#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a11 n GLY -2 N 0.00 -0.35 3.75 8.31 0.00 -1.26 -4.97 105.19 110.67 3a11 n GLY -2 Ca 0.00 0.14 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 3a11 n GLY -2 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3a11 s ARG -1 N -5.72 4.33 -0.16 1.61 3.52 -1.26 -5.02 118.95 116.25 3a11 s ARG -1 Ca 0.02 0.71 -0.34 0.00 -0.13 0.00 0.00 55.73 56.00 3a11 s ARG -1 Cb -0.01 -3.36 0.13 0.00 -1.56 0.00 0.00 34.95 30.15 3a11 s ARG -1 CO 0.78 0.31 1.16 -3.38 -0.81 0.00 0.00 175.30 173.36 3a11 s HIS 0 N 0.01 -0.16 0.07 5.12 -3.43 -1.26 -5.06 115.29 110.57 3a11 s HIS 0 Ca 0.31 0.10 -0.29 0.00 -0.80 0.00 0.00 55.06 54.38 3a11 s HIS 0 Cb -0.18 0.52 -0.05 0.00 -1.43 0.00 0.00 32.58 31.44 3a11 s HIS 0 CO 0.16 -0.26 0.91 1.41 -2.00 0.00 0.00 174.74 174.96 3a11 s MET 1 N -2.54 4.62 0.04 -0.38 1.75 -1.26 -4.99 119.30 116.54 3a11 s MET 1 Ca 0.09 1.34 -0.14 0.00 -1.25 0.00 0.00 55.69 55.72 3a11 s MET 1 Cb -0.01 -3.39 -0.06 0.00 2.84 0.00 0.00 34.83 34.21 3a11 s MET 1 CO -0.05 0.19 1.23 0.00 -0.65 0.00 0.00 175.02 175.73 3a11 h ALA 2 N 5.80 -0.78 -2.95 4.11 0.00 -2.01 -3.41 119.26 120.04 3a11 h ALA 2 Ca -0.43 -0.05 -0.59 0.00 0.00 0.00 0.00 54.91 53.84 3a11 h ALA 2 Cb 1.21 0.59 -0.08 0.00 0.00 0.00 0.00 17.79 19.51 3a11 h ALA 2 CO 0.72 -0.82 -0.21 0.08 0.00 0.00 0.00 179.25 179.02 3a11 s VAL 3 N -4.13 5.21 0.45 0.00 1.01 -1.26 -4.89 120.40 116.78 3a11 s VAL 3 Ca -0.07 0.79 -0.23 0.00 0.00 0.00 0.00 61.98 62.48 3a11 s VAL 3 Cb 0.02 -3.74 -0.08 0.00 0.00 0.00 0.00 36.38 32.59 3a11 s VAL 3 CO 0.25 0.38 1.13 -0.69 0.00 0.00 0.00 175.10 176.17 3a11 s VAL 4 N 0.33 3.29 0.35 2.92 1.01 -1.26 -4.93 120.40 122.10 3a11 s VAL 4 Ca 0.22 0.96 0.12 0.00 0.00 0.00 0.00 61.98 63.28 3a11 s VAL 4 Cb -0.15 -3.48 0.34 0.00 0.00 0.00 0.00 36.38 33.09 3a11 s VAL 4 CO 0.08 -0.02 1.77 0.07 0.00 0.00 0.00 175.10 177.00 3a11 h LYS 5 N 2.11 0.55 -0.88 2.72 2.10 -1.97 -1.46 116.57 119.74 3a11 h LYS 5 Ca -0.49 -0.03 0.03 0.00 -2.00 0.00 0.00 60.65 58.15 3a11 h LYS 5 Cb 1.24 -0.12 -0.05 0.00 -0.90 0.00 0.00 32.23 32.40 3a11 h LYS 5 CO 0.61 0.36 0.58 0.93 -2.00 0.00 0.00 179.45 179.93 3a11 h GLU 6 N 0.57 1.10 -0.39 0.07 4.39 -1.98 -0.71 114.58 117.61 3a11 h GLU 6 Ca 0.59 -0.07 -0.05 0.00 0.34 0.00 0.00 59.36 60.17 3a11 h GLU 6 Cb 1.20 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 29.59 3a11 h GLU 6 CO -0.35 0.72 0.05 0.28 -1.16 0.00 0.00 179.01 178.55 3a11 h VAL 7 N 1.13 1.25 0.00 3.13 2.07 -1.57 0.58 116.25 122.84 3a11 h VAL 7 Ca 0.34 -0.90 -0.09 0.00 0.82 0.00 0.00 66.70 66.87 3a11 h VAL 7 Cb -0.02 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 3a11 h VAL 7 CO -0.10 0.31 -0.42 -0.07 0.02 0.00 0.00 177.57 177.32 3a11 h LEU 8 N 0.51 0.00 -0.03 2.57 3.38 -1.37 -0.59 115.31 119.77 3a11 h LEU 8 Ca 0.12 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 3a11 h LEU 8 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3a11 h LEU 8 CO 0.01 0.42 -0.23 -0.08 0.09 0.00 0.00 178.44 178.65 3a11 h GLU 9 N 0.00 0.22 -0.56 1.13 4.81 -0.86 -1.95 114.58 117.37 3a11 h GLU 9 Ca -0.00 -0.19 -0.05 0.00 -0.13 0.00 0.00 59.36 58.98 3a11 h GLU 9 Cb 0.78 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.18 3a11 h GLU 9 CO 0.05 0.86 0.13 0.82 -0.73 0.00 0.00 179.01 180.14 3a11 h ILE 10 N -0.36 1.25 -0.68 2.32 2.04 -0.78 -2.44 117.51 118.85 3a11 h ILE 10 Ca -0.02 -0.89 -0.01 0.00 1.00 0.00 0.00 64.86 64.95 3a11 h ILE 10 Cb 0.91 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 3a11 h ILE 10 CO 0.05 0.33 0.40 0.00 0.00 0.00 0.00 178.15 178.92 3a11 h ALA 11 N 1.02 1.43 0.45 1.87 0.00 -1.15 -2.26 119.26 120.61 3a11 h ALA 11 Ca 0.17 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3a11 h ALA 11 Cb 0.35 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3a11 h ALA 11 CO 0.00 0.49 -0.27 0.93 0.00 0.00 0.00 179.25 180.40 3a11 h GLU 12 N 0.94 -0.66 -0.37 0.00 4.39 -0.90 -0.01 114.58 117.96 3a11 h GLU 12 Ca 0.24 0.05 0.06 0.00 0.34 0.00 0.00 59.36 60.05 3a11 h GLU 12 Cb -0.02 0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 3a11 h GLU 12 CO -0.04 -0.44 0.25 0.87 -1.16 0.00 0.00 179.01 178.49 3a11 h LYS 13 N -0.69 0.21 0.01 2.33 1.57 -1.15 0.44 116.57 119.29 3a11 h LYS 13 Ca -0.05 -0.01 -0.22 0.00 -1.87 0.00 0.00 60.65 58.50 3a11 h LYS 13 Cb 0.56 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 3a11 h LYS 13 CO 0.05 0.14 -0.94 0.82 -0.57 0.00 0.00 179.45 178.95 3a11 h ILE 14 N 0.22 1.45 -0.23 1.86 2.04 -1.09 0.64 117.51 122.40 3a11 h ILE 14 Ca 0.17 -2.56 -0.14 0.00 1.00 0.00 0.00 64.86 63.33 3a11 h ILE 14 Cb 0.38 2.48 -0.00 0.00 -0.74 0.00 0.00 36.82 38.94 3a11 h ILE 14 CO -0.03 0.76 -0.39 0.50 0.00 0.00 0.00 178.15 178.99 3a11 h LYS 15 N 0.17 0.66 -0.00 2.37 3.64 0.76 -2.90 116.57 121.27 3a11 h LYS 15 Ca -0.07 -0.41 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 3a11 h LYS 15 Cb 1.58 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.44 3a11 h LYS 15 CO 0.15 1.03 -0.01 0.09 -2.27 0.00 0.00 179.45 178.45 3a11 n ASN 16 N -4.23 0.19 -0.20 4.20 3.02 0.14 -4.89 115.26 113.49 3a11 n ASN 16 Ca -0.05 -0.92 -0.03 0.00 -0.03 0.00 0.00 54.58 53.55 3a11 n ASN 16 Cb 0.53 -0.04 -0.01 0.00 -0.61 0.00 0.00 39.78 39.65 3a11 n ASN 16 CO 0.00 0.00 0.00 0.80 -2.62 0.00 0.00 177.26 175.44 3a11 n MET 17 N -0.91 -0.81 0.30 3.52 1.56 -0.57 -4.86 117.12 115.35 3a11 n MET 17 Ca 0.22 0.39 0.16 0.00 -0.27 0.00 0.00 57.70 58.20 3a11 n MET 17 Cb 0.16 -4.11 0.93 0.00 2.15 0.00 0.00 33.22 32.35 3a11 n MET 17 CO 0.00 0.00 0.00 0.93 -0.73 0.00 0.00 175.97 176.17 3a11 h GLU 18 N 0.40 0.00 -5.25 2.12 5.08 -0.03 -3.37 114.58 113.53 3a11 h GLU 18 Ca -0.05 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.65 3a11 h GLU 18 Cb 0.48 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.46 3a11 h GLU 18 CO 0.08 0.03 -0.76 0.42 -1.00 0.00 0.00 179.01 177.78 3a11 s ILE 19 N -4.40 3.10 0.06 3.13 1.01 -0.86 -5.01 121.20 118.23 3a11 s ILE 19 Ca -0.04 -0.63 0.01 0.00 0.00 0.00 0.00 60.65 59.98 3a11 s ILE 19 Cb 0.14 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 40.25 3a11 s ILE 19 CO 0.53 0.51 -0.05 -0.13 0.00 0.00 0.00 174.94 175.80 3a11 s ARG 20 N 0.60 0.60 0.00 2.79 0.52 -1.26 -4.71 118.95 117.49 3a11 s ARG 20 Ca -0.07 -1.05 0.00 0.00 -0.52 0.00 0.00 55.73 54.09 3a11 s ARG 20 Cb -0.15 -0.02 0.00 0.00 0.52 0.00 0.00 34.95 35.30 3a11 s ARG 20 CO 0.03 -0.04 0.00 0.41 0.02 0.00 0.00 175.30 175.72 3a11 n GLY 21 N 0.61 2.69 0.27 -3.53 0.00 -1.26 -4.50 105.19 99.46 3a11 n GLY 21 Ca -0.17 -1.48 0.04 0.00 0.00 0.00 0.00 46.02 44.41 3a11 n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a11 h ALA 22 N 0.00 1.01 0.09 4.61 0.00 -1.99 -1.64 119.26 121.34 3a11 h ALA 22 Ca 0.00 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3a11 h ALA 22 Cb 0.00 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3a11 h ALA 22 CO 0.00 -0.17 -0.04 0.78 0.00 0.00 0.00 179.25 179.82 3a11 h GLY 23 N 0.48 -0.13 1.00 0.00 0.00 -1.98 -2.54 103.07 99.90 3a11 h GLY 23 Ca 0.39 0.05 0.01 0.00 0.00 0.00 0.00 47.33 47.77 3a11 h GLY 23 CO -0.36 -0.05 0.41 0.50 0.00 0.00 0.00 176.54 177.05 3a11 h LYS 24 N -0.54 0.82 0.18 4.80 1.57 -1.75 0.61 116.57 122.26 3a11 h LYS 24 Ca -0.01 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 3a11 h LYS 24 Cb 0.45 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.58 3a11 h LYS 24 CO 0.02 0.54 -0.09 0.82 -0.57 0.00 0.00 179.45 180.17 3a11 h ILE 25 N 0.84 0.88 -0.76 1.86 2.04 -1.39 0.22 117.51 121.20 3a11 h ILE 25 Ca 0.23 -0.28 0.05 0.00 1.00 0.00 0.00 64.86 65.86 3a11 h ILE 25 Cb -0.09 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 36.99 3a11 h ILE 25 CO -0.05 0.07 0.50 0.00 0.00 0.00 0.00 178.15 178.66 3a11 h ALA 26 N 0.41 1.61 -0.25 1.87 0.00 -1.29 0.84 119.26 122.44 3a11 h ALA 26 Ca -0.03 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 3a11 h ALA 26 Cb 0.30 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3a11 h ALA 26 CO 0.04 0.29 -0.16 -0.09 0.00 0.00 0.00 179.25 179.33 3a11 h ARG 27 N 0.87 0.55 -0.48 0.00 2.43 -0.55 -2.31 114.38 114.89 3a11 h ARG 27 Ca 0.31 -0.26 -0.11 0.00 -0.81 0.00 0.00 59.98 59.12 3a11 h ARG 27 Cb 0.15 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 3a11 h ARG 27 CO -0.10 