.18 1li7 s HIS 256 Ca -0.10 -1.21 -0.17 0.00 -0.15 0.00 0.00 55.06 53.43 1li7 s HIS 256 Cb -0.16 -1.56 -0.06 0.00 1.11 0.00 0.00 32.58 31.92 1li7 s HIS 256 CO 0.01 -0.66 1.02 -1.54 -0.85 0.00 0.00 174.74 172.72 1li7 s SER 257 N 1.50 6.19 0.87 1.40 1.04 -0.59 -4.58 113.70 119.54 1li7 s SER 257 Ca 0.04 1.72 -0.13 0.00 0.48 0.00 0.00 55.95 58.07 1li7 s SER 257 Cb -0.13 -2.53 0.12 0.00 0.10 0.00 0.00 66.02 63.58 1li7 s SER 257 CO -0.10 -0.88 1.18 -0.83 0.98 0.00 0.00 173.24 173.58 1li7 s GLY 258 N -2.82 1.60 0.63 7.32 0.00 0.11 -0.11 107.32 114.05 1li7 s GLY 258 Ca 0.62 -0.67 -0.01 0.00 0.00 0.00 0.00 44.72 44.65 1li7 s GLY 258 CO 0.33 -0.12 0.89 1.06 0.00 0.00 0.00 173.10 175.26 1li7 s MET 259 N -5.51 2.22 -0.18 2.90 -1.94 -1.26 -4.77 119.30 110.77 1li7 s MET 259 Ca 0.64 -0.73 -0.03 0.00 -1.71 0.00 0.00 55.69 53.86 1li7 s MET 259 Cb -0.12 -2.37 -0.02 0.00 2.01 0.00 0.00 34.83 34.34 1li7 s MET 259 CO 0.51 -1.04 -0.06 0.08 -0.01 0.00 0.00 175.02 174.51 1li7 s VAL 260 N -2.98 3.48 0.10 -6.03 1.01 -1.26 -1.12 120.40 113.60 1li7 s VAL 260 Ca 0.60 -0.48 0.05 0.00 0.00 0.00 0.00 61.98 62.15 1li7 s VAL 260 Cb -0.09 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1li7 s VAL 260 CO 0.41 0.46 0.02 -0.04 0.00 0.00 0.00 175.10 175.96 1li7 s MET 261 N 0.92 2.61 -0.48 2.72 -1.94 0.50 -4.41 119.30 119.22 1li7 s MET 261 Ca -0.01 -0.84 0.04 0.00 -1.71 0.00 0.00 55.69 53.17 1li7 s MET 261 Cb -0.15 -2.56 0.12 0.00 2.01 0.00 0.00 34.83 34.26 1li7 s MET 261 CO 0.01 0.53 0.22 0.08 -0.01 0.00 0.00 175.02 175.85 1li7 s VAL 262 N -1.38 2.41 0.00 -6.03 1.01 -1.10 -1.02 120.40 114.29 1li7 s VAL 262 Ca 0.27 -3.06 0.00 0.00 0.00 0.00 0.00 61.98 59.18 1li7 s VAL 262 Cb -0.11 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.57 1li7 s VAL 262 CO 0.19 -0.77 0.00 0.47 0.00 0.00 0.00 175.10 174.99 1li7 n ASP 263 N 3.37 0.00 0.00 3.32 9.92 -1.26 -4.37 116.55 127.53 1li7 n ASP 263 Ca 0.05 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.31 1li7 n ASP 263 Cb 0.34 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.82 1li7 n ASP 263 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 1li7 n ARG 264 N 0.00 0.00 -2.96 -1.24 -4.01 -1.26 -5.07 116.66 102.12 1li7 n ARG 264 Ca 0.00 0.00 -0.27 0.00 -1.04 0.00 0.00 57.85 56.54 1li7 n ARG 264 Cb 0.00 0.00 -0.01 0.00 -3.04 0.00 0.00 32.46 29.41 1li7 n ARG 264 CO 0.00 0.00 0.00 -1.83 -3.04 0.00 0.00 177.63 172.76 1li7 s GLU 265 N -0.30 3.56 1.40 2.89 4.04 -1.26 -4.98 118.70 124.05 1li7 s GLU 265 Ca 0.00 0.05 -0.23 0.00 0.04 0.00 0.00 54.97 54.84 1li7 s GLU 265 Cb 0.00 -2.49 0.36 0.00 0.02 0.00 0.00 34.13 32.01 1li7 s GLU 265 CO 0.00 -0.03 0.97 0.21 -1.84 0.00 0.00 175.26 174.57 1li7 s LYS 266 N -4.36 -2.73 -0.05 -4.83 2.47 -1.26 -2.70 119.74 106.27 1li7 s LYS 266 Ca 0.45 0.02 -0.14 0.00 -1.56 0.00 0.00 55.97 54.74 1li7 s LYS 266 Cb -0.10 -1.41 -0.05 0.00 -1.46 0.00 0.00 37.83 34.81 1li7 s LYS 266 CO 0.39 -4.72 0.36 -1.64 0.16 0.00 0.00 175.35 169.90 1li7 s MET 267 N -5.22 3.96 -0.27 4.03 -1.94 -1.26 -4.63 119.30 113.97 1li7 s MET 267 Ca 0.69 0.29 -0.22 0.00 -1.71 0.00 0.00 55.69 54.75 1li7 s MET 267 Cb -0.11 -3.27 0.08 0.00 2.01 0.00 0.00 34.83 33.53 1li7 s MET 267 CO 0.57 0.57 0.74 -1.12 -0.01 0.00 0.00 175.02 175.76 1li7 s SER 268 N -0.63 -0.79 0.34 3.03 0.01 -1.26 -4.93 113.70 109.48 1li7 s SER 268 Ca 0.22 1.42 0.02 0.00 1.31 0.00 0.00 55.95 58.92 1li7 s SER 268 Cb -0.15 1.40 0.61 0.00 0.21 0.00 0.00 66.02 68.09 1li7 s SER 268 CO 0.10 -0.24 1.99 0.11 0.41 0.00 0.00 173.24 175.62 1li7 h LYS 269 N 5.63 0.87 -0.51 12.44 1.57 -1.93 0.17 116.57 134.82 1li7 h LYS 269 Ca -0.29 -0.05 0.06 0.00 -1.87 0.00 0.00 60.65 58.49 1li7 h LYS 269 Cb 1.18 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 33.27 1li7 h LYS 269 CO 0.09 0.58 0.34 0.66 -0.57 0.00 0.00 179.45 180.55 1li7 h SER 270 N 0.90 0.39 0.11 0.86 4.64 -2.01 -2.09 113.55 116.35 1li7 h SER 270 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1li7 h SER 270 Cb -0.05 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 61.95 1li7 h SER 270 CO -0.06 0.26 -0.43 0.18 -0.87 0.00 0.00 176.83 175.90 1li7 n LEU 271 N -4.47 1.49 -0.70 5.97 4.32 0.41 -4.97 117.00 119.04 1li7 n LEU 271 Ca 0.07 -0.51 -0.09 0.00 -0.02 0.00 0.00 56.01 55.46 1li7 n LEU 271 Cb 0.24 -0.06 -0.03 0.00 -1.62 0.00 0.00 43.42 41.95 1li7 n LEU 271 CO 0.34 0.28 -0.09 0.61 -1.22 0.00 0.00 177.39 177.32 1li7 n GLY 272 N 1.40 0.97 0.57 -0.72 0.00 -0.19 -4.89 105.19 102.33 1li7 n GLY 272 Ca 0.10 -0.63 0.06 0.00 0.00 0.00 0.00 46.02 45.55 1li7 n GLY 272 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1li7 n ASN 273 N 0.56 1.76 -4.34 1.61 6.94 -1.19 -5.00 115.26 115.61 1li7 n ASN 273 Ca -0.09 -3.85 -0.36 0.00 -0.02 0.00 0.00 54.58 50.26 1li7 n ASN 273 Cb 0.31 -0.52 -0.14 0.00 -2.36 0.00 0.00 39.78 37.07 1li7 n ASN 273 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 1li7 s PHE 274 N -3.21 3.02 -0.01 -2.53 5.36 -1.25 -4.33 117.98 115.02 1li7 s PHE 274 Ca 0.38 -0.87 0.05 0.00 -0.96 0.00 0.00 56.93 55.53 1li7 s PHE 274 Cb 0.36 -2.15 -0.01 0.00 -0.34 0.00 0.00 43.02 40.88 1li7 s PHE 274 CO -0.06 -0.52 -0.18 -0.06 -1.46 0.00 0.00 175.22 172.94 1li7 s PHE 275 N 1.50 1.58 0.59 10.12 0.40 -1.26 -4.93 117.98 125.98 1li7 s PHE 275 Ca 0.05 -0.30 0.02 0.00 -0.60 0.00 0.00 56.93 56.09 1li7 s PHE 275 Cb -0.15 -1.02 0.06 0.00 0.51 0.00 0.00 43.02 42.42 1li7 s PHE 275 CO -0.01 -0.03 0.82 0.95 0.70 0.00 0.00 175.22 177.65 1li7 s THR 276 N -0.39 2.52 0.17 0.64 -4.23 -1.26 -1.17 115.64 111.91 1li7 s THR 276 Ca 0.06 -0.69 -0.13 0.00 -1.18 0.00 0.00 61.69 59.75 1li7 s THR 276 Cb -0.07 -2.83 0.06 0.00 1.34 0.00 0.00 72.50 71.00 1li7 s THR 276 CO -0.01 0.00 1.76 0.58 -0.54 0.00 0.00 174.62 176.41 1li7 h VAL 277 N -0.04 1.20 -0.40 2.29 2.07 -1.59 -2.06 116.25 117.71 1li7 h VAL 277 Ca -0.40 -0.55 0.08 0.00 0.82 0.00 0.00 66.70 66.65 1li7 h VAL 277 Cb 1.29 0.55 -0.07 0.00 -1.52 0.00 0.00 31.29 31.54 1li7 h VAL 277 CO 0.48 0.22 -0.02 0.03 0.02 0.00 0.00 177.57 178.30 1li7 h ARG 278 N 0.74 0.08 0.07 1.57 2.47 -1.94 0.11 114.38 117.48 1li7 h ARG 278 Ca 0.19 -0.00 0.02 0.00 -1.26 0.00 0.00 59.98 58.93 1li7 h ARG 278 Cb 0.10 -0.02 -0.04 0.00 -1.65 0.00 0.00 29.97 28.37 1li7 h ARG 278 CO -0.03 0.05 -0.26 -0.44 0.56 0.00 0.00 179.97 179.86 1li7 h ASP 279 N 0.08 -0.75 -0.86 7.04 3.32 -1.84 -2.31 116.42 121.11 1li7 h ASP 279 Ca 0.20 0.09 0.02 0.00 0.02 0.00 0.00 57.03 57.37 1li7 h ASP 279 Cb 0.29 0.29 -0.05 0.00 0.22 0.00 0.00 39.33 40.09 1li7 h ASP 279 CO -0.35 -0.34 0.56 0.58 -1.72 0.00 0.00 179.24 177.97 1li7 h VAL 280 N -0.44 1.17 0.00 -1.35 2.07 -0.81 -2.51 116.25 114.39 1li7 h VAL 280 Ca 0.04 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 1li7 h VAL 280 Cb 0.49 -0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1li7 h VAL 280 CO -0.18 0.20 -0.08 -0.07 0.02 0.00 0.00 177.57 177.46 1li7 h LEU 281 N 1.11 0.00 -0.78 2.57 3.38 -0.40 -1.41 115.31 119.78 1li7 h LEU 281 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1li7 h LEU 281 Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1li7 h LEU 281 CO -0.10 0.08 0.00 0.11 0.09 0.00 0.00 178.44 178.62 1li7 h LYS 282 N 0.00 0.00 0.00 1.13 1.57 -0.95 -3.20 116.57 115.11 1li7 h LYS 282 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1li7 h LYS 282 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1li7 h LYS 282 CO 0.01 0.00 -0.60 2.48 -0.57 0.00 0.00 179.45 180.77 1li7 n TYR 283 N -2.58 0.00 -3.96 -1.35 4.11 -0.79 -5.04 117.16 107.55 1li7 n TYR 283 Ca 0.02 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.83 1li7 n TYR 283 Cb 0.31 -0.04 -0.10 0.00 -0.00 0.00 0.00 39.34 39.50 1li7 n TYR 283 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.86 177.57 1li7 s TYR 284 N -1.78 0.23 0.57 -3.48 1.51 -0.60 -5.14 117.35 108.66 1li7 s TYR 284 Ca 0.00 -0.50 -0.17 0.00 -1.01 0.00 0.00 57.07 55.40 1li7 s TYR 284 Cb 0.03 -0.17 -0.05 0.00 -0.11 0.00 0.00 41.96 41.66 1li7 s TYR 284 CO 0.19 -0.25 1.07 0.16 -1.11 0.00 0.00 175.55 175.61 1li7 s ASP 285 N -1.66 5.82 0.27 2.29 1.47 -1.26 -4.31 116.67 119.29 1li7 s ASP 285 Ca -0.12 1.90 -0.00 0.00 1.18 0.00 0.00 52.55 55.51 1li7 s ASP 285 Cb -0.07 -2.55 0.54 0.00 -0.34 0.00 0.00 42.92 40.50 1li7 s ASP 285 CO -0.02 -1.14 1.79 0.00 0.68 0.00 0.00 175.17 176.49 1li7 h ALA 286 N 0.73 1.37 0.00 2.11 0.00 -1.89 -2.14 119.26 119.44 1li7 h ALA 286 Ca -0.48 0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.37 1li7 h ALA 286 Cb 1.23 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1li7 h ALA 286 CO 0.57 0.04 -0.59 1.49 0.00 0.00 0.00 179.25 180.76 1li7 h GLU 287 N 0.78 0.00 -0.20 0.00 4.81 -1.93 -1.33 114.58 116.71 1li7 h GLU 287 Ca 0.48 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.65 1li7 h GLU 287 Cb 0.59 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 1li7 h GLU 287 CO -0.32 0.59 -0.08 1.15 -0.73 0.00 0.00 179.01 179.62 1li7 h THR 288 N 0.00 1.30 -0.29 0.32 2.02 -1.78 0.86 112.91 115.34 1li7 h THR 288 Ca -0.01 -1.12 -0.01 0.00 0.77 0.00 0.00 66.41 66.05 1li7 h THR 288 Cb 1.06 1.62 -0.01 0.00 -1.74 0.00 0.00 68.15 69.08 1li7 h THR 288 CO 0.08 0.34 0.16 0.58 0.37 0.00 0.00 175.52 177.04 1li7 h VAL 289 N 0.11 1.13 -0.96 3.16 2.07 -1.31 0.22 116.25 120.67 1li7 h VAL 289 Ca 0.05 -0.33 0.01 0.00 0.82 0.00 0.00 66.70 67.24 1li7 h VAL 289 Cb 0.56 0.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 1li7 h VAL 289 CO 0.03 0.13 0.63 -0.09 0.02 0.00 0.00 177.57 178.29 1li7 h ARG 290 N 0.35 1.26 -0.03 1.57 2.43 -1.16 0.15 114.38 118.95 1li7 h ARG 290 Ca 0.10 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1li7 h ARG 290 Cb 0.06 -0.28 -0.00 0.00 -0.42 0.00 0.00 29.97 29.33 1li7 h ARG 290 CO -0.02 0.84 0.01 -0.92 -1.51 0.00 0.00 179.97 178.37 1li7 h TYR 291 N 1.30 0.04 -0.43 2.20 3.20 -0.32 -2.53 116.97 120.43 1li7 h TYR 291 Ca 0.35 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.25 1li7 h TYR 291 Cb -0.15 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.07 1li7 h TYR 291 CO -0.00 0.10 0.21 0.35 -1.64 0.00 0.00 178.16 177.18 1li7 h PHE 292 N -0.04 0.39 -0.27 -3.82 3.57 -0.02 -1.87 116.94 114.89 1li7 h PHE 292 Ca 0.01 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.60 1li7 h PHE 292 Cb 0.07 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1li7 h PHE 292 CO -0.05 0.20 0.22 -0.07 -2.23 0.00 0.00 