0.83 -0.13 0.77 -1.51 0.00 0.00 179.97 179.83 3a11 h SER 28 N 0.27 0.89 -0.38 -3.80 0.02 0.18 -0.58 113.55 110.14 3a11 h SER 28 Ca 0.05 -0.29 -0.07 0.00 -0.84 0.00 0.00 61.79 60.64 3a11 h SER 28 Cb 0.69 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.97 3a11 h SER 28 CO 0.04 1.03 -0.05 0.00 -1.14 0.00 0.00 176.83 176.71 3a11 h ALA 29 N 1.05 0.52 -0.72 3.77 0.00 -0.87 -0.97 119.26 122.05 3a11 h ALA 29 Ca 0.12 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 3a11 h ALA 29 Cb 0.66 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 3a11 h ALA 29 CO 0.05 0.34 0.28 0.00 0.00 0.00 0.00 179.25 179.92 3a11 h ALA 30 N 0.85 0.93 -0.49 0.00 0.00 -1.29 -2.56 119.26 116.71 3a11 h ALA 30 Ca 0.10 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 3a11 h ALA 30 Cb 0.54 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3a11 h ALA 30 CO 0.03 0.56 0.05 -0.92 0.00 0.00 0.00 179.25 178.97 3a11 h TYR 31 N 1.03 0.82 0.06 0.00 3.20 -0.92 -1.58 116.97 119.58 3a11 h TYR 31 Ca 0.24 -0.10 -0.00 0.00 3.14 0.00 0.00 58.73 62.01 3a11 h TYR 31 Cb 0.22 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.26 3a11 h TYR 31 CO 0.02 0.74 -0.04 0.00 -1.64 0.00 0.00 178.16 177.23 3a11 h ALA 32 N 1.31 -0.10 -0.13 1.82 0.00 -0.81 0.49 119.26 121.85 3a11 h ALA 32 Ca 0.15 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.07 3a11 h ALA 32 Cb 0.38 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3a11 h ALA 32 CO 0.01 -0.56 0.09 -0.07 0.00 0.00 0.00 179.25 178.72 3a11 h LEU 33 N -0.11 0.07 0.05 0.00 3.38 -1.17 0.28 115.31 117.82 3a11 h LEU 33 Ca -0.00 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3a11 h LEU 33 Cb 0.09 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3a11 h LEU 33 CO 0.00 0.05 -0.03 -0.61 0.09 0.00 0.00 178.44 177.94 3a11 h GLN 34 N 0.08 -0.07 -0.79 1.13 4.15 -0.38 -1.96 115.11 117.27 3a11 h GLN 34 Ca 0.06 0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.50 3a11 h GLN 34 Cb 0.14 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.80 3a11 h GLN 34 CO -0.01 0.31 0.52 -0.07 -1.93 0.00 0.00 178.83 177.65 3a11 h LEU 35 N -0.46 0.89 -0.31 -2.39 3.38 -0.16 0.30 115.31 116.57 3a11 h LEU 35 Ca -0.01 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.98 3a11 h LEU 35 Cb 0.41 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 3a11 h LEU 35 CO 0.01 0.64 0.09 -0.61 0.09 0.00 0.00 178.44 178.67 3a11 h GLN 36 N 1.06 0.21 -0.03 1.13 5.75 -0.95 0.42 115.11 122.69 3a11 h GLN 36 Ca 0.30 -0.01 -0.08 0.00 -0.15 0.00 0.00 58.65 58.71 3a11 h GLN 36 Cb -0.10 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.39 3a11 h GLN 36 CO -0.07 0.14 -0.34 0.00 -2.65 0.00 0.00 178.83 175.91 3a11 h ALA 37 N 1.21 1.37 0.00 3.38 0.00 -0.66 0.24 119.26 124.80 3a11 h ALA 37 Ca 0.14 -0.33 -0.12 0.00 0.00 0.00 0.00 54.91 54.60 3a11 h ALA 37 Cb 0.12 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3a11 h ALA 37 CO -0.16 0.46 -0.66 0.93 0.00 0.00 0.00 179.25 179.82 3a11 h GLU 38 N 0.06 0.00 -0.06 0.00 5.08 0.73 -3.37 114.58 117.02 3a11 h GLU 38 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3a11 h GLU 38 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 3a11 h GLU 38 CO 0.05 0.53 0.00 1.63 -1.00 0.00 0.00 179.01 180.21 3a11 n LYS 39 N -3.20 0.81 -1.67 2.33 5.02 0.14 -5.04 118.16 116.56 3a11 n LYS 39 Ca 0.00 -1.14 -0.44 0.00 -2.02 0.00 0.00 58.31 54.71 3a11 n LYS 39 Cb 0.77 -1.11 -0.02 0.00 -0.02 0.00 0.00 35.03 34.64 3a11 n LYS 39 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3a11 n SER 40 N 0.21 2.55 -1.66 4.39 2.88 0.06 -4.88 113.62 117.17 3a11 n SER 40 Ca 0.04 1.17 0.08 0.00 -1.33 0.00 0.00 58.87 58.83 3a11 n SER 40 Cb 0.20 -1.42 0.37 0.00 -0.75 0.00 0.00 64.21 62.61 3a11 n SER 40 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3a11 n LYS 41 N 1.46 4.20 -1.25 -1.46 4.01 -1.26 -4.99 118.16 118.86 3a11 n LYS 41 Ca 0.10 -3.00 -0.32 0.00 -0.51 0.00 0.00 58.31 54.57 3a11 n LYS 41 Cb 0.32 -2.05 0.10 0.00 -0.51 0.00 0.00 35.03 32.89 3a11 n LYS 41 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3a11 s ALA 42 N -2.34 2.10 0.00 7.82 0.00 -1.26 -4.91 121.76 123.17 3a11 s ALA 42 Ca 0.52 0.48 0.00 0.00 0.00 0.00 0.00 51.96 52.96 3a11 s ALA 42 Cb 0.37 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 20.14 3a11 s ALA 42 CO 0.19 -1.91 0.64 0.25 0.00 0.00 0.00 175.76 174.93 3a11 n THR 43 N -3.35 0.31 -3.73 0.00 -2.24 -1.26 -5.00 114.28 99.01 3a11 n THR 43 Ca 0.11 -0.63 -0.13 0.00 -2.27 0.00 0.00 64.05 61.12 3a11 n THR 43 Cb 0.52 0.88 -0.10 0.00 -2.10 0.00 0.00 70.33 69.53 3a11 n THR 43 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3a11 s ASN 44 N -0.31 -0.43 0.38 3.42 4.22 -1.26 -5.04 114.94 115.93 3a11 s ASN 44 Ca 0.00 0.81 0.21 0.00 -2.14 0.00 0.00 52.86 51.74 3a11 s ASN 44 Cb 0.00 0.81 1.23 0.00 1.28 0.00 0.00 41.25 44.57 3a11 s ASN 44 CO 0.00 -0.14 1.66 1.62 -2.04 0.00 0.00 177.10 178.19 3a11 h VAL 45 N 4.62 0.25 -0.30 3.54 3.04 -1.92 -1.43 116.25 124.05 3a11 h VAL 45 Ca -0.28 -0.08 -0.04 0.00 -1.01 0.00 0.00 66.70 65.29 3a11 h VAL 45 Cb 1.18 -0.00 -0.01 0.00 -2.01 0.00 0.00 31.29 30.45 3a11 h VAL 45 CO 0.26 0.04 0.03 0.44 -1.01 0.00 0.00 177.57 177.33 3a11 h ASP 46 N 0.23 0.50 -0.49 3.17 3.32 -1.96 -0.39 116.42 120.79 3a11 h ASP 46 Ca 0.75 -0.28 -0.08 0.00 0.02 0.00 0.00 57.03 57.45 3a11 h ASP 46 Cb 2.00 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 41.40 3a11 h ASP 46 CO -0.52 0.66 0.01 -0.08 -1.72 0.00 0.00 179.24 177.59 3a11 h GLU 47 N 0.33 0.87 0.02 3.56 4.81 -1.71 -1.75 114.58 120.70 3a11 h GLU 47 Ca 0.09 -0.27 0.01 0.00 -0.13 0.00 0.00 59.36 59.06 3a11 h GLU 47 Cb 0.38 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 3a11 h GLU 47 CO 0.01 0.90 -0.08 0.35 -0.73 0.00 0.00 179.01 179.46 3a11 h PHE 48 N 0.73 -0.21 -0.72 0.92 3.57 -1.30 -0.43 116.94 119.51 3a11 h PHE 48 Ca 0.14 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.67 3a11 h PHE 48 Cb 0.50 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.29 3a11 h PHE 48 CO 0.04 -0.13 0.47 2.35 -2.23 0.00 0.00 178.31 178.82 3a11 h TRP 49 N -0.15 0.87 -0.45 0.41 -0.00 -0.95 0.37 115.95 116.04 3a11 h TRP 49 Ca 0.03 0.02 -0.05 0.00 -0.00 0.00 0.00 58.89 58.89 3a11 h TRP 49 Cb 0.18 -0.29 -0.02 0.00 -0.00 0.00 0.00 29.16 29.03 3a11 h TRP 49 CO -0.14 0.52 0.08 -0.22 -0.00 0.00 0.00 178.44 178.68 3a11 h LYS 50 N 0.91 0.74 -0.22 2.65 3.64 -0.70 -1.50 116.57 122.09 3a11 h LYS 50 Ca 0.28 -0.20 -0.11 0.00 -1.27 0.00 0.00 60.65 59.35 3a11 h LYS 50 Cb -0.01 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 3a11 h LYS 50 CO -0.07 0.76 -0.34 0.93 -2.27 0.00 0.00 179.45 178.45 3a11 h GLU 51 N 0.61 0.46 -0.56 1.90 5.08 -0.30 -2.12 114.58 119.63 3a11 h GLU 51 Ca 0.14 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3a11 h GLU 51 Cb 0.37 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 3a11 h GLU 51 CO 0.01 0.74 0.31 1.98 -1.00 0.00 0.00 179.01 181.05 3a11 h MET 52 N 0.39 0.78 0.00 2.33 4.05 -0.69 0.31 114.93 122.10 3a11 h MET 52 Ca 0.04 -0.09 -0.07 0.00 -0.28 0.00 0.00 59.70 59.30 3a11 h MET 52 Cb 0.79 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 31.43 3a11 h MET 52 CO 0.06 0.60 -0.34 0.87 0.23 0.00 0.00 176.91 178.33 3a11 h LYS 53 N 0.75 0.00 -0.16 0.39 1.57 -0.98 -1.92 116.57 116.23 3a11 h LYS 53 Ca 0.20 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.86 3a11 h LYS 53 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3a11 h LYS 53 CO -0.03 0.34 -0.37 1.96 -0.57 0.00 0.00 179.45 180.77 3a11 h GLN 54 N 0.00 0.53 0.05 3.15 4.20 -0.68 -1.97 115.11 120.39 3a11 h GLN 54 Ca -0.00 -0.36 0.02 0.00 0.06 0.00 0.00 58.65 58.36 3a11 h GLN 54 Cb 0.65 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 3a11 h GLN 54 CO 0.04 0.97 -0.15 0.00 -0.67 0.00 0.00 178.83 179.03 3a11 h ALA 55 N 0.55 -0.21 -0.83 3.87 0.00 -0.69 -1.92 119.26 120.04 3a11 h ALA 55 Ca -0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.91 3a11 h ALA 55 Cb 0.98 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 3a11 h ALA 55 CO 0.08 -0.65 0.54 0.00 0.00 0.00 0.00 179.25 179.22 3a11 h ALA 56 N 0.63 1.05 -0.70 0.00 0.00 -1.38 -2.20 119.26 116.66 3a11 h ALA 56 Ca 0.03 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3a11 h ALA 56 Cb 0.30 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3a11 h ALA 56 CO -0.11 0.46 0.36 -0.22 0.00 0.00 0.00 179.25 179.75 3a11 h LYS 57 N 1.12 0.97 -0.27 0.00 3.64 -1.03 0.36 116.57 121.36 3a11 h LYS 57 Ca 0.30 -0.11 -0.05 0.00 -1.27 0.00 0.00 60.65 59.52 3a11 h LYS 57 Cb -0.12 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.50 3a11 h LYS 57 CO -0.06 0.73 -0.01 0.82 -2.27 0.00 0.00 179.45 178.65 3a11 h ILE 58 N 0.98 1.26 -0.46 2.00 2.04 -0.97 -2.62 117.51 119.74 3a11 h ILE 58 Ca 0.25 -0.96 -0.05 0.00 1.00 0.00 0.00 64.86 65.09 3a11 h ILE 58 Cb 0.05 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 3a11 h ILE 58 CO -0.04 0.30 0.08 -0.07 0.00 0.00 0.00 178.15 178.43 3a11 h LEU 59 N 0.27 0.72 -2.00 1.44 3.38 -0.86 -2.73 115.31 115.54 3a11 h LEU 59 Ca 0.08 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.81 3a11 h LEU 59 Cb 0.45 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 3a11 h LEU 59 CO 0.02 0.79 0.03 0.15 0.09 0.00 0.00 178.44 179.52 3a11 h PHE 60 N 0.62 0.00 -0.01 1.13 3.57 -0.26 -2.30 116.94 119.70 3a11 h PHE 60 Ca 0.14 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.64 3a11 h PHE 60 Cb 0.37 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.11 3a11 h PHE 60 CO 0.03 0.00 -0.22 0.39 -2.23 0.00 0.00 178.31 176.28 3a11 n GLU 61 N -4.53 0.76 -0.02 1.11 1.02 -0.99 -4.13 120.64 113.85 3a11 n GLU 61 Ca -0.02 -0.40 -0.11 0.00 -0.02 0.00 0.00 57.16 56.61 3a11 n GLU 61 Cb 0.14 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.01 3a11 n GLU 61 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3a11 h THR 62 N 0.97 1.15 -2.36 2.62 1.35 -1.27 -3.41 112.91 111.95 3a11 h THR 62 Ca 0.00 -0.43 -0.46 0.00 -0.55 0.00 0.00 66.41 64.96 3a11 h THR 62 Cb 0.46 1.22 -0.36 0.00 -1.73 0.00 0.00 68.15 67.74 3a11 h THR 62 CO 0.00 0.13 -0.75 -0.13 -0.25 0.00 0.00 175.52 174.52 3a11 s ARG 63 N -5.57 0.46 0.00 4.72 0.52 -1.26 -4.68 118.95 113.14 3a11 s ARG 63 Ca -0.14 -0.81 0.11 0.00 -0.52 0.00 0.00 55.73 54.37 3a11 s ARG 63 Cb 0.06 -0.98 0.53 0.00 0.52 0.00 0.00 34.95 35.08 3a11 s ARG 63 CO 0.69 -1.14 1.32 -2.30 0.02 0.00 0.00 175.30 173.89 3a11 n PRO 64 N 4.58 0.08 0.06 3.54 -0.02 -1.26 -2.10 135.00 139.87 3a11 n PRO 64 Ca 0.06 0.24 0.11 0.00 -2.02 0.00 0.00 63.50 61.89 3a11 n PRO 64 Cb 0.42 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.33 3a11 n PRO 64 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3a11 n THR 65 N -1.39 0.40 -2.38 3.45 -1.04 -1.26 -4.86 114.28 107.20 3a11 n THR 65 Ca 0.04 -0.54 -0.42 0.00 -2.04 0.00 0.00 64.05 61.09 3a11 n THR 65 Cb 0.11 -0.22 -0.03 0.00 -1.82 0.00 0.00 70.33 68.38 3a11 n THR 65 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3a11 s ALA 66 N -3.41 3.56 0.05 2.41 0.00 -0.89 -4.94 121.76 118.54 3a11 s ALA 66 Ca -0.04 0.65 -0.01 0.00 0.00 0.00 0.00 51.96 52.56 3a11 s ALA 66 Cb 0.11 -3.57 -0.27 0.00 0.00 0.00 0.00 23.12 19.40 3a11 s ALA 66 CO 0.84 -0.92 1.02 -0.24 0.00 0.00 0.00 175.76 176.45 3a11 h VAL 67 N 5.13 1.35 0.00 0.00 3.04 -1.89 -3.34 116.25 120.55 3a11 h VAL 67 Ca -0.33 -2.99 -0.12 0.00 -1.01 0.00 0.00 66.70 62.25 3a11 h VAL 67 Cb 1.15 2.82 -0.02 0.00 -2.01 0.00 0.00 31.29 33.24 3a11 h VAL 67 CO 0.91 0.85 -0.57 0.77 -1.01 0.00 0.00 177.57 178.52 3a11 h SER 68 N 0.06 0.00 0.18 3.17 4.64 -1.86 -3.35 113.55 116.38 3a11 h SER 68 Ca -0.17 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.16 3a11 h SER 68 Cb 1.96 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 64.01 3a11 h SER 68 CO 0.17 0.57 -0.52 0.25 -0.87 0.00 0.00 176.83 176.43 3a11 h LEU 69 N 0.00 -1.53 -1.91 5.97 5.85 -1.87 -1.65 115.31 120.17 3a11 h LEU 69 Ca -0.01 0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 3a11 h LEU 69 Cb 1.09 0.56 -0.00 0.00 0.37 0.00 0.00 40.66 42.67 3a11 h LEU 69 CO 0.07 -0.56 -0.08 1.55 -0.34 0.00 0.00 178.44 179.08 3a11 h PRO 70 N -0.78 0.00 -0.02 5.25 0.13 -1.76 -2.27 132.00 132.54 3a11 h PRO 70 Ca -0.02 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.99 3a11 h PRO 70 Cb 0.76 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.88 3a11 h PRO 70 CO -0.25 0.08 -0.56 -0.91 -0.23 0.00 0.00 178.00 176.14 3a11 h ASN 71 N 0.00 0.05 -0.43 1.44 2.35 -1.57 0.37 115.58 117.80 3a11 h ASN 71 Ca -0.00 -0.03 -0.13 0.00 -0.55 0.00 0.00 56.30 55.59 3a11 h ASN 71 Cb 0.15 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 3a11 h ASN 71 CO 0.01 0.60 -0.24 0.00 -1.65 0.00 0.00 177.43 176.15 3a11 h ALA 72 N 1.40 0.71 -0.48 -0.83 0.00 -0.77 -0.15 119.26 119.14 3a11 h ALA 72 Ca -0.00 -0.40 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 3a11 h ALA 72 Cb 1.00 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 3a11 h ALA 72 CO 0.08 0.67 -0.06 -0.07 0.00 0.00 0.00 179.25 179.87 3a11 h LEU 73 N 0.81 0.88 -0.50 0.00 3.38 -0.93 -2.84 115.31 116.11 3a11 h LEU 73 Ca 0.10 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 3a11 h LEU 73 Cb 0.81 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 3a11 h LEU 73 CO 0.07 1.00 0.08 0.03 0.09 0.00 0.00 178.44 179.71 3a11 h ARG 74 N 0.73 0.83 -0.26 1.13 3.08 -0.11 -0.55 114.38 119.25 3a11 h ARG 74 Ca 0.13 -0.22 0.05 0.00 0.07 0.00 0.00 59.98 60.01 3a11 h ARG 74 Cb 0.59 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.49 3a11 h ARG 74 CO 0.04 0.83 -0.08 -0.92 -1.07 0.00 0.00 179.97 178.77 3a11 h TYR 75 N 0.71 -0.17 -0.01 3.04 3.20 -0.90 0.15 116.97 122.98 3a11 h TYR 75 Ca 0.15 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 3a11 h TYR 75 Cb 0.40 0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.79 3a11 h TYR 75 CO 0.03 -0.13 -0.04 0.28 -1.64 0.00 0.00 178.16 176.66 3a11 h VAL 76 N -0.02 1.49 -0.69 1.81 2.07 -1.44 -3.28 116.25 116.19 3a11 h VAL 76 Ca 0.13 -1.49 -0.08 0.00 0.82 0.00 0.00 66.70 66.08 3a11 h VAL 76 Cb 0.21 2.46 -0.03 0.00 -1.52 0.00 0.00 31.29 32.41 3a11 h VAL 76 CO -0.28 0.39 0.13 0.24 0.02 0.00 0.00 177.57 178.08 3a11 h MET 77 N -0.55 1.12 -0.78 1.57 2.86 -1.02 -2.06 114.93 116.08 3a11 h MET 77 Ca -0.00 -0.29 0.05 0.00 -2.06 0.00 0.00 59.70 57.41 3a11 h MET 77 Cb 0.66 -0.14 -0.06 0.00 0.06 0.00 0.00 31.60 32.13 3a11 h MET 77 CO 0.01 1.01 0.47 1.25 1.06 0.00 0.00 176.91 180.71 3a11 h HIS 78 N 1.05 0.87 0.00 -0.22 6.17 -0.84 0.57 115.15 122.75 3a11 h HIS 78 Ca 0.21 0.03 -0.07 0.00 0.71 0.00 0.00 60.37 61.25 3a11 h HIS 78 Cb 0.42 -0.28 -0.01 0.00 2.52 0.00 0.00 27.41 30.06 3a11 h HIS 78 CO 0.03 0.45 -0.34 0.00 0.71 0.00 0.00 177.93 178.78 3a11 h ARG 79 N 0.87 0.00 0.18 5.26 3.08 -1.57 -2.49 114.38 119.70 3a11 h ARG 79 Ca 0.34 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 60.08 3a11 h ARG 79 Cb 0.14 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.23 3a11 h ARG 79 CO -0.16 0.34 -1.30 0.78 -1.07 0.00 0.00 179.97 178.56 3a11 h GLY 80 N 2.54 0.65 1.57 0.04 0.00 -0.48 -2.82 103.07 104.56 3a11 h GLY 80 Ca -0.00 -1.47 0.01 0.00 0.00 0.00 0.00 47.33 45.86 3a11 h GLY 80 CO 0.04 1.29 0.28 1.70 0.00 0.00 0.00 176.54 179.85 3a11 h LYS 81 N 0.17 0.52 0.27 4.80 1.63 0.20 0.10 116.57 124.26 3a11 h LYS 81 Ca -0.21 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.54 3a11 h LYS 81 Cb 1.99 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 33.50 3a11 h LYS 81 CO 0.25 0.34 -0.13 0.82 -3.45 0.00 0.00 179.45 177.28 3a11 h ILE 82 N 0.53 0.66 -0.61 2.00 2.04 -1.46 -1.10 117.51 119.57 3a11 h ILE 82 Ca 0.16 -0.80 0.07 0.00 1.00 0.00 0.00 64.86 65.29 3a11 h ILE 82 Cb -0.02 1.03 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 3a11 h ILE 82 CO -0.04 0.14 0.29 0.00 0.00 0.00 0.00 178.15 178.55 3a11 h ALA 83 N -0.38 0.81 0.52 1.87 0.00 -1.25 -1.40 119.26 119.44 3a11 h ALA 83 Ca -0.04 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3a11 h ALA 83 Cb 0.51 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3a11 h ALA 83 CO 0.06 -0.08 -0.36 -0.92 0.00 0.00 0.00 179.25 177.94 3a11 h TYR 84 N 0.53 -0.96 0.00 0.00 3.20 -0.81 -2.61 116.97 116.31 3a11 h TYR 84 Ca 0.29 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.16 3a11 h TYR 84 Cb 0.27 0.35 -0.00 0.00 1.54 0.00 0.00 36.73 38.89 3a11 h TYR 84 CO -0.12 -0.54 -0.00 0.77 -1.64 0.00 0.00 178.16 176.63 3a11 h SER 85 N -0.86 0.00 -0.00 -2.11 0.02 -0.99 -1.61 113.55 108.00 3a11 h SER 85 Ca -0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 3a11 h SER 85 Cb 