178.31 176.38 1li7 h LEU 293 N 0.43 0.00 -1.10 0.59 3.38 -0.44 -1.21 115.31 116.97 1li7 h LEU 293 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1li7 h LEU 293 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1li7 h LEU 293 CO -0.13 0.00 -0.39 0.23 0.09 0.00 0.00 178.44 178.24 1li7 n MET 294 N -4.15 1.35 0.32 1.13 2.81 -0.84 -4.45 117.12 113.29 1li7 n MET 294 Ca 0.03 -1.10 0.19 0.00 -1.81 0.00 0.00 57.70 55.02 1li7 n MET 294 Cb 0.38 -1.48 1.06 0.00 -0.71 0.00 0.00 33.22 32.47 1li7 n MET 294 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1li7 h SER 295 N 2.68 0.00 -3.67 7.83 4.64 -0.44 -3.39 113.55 121.21 1li7 h SER 295 Ca 0.00 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.65 1li7 h SER 295 Cb 0.77 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.69 1li7 h SER 295 CO 0.00 0.01 -0.77 -0.83 -0.87 0.00 0.00 176.83 174.37 1li7 s GLY 296 N -4.14 1.73 0.20 -0.77 0.00 -1.26 -4.55 107.32 98.54 1li7 s GLY 296 Ca -0.05 -1.27 -0.32 0.00 0.00 0.00 0.00 44.72 43.07 1li7 s GLY 296 CO 0.48 -1.24 1.40 1.57 0.00 0.00 0.00 173.10 175.31 1li7 n HIS 297 N 0.85 2.01 -0.26 1.90 -0.00 -1.26 -4.82 115.22 113.64 1li7 n HIS 297 Ca -0.15 0.45 0.17 0.00 -0.00 0.00 0.00 57.72 58.19 1li7 n HIS 297 Cb 0.52 -2.44 0.46 0.00 -0.00 0.00 0.00 29.99 28.54 1li7 n HIS 297 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 176.34 176.44 1li7 h TYR 298 N 4.47 0.65 0.00 1.57 -0.00 -1.89 -1.72 116.97 120.06 1li7 h TYR 298 Ca -0.45 0.02 0.00 0.00 0.00 0.00 0.00 58.73 58.30 1li7 h TYR 298 Cb 1.29 -0.20 0.00 0.00 0.00 0.00 0.00 36.73 37.81 1li7 h TYR 298 CO 0.58 0.19 0.00 -0.09 -0.00 0.00 0.00 178.16 178.83 1li7 h ARG 299 N 0.50 0.00 0.00 0.10 2.43 -1.88 0.31 114.38 115.84 1li7 h ARG 299 Ca 0.47 0.00 -0.47 0.00 -0.81 0.00 0.00 59.98 59.18 1li7 h ARG 299 Cb 1.04 0.00 0.07 0.00 -0.42 0.00 0.00 29.97 30.66 1li7 h ARG 299 CO -0.20 0.00 0.06 -1.13 -1.51 0.00 0.00 179.97 177.19 1li7 n SER 300 N -2.70 1.56 -4.78 -3.80 3.41 -0.65 -3.66 113.62 103.00 1li7 n SER 300 Ca 0.03 -2.25 -0.38 0.00 -0.26 0.00 0.00 58.87 56.01 1li7 n SER 300 Cb 0.35 -0.59 -0.06 0.00 -0.26 0.00 0.00 64.21 63.66 1li7 n SER 300 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1li7 s GLN 301 N -4.97 4.55 -0.11 4.33 -0.21 -1.26 -3.59 119.66 118.40 1li7 s GLN 301 Ca 0.65 1.19 -0.01 0.00 0.02 0.00 0.00 55.36 57.20 1li7 s GLN 301 Cb -0.04 -3.08 -0.03 0.00 1.00 0.00 0.00 33.01 30.86 1li7 s GLN 301 CO 0.42 0.46 -0.05 -1.17 -2.12 0.00 0.00 175.29 172.83 1li7 s LEU 302 N -1.53 3.23 -0.45 2.90 2.96 -0.28 -4.95 118.68 120.56 1li7 s LEU 302 Ca 0.41 -0.06 -0.12 0.00 -0.22 0.00 0.00 54.13 54.14 1li7 s LEU 302 Cb -0.21 -1.74 0.08 0.00 0.50 0.00 0.00 46.19 44.82 1li7 s LEU 302 CO 0.26 0.27 0.33 0.21 -1.32 0.00 0.00 176.35 176.10 1li7 s ASN 303 N -0.28 5.87 -0.15 3.68 2.47 -1.26 -0.37 114.94 124.90 1li7 s ASN 303 Ca 0.04 -1.48 -0.29 0.00 0.42 0.00 0.00 52.86 51.55 1li7 s ASN 303 Cb -0.13 -2.08 -0.01 0.00 -1.45 0.00 0.00 41.25 37.58 1li7 s ASN 303 CO 0.02 -0.61 1.16 -0.47 -3.72 0.00 0.00 177.10 173.49 1li7 s TYR 304 N 1.52 3.12 0.22 0.43 5.04 -0.19 -4.90 117.35 122.58 1li7 s TYR 304 Ca 0.04 1.23 -0.10 0.00 -2.44 0.00 0.00 57.07 55.80 1li7 s TYR 304 Cb -0.24 -3.39 -0.01 0.00 0.35 0.00 0.00 41.96 38.67 1li7 s TYR 304 CO 0.04 -1.15 0.38 -1.54 -1.34 0.00 0.00 175.55 171.94 1li7 s SER 305 N 1.57 -0.03 0.01 4.32 1.04 -1.26 -4.06 113.70 115.30 1li7 s SER 305 Ca 0.51 -0.98 -0.25 0.00 0.48 0.00 0.00 55.95 55.72 1li7 s SER 305 Cb -0.20 0.52 -0.17 0.00 0.10 0.00 0.00 66.02 66.26 1li7 s SER 305 CO 0.14 -1.03 1.32 1.05 0.98 0.00 0.00 173.24 175.70 1li7 h GLU 306 N 2.38 -0.28 -0.73 4.02 9.09 -1.99 -2.71 114.58 124.36 1li7 h GLU 306 Ca -0.29 0.02 0.10 0.00 0.05 0.00 0.00 59.36 59.24 1li7 h GLU 306 Cb 1.25 0.06 -0.08 0.00 -1.65 0.00 0.00 28.75 28.33 1li7 h GLU 306 CO 0.41 0.04 0.36 1.05 0.05 0.00 0.00 179.01 180.92 1li7 h GLU 307 N -0.61 0.58 -0.75 1.06 -0.00 -1.98 -0.67 114.58 112.20 1li7 h GLU 307 Ca -0.03 -0.03 -0.03 0.00 -0.00 0.00 0.00 59.36 59.26 1li7 h GLU 307 Cb 0.44 -0.13 -0.03 0.00 -0.00 0.00 0.00 28.75 29.03 1li7 h GLU 307 CO 0.05 0.38 0.35 -0.91 -0.00 0.00 0.00 179.01 178.88 1li7 h ASN 308 N 0.59 1.00 1.08 3.06 -0.26 -1.90 0.53 115.58 119.68 1li7 h ASN 308 Ca 0.37 -0.14 -0.05 0.00 -0.56 0.00 0.00 56.30 55.92 1li7 h ASN 308 Cb 0.42 -0.26 -0.01 0.00 -1.06 0.00 0.00 38.32 37.41 1li7 h ASN 308 CO -0.29 0.87 -0.23 -0.07 -1.06 0.00 0.00 177.43 176.65 1li7 h LEU 309 N 1.07 0.00 0.06 1.61 -0.00 -1.07 0.30 115.31 117.28 1li7 h LEU 309 Ca 0.26 0.00 -0.18 0.00 -0.00 0.00 0.00 57.88 57.96 1li7 h LEU 309 Cb 0.14 0.00 0.02 0.00 -0.00 0.00 0.00 40.66 40.82 1li7 h LEU 309 CO -0.03 0.23 -0.73 0.11 -0.00 0.00 0.00 178.44 178.01 1li7 h LYS 310 N 0.00 0.39 -0.63 1.13 1.79 -0.22 -2.66 116.57 116.38 1li7 h LYS 310 Ca -0.00 -0.50 -0.02 0.00 -2.18 0.00 0.00 60.65 57.95 1li7 h LYS 310 Cb 0.83 0.16 -0.03 0.00 -1.58 0.00 0.00 32.23 31.61 1li7 h LYS 310 CO 0.03 1.18 0.31 1.96 -1.08 0.00 0.00 179.45 181.85 1li7 h GLN 311 N -0.16 0.90 -0.51 3.15 1.08 0.27 -0.04 115.11 119.80 1li7 h GLN 311 Ca -0.11 -0.13 0.10 0.00 -1.45 0.00 0.00 58.65 57.06 1li7 h GLN 311 Cb 1.48 -0.16 -0.08 0.00 -0.05 0.00 0.00 27.48 28.67 1li7 h GLN 311 CO 0.14 0.71 0.04 0.00 -0.95 0.00 0.00 178.83 178.77 1li7 h ALA 312 N 1.14 0.52 -0.52 3.87 0.00 -0.43 0.12 119.26 123.96 1li7 h ALA 312 Ca 0.22 0.13 -0.07 0.00 0.00 0.00 0.00 54.91 55.19 1li7 h ALA 312 Cb 0.10 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1li7 h ALA 312 CO -0.03 -0.36 0.04 -0.09 0.00 0.00 0.00 179.25 178.81 1li7 h ARG 313 N 0.16 0.88 -0.52 0.00 9.65 -1.05 -2.04 114.38 121.48 1li7 h ARG 313 Ca 0.26 -0.26 -0.03 0.00 -1.10 0.00 0.00 59.98 58.85 1li7 h ARG 313 Cb 0.38 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.84 1li7 h ARG 313 CO -0.39 0.89 0.21 0.00 2.80 0.00 0.00 179.97 183.49 1li7 h ALA 314 N 0.96 1.40 -0.13 2.80 0.00 -0.09 -1.01 119.26 123.19 1li7 h ALA 314 Ca 0.15 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1li7 h ALA 314 Cb 0.47 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1li7 h ALA 314 CO 0.02 0.46 -0.06 0.00 0.00 0.00 0.00 179.25 179.66 1li7 h ALA 315 N 1.50 0.18 -0.69 0.00 0.00 -0.60 -2.30 119.26 117.34 1li7 h ALA 315 Ca 0.18 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1li7 h ALA 315 Cb 0.13 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1li7 h ALA 315 CO -0.02 -0.04 0.46 1.25 0.00 0.00 0.00 179.25 180.90 1li7 h LEU 316 N -0.08 0.72 -0.65 0.00 5.85 -1.05 -1.52 115.31 118.58 1li7 h LEU 316 Ca 0.03 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.63 1li7 h LEU 316 Cb 0.52 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 1li7 h LEU 316 CO 0.02 0.50 -0.10 -0.33 -0.34 0.00 0.00 178.44 178.18 1li7 h GLU 317 N 0.84 0.95 -0.29 1.25 5.08 -1.06 -0.22 114.58 121.13 1li7 h GLU 317 Ca 0.28 -0.34 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 1li7 h GLU 317 Cb 0.06 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 1li7 h GLU 317 CO -0.08 1.00 -0.01 0.00 -1.00 0.00 0.00 179.01 178.93 1li7 h ARG 318 N 0.85 0.43 0.12 2.33 3.08 -0.71 -0.64 114.38 119.84 1li7 h ARG 318 Ca 0.14 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1li7 h ARG 318 Cb 0.64 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.63 1li7 h ARG 318 CO 0.04 0.47 -0.06 -0.07 -1.07 0.00 0.00 179.97 179.29 1li7 h LEU 319 N 0.42 -0.13 -1.91 3.04 3.38 -1.13 -3.14 115.31 115.84 1li7 h LEU 319 Ca 0.09 -0.06 0.25 0.00 0.09 0.00 0.00 57.88 58.26 1li7 h LEU 319 Cb 0.29 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 1li7 h LEU 319 CO 0.01 0.37 0.64 1.88 0.09 0.00 0.00 178.44 181.43 1li7 h TYR 320 N -1.03 0.10 -0.15 1.13 -1.99 -1.04 0.14 116.97 114.13 1li7 h TYR 320 Ca -0.02 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.70 1li7 h TYR 320 Cb 0.18 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 38.88 1li7 h TYR 320 CO 0.02 0.02 0.01 1.15 -0.00 0.00 0.00 178.16 179.36 1li7 h THR 321 N 0.07 1.24 -0.86 -2.88 2.02 -1.20 -1.85 112.91 109.45 1li7 h THR 321 Ca 0.44 -0.77 0.11 0.00 0.77 0.00 0.00 66.41 66.95 1li7 h THR 321 Cb 1.64 1.46 -0.06 0.00 -1.74 0.00 0.00 68.15 69.44 1li7 h THR 321 CO -0.04 0.23 0.56 0.00 0.37 0.00 0.00 175.52 176.64 1li7 h ALA 322 N 0.78 1.71 0.00 6.16 0.00 -0.68 0.13 119.26 127.37 1li7 h ALA 322 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1li7 h ALA 322 Cb 0.34 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1li7 h ALA 322 CO 0.01 0.10 0.00 1.28 0.00 0.00 0.00 179.25 180.64 1li7 n LEU 323 N -4.53 0.00 -4.74 0.00 4.77 -0.86 -4.72 117.00 106.92 1li7 n LEU 323 Ca 0.15 0.37 -0.42 0.00 -0.03 0.00 0.00 56.01 56.08 1li7 n LEU 323 Cb 0.34 -0.37 -0.02 0.00 -2.33 0.00 0.00 43.42 41.04 1li7 n LEU 323 CO 0.31 -0.01 1.26 -0.60 -1.33 0.00 0.00 177.39 177.02 1li7 s ARG 324 N -2.73 4.15 -0.49 3.23 6.06 0.03 -2.13 118.95 127.07 1li7 s ARG 324 Ca 0.23 2.52 0.00 0.00 -2.50 0.00 0.00 55.73 55.98 1li7 s ARG 324 Cb 0.20 -3.07 0.00 0.00 0.06 0.00 0.00 34.95 32.14 1li7 s ARG 324 CO 0.48 -0.63 0.00 0.41 -2.50 0.00 0.00 175.30 173.06 1li7 n GLY 325 N 2.86 0.73 3.93 8.12 0.00 -1.26 -5.02 105.19 114.55 1li7 n GLY 325 Ca 0.11 -0.59 -0.27 0.00 0.00 0.00 0.00 46.02 45.27 1li7 n GLY 325 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1li7 s THR 326 N -2.10 5.17 -0.41 2.61 2.01 -0.90 -5.06 115.64 116.95 1li7 s THR 326 Ca 0.00 -0.35 -0.14 0.00 0.31 0.00 0.00 61.69 61.52 1li7 s THR 326 Cb 0.00 -3.75 0.04 0.00 0.01 0.00 0.00 72.50 68.80 1li7 s THR 326 CO 0.00 -0.24 0.29 -0.62 -0.69 0.00 0.00 174.62 173.37 1li7 s ASP 327 N -3.28 5.99 0.19 3.53 3.68 -1.26 -4.94 116.67 120.58 1li7 s ASP 327 Ca 0.39 -1.06 0.16 0.00 2.13 0.00 0.00 52.55 54.17 1li7 s ASP 327 Cb -0.11 -2.12 0.77 0.00 -1.45 0.00 0.00 42.92 40.02 1li7 s ASP 327 CO 0.30 -0.48 1.48 0.29 0.13 0.00 0.00 175.17 176.89 1li7 n LYS 328 N 5.11 0.10 0.15 4.34 5.02 -1.26 -1.98 118.16 129.65 1li7 n LYS 328 Ca -0.11 0.51 0.04 0.00 -2.02 0.00 0.00 58.31 56.73 1li7 n LYS 328 Cb 0.46 -1.77 0.10 0.00 -0.02 0.00 0.00 35.03 33.79 1li7 n LYS 328 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1li7 h THR 329 N 0.00 0.82 -3.86 -0.18 1.03 -1.97 -3.45 112.91 105.29 1li7 h THR 329 Ca 0.00 -2.02 -0.52 0.00 -0.01 0.00 0.00 66.41 63.85 1li7 h THR 329 Cb 0.10 2.31 0.06 0.00 -1.07 0.00 0.00 68.15 69.55 1li7 h THR 329 