0.71 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.25 3a11 h SER 85 CO 0.03 0.00 0.00 -1.54 -1.14 0.00 0.00 176.83 174.19 3a11 n SER 86 N -4.09 0.28 -0.60 3.07 3.41 -0.54 -4.87 113.62 110.29 3a11 n SER 86 Ca -0.03 -2.00 -0.06 0.00 -0.26 0.00 0.00 58.87 56.52 3a11 n SER 86 Cb 0.09 -0.13 -0.01 0.00 -0.26 0.00 0.00 64.21 63.90 3a11 n SER 86 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3a11 n GLY 87 N 0.38 0.34 3.79 5.00 0.00 -0.60 -5.03 105.19 109.05 3a11 n GLY 87 Ca 0.00 -0.69 -0.34 0.00 0.00 0.00 0.00 46.02 44.99 3a11 n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a11 s ALA 88 N -2.27 2.70 0.56 4.61 0.00 -1.03 -5.05 121.76 121.28 3a11 s ALA 88 Ca 0.00 0.60 0.01 0.00 0.00 0.00 0.00 51.96 52.57 3a11 s ALA 88 Cb 0.00 -3.29 0.04 0.00 0.00 0.00 0.00 23.12 19.86 3a11 s ALA 88 CO 0.00 -0.79 0.79 0.16 0.00 0.00 0.00 175.76 175.93 3a11 s ASP 89 N -2.27 5.24 0.18 0.00 3.84 -1.26 -4.77 116.67 117.63 3a11 s ASP 89 Ca 0.68 0.02 -0.25 0.00 -0.00 0.00 0.00 52.55 53.00 3a11 s ASP 89 Cb -0.19 -0.89 0.06 0.00 -1.38 0.00 0.00 42.92 40.52 3a11 s ASP 89 CO 0.31 -1.18 1.50 -0.11 -0.00 0.00 0.00 175.17 175.70 3a11 n LEU 90 N -2.38 -0.86 0.04 2.11 -0.00 -1.26 -0.81 117.00 113.84 3a11 n LEU 90 Ca 0.08 1.72 -0.12 0.00 -0.00 0.00 0.00 56.01 57.68 3a11 n LEU 90 Cb 0.60 -0.29 -0.08 0.00 -0.00 0.00 0.00 43.42 43.65 3a11 n LEU 90 CO 0.46 -1.46 0.51 -0.08 -0.00 0.00 0.00 177.39 176.82 3a11 h GLU 91 N 0.00 -0.51 -0.68 1.96 4.81 -1.99 0.51 114.58 118.68 3a11 h GLU 91 Ca 0.23 0.03 0.13 0.00 -0.13 0.00 0.00 59.36 59.63 3a11 h GLU 91 Cb 0.48 0.11 -0.09 0.00 0.63 0.00 0.00 28.75 29.88 3a11 h GLU 91 CO -0.93 -0.34 0.21 1.96 -0.73 0.00 0.00 179.01 179.18 3a11 h GLN 92 N -0.53 0.33 -0.39 1.92 4.20 -1.66 -1.61 115.11 117.38 3a11 h GLN 92 Ca 0.01 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 3a11 h GLN 92 Cb 0.56 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 3a11 h GLN 92 CO -0.28 0.22 0.09 1.25 -0.67 0.00 0.00 178.83 179.44 3a11 h LEU 93 N 0.34 0.61 -0.49 1.46 5.85 -0.52 -1.38 115.31 121.18 3a11 h LEU 93 Ca 0.37 -0.24 0.04 0.00 0.84 0.00 0.00 57.88 58.88 3a11 h LEU 93 Cb 0.55 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 3a11 h LEU 93 CO -0.41 0.69 0.26 0.03 -0.34 0.00 0.00 178.44 178.67 3a11 h ARG 94 N 0.50 0.49 -0.20 1.25 3.08 -0.28 -1.97 114.38 117.25 3a11 h ARG 94 Ca 0.12 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.15 3a11 h ARG 94 Cb 0.33 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 3a11 h ARG 94 CO 0.00 0.33 0.12 0.35 -1.07 0.00 0.00 179.97 179.70 3a11 h PHE 95 N 0.51 0.23 -0.34 3.04 3.04 -1.12 -0.09 116.94 122.20 3a11 h PHE 95 Ca 0.21 0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.22 3a11 h PHE 95 Cb 0.10 -0.07 -0.04 0.00 2.56 0.00 0.00 35.95 38.50 3a11 h PHE 95 CO -0.09 0.14 0.07 0.28 -2.02 0.00 0.00 178.31 176.69 3a11 h VAL 96 N 0.25 0.84 0.30 1.41 2.07 -0.95 0.18 116.25 120.35 3a11 h VAL 96 Ca 0.08 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3a11 h VAL 96 Cb -0.01 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 3a11 h VAL 96 CO -0.03 0.04 -0.15 0.40 0.02 0.00 0.00 177.57 177.85 3a11 h ILE 97 N 0.20 0.73 -0.89 4.57 2.04 -1.16 -0.54 117.51 122.45 3a11 h ILE 97 Ca 0.16 -0.40 0.11 0.00 1.00 0.00 0.00 64.86 65.73 3a11 h ILE 97 Cb 0.17 0.94 -0.08 0.00 -0.74 0.00 0.00 36.82 37.12 3a11 h ILE 97 CO -0.20 0.08 0.53 0.40 0.00 0.00 0.00 178.15 178.96 3a11 h ILE 98 N -0.62 0.90 -0.49 -0.67 2.04 -0.88 -1.59 117.51 116.20 3a11 h ILE 98 Ca -0.04 -0.30 -0.13 0.00 1.00 0.00 0.00 64.86 65.40 3a11 h ILE 98 Cb 0.45 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.48 3a11 h ILE 98 CO 0.07 0.16 -0.18 -1.13 0.00 0.00 0.00 178.15 177.06 3a11 h ASN 99 N 0.86 1.01 -0.12 1.72 -0.73 -0.53 -2.27 115.58 115.52 3a11 h ASN 99 Ca 0.44 -0.38 -0.00 0.00 1.87 0.00 0.00 56.30 58.22 3a11 h ASN 99 Cb 0.42 -0.28 -0.01 0.00 0.27 0.00 0.00 38.32 38.73 3a11 h ASN 99 CO -0.26 1.17 0.07 0.00 -0.37 0.00 0.00 177.43 178.04 3a11 h ALA 100 N 0.88 0.16 -0.65 1.57 0.00 -0.29 -0.87 119.26 120.05 3a11 h ALA 100 Ca 0.12 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.00 3a11 h ALA 100 Cb 0.76 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 3a11 h ALA 100 CO 0.06 -0.32 0.42 0.00 0.00 0.00 0.00 179.25 179.41 3a11 h ALA 101 N 0.98 0.84 -0.45 0.00 0.00 -1.29 0.21 119.26 119.55 3a11 h ALA 101 Ca 0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3a11 h ALA 101 Cb 0.05 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3a11 h ALA 101 CO -0.01 0.20 0.26 0.87 0.00 0.00 0.00 179.25 180.57 3a11 h LYS 102 N 0.84 0.62 -0.39 0.00 1.57 -1.23 -0.07 116.57 117.90 3a11 h LYS 102 Ca 0.25 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.99 3a11 h LYS 102 Cb -0.03 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.12 3a11 h LYS 102 CO -0.08 0.47 0.21 1.49 -0.57 0.00 0.00 179.45 180.98 3a11 h GLU 103 N 0.59 0.42 -0.50 3.15 4.81 -0.39 -0.54 114.58 122.11 3a11 h GLU 103 Ca 0.16 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.34 3a11 h GLU 103 Cb 0.02 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 3a11 h GLU 103 CO -0.03 0.28 0.22 0.35 -0.73 0.00 0.00 179.01 179.10 3a11 h PHE 104 N 0.43 0.75 -0.58 0.92 3.57 -0.20 -1.81 116.94 120.02 3a11 h PHE 104 Ca 0.16 -0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.52 3a11 h PHE 104 Cb 0.04 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.53 3a11 h PHE 104 CO -0.09 0.61 -0.01 0.82 -2.23 0.00 0.00 178.31 177.41 3a11 h ILE 105 N 0.67 1.26 -0.09 1.41 2.04 -0.75 -1.23 117.51 120.83 3a11 h ILE 105 Ca 0.17 -1.14 -0.01 0.00 1.00 0.00 0.00 64.86 64.88 3a11 h ILE 105 Cb 0.16 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 3a11 h ILE 105 CO -0.02 0.41 0.02 -0.74 0.00 0.00 0.00 178.15 177.82 3a11 h HIS 106 N 0.94 0.15 -0.72 1.37 2.76 -0.96 -0.19 115.15 118.49 3a11 h HIS 106 Ca 0.17 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 3a11 h HIS 106 Cb 0.55 -0.04 -0.04 0.00 1.55 0.00 0.00 27.41 29.44 3a11 h HIS 106 CO 0.04 0.34 0.47 -0.97 -1.30 0.00 0.00 177.93 176.50 3a11 h ASN 107 N -0.08 0.83 -0.21 3.26 -1.24 -1.25 -1.49 115.58 115.40 3a11 h ASN 107 Ca 0.03 -0.03 -0.10 0.00 0.71 0.00 0.00 56.30 56.91 3a11 h ASN 107 Cb 0.26 -0.21 -0.00 0.00 0.73 0.00 0.00 38.32 39.10 3a11 h ASN 107 CO 0.00 0.61 -0.26 -1.28 -1.29 0.00 0.00 177.43 175.22 3a11 h SER 108 N 0.98 0.59 -0.25 1.15 0.87 -1.02 -0.04 113.55 115.83 3a11 h SER 108 Ca 0.26 -0.50 0.05 0.00 -1.23 0.00 0.00 61.79 60.38 3a11 h SER 108 Cb -0.10 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.68 3a11 h SER 108 CO -0.06 0.97 0.17 -0.33 -0.53 0.00 0.00 176.83 177.06 3a11 h GLU 109 N 0.23 0.10 -0.03 2.24 5.08 -0.45 -1.48 114.58 120.28 3a11 h GLU 109 Ca 0.03 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 3a11 h GLU 109 Cb 0.82 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.05 3a11 h GLU 109 CO 0.06 0.07 -0.07 1.63 -1.00 0.00 0.00 179.01 179.70 3a11 n LYS 110 N -4.48 2.06 -0.13 2.33 4.76 -0.62 -4.62 118.16 117.46 3a11 n LYS 110 Ca 0.02 -1.65 -0.06 0.00 -2.87 0.00 0.00 58.31 53.76 3a11 n LYS 110 Cb 0.25 -1.47 0.03 0.00 -1.84 0.00 0.00 35.03 32.01 3a11 n LYS 110 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3a11 h ALA 111 N 4.53 0.52 -0.23 7.82 0.00 0.12 -1.17 119.26 130.85 3a11 h ALA 111 Ca 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3a11 h ALA 111 Cb 0.89 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 3a11 h ALA 111 CO 0.00 -0.18 0.08 -0.07 0.00 0.00 0.00 179.25 179.09 3a11 h LEU 112 N 0.39 0.32 -0.48 0.00 3.38 -1.82 0.51 115.31 117.61 3a11 h LEU 112 Ca 0.19 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.00 3a11 h LEU 112 Cb 0.12 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3a11 h LEU 112 CO -0.15 0.42 0.28 -0.08 0.09 0.00 0.00 178.44 179.00 3a11 h GLU 113 N 0.21 0.54 -0.30 1.13 4.81 -1.84 0.02 114.58 119.15 3a11 h GLU 113 Ca 0.08 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.16 3a11 h GLU 113 Cb 0.20 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3a11 h GLU 113 CO -0.00 0.36 -0.29 0.00 -0.73 0.00 0.00 179.01 178.35 3a11 h ARG 114 N 0.56 0.62 -0.56 1.92 3.08 -0.99 -1.74 114.38 117.27 3a11 h ARG 114 Ca 0.19 -0.26 -0.09 0.00 0.07 0.00 