CO 0.00 0.44 0.63 -0.69 -0.01 0.00 0.00 175.52 175.89 1li7 s VAL 330 N -3.09 2.77 0.57 0.00 1.01 -0.84 -5.00 120.40 115.83 1li7 s VAL 330 Ca 0.03 0.78 -0.16 0.00 0.00 0.00 0.00 61.98 62.63 1li7 s VAL 330 Cb 0.08 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 1li7 s VAL 330 CO 0.73 0.18 1.05 0.00 0.00 0.00 0.00 175.10 177.06 1li7 s ALA 331 N -1.10 2.79 0.25 5.51 0.00 -1.26 -4.73 121.76 123.21 1li7 s ALA 331 Ca 0.49 0.40 -0.30 0.00 0.00 0.00 0.00 51.96 52.55 1li7 s ALA 331 Cb -0.39 -3.22 -0.09 0.00 0.00 0.00 0.00 23.12 19.41 1li7 s ALA 331 CO 0.52 -0.70 1.16 -2.14 0.00 0.00 0.00 175.76 174.60 1li7 s PRO 332 N -3.97 4.55 -0.16 0.00 0.02 -1.26 -4.45 135.00 129.73 1li7 s PRO 332 Ca 0.64 1.88 -0.30 0.00 0.02 0.00 0.00 61.00 63.23 1li7 s PRO 332 Cb -0.16 -3.20 0.13 0.00 0.02 0.00 0.00 34.50 31.30 1li7 s PRO 332 CO 0.34 0.05 1.02 0.00 -0.33 0.00 0.00 177.00 178.08 1li7 s ALA 333 N -0.71 -1.94 0.00 -1.55 0.00 -0.92 -4.89 121.76 111.75 1li7 s ALA 333 Ca 0.48 1.56 0.00 0.00 0.00 0.00 0.00 51.96 54.00 1li7 s ALA 333 Cb -0.33 -0.64 0.00 0.00 0.00 0.00 0.00 23.12 22.15 1li7 s ALA 333 CO 0.41 -0.35 0.00 0.41 0.00 0.00 0.00 175.76 176.23 1li7 n GLY 334 N 0.59 2.97 1.08 0.00 0.00 -1.26 -3.27 105.19 105.30 1li7 n GLY 334 Ca -0.09 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.98 1li7 n GLY 334 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1li7 n GLY 335 N -2.00 1.80 0.31 -0.02 0.00 -1.26 -4.57 105.19 99.45 1li7 n GLY 335 Ca 0.00 -0.49 0.12 0.00 0.00 0.00 0.00 46.02 45.65 1li7 n GLY 335 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1li7 h GLU 336 N 2.30 0.39 -0.69 1.61 3.07 -1.99 0.19 114.58 119.46 1li7 h GLU 336 Ca 0.00 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 58.80 1li7 h GLU 336 Cb 1.03 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.82 1li7 h GLU 336 CO 0.17 0.26 0.29 0.00 -1.40 0.00 0.00 179.01 178.33 1li7 h ALA 337 N 1.69 1.21 -0.16 3.43 0.00 -2.01 -1.45 119.26 121.98 1li7 h ALA 337 Ca 0.54 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 55.18 1li7 h ALA 337 Cb 1.01 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1li7 h ALA 337 CO -0.52 0.58 -0.32 0.74 0.00 0.00 0.00 179.25 179.74 1li7 h PHE 338 N 0.99 0.63 -0.79 0.00 -1.00 -1.08 -2.72 116.94 112.98 1li7 h PHE 338 Ca 0.24 -0.23 0.08 0.00 2.81 0.00 0.00 57.97 60.87 1li7 h PHE 338 Cb 0.16 -0.12 -0.07 0.00 3.61 0.00 0.00 35.95 39.54 1li7 h PHE 338 CO 0.01 0.95 0.45 1.49 -1.61 0.00 0.00 178.31 179.61 1li7 h GLU 339 N 0.13 0.77 0.09 1.51 4.81 -0.74 0.29 114.58 121.44 1li7 h GLU 339 Ca 0.01 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1li7 h GLU 339 Cb 0.91 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 30.08 1li7 h GLU 339 CO 0.07 0.51 -0.22 0.00 -0.73 0.00 0.00 179.01 178.64 1li7 h ALA 340 N 1.41 -0.36 -0.34 2.92 0.00 -1.21 0.24 119.26 121.92 1li7 h ALA 340 Ca 0.36 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 1li7 h ALA 340 Cb 0.27 0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1li7 h ALA 340 CO -0.21 -0.75 0.10 0.00 0.00 0.00 0.00 179.25 178.39 1li7 h ARG 341 N -0.40 0.49 -0.42 0.00 3.08 -1.01 0.12 114.38 116.23 1li7 h ARG 341 Ca 0.04 -0.07 -0.10 0.00 0.07 0.00 0.00 59.98 59.91 1li7 h ARG 341 Cb 0.44 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1li7 h ARG 341 CO -0.14 0.45 -0.13 0.35 -1.07 0.00 0.00 179.97 179.42 1li7 h PHE 342 N 0.49 0.94 -0.63 3.04 3.57 0.14 -1.87 116.94 122.62 1li7 h PHE 342 Ca 0.12 -0.21 -0.07 0.00 3.53 0.00 0.00 57.97 61.34 1li7 h PHE 342 Cb 0.17 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 1li7 h PHE 342 CO 0.01 0.96 0.13 0.82 -2.23 0.00 0.00 178.31 177.99 1li7 h ILE 343 N 0.65 1.26 -0.17 1.41 1.08 0.27 -0.76 117.51 121.26 1li7 h ILE 343 Ca 0.10 -0.97 -0.01 0.00 -0.39 0.00 0.00 64.86 63.58 1li7 h ILE 343 Cb 0.67 0.68 -0.01 0.00 -3.07 0.00 0.00 36.82 35.09 1li7 h ILE 343 CO 0.05 0.36 0.05 -0.08 -0.69 0.00 0.00 178.15 177.84 1li7 h GLU 344 N 0.94 0.26 -0.45 2.37 4.81 -0.65 0.11 114.58 121.97 1li7 h GLU 344 Ca 0.19 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 1li7 h GLU 344 Cb 0.40 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1li7 h GLU 344 CO 0.01 0.39 0.20 0.00 -0.73 0.00 0.00 179.01 178.88 1li7 h ALA 345 N 0.86 0.59 -0.22 2.92 0.00 -1.26 -2.56 119.26 119.58 1li7 h ALA 345 Ca 0.05 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 1li7 h ALA 345 Cb 0.24 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1li7 h ALA 345 CO -0.00 0.17 -0.31 0.52 0.00 0.00 0.00 179.25 179.62 1li7 h MET 346 N 0.59 0.46 -0.09 0.00 2.86 -1.06 -2.60 114.93 115.09 1li7 h MET 346 Ca 0.15 -0.19 -0.06 0.00 -2.06 0.00 0.00 59.70 57.54 1li7 h MET 346 Cb 0.15 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 1li7 h MET 346 CO -0.02 0.72 -0.23 -0.44 1.06 0.00 0.00 176.91 178.01 1li7 h ASP 347 N 0.39 0.15 0.00 1.22 3.32 -0.80 -0.51 116.42 120.19 1li7 h ASP 347 Ca 0.05 -0.04 -0.66 0.00 0.02 0.00 0.00 57.03 56.40 1li7 h ASP 347 Cb 0.75 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.26 1li7 h ASP 347 CO 0.06 0.39 3.06 -0.67 -1.72 0.00 0.00 179.24 180.35 1li7 n ASP 348 N -4.21 4.68 -3.60 6.45 2.03 -0.98 0.11 