0.00 59.98 59.89 3a11 h ARG 114 Cb 0.02 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3a11 h ARG 114 CO -0.09 0.84 0.01 0.82 -1.07 0.00 0.00 179.97 180.48 3a11 h ILE 115 N 0.53 1.26 -0.53 2.04 2.04 -0.65 -0.95 117.51 121.25 3a11 h ILE 115 Ca 0.07 -1.09 0.05 0.00 1.00 0.00 0.00 64.86 64.89 3a11 h ILE 115 Cb 0.77 0.81 -0.05 0.00 -0.74 0.00 0.00 36.82 37.61 3a11 h ILE 115 CO 0.06 0.39 0.27 1.23 0.00 0.00 0.00 178.15 180.10 3a11 h GLY 116 N 1.00 0.75 1.02 5.37 0.00 -0.46 0.48 103.07 111.23 3a11 h GLY 116 Ca 0.16 -0.18 -0.13 0.00 0.00 0.00 0.00 47.33 47.19 3a11 h GLY 116 CO 0.02 0.11 -0.30 0.83 0.00 0.00 0.00 176.54 177.20 3a11 h GLU 117 N 0.51 0.79 -0.41 4.80 3.07 -0.95 -1.63 114.58 120.76 3a11 h GLU 117 Ca 0.24 -0.41 -0.09 0.00 -0.50 0.00 0.00 59.36 58.60 3a11 h GLU 117 Cb 0.16 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.06 3a11 h GLU 117 CO -0.17 1.03 -0.12 0.74 -1.40 0.00 0.00 179.01 179.09 3a11 h PHE 118 N 0.56 0.80 -0.33 4.33 0.04 -0.88 -2.79 116.94 118.67 3a11 h PHE 118 Ca 0.06 -0.14 -0.16 0.00 2.80 0.00 0.00 57.97 60.52 3a11 h PHE 118 Cb 0.88 -0.21 -0.00 0.00 2.20 0.00 0.00 35.95 38.82 3a11 h PHE 118 CO 0.07 0.81 -0.44 0.78 -0.60 0.00 0.00 178.31 178.93 3a11 h GLY 119 N 0.97 0.96 1.88 -1.45 0.00 -0.87 -3.17 103.07 101.39 3a11 h GLY 119 Ca 0.11 -1.04 -0.02 0.00 0.00 0.00 0.00 47.33 46.38 3a11 h GLY 119 CO 0.04 0.94 -0.02 0.00 0.00 0.00 0.00 176.54 177.50 3a11 h ALA 120 N 0.72 1.76 -0.51 3.60 0.00 -1.14 -2.30 119.26 121.39 3a11 h ALA 120 Ca 0.04 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 55.01 3a11 h ALA 120 Cb 1.04 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 3a11 h ALA 120 CO 0.10 0.18 0.43 0.87 0.00 0.00 0.00 179.25 180.84 3a11 h LYS 121 N 0.16 0.00 -0.04 0.00 1.57 -1.47 0.12 116.57 116.91 3a11 h LYS 121 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3a11 h LYS 121 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3a11 h LYS 121 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.42 3a11 n ARG 122 N -4.05 2.12 -3.78 3.15 5.12 -0.87 -4.90 116.66 113.46 3a11 n ARG 122 Ca 0.09 -1.63 -0.36 0.00 -1.93 0.00 0.00 57.85 54.02 3a11 n ARG 122 Cb 0.64 -1.47 -0.07 0.00 -1.16 0.00 0.00 32.46 30.41 3a11 n ARG 122 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3a11 s ILE 123 N -1.99 5.44 0.19 0.55 -1.09 0.41 -5.09 121.20 119.62 3a11 s ILE 123 Ca 0.31 0.26 0.07 0.00 -2.23 0.00 0.00 60.65 59.06 3a11 s ILE 123 Cb 0.20 -3.46 -0.04 0.00 -1.58 0.00 0.00 42.46 37.59 3a11 s ILE 123 CO 0.31 0.54 0.02 -1.61 -1.23 0.00 0.00 174.94 172.97 3a11 s GLU 124 N -0.42 2.45 0.34 2.79 2.02 -1.26 -4.99 118.70 119.63 3a11 s GLU 124 Ca 0.13 -1.14 -0.29 0.00 0.02 0.00 0.00 54.97 53.69 3a11 s GLU 124 Cb -0.12 -2.36 -0.11 0.00 0.10 0.00 0.00 34.13 31.64 3a11 s GLU 124 CO 0.02 0.44 1.55 0.34 0.02 0.00 0.00 175.26 177.63 3a11 s ASP 125 N -3.12 6.33 0.00 -0.19 2.15 -1.26 -1.82 116.67 118.76 3a11 s ASP 125 Ca 0.29 3.03 0.00 0.00 0.43 0.00 0.00 52.55 56.29 3a11 s ASP 125 Cb -0.09 -2.65 0.00 0.00 -0.30 0.00 0.00 42.92 39.88 3a11 s ASP 125 CO 0.19 -0.91 0.00 0.61 -0.17 0.00 0.00 175.17 174.89 3a11 n GLY 126 N 1.27 0.80 3.75 2.66 0.00 0.38 -4.89 105.19 109.16 3a11 n GLY 126 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 3a11 n GLY 126 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3a11 s ASP 127 N -2.76 6.95 -0.32 1.61 1.01 -0.75 -4.84 116.67 117.55 3a11 s ASP 127 Ca 0.00 2.44 -0.12 0.00 0.71 0.00 0.00 52.55 55.58 3a11 s ASP 127 Cb 0.00 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.29 3a11 s ASP 127 CO 0.00 -0.45 0.21 -0.69 0.21 0.00 0.00 175.17 174.45 3a11 s VAL 128 N -0.45 5.07 -0.13 -1.27 1.01 -1.26 -1.79 120.40 121.57 3a11 s VAL 128 Ca 0.52 -0.23 -0.02 0.00 0.00 0.00 0.00 61.98 62.26 3a11 s VAL 128 Cb -0.36 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.42 3a11 s VAL 128 CO 0.42 0.05 -0.07 -0.63 0.00 0.00 0.00 175.10 174.87 3a11 s ILE 129 N 1.69 3.57 -0.11 2.22 1.01 0.01 -0.37 121.20 129.22 3a11 s ILE 129 Ca 0.06 -0.48 -0.03 0.00 0.00 0.00 0.00 60.65 60.19 3a11 s ILE 129 Cb -0.17 -2.53 -0.03 0.00 0.01 0.00 0.00 42.46 39.74 3a11 s ILE 129 CO 0.09 0.52 0.01 -0.32 0.00 0.00 0.00 174.94 175.24 3a11 s MET 130 N 0.19 3.27 0.39 2.79 1.75 -0.06 0.13 119.30 127.76 3a11 s MET 130 Ca -0.04 -0.40 0.04 0.00 -1.25 0.00 0.00 55.69 54.04 3a11 s MET 130 Cb -0.14 -2.90 -0.02 0.00 2.84 0.00 0.00 34.83 34.60 3a11 s MET 130 CO 0.04 0.57 0.16 -0.08 -0.65 0.00 0.00 175.02 175.06 3a11 s THR 131 N -0.50 0.46 0.02 10.11 -1.32 -0.73 -1.74 115.64 121.94 3a11 s THR 131 Ca 0.09 -2.00 -0.10 0.00 -1.21 0.00 0.00 61.69 58.47 3a11 s THR 131 Cb -0.12 -2.37 0.01 0.00 -1.51 0.00 0.00 72.50 68.51 3a11 s THR 131 CO 0.02 0.00 0.21 -2.28 -2.21 0.00 0.00 174.62 170.36 3a11 s HIS 132 N -3.27 -0.00 0.00 9.09 2.46 -1.26 -3.05 115.29 119.26 3a11 s HIS 132 Ca 0.27 -0.11 0.00 0.00 0.47 0.00 0.00 55.06 55.69 3a11 s HIS 132 Cb 0.02 -0.00 0.00 0.00 -0.13 0.00 0.00 32.58 32.47 3a11 s HIS 132 CO 0.17 -0.38 0.00 0.00 -2.47 0.00 0.00 174.74 172.06 3a11 s HIS 134 N 0.00 0.95 -0.23 0.00 2.46 -1.26 -4.36 115.29 112.85 3a11 s HIS 134 Ca 0.00 -1.74 -0.06 0.00 0.47 0.00 0.00 55.06 53.72 3a11 s HIS 134 Cb 0.00 -1.10 -0.03 0.00 -0.13 0.00 0.00 32.58 31.32 3a11 s HIS 134 CO 0.00 -0.82 0.04 0.45 -2.47 0.00 0.00 174.74 171.94 3a11 s SER 135 N 0.99 4.99 0.24 9.88 0.15 -1.26 -4.99 113.70 123.69 3a11 s SER 135 Ca 0.17 -0.21 -0.07 0.00 0.70 0.00 0.00 55.95 56.54 3a11 s SER 135 Cb -0.23 -1.88 0.23 0.00 -1.71 0.00 0.00 66.02 62.43 3a11 s SER 135 CO -0.01 -0.00 1.90 0.11 1.20 0.00 0.00 173.24 176.44 3a11 h LYS 136 N 7.98 1.25 -0.14 5.44 1.57 -1.97 0.33 116.57 131.03 3a11 h LYS 136 Ca -0.38 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.29 3a11 h LYS 136 Cb 1.17 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 3a11 h LYS 136 CO 0.59 0.86 0.05 0.00 -0.57 0.00 0.00 179.45 180.38 3a11 h ALA 137 N 1.32 0.18 -0.24 3.86 0.00 -1.94 0.19 119.26 122.64 3a11 h ALA 137 Ca 0.34 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 3a11 h ALA 137 Cb -0.09 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3a11 h ALA 137 CO -0.07 -0.22 0.07 0.00 0.00 0.00 0.00 179.25 179.03 3a11 h ALA 138 N 0.88 0.31 -0.60 0.00 0.00 -1.74 -2.21 119.26 115.90 3a11 h ALA 138 Ca 0.05 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.85 3a11 h ALA 138 Cb 0.19 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3a11 h ALA 138 CO -0.00 -0.06 0.40 0.82 0.00 0.00 0.00 179.25 180.41 3a11 h ILE 139 N 0.21 1.08 -0.68 0.00 2.04 -0.21 -1.78 117.51 118.17 3a11 h ILE 139 Ca 0.08 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 3a11 h ILE 139 Cb 0.24 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.60 3a11 h ILE 139 CO -0.00 0.13 0.36 -1.28 0.00 0.00 0.00 178.15 177.35 3a11 h SER 140 N 0.70 0.86 -0.95 1.72 0.87 -0.05 0.16 113.55 116.87 3a11 h SER 140 Ca 0.24 -0.11 -0.00 0.00 -1.23 0.00 0.00 61.79 60.69 3a11 h SER 140 Cb 0.09 -0.22 -0.05 0.00 -0.44 0.00 0.00 62.40 61.78 3a11 h SER 140 CO -0.07 0.73 0.59 0.58 -0.53 0.00 0.00 176.83 178.13 3a11 h VAL 141 N 0.94 1.26 -0.15 2.23 2.07 -0.76 0.21 116.25 122.04 3a11 h VAL 141 Ca 0.24 -0.53 -0.10 0.00 0.82 0.00 0.00 66.70 67.12 3a11 h VAL 141 Cb 0.07 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 29.74 3a11 h VAL 141 CO -0.04 0.26 -0.30 0.24 0.02 0.00 0.00 177.57 177.76 3a11 h MET 142 N 1.30 0.48 -0.31 1.57 2.07 -0.90 -2.19 114.93 116.95 3a11 h MET 142 Ca 0.34 -0.31 -0.10 0.00 -2.07 0.00 0.00 59.70 57.56 3a11 h MET 142 Cb -0.08 0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 29.67 3a11 h MET 142 CO -0.07 0.91 -0.23 -0.22 1.07 0.00 0.00 176.91 178.37 3a11 h LYS 143 N 0.10 0.61 -0.33 1.72 3.64 -0.56 -1.88 116.57 119.87 3a11 h LYS 143 Ca 0.01 -0.23 -0.04 0.00 -1.27 0.00 0.00 60.65 59.11 3a11 h LYS 143 Cb 0.90 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 3a11 h LYS 143 CO 0.07 0.79 0.05 1.15 -2.27 0.00 0.00 179.45 179.24 3a11 h THR 144 N 0.54 1.24 -0.66 1.00 2.02 -0.94 -0.91 112.91 115.18 3a11 h THR 144 Ca 0.08 -0.84 -0.07 0.00 0.77 0.00 0.00 66.41 66.35 3a11 h THR 144 Cb 0.69 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 68.21 3a11 h THR 144 CO 0.05 0.28 0.14 0.00 0.37 0.00 0.00 175.52 176.36 3a11 