116.55 121.03 1li7 n ASP 348 Ca -0.01 -2.70 -0.23 0.00 0.52 0.00 0.00 54.79 52.36 1li7 n ASP 348 Cb 0.32 -1.47 0.04 0.00 -0.72 0.00 0.00 41.12 39.30 1li7 n ASP 348 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1li7 n ASP 349 N 5.70 -3.63 -4.17 1.67 2.03 0.41 -2.85 116.55 115.71 1li7 n ASP 349 Ca 0.56 -0.86 -0.38 0.00 0.52 0.00 0.00 54.79 54.62 1li7 n ASP 349 Cb 0.34 -4.06 -0.04 0.00 -0.72 0.00 0.00 41.12 36.64 1li7 n ASP 349 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1li7 n PHE 350 N -4.03 -1.36 -1.54 -0.67 3.01 -0.20 -4.76 117.46 107.92 1li7 n PHE 350 Ca -0.19 0.35 -0.42 0.00 1.01 0.00 0.00 57.45 58.20 1li7 n PHE 350 Cb 0.64 -2.86 -0.03 0.00 -0.01 0.00 0.00 39.48 37.23 1li7 n PHE 350 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1li7 n ASN 351 N -2.54 3.33 -0.32 4.37 5.15 -1.01 -4.64 115.26 119.62 1li7 n ASN 351 Ca -0.22 -2.77 0.11 0.00 -0.60 0.00 0.00 54.58 51.10 1li7 n ASN 351 Cb 0.63 -1.44 0.29 0.00 -0.53 0.00 0.00 39.78 38.73 1li7 n ASN 351 CO 0.00 0.00 0.00 0.71 1.40 0.00 0.00 177.26 179.37 1li7 h THR 352 N 4.33 0.63 -0.57 -0.44 1.35 -1.86 -2.53 112.91 113.82 1li7 h THR 352 Ca 0.49 -0.20 0.08 0.00 -0.55 0.00 0.00 66.41 66.23 1li7 h THR 352 Cb 0.67 -0.01 -0.06 0.00 -1.73 0.00 0.00 68.15 67.02 1li7 h THR 352 CO 1.88 0.11 0.22 -0.65 -0.25 0.00 0.00 175.52 176.83 1li7 h PRO 353 N 0.58 0.41 -0.90 4.72 0.11 -1.80 0.11 132.00 135.23 1li7 h PRO 353 Ca 0.54 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.60 1li7 h PRO 353 Cb 0.89 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 31.87 1li7 h PRO 353 CO -0.43 0.27 0.49 1.49 -0.21 0.00 0.00 178.00 179.61 1li7 h GLU 354 N 0.42 1.26 -0.91 1.05 4.81 -1.84 -1.87 114.58 117.50 1li7 h GLU 354 Ca 0.28 -0.15 0.02 0.00 -0.13 0.00 0.00 59.36 59.38 1li7 h GLU 354 Cb 0.31 -0.25 -0.05 0.00 0.63 0.00 0.00 28.75 29.39 1li7 h GLU 354 CO -0.27 0.92 0.60 0.00 -0.73 0.00 0.00 179.01 179.53 1li7 h ALA 355 N 1.28 1.16 -1.00 2.92 0.00 -0.79 -1.11 119.26 121.73 1li7 h ALA 355 Ca 0.32 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.23 1li7 h ALA 355 Cb 0.03 -0.35 -0.07 0.00 0.00 0.00 0.00 17.79 17.40 1li7 h ALA 355 CO -0.05 0.52 0.64 1.88 0.00 0.00 0.00 179.25 182.24 1li7 h TYR 356 N 1.20 1.19 -0.88 0.00 -1.99 -0.08 -1.06 116.97 115.36 1li7 h TYR 356 Ca 0.34 0.03 0.04 0.00 2.00 0.00 0.00 58.73 61.14 1li7 h TYR 356 Cb -0.10 -0.39 -0.05 0.00 2.00 0.00 0.00 36.73 38.19 1li7 h TYR 356 CO -0.01 0.63 0.57 1.03 -0.00 0.00 0.00 178.16 180.37 1li7 h SER 357 N 1.18 0.94 0.03 3.88 0.87 -0.68 -2.03 113.55 117.74 1li7 h SER 357 Ca 0.42 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.98 1li7 h SER 357 Cb 0.14 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 1li7 h SER 357 CO -0.17 0.64 -0.01 0.58 -0.53 0.00 0.00 176.83 177.34 1li7 h VAL 358 N 1.09 1.15 -0.89 2.23 2.07 -0.80 -2.52 116.25 118.58 1li7 h VAL 358 Ca 0.36 -0.56 0.17 0.00 0.82 0.00 0.00 66.70 67.48 1li7 h VAL 358 Cb 0.03 1.53 -0.10 0.00 -1.52 0.00 0.00 31.29 31.22 1li7 h VAL 358 CO -0.12 0.14 0.47 -0.07 0.02 0.00 0.00 177.57 178.01 1li7 h LEU 359 N -0.29 0.55 -0.55 2.57 3.38 -0.87 0.81 115.31 120.91 1li7 h LEU 359 Ca -0.00 0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 1li7 h LEU 359 Cb 0.27 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1li7 h LEU 359 CO 0.01 0.19 0.05 -0.26 0.09 0.00 0.00 178.44 178.52 1li7 h PHE 360 N 0.61 1.01 0.11 1.13 -1.00 -1.28 0.19 116.94 117.71 1li7 h PHE 360 Ca 0.51 -0.16 -0.01 0.00 2.81 0.00 0.00 57.97 61.12 1li7 h PHE 360 Cb 0.78 -0.27 0.00 0.00 3.61 0.00 0.00 35.95 40.07 1li7 h PHE 360 CO -0.08 0.91 -0.05 -0.44 -1.61 0.00 0.00 178.31 177.03 1li7 h ASP 361 N 0.82 -0.12 -0.82 2.17 3.32 -0.64 -0.68 116.42 120.46 1li7 h ASP 361 Ca 0.16 -0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.24 1li7 h ASP 361 Cb 0.47 0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.01 1li7 h ASP 361 CO 0.02 -0.07 0.54 -0.03 -1.72 0.00 0.00 179.24 177.98 1li7 h MET 362 N -0.16 0.98 -0.37 3.56 4.05 -0.71 -1.35 114.93 120.93 1li7 h MET 362 Ca -0.02 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.34 1li7 h MET 362 Cb 0.13 -0.22 -0.02 0.00 -0.80 0.00 0.00 31.60 30.69 1li7 h MET 362 CO 0.02 0.65 0.21 0.00 0.23 0.00 0.00 176.91 178.02 1li7 h ALA 363 N 1.52 0.48 -0.90 0.39 0.00 -0.09 -0.64 119.26 120.02 1li7 h ALA 363 Ca 0.33 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1li7 h ALA 363 Cb 0.05 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1li7 h ALA 363 CO -0.10 -0.00 0.48 0.07 0.00 0.00 0.00 179.25 179.70 1li7 h ARG 364 N 0.48 1.26 -0.54 0.00 0.11 -0.35 -0.89 114.38 114.45 1li7 h ARG 364 Ca 0.13 -0.15 -0.02 0.00 0.10 0.00 0.00 59.98 60.04 1li7 h ARG 364 Cb 0.04 -0.24 -0.03 0.00 1.11 0.00 0.00 29.97 30.85 1li7 h ARG 364 CO -0.02 0.92 0.25 1.49 0.10 0.00 0.00 179.97 182.71 1li7 h GLU 365 N 1.26 0.75 -0.62 0.08 4.57 -0.80 -1.10 114.58 118.71 1li7 h GLU 365 Ca 0.31 -0.09 -0.05 0.00 -1.18 0.00 0.00 59.36 58.35 1li7 h GLU 365 Cb 0.04 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.46 1li7 h GLU 365 CO -0.05 0.59 0.19 0.28 -1.18 0.00 0.00 179.01 178.85 1li7 h VAL 366 N 0.75 1.25 0.01 0.32 2.07 0.17 -1.14 116.25 