h ALA 145 N 0.89 0.88 -0.26 6.16 0.00 -1.30 -1.59 119.26 124.03 3a11 h ALA 145 Ca 0.10 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 3a11 h ALA 145 Cb 0.36 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3a11 h ALA 145 CO 0.01 0.61 -0.03 2.35 0.00 0.00 0.00 179.25 182.19 3a11 h TRP 146 N 1.00 0.40 0.00 0.00 2.91 -1.20 -2.11 115.95 116.96 3a11 h TRP 146 Ca 0.21 -0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.19 3a11 h TRP 146 Cb 0.39 -0.12 0.00 0.00 -0.51 0.00 0.00 29.16 28.93 3a11 h TRP 146 CO 0.03 0.43 -0.06 0.39 -1.03 0.00 0.00 178.44 178.20 3a11 n GLU 147 N -4.31 0.26 -0.13 2.65 1.02 -0.36 -2.88 120.64 116.90 3a11 n GLU 147 Ca 0.01 0.20 0.06 0.00 -0.02 0.00 0.00 57.16 57.40 3a11 n GLU 147 Cb 0.23 -1.79 0.18 0.00 -0.02 0.00 0.00 31.44 30.04 3a11 n GLU 147 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3a11 n GLN 148 N -2.24 1.65 -0.59 3.49 6.02 -0.65 -4.86 117.38 120.20 3a11 n GLN 148 Ca 0.05 -1.01 0.00 0.00 -0.01 0.00 0.00 57.00 56.03 3a11 n GLN 148 Cb 0.43 -1.25 0.00 0.00 1.02 0.00 0.00 30.24 30.44 3a11 n GLN 148 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3a11 n GLY 149 N 0.98 0.69 3.59 1.08 0.00 -1.14 -5.04 105.19 105.35 3a11 n GLY 149 Ca 0.11 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 3a11 n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a11 s LYS 150 N -0.55 3.83 -0.03 1.61 1.02 -0.89 -4.99 119.74 119.74 3a11 s LYS 150 Ca 0.00 0.13 -0.30 0.00 0.02 0.00 0.00 55.97 55.82 3a11 s LYS 150 Cb 0.00 -3.74 -0.04 0.00 -0.52 0.00 0.00 37.83 33.53 3a11 s LYS 150 CO 0.00 -0.55 1.21 -0.51 -0.92 0.00 0.00 175.35 174.58 3a11 s ASP 151 N 1.67 7.05 0.04 2.83 1.01 -1.26 -3.95 116.67 124.06 3a11 s ASP 151 Ca 0.22 1.87 0.00 0.00 0.71 0.00 0.00 52.55 55.35 3a11 s ASP 151 Cb -0.15 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.19 3a11 s ASP 151 CO 0.12 -0.56 -0.04 0.27 0.21 0.00 0.00 175.17 175.17 3a11 s ILE 152 N 1.96 0.25 -0.02 0.77 -4.36 -1.26 0.14 121.20 118.68 3a11 s ILE 152 Ca 0.57 -1.36 0.08 0.00 -0.26 0.00 0.00 60.65 59.68 3a11 s ILE 152 Cb -0.26 -0.90 -0.02 0.00 1.25 0.00 0.00 42.46 42.53 3a11 s ILE 152 CO 0.24 -0.71 -0.25 -0.75 0.24 0.00 0.00 174.94 173.71 3a11 s LYS 153 N -2.61 2.03 -0.19 0.37 2.20 -0.74 -4.29 119.74 116.51 3a11 s LYS 153 Ca -0.04 -0.88 -0.01 0.00 -0.36 0.00 0.00 55.97 54.67 3a11 s LYS 153 Cb -0.02 -1.95 0.00 0.00 -1.51 0.00 0.00 37.83 34.35 3a11 s LYS 153 CO -0.05 0.53 -0.12 0.08 -0.36 0.00 0.00 175.35 175.43 3a11 s VAL 154 N -0.56 2.82 -0.40 4.02 1.01 -0.49 -0.81 120.40 125.99 3a11 s VAL 154 Ca 0.09 -0.69 -0.23 0.00 0.00 0.00 0.00 61.98 61.15 3a11 s VAL 154 Cb -0.10 -2.24 0.02 0.00 0.00 0.00 0.00 36.38 34.06 3a11 s VAL 154 CO -0.01 0.48 0.78 -0.63 0.00 0.00 0.00 175.10 175.72 3a11 s ILE 155 N 1.26 4.70 -0.30 2.22 1.01 0.12 -1.40 121.20 128.81 3a11 s ILE 155 Ca 0.03 0.71 -0.12 0.00 0.00 0.00 0.00 60.65 61.27 3a11 s ILE 155 Cb -0.14 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 38.04 3a11 s ILE 155 CO -0.06 -0.54 0.21 -0.69 0.00 0.00 0.00 174.94 173.86 3a11 s VAL 156 N 3.17 5.28 0.11 2.92 1.01 0.18 -1.77 120.40 131.30 3a11 s VAL 156 Ca 0.31 0.02 -0.28 0.00 0.00 0.00 0.00 61.98 62.03 3a11 s VAL 156 Cb -0.13 -3.59 -0.06 0.00 0.00 0.00 0.00 36.38 32.60 3a11 s VAL 156 CO 0.19 0.15 0.86 0.42 0.00 0.00 0.00 175.10 176.72 3a11 s THR 157 N 1.74 4.51 0.33 3.92 -4.23 -1.17 -1.33 115.64 119.41 3a11 s THR 157 Ca 0.07 1.86 0.11 0.00 -1.18 0.00 0.00 61.69 62.55 3a11 s THR 157 Cb -0.17 -4.22 0.35 0.00 1.34 0.00 0.00 72.50 69.80 3a11 s THR 157 CO 0.11 0.39 1.61 -0.08 -0.54 0.00 0.00 174.62 176.11 3a11 h GLU 158 N 5.24 0.13 -5.30 3.99 4.81 -0.86 -3.36 114.58 119.23 3a11 h GLU 158 Ca -0.44 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 58.65 3a11 h GLU 158 Cb 1.21 -0.03 0.10 0.00 0.63 0.00 0.00 28.75 30.66 3a11 h GLU 158 CO 0.70 0.09 -0.44 2.41 -0.73 0.00 0.00 179.01 181.04 3a11 n THR 159 N -5.24 -9.28 -1.27 0.32 -1.04 -1.26 -1.31 114.28 95.19 3a11 n THR 159 Ca 0.30 -0.80 -0.30 0.00 -2.04 0.00 0.00 64.05 61.21 3a11 n THR 159 Cb 0.97 -6.57 0.12 0.00 -1.82 0.00 0.00 70.33 63.03 3a11 n THR 159 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3a11 s ARG 160 N -3.70 1.59 0.14 -2.82 1.81 -1.26 -2.10 118.95 112.60 3a11 s ARG 160 Ca 0.23 0.86 0.11 0.00 -1.72 0.00 0.00 55.73 55.22 3a11 s ARG 160 Cb -0.03 -1.84 -0.12 0.00 -0.45 0.00 0.00 34.95 32.50 3a11 s ARG 160 CO 0.71 -2.02 1.18 -1.00 -0.68 0.00 0.00 175.30 173.49 3a11 h PRO 161 N -1.39 0.00 0.00 3.54 0.13 -1.95 -3.45 132.00 128.88 3a11 h PRO 161 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3a11 h PRO 161 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 3a11 h PRO 161 CO 0.55 0.69 0.00 1.63 -0.23 0.00 0.00 178.00 180.63 3a11 n LYS 162 N -3.21 0.71 -3.29 0.86 5.02 -1.25 -4.88 118.16 112.11 3a11 n LYS 162 Ca -0.03 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.02 3a11 n LYS 162 Cb 0.88 -1.31 0.03 0.00 -0.02 0.00 0.00 35.03 34.61 3a11 n LYS 162 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 3a11 n TRP 163 N -0.81 -2.07 0.29 2.13 7.02 -0.89 -4.88 117.44 118.22 3a11 n TRP 163 Ca 0.11 0.61 0.18 0.00 -1.02 0.00 0.00 57.50 57.38 3a11 n TRP 163 Cb 0.05 -4.07 0.97 0.00 -2.42 0.00 0.00 31.31 25.84 3a11 n TRP 163 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 3a11 h GLN 164 N -1.51 0.00 -0.62 -0.99 7.50 -1.58 -2.29 115.11 115.61 3a11 h GLN 164 Ca -0.51 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 58.61 3a11 h GLN 164 Cb 1.35 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 28.85 3a11 h GLN 164 CO 0.57 0.00 0.29 0.78 -1.50 0.00 0.00 178.83 178.98 3a11 h GLY 165 N 0.00 0.94 0.96 3.46 0.00 -1.34 -1.97 103.07 105.12 3a11 h GLY 165 Ca 0.00 -0.45 0.02 0.00 0.00 0.00 0.00 47.33 46.90 3a11 h GLY 165 CO 0.00 0.43 0.58 0.50 0.00 0.00 0.00 176.54 178.05 3a11 h LYS 166 N 0.88 1.14 -0.23 4.80 1.57 -1.61 0.56 116.57 123.68 3a11 h LYS 166 Ca 0.22 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.91 3a11 h LYS 166 Cb 0.10 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 3a11 h LYS 166 CO -0.03 0.75 0.07 0.82 -0.57 0.00 0.00 179.45 180.49 3a11 h ILE 167 N 1.17 1.20 -0.57 1.86 2.04 -1.59 -1.54 117.51 120.08 3a11 h ILE 167 Ca 0.34 -0.63 -0.04 0.00 1.00 0.00 0.00 64.86 65.53 3a11 h ILE 167 Cb -0.09 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 3a11 h ILE 167 CO -0.09 0.20 0.21 0.74 0.00 0.00 0.00 178.15 179.22 3a11 h THR 168 N 0.21 1.23 0.32 -0.27 2.02 -0.64 -1.49 112.91 114.29 3a11 h THR 168 Ca 0.08 -0.73 -0.02 0.00 0.77 0.00 0.00 66.41 66.51 3a11 h THR 168 Cb 0.25 0.65 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 3a11 h THR 168 CO -0.00 0.28 -0.16 0.00 0.37 0.00 0.00 175.52 176.01 3a11 h ALA 169 N 1.06 -0.43 -0.41 6.16 0.00 0.23 -0.38 119.26 125.48 3a11 h ALA 169 Ca 0.19 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.01 3a11 h ALA 169 Cb 0.23 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3a11 h ALA 169 CO -0.01 -0.71 0.21 0.87 0.00 0.00 0.00 179.25 179.61 3a11 h LYS 170 N -0.50 0.42 -0.09 0.00 1.57 -1.25 0.11 116.57 116.82 3a11 h LYS 170 Ca -0.04 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3a11 h LYS 170 Cb 0.38 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 3a11 h LYS 170 CO 0.07 0.28 0.04 1.49 -0.57 0.00 0.00 179.45 180.76 3a11 h GLU 171 N 0.43 0.10 -0.33 3.15 4.81 -1.18 0.16 114.58 121.72 3a11 h GLU 171 Ca 0.17 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.37 3a11 h GLU 171 Cb 0.07 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 3a11 h GLU 171 CO -0.11 0.06 0.11 -0.07 -0.73 0.00 0.00 179.01 178.27 3a11 h LEU 172 N 0.10 0.47 -0.94 1.64 3.38 -0.88 -2.40 115.31 116.68 3a11 h LEU 172 Ca 0.04 -0.19 0.14 0.00 0.09 0.00 0.00 57.88 57.95 3a11 h LEU 172 Cb 0.00 -0.12 -0.09 0.00 0.09 0.00 0.00 40.66 40.54 3a11 h LEU 172 CO -0.02 0.54 0.56 0.00 0.09 0.00 0.00 178.44 179.61 3a11 h ALA 173 N 0.95 1.44 -0.59 1.53 0.00 -0.49 -1.33 119.26 120.77 3a11 h ALA 173 Ca 0.11 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3a11 h ALA 173 Cb 0.23 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3a11 h ALA 173 CO -0.00 0.09 0.26 0.66 0.00 0.00 0.00 179.25 180.25 3a11 h SER 174 N 0.84 0.77 0.33 0.00 4.64 -0.20 -0.54 113.55 119.39 