119.68 1li7 h VAL 366 Ca 0.19 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1li7 h VAL 366 Cb 0.09 0.61 -0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1li7 h VAL 366 CO -0.02 0.32 -0.01 0.78 0.02 0.00 0.00 177.57 178.66 1li7 h ASN 367 N 0.90 -0.03 -0.62 0.57 2.35 -0.16 -1.15 115.58 117.43 1li7 h ASN 367 Ca 0.20 0.00 0.04 0.00 -0.55 0.00 0.00 56.30 56.00 1li7 h ASN 367 Cb 0.29 0.01 -0.05 0.00 0.05 0.00 0.00 38.32 38.63 1li7 h ASN 367 CO -0.01 -0.02 0.36 0.03 -1.65 0.00 0.00 177.43 176.14 1li7 h ARG 368 N -0.03 0.66 0.00 0.81 -0.00 -1.05 -1.84 114.38 112.93 1li7 h ARG 368 Ca 0.00 -0.04 -0.05 0.00 -0.50 0.00 0.00 59.98 59.40 1li7 h ARG 368 Cb 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 29.97 29.84 1li7 h ARG 368 CO -0.01 0.44 -0.22 -0.07 0.00 0.00 0.00 179.97 180.11 1li7 h LEU 369 N 0.68 0.00 -2.44 3.04 3.38 -0.93 -2.59 115.31 116.45 1li7 h LEU 369 Ca 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 1li7 h LEU 369 Cb 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1li7 h LEU 369 CO -0.15 0.22 -0.03 0.11 0.09 0.00 0.00 178.44 178.69 1li7 h LYS 370 N 0.00 0.00 0.07 1.13 1.57 -0.32 -0.02 116.57 118.99 1li7 h LYS 370 Ca -0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 1li7 h LYS 370 Cb 0.40 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.72 1li7 h LYS 370 CO 0.03 0.03 -0.59 0.00 -0.57 0.00 0.00 179.45 178.34 1li7 h ALA 371 N 1.97 -0.03 0.00 3.86 0.00 -1.48 -3.43 119.26 120.16 1li7 h ALA 371 Ca -0.00 -0.61 -0.13 0.00 0.00 0.00 0.00 54.91 54.17 1li7 h ALA 371 Cb 0.14 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1li7 h ALA 371 CO 0.00 0.29 -0.96 -0.85 0.00 0.00 0.00 179.25 177.73 1li7 n GLU 372 N -4.25 0.51 -3.59 0.00 0.00 -1.07 -4.93 120.64 107.30 1li7 n GLU 372 Ca -0.12 0.54 -0.29 0.00 0.00 0.00 0.00 57.16 57.29 1li7 n GLU 372 Cb 0.70 -1.71 -0.15 0.00 0.00 0.00 0.00 31.44 30.28 1li7 n GLU 372 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 1li7 s ASP 373 N -6.36 3.46 0.49 -1.84 2.15 -0.05 -4.99 116.67 109.54 1li7 s ASP 373 Ca -0.23 -1.25 0.26 0.00 0.43 0.00 0.00 52.55 51.76 1li7 s ASP 373 Cb 0.04 -0.44 1.28 0.00 -0.30 0.00 0.00 42.92 43.50 1li7 s ASP 373 CO 0.42 -0.42 1.99 0.24 -0.17 0.00 0.00 175.17 177.23 1li7 h MET 374 N 8.35 0.00 -0.65 4.34 2.86 -1.82 0.11 114.93 128.11 1li7 h MET 374 Ca -0.18 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.39 1li7 h MET 374 Cb 1.03 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.67 1li7 h MET 374 CO 0.42 0.16 0.14 0.00 1.06 0.00 0.00 176.91 178.69 1li7 h ALA 375 N 1.84 0.86 -0.00 6.32 0.00 -1.94 0.40 119.26 126.75 1li7 h ALA 375 Ca -0.00 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1li7 h ALA 375 Cb 0.46 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1li7 h ALA 375 CO 0.02 0.60 -0.01 0.00 0.00 0.00 0.00 179.25 179.86 1li7 h ALA 376 N 1.05 0.01 -0.70 0.00 0.00 -1.66 -2.38 119.26 115.58 1li7 h ALA 376 Ca 0.20 -0.31 0.08 0.00 0.00 0.00 0.00 54.91 54.89 1li7 h ALA 376 Cb 0.39 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 1li7 h ALA 376 CO 0.01 -0.18 0.46 0.00 0.00 0.00 0.00 179.25 179.54 1li7 h ALA 377 N 0.40 1.80 -0.45 0.00 0.00 -0.70 0.11 119.26 120.42 1li7 h ALA 377 Ca -0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1li7 h ALA 377 Cb 0.61 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1li7 h ALA 377 CO 0.00 0.07 -0.19 -0.91 0.00 0.00 0.00 179.25 178.22 1li7 h ASN 378 N 0.65 0.89 -0.19 0.00 4.21 -0.14 -0.07 115.58 120.93 1li7 h ASN 378 Ca 0.32 -0.31 -0.11 0.00 1.21 0.00 0.00 56.30 57.40 1li7 h ASN 378 Cb 0.38 -0.24 -0.01 0.00 -1.12 0.00 0.00 38.32 37.32 1li7 h ASN 378 CO -0.11 1.06 -0.27 0.00 -1.29 0.00 0.00 177.43 176.82 1li7 h ALA 379 N 1.01 0.92 -0.33 -0.83 0.00 -0.61 -2.31 119.26 117.10 1li7 h ALA 379 Ca 0.11 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1li7 h ALA 379 Cb 0.72 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1li7 h ALA 379 CO 0.06 0.62 0.00 0.52 0.00 0.00 0.00 179.25 180.45 1li7 h MET 380 N 0.58 0.59 -0.82 0.00 2.86 -0.72 -2.11 114.93 115.31 1li7 h MET 380 Ca 0.08 -0.19 -0.03 0.00 -2.06 0.00 0.00 59.70 57.50 1li7 h MET 380 Cb 0.75 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.32 1li7 h MET 380 CO 0.06 0.71 0.38 0.00 1.06 0.00 0.00 176.91 179.12 1li7 h ALA 381 N 0.86 1.06 -0.22 6.32 0.00 -0.87 0.42 119.26 126.82 1li7 h ALA 381 Ca 0.10 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 1li7 h ALA 381 Cb 0.44 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1li7 h ALA 381 CO 0.02 0.64 -0.28 0.77 0.00 0.00 0.00 179.25 180.39 1li7 h SER 382 N 1.17 0.44 -0.24 0.00 0.02 -1.38 0.26 113.55 113.81 1li7 h SER 382 Ca 0.28 -0.15 -0.17 0.00 -0.84 0.00 0.00 61.79 60.91 1li7 h SER 382 Cb 0.14 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.56 1li7 h SER 382 CO -0.03 0.71 -0.47 -0.74 -1.14 0.00 0.00 176.83 175.16 1li7 h HIS 383 N 0.38 1.00 -0.58 3.45 2.76 -0.70 -1.02 115.15 120.45 1li7 h HIS 383 Ca 0.05 -0.33 -0.08 0.00 -2.20 0.00 0.00 60.37 57.82 1li7 h HIS 383 Cb 0.70 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.43 1li7 h HIS 383 CO 0.02 1.13 0.05 1.25 -1.30 0.00 0.00 177.93 179.07 