3a11 h SER 174 Ca 0.49 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 3a11 h SER 174 Cb 0.58 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3a11 h SER 174 CO -0.31 0.67 0.00 -1.22 -0.87 0.00 0.00 176.83 175.11 3a11 n TYR 175 N -4.34 0.00 -0.18 4.77 4.01 -0.59 -4.82 117.16 116.01 3a11 n TYR 175 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 3a11 n TYR 175 Cb 0.15 -0.24 0.00 0.00 -0.31 0.00 0.00 39.34 38.94 3a11 n TYR 175 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3a11 n GLY 176 N 0.47 0.90 3.72 2.72 0.00 -0.21 -5.08 105.19 107.71 3a11 n GLY 176 Ca 0.11 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 3a11 n GLY 176 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a11 s ILE 177 N -2.00 5.21 0.13 -0.61 1.01 -0.66 -5.00 121.20 119.28 3a11 s ILE 177 Ca 0.00 0.87 -0.31 0.00 0.00 0.00 0.00 60.65 61.21 3a11 s ILE 177 Cb 0.00 -3.78 -0.08 0.00 0.01 0.00 0.00 42.46 38.61 3a11 s ILE 177 CO 0.00 0.33 1.36 -2.16 0.00 0.00 0.00 174.94 174.47 3a11 s PRO 178 N 0.65 4.34 -0.00 2.79 0.04 -1.26 -3.52 135.00 138.05 3a11 s PRO 178 Ca 0.24 2.05 0.06 0.00 0.04 0.00 0.00 61.00 63.39 3a11 s PRO 178 Cb -0.15 -3.24 -0.02 0.00 0.04 0.00 0.00 34.50 31.13 3a11 s PRO 178 CO 0.09 -0.39 -0.20 0.08 0.04 0.00 0.00 177.00 176.62 3a11 s VAL 179 N 0.88 1.58 -0.31 -0.36 1.01 -1.26 -1.40 120.40 120.53 3a11 s VAL 179 Ca 0.62 -0.93 -0.00 0.00 0.00 0.00 0.00 61.98 61.67 3a11 s VAL 179 Cb -0.36 -1.33 0.07 0.00 0.00 0.00 0.00 36.38 34.76 3a11 s VAL 179 CO 0.32 0.38 0.01 -0.63 0.00 0.00 0.00 175.10 175.18 3a11 s ILE 180 N -0.55 2.81 0.12 2.22 1.01 -0.49 -4.98 121.20 121.34 3a11 s ILE 180 Ca 0.07 -1.62 -0.27 0.00 0.00 0.00 0.00 60.65 58.84 3a11 s ILE 180 Cb -0.08 -2.71 -0.07 0.00 0.01 0.00 0.00 42.46 39.61 3a11 s ILE 180 CO -0.00 -0.23 0.82 -0.47 0.00 0.00 0.00 174.94 175.07 3a11 s TYR 181 N 1.17 3.84 0.04 3.97 5.04 -1.26 -0.65 117.35 129.50 3a11 s TYR 181 Ca -0.02 1.64 -0.09 0.00 -2.44 0.00 0.00 57.07 56.15 3a11 s TYR 181 Cb -0.20 -2.86 0.00 0.00 0.35 0.00 0.00 41.96 39.25 3a11 s TYR 181 CO -0.03 0.37 0.19 0.08 -1.34 0.00 0.00 175.55 174.82 3a11 s VAL 182 N -0.54 0.11 0.44 3.14 1.01 -0.44 -4.94 120.40 119.18 3a11 s VAL 182 Ca 0.39 -0.91 -0.22 0.00 0.00 0.00 0.00 61.98 61.24 3a11 s VAL 182 Cb -0.22 -0.92 -0.09 0.00 0.00 0.00 0.00 36.38 35.14 3a11 s VAL 182 CO 0.26 -0.50 1.02 0.54 0.00 0.00 0.00 175.10 176.42 3a11 s VAL 183 N -2.61 3.91 0.35 2.92 0.11 -1.26 -0.20 120.40 123.62 3a11 s VAL 183 Ca -0.05 1.30 0.12 0.00 -2.93 0.00 0.00 61.98 60.42 3a11 s VAL 183 Cb -0.01 -3.59 0.34 0.00 -1.53 0.00 0.00 36.38 31.59 3a11 s VAL 183 CO -0.04 -0.15 1.78 0.44 -3.33 0.00 0.00 175.10 173.81 3a11 h ASP 184 N 2.04 0.62 0.00 3.54 3.32 -1.94 -0.21 116.42 123.79 3a11 h ASP 184 Ca -0.49 0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.65 3a11 h ASP 184 Cb 1.21 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.74 3a11 h ASP 184 CO 0.61 0.19 0.04 0.28 -1.72 0.00 0.00 179.24 178.63 3a11 h SER 185 N 0.58 0.00 -0.12 6.45 0.02 -2.03 -2.55 113.55 115.91 3a11 h SER 185 Ca 0.57 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.52 3a11 h SER 185 Cb 1.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.68 3a11 h SER 185 CO -0.33 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.36 3a11 n ALA 186 N -1.96 2.54 -0.10 3.77 0.00 -0.09 -4.48 120.51 120.20 3a11 n ALA 186 Ca -0.02 -0.47 -0.07 0.00 0.00 0.00 0.00 53.44 52.87 3a11 n ALA 186 Cb 0.09 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.40 3a11 n ALA 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a11 h ALA 187 N 4.09 -0.11 -0.18 0.00 0.00 -1.62 -1.91 119.26 119.53 3a11 h ALA 187 Ca 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3a11 h ALA 187 Cb 0.45 0.61 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3a11 h ALA 187 CO 0.00 -0.68 0.04 -0.09 0.00 0.00 0.00 179.25 178.52 3a11 h ARG 188 N -0.23 0.30 -0.94 0.00 2.43 -1.87 -1.82 114.38 112.24 3a11 h ARG 188 Ca 0.17 -0.08 0.20 0.00 -0.81 0.00 0.00 59.98 59.46 3a11 h ARG 188 Cb 0.50 -0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 29.94 3a11 h ARG 188 CO -0.49 0.45 0.61 1.25 -1.51 0.00 0.00 179.97 180.28 3a11 h HIS 189 N 0.10 0.71 -0.51 2.20 2.76 -1.75 -1.23 115.15 117.44 3a11 h HIS 189 Ca 0.06 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 3a11 h HIS 189 Cb 0.29 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 29.03 3a11 h HIS 189 CO 0.01 0.18 0.00 0.66 -1.30 0.00 0.00 177.93 177.48 3a11 n TYR 190 N -4.59 0.67 0.25 5.26 4.01 -0.75 -4.23 117.16 117.77 3a11 n TYR 190 Ca 0.21 -0.37 0.15 0.00 -0.16 0.00 0.00 57.90 57.73 3a11 n TYR 190 Cb 0.66 -0.00 0.44 0.00 -0.31 0.00 0.00 39.34 40.12 3a11 n TYR 190 CO 0.00 0.00 0.00 1.98 -0.46 0.00 0.00 176.86 178.38 3a11 h MET 191 N 4.05 0.00 0.00 -0.72 4.05 -0.33 -2.91 114.93 119.07 3a11 h MET 191 Ca 0.00 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 3a11 h MET 191 Cb 0.94 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.74 3a11 h MET 191 CO 0.00 0.01 -0.06 1.57 0.23 0.00 0.00 176.91 178.66 3a11 h LYS 192 N 0.00 0.00 -0.32 0.39 2.10 -1.74 -2.83 116.57 114.17 3a11 h LYS 192 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3a11 h LYS 192 Cb 0.75 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.08 3a11 h LYS 192 CO 0.00 0.06 0.00 0.00 -2.00 0.00 0.00 179.45 177.51 3a11 n MET 193 N -3.14 3.04 -4.14 0.07 0.00 -1.11 -4.98 117.12 106.86 3a11 n MET 193 Ca 0.02 -2.60 -0.36 0.00 0.00 0.00 0.00 57.70 54.75 3a11 n MET 193 Cb 0.41 -1.68 -0.08 0.00 0.00 0.00 0.00 33.22 31.87 3a11 n MET 193 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 3a11 s THR 194 N -2.18 4.87 -0.22 3.17 2.01 -1.07 -4.73 115.64 117.49 3a11 s THR 194 Ca 0.37 -0.03 0.11 0.00 0.31 0.00 0.00 61.69 62.44 3a11 s THR 194 Cb 0.27 -3.09 -0.21 0.00 0.01 0.00 0.00 72.50 69.48 3a11 s THR 194 CO 0.12 0.61 -0.06 0.47 -0.69 0.00 0.00 174.62 175.07 3a11 n ASP 195 N 2.09 0.98 -3.86 3.53 8.00 0.50 -4.89 116.55 122.89 3a11 n ASP 195 Ca -0.19 -0.06 -0.11 0.00 0.71 0.00 0.00 54.79 55.13 3a11 n ASP 195 Cb 0.54 0.36 -0.11 0.00 -0.02 0.00 0.00 41.12 41.89 3a11 n ASP 195 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3a11 s LYS 196 N -2.49 0.33 -0.18 -1.24 -0.14 -0.93 -3.47 119.74 111.61 3a11 s LYS 196 Ca -0.21 -0.16 -0.01 0.00 -1.36 0.00 0.00 55.97 54.23 3a11 s LYS 196 Cb 0.07 0.14 0.00 0.00 -1.68 0.00 0.00 37.83 36.36 3a11 s LYS 196 CO 0.71 -0.07 -0.13 0.08 -0.76 0.00 0.00 175.35 175.18 3a11 s VAL 197 N -0.76 2.71 -0.15 3.17 1.01 0.14 -0.88 120.40 125.65 3a11 s VAL 197 Ca -0.08 -0.73 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 3a11 s VAL 197 Cb -0.05 -2.18 0.03 0.00 0.00 0.00 0.00 36.38 34.19 3a11 s VAL 197 CO 0.01 0.49 -0.08 -0.69 0.00 0.00 0.00 175.10 174.83 3a11 s VAL 198 N 1.15 1.26 0.26 2.92 1.01 -0.71 0.27 120.40 126.57 3a11 s VAL 198 Ca 0.01 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.42 3a11 s VAL 198 Cb -0.14 -1.32 -0.05 0.00 0.00 0.00 0.00 36.38 34.86 3a11 s VAL 198 CO -0.05 0.27 0.07 -0.04 0.00 0.00 0.00 175.10 175.35 3a11 s MET 199 N 1.59 1.43 0.00 2.72 -1.94 -0.62 -4.29 119.30 118.19 3a11 s MET 199 Ca 0.02 -1.77 0.00 0.00 -1.71 0.00 0.00 55.69 52.24 3a11 s MET 199 Cb -0.14 -0.42 0.00 0.00 2.01 0.00 0.00 34.83 36.28 3a11 s MET 199 CO -0.09 -0.24 0.00 0.41 -0.01 0.00 0.00 175.02 175.09 3a11 n GLY 200 N -0.49 1.63 3.42 -0.03 0.00 -1.26 -0.79 105.19 107.67 3a11 n GLY 200 Ca -0.01 -2.00 -0.16 0.00 0.00 0.00 0.00 46.02 43.85 3a11 n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a11 s ALA 201 N -2.21 -1.37 -0.09 4.61 0.00 -1.24 -4.65 121.76 116.81 3a11 s ALA 201 Ca 0.00 1.05 -0.02 0.00 0.00 0.00 0.00 51.96 52.98 3a11 s ALA 201 Cb 0.00 -0.15 -0.26 0.00 0.00 0.00 0.00 23.12 22.71 3a11 s ALA 201 CO 0.00 -0.31 0.49 0.22 0.00 0.00 0.00 175.76 176.15 3a11 h ASP 202 N 3.72 0.33 -4.59 0.00 1.82 0.30 -3.49 116.42 114.52 3a11 h ASP 202 Ca -0.28 -0.71 0.07 0.00 -0.39 0.00 0.00 57.03 55.72 3a11 h ASP 202 Cb 1.16 -0.11 -0.17 0.00 0.68 0.00 0.00 39.33 40.89 3a11 h ASP 202 CO 0.35 1.64 0.45 -0.94 -1.61 0.00 0.00 179.24 179.12 3a11 s SER 203 N -6.84 -0.42 -0.09 2.28 1.04 -0.96 -4.94 113.70 103.77 3a11 s SER 203 Ca -0.17 0.17 0.02 0.00 0.48 0.00 0.00 55.95 56.45 3a11 s SER 203 Cb 