1li7 h LEU 384 N 0.65 0.92 -0.93 0.26 5.85 0.28 -2.62 115.31 119.71 1li7 h LEU 384 Ca 0.03 -0.23 -0.11 0.00 0.84 0.00 0.00 57.88 58.42 1li7 h LEU 384 Cb 1.05 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 1li7 h LEU 384 CO 0.10 0.95 -0.51 0.03 -0.34 0.00 0.00 178.44 178.67 1li7 h ARG 385 N 0.89 0.00 -0.22 1.25 3.08 -0.25 -1.36 114.38 117.78 1li7 h ARG 385 Ca 0.17 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.19 1li7 h ARG 385 Cb 0.46 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 1li7 h ARG 385 CO 0.02 0.51 0.01 -0.22 -1.07 0.00 0.00 179.97 179.22 1li7 h LYS 386 N 0.00 0.37 0.19 0.04 3.64 -0.84 -1.06 116.57 118.92 1li7 h LYS 386 Ca -0.01 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 1li7 h LYS 386 Cb 0.94 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.73 1li7 h LYS 386 CO 0.07 0.55 -0.09 -0.07 -2.27 0.00 0.00 179.45 177.63 1li7 h LEU 387 N 0.15 -0.22 -1.90 5.20 3.38 -1.39 -3.10 115.31 117.43 1li7 h LEU 387 Ca 0.06 -0.30 0.15 0.00 0.09 0.00 0.00 57.88 57.89 1li7 h LEU 387 Cb 0.37 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1li7 h LEU 387 CO 0.01 0.23 0.42 0.77 0.09 0.00 0.00 178.44 179.95 1li7 h SER 388 N -0.72 0.09 0.07 -0.43 4.64 -1.31 0.22 113.55 116.10 1li7 h SER 388 Ca -0.03 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 1li7 h SER 388 Cb 0.50 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1li7 h SER 388 CO 0.04 0.05 -0.06 0.00 -0.87 0.00 0.00 176.83 176.00 1li7 h ALA 389 N 1.71 1.82 -0.18 5.18 0.00 -1.11 0.11 119.26 126.79 1li7 h ALA 389 Ca 0.28 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 1li7 h ALA 389 Cb 0.98 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1li7 h ALA 389 CO -0.03 0.07 -0.06 0.28 0.00 0.00 0.00 179.25 179.51 1li7 h VAL 390 N 0.00 1.15 -0.30 0.00 2.07 -0.60 -0.09 116.25 118.48 1li7 h VAL 390 Ca -0.00 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 66.90 1li7 h VAL 390 Cb 0.11 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1li7 h VAL 390 CO 0.01 0.20 0.00 0.18 0.02 0.00 0.00 177.57 177.98 1li7 n LEU 391 N -4.33 2.42 -2.12 2.57 4.77 0.25 -4.50 117.00 116.06 1li7 n LEU 391 Ca -0.00 -1.07 -0.16 0.00 -0.03 0.00 0.00 56.01 54.75 1li7 n LEU 391 Cb 0.22 -0.20 0.02 0.00 -2.33 0.00 0.00 43.42 41.13 1li7 n LEU 391 CO 0.37 0.54 -0.06 0.61 -1.33 0.00 0.00 177.39 177.52 1li7 n GLY 392 N 1.28 -0.22 3.42 -0.72 0.00 -0.05 -5.00 105.19 103.90 1li7 n GLY 392 Ca 0.17 -0.15 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 1li7 n GLY 392 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1li7 s LEU 393 N -4.85 2.56 -1.87 0.99 1.43 -0.43 -4.80 118.68 111.71 1li7 s LEU 393 Ca 0.16 -1.01 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 1li7 s LEU 393 Cb -0.07 -0.96 0.00 0.00 0.03 0.00 0.00 46.19 45.19 1li7 s LEU 393 CO 0.20 -0.02 0.00 0.18 0.23 0.00 0.00 176.35 176.94 1li7 n LEU 394 N -0.44 -1.40 -0.13 1.79 4.77 -1.26 -3.65 117.00 116.68 1li7 n LEU 394 Ca -0.07 0.38 0.15 0.00 -0.03 0.00 0.00 56.01 56.44 1li7 n LEU 394 Cb 0.60 -2.57 0.73 0.00 -2.33 0.00 0.00 43.42 39.85 1li7 n LEU 394 CO 0.36 -0.84 0.97 -0.62 -1.33 0.00 0.00 177.39 175.94 1li7 n GLU 395 N -2.51 0.94 -2.70 3.23 1.02 -1.26 -4.97 120.64 114.39 1li7 n GLU 395 Ca -0.19 -0.25 -0.23 0.00 -0.02 0.00 0.00 57.16 56.48 1li7 n GLU 395 Cb 0.61 -1.49 0.03 0.00 -0.02 0.00 0.00 31.44 30.56 1li7 n GLU 395 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1li7 s GLN 396 N -2.23 2.72 -0.03 3.49 -0.21 -1.26 -5.05 119.66 117.09 1li7 s GLN 396 Ca 0.37 -0.57 -0.30 0.00 0.02 0.00 0.00 55.36 54.88 1li7 s GLN 396 Cb 0.21 -2.47 -0.05 0.00 1.00 0.00 0.00 33.01 31.71 1li7 s GLN 396 CO 0.41 -0.60 1.35 -1.21 -2.12 0.00 0.00 175.29 173.12 1li7 s GLU 397 N -4.75 4.29 0.24 2.91 0.41 -1.26 -4.88 118.70 115.66 1li7 s GLU 397 Ca 0.54 1.87 -0.14 0.00 -0.41 0.00 0.00 54.97 56.84 1li7 s GLU 397 Cb -0.10 -3.61 0.32 0.00 -1.78 0.00 0.00 34.13 28.95 1li7 s GLU 397 CO 0.39 -0.57 1.57 -1.35 -0.49 0.00 0.00 175.26 174.81 1li7 h PRO 398 N 7.86 -0.02 -0.07 0.39 0.11 -1.89 -1.74 132.00 136.66 1li7 h PRO 398 Ca -0.36 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.76 1li7 h PRO 398 Cb 1.17 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1li7 h PRO 398 CO 0.91 -0.01 -0.12 0.93 -0.21 0.00 0.00 178.00 179.49 1li7 h GLU 399 N -0.02 -0.10 0.00 1.05 3.07 -1.89 0.45 114.58 117.14 1li7 h GLU 399 Ca 0.38 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.25 1li7 h GLU 399 Cb 0.63 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.57 1li7 h GLU 399 CO -0.94 -0.07 0.00 0.00 -1.40 0.00 0.00 179.01 176.60 1li7 n ALA 400 N -2.74 0.00 -0.29 3.43 0.00 -0.69 -1.09 120.51 119.12 1li7 n ALA 400 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.33 1li7 n ALA 400 Cb 0.08 0.38 -0.07 0.00 0.00 0.00 0.00 19.45 19.83 1li7 n ALA 400 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1li7 h PHE 401 N 0.00 -1.64 0.00 0.00 3.57 -1.22 -3.50 116.94 114.14 1li7 h PHE 401 Ca 0.00 0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1li7 h PHE 401 Cb 0.00 0.82 0.00 0.00 2.79 0.00 0.00 35.95 39.56 1li7 h PHE 401 CO -0.65 -0.42 0.00 1.28 -2.23 0.00 0.00 178.31 176.29