0.07 0.40 -0.01 0.00 0.10 0.00 0.00 66.02 66.58 3a11 s SER 203 CO 0.79 -0.59 -0.17 -0.63 0.98 0.00 0.00 173.24 173.63 3a11 s ILE 204 N -2.51 2.74 0.72 -1.02 -1.09 -0.07 -0.48 121.20 119.50 3a11 s ILE 204 Ca 0.01 -0.80 -0.07 0.00 -2.23 0.00 0.00 60.65 57.56 3a11 s ILE 204 Cb -0.01 -2.10 0.07 0.00 -1.58 0.00 0.00 42.46 38.84 3a11 s ILE 204 CO -0.05 0.55 1.04 0.42 -1.23 0.00 0.00 174.94 175.68 3a11 s THR 205 N -0.01 2.23 0.54 2.92 -4.23 -0.35 0.64 115.64 117.38 3a11 s THR 205 Ca -0.05 -0.23 0.22 0.00 -1.18 0.00 0.00 61.69 60.45 3a11 s THR 205 Cb -0.14 -3.00 0.34 0.00 1.34 0.00 0.00 72.50 71.04 3a11 s THR 205 CO 0.04 0.00 2.08 -0.37 -0.54 0.00 0.00 174.62 175.84 3a11 h VAL 206 N -0.68 0.78 -0.00 2.29 -1.51 -0.75 0.16 116.25 116.54 3a11 h VAL 206 Ca -0.45 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.02 3a11 h VAL 206 Cb 1.32 0.86 0.00 0.00 -2.13 0.00 0.00 31.29 31.34 3a11 h VAL 206 CO 0.61 0.00 -0.13 0.59 -1.23 0.00 0.00 177.57 177.41 3a11 n ASN 207 N -4.32 0.46 0.00 4.19 3.02 -1.26 -3.97 115.26 113.38 3a11 n ASN 207 Ca 0.03 -0.49 0.00 0.00 -0.03 0.00 0.00 54.58 54.09 3a11 n ASN 207 Cb 0.34 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 3a11 n ASN 207 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3a11 n GLY 208 N 1.31 0.67 3.78 7.41 0.00 0.56 -4.32 105.19 114.60 3a11 n GLY 208 Ca 0.13 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 3a11 n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a11 s ALA 209 N -2.00 2.55 -0.20 4.61 0.00 -1.26 -4.30 121.76 121.16 3a11 s ALA 209 Ca 0.00 0.52 -0.03 0.00 0.00 0.00 0.00 51.96 52.45 3a11 s ALA 209 Cb 0.00 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 19.81 3a11 s ALA 209 CO 0.00 -1.14 -0.05 0.08 0.00 0.00 0.00 175.76 174.65 3a11 s VAL 210 N -2.34 3.38 -0.29 0.00 1.01 0.33 -1.21 120.40 121.29 3a11 s VAL 210 Ca 0.66 -0.50 -0.14 0.00 0.00 0.00 0.00 61.98 62.00 3a11 s VAL 210 Cb -0.20 -2.52 -0.03 0.00 0.00 0.00 0.00 36.38 33.63 3a11 s VAL 210 CO 0.40 0.44 0.32 -0.63 0.00 0.00 0.00 175.10 175.63 3a11 s ILE 211 N 1.23 5.21 0.31 2.22 -1.09 0.37 -0.86 121.20 128.59 3a11 s ILE 211 Ca 0.03 0.31 -0.10 0.00 -2.23 0.00 0.00 60.65 58.66 3a11 s ILE 211 Cb -0.14 -3.69 0.01 0.00 -1.58 0.00 0.00 42.46 37.05 3a11 s ILE 211 CO -0.02 0.10 0.55 0.21 -1.23 0.00 0.00 174.94 174.56 3a11 s ASN 212 N 1.70 0.30 0.26 3.58 2.47 -1.20 0.10 114.94 122.15 3a11 s ASN 212 Ca 0.12 -1.17 -0.29 0.00 0.42 0.00 0.00 52.86 51.94 3a11 s ASN 212 Cb -0.16 0.68 -0.14 0.00 -1.45 0.00 0.00 41.25 40.17 3a11 s ASN 212 CO 0.11 -1.32 1.09 1.17 -3.72 0.00 0.00 177.10 174.43 3a11 n LYS 213 N -0.48 1.39 -1.51 0.43 3.00 -1.26 -1.79 118.16 117.93 3a11 n LYS 213 Ca -0.02 0.49 -0.54 0.00 -0.00 0.00 0.00 58.31 58.24 3a11 n LYS 213 Cb 0.61 -1.92 -0.06 0.00 0.00 0.00 0.00 35.03 33.66 3a11 n LYS 213 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.40 178.91 3a11 n ILE 214 N 0.70 0.56 0.00 3.15 0.13 -0.19 -1.69 119.36 122.02 3a11 n ILE 214 Ca 0.11 -0.14 0.00 0.00 -1.10 0.00 0.00 62.75 61.62 3a11 n ILE 214 Cb 0.30 -0.28 0.00 0.00 -0.84 0.00 0.00 39.64 38.82 3a11 n ILE 214 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 3a11 n GLY 215 N 1.83 2.99 0.21 4.50 0.00 -1.26 -4.92 105.19 108.54 3a11 n GLY 215 Ca 0.18 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.15 3a11 n GLY 215 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3a11 h THR 216 N 0.00 1.04 -0.57 2.61 2.02 -1.63 -2.13 112.91 114.26 3a11 h THR 216 Ca 0.00 -0.21 -0.05 0.00 0.77 0.00 0.00 66.41 66.92 3a11 h THR 216 Cb 0.00 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 66.76 3a11 h THR 216 CO 0.00 0.11 0.16 0.00 0.37 0.00 0.00 175.52 176.17 3a11 h ALA 217 N 1.24 1.22 -0.00 6.16 0.00 -1.87 -1.43 119.26 124.57 3a11 h ALA 217 Ca 0.21 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3a11 h ALA 217 Cb 0.03 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 3a11 h ALA 217 CO -0.10 0.55 0.00 -0.07 0.00 0.00 0.00 179.25 179.63 3a11 h LEU 218 N 0.84 0.00 -0.11 0.00 3.38 -1.86 0.50 115.31 118.06 3a11 h LEU 218 Ca 0.19 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 58.04 3a11 h LEU 218 Cb 0.26 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3a11 h LEU 218 CO -0.01 0.14 -0.04 0.40 0.09 0.00 0.00 178.44 179.02 3a11 h ILE 219 N -0.14 0.85 -0.91 1.22 2.04 -1.15 -1.95 117.51 117.47 3a11 h ILE 219 Ca 0.00 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.92 3a11 h ILE 219 Cb 0.14 0.85 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 3a11 h ILE 219 CO -0.00 0.00 0.59 0.00 0.00 0.00 0.00 178.15 178.74 3a11 h ALA 220 N 1.07 1.49 0.15 1.87 0.00 -1.11 -0.15 119.26 122.58 3a11 h ALA 220 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3a11 h ALA 220 Cb 0.11 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3a11 h ALA 220 CO -0.12 0.38 -0.12 1.25 0.00 0.00 0.00 179.25 180.63 3a11 h LEU 221 N 1.05 -0.31 -1.45 0.00 6.46 -0.23 -0.65 115.31 120.18 3a11 h LEU 221 Ca 0.38 0.03 -0.00 0.00 -0.12 0.00 0.00 57.88 58.17 3a11 h LEU 221 Cb 0.16 0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 40.20 3a11 h LEU 221 CO -0.14 -0.19 -0.02 0.00 -0.62 0.00 0.00 178.44 177.47 3a11 h THR 222 N -0.28 0.04 -0.18 1.05 1.03 -0.83 -1.04 112.91 112.70 3a11 h THR 222 Ca -0.00 -0.55 -0.16 0.00 -0.01 0.00 0.00 66.41 65.69 3a11 h THR 222 Cb 0.26 1.53 0.00 0.00 -1.07 0.00 0.00 68.15 68.87 3a11 h THR 222 CO -0.02 0.02 -0.50 0.00 -0.01 0.00 0.00 175.52 175.01 3a11 h ALA 223 N 1.98 0.30 -0.09 0.00 0.00 -0.42 -2.60 119.26 118.44 3a11 h ALA 223 Ca -0.00 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 3a11 h ALA 223 Cb 0.52 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 3a11 h ALA 223 CO 0.00 0.48 0.05 -0.22 0.00 0.00 0.00 179.25 179.55 3a11 h LYS 224 N 0.34 0.13 -1.04 0.00 1.63 -0.68 0.44 116.57 117.38 3a11 h LYS 224 Ca -0.01 -0.02 0.28 0.00 -0.85 0.00 0.00 60.65 60.05 3a11 h LYS 224 Cb 1.11 -0.02 -0.07 0.00 -0.60 0.00 0.00 32.23 32.65 3a11 h LYS 224 CO 0.11 0.19 0.71 1.49 -3.45 0.00 0.00 179.45 178.50 3a11 h GLU 225 N 0.03 0.21 -0.01 1.90 4.81 -1.19 -0.92 114.58 119.40 3a11 h GLU 225 Ca 0.03 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 3a11 h GLU 225 Cb 0.10 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.44 3a11 h GLU 225 CO -0.00 0.14 -0.30 0.72 -0.73 0.00 0.00 179.01 178.83 3a11 n HIS 226 N -4.43 0.00 -2.68 0.92 8.25 -0.70 -5.00 115.22 111.58 3a11 n HIS 226 Ca 0.24 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.53 3a11 n HIS 226 Cb 0.97 0.00 0.02 0.00 1.12 0.00 0.00 29.99 32.10 3a11 n HIS 226 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3a11 n ARG 227 N 0.11 -3.05 -2.96 -0.41 5.12 0.14 -4.97 116.66 110.63 3a11 n ARG 227 Ca 0.08 0.73 -0.41 0.00 -1.93 0.00 0.00 57.85 56.32 3a11 n ARG 227 Cb 0.39 -5.15 -0.04 0.00 -1.16 0.00 0.00 32.46 26.49 3a11 n ARG 227 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3a11 s VAL 228 N -2.97 4.97 -0.04 1.55 1.01 -0.37 -4.97 120.40 119.59 3a11 s VAL 228 Ca 0.16 1.57 -0.35 0.00 0.00 0.00 0.00 61.98 63.36 3a11 s VAL 228 Cb -0.07 -4.10 -0.13 0.00 0.00 0.00 0.00 36.38 32.07 3a11 s VAL 228 CO 0.20 0.17 1.73 1.87 0.00 0.00 0.00 175.10 179.07 3a11 n TRP 229 N 4.29 2.20 -4.22 5.22 -0.00 -1.23 -4.66 117.44 119.05 3a11 n TRP 229 Ca 0.01 0.20 -0.34 0.00 -0.00 0.00 0.00 57.50 57.38 3a11 n TRP 229 Cb 0.50 -2.57 -0.15 0.00 -0.00 0.00 0.00 31.31 29.09 3a11 n TRP 229 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 3a11 s THR 230 N 2.84 2.84 0.00 5.87 2.01 -1.26 -0.68 115.64 127.26 3a11 s THR 230 Ca 0.89 -0.69 0.08 0.00 0.31 0.00 0.00 61.69 62.28 3a11 s THR 230 Cb -0.77 -2.24 -0.02 0.00 0.01 0.00 0.00 72.50 69.48 3a11 s THR 230 CO 0.50 0.49 -0.25 -0.04 -0.69 0.00 0.00 174.62 174.63 3a11 s MET 231 N 1.13 1.88 -0.19 4.92 -1.94 0.14 -1.73 119.30 123.51 3a11 s MET 231 Ca 0.01 -0.94 -0.00 0.00 -1.71 0.00 0.00 55.69 53.04 3a11 s MET 231 Cb -0.14 -1.89 0.01 0.00 2.01 0.00 0.00 34.83 34.81 3a11 s MET 231 CO -0.04 0.51 -0.16 0.42 -0.01 0.00 0.00 175.02 175.74 3a11 s ILE 232 N -0.66 2.45 -0.30 2.53 -1.09 -0.65 -1.59 121.20 121.90 3a11 s ILE 232 Ca 0.10 -0.81 -0.18 0.00 -2.23 0.00 0.00 60.65 57.53 3a11 s ILE 232 Cb -0.09 -2.06 -0.02 0.00 -1.58 0.00 0.00 42.46 38.71 3a11 s ILE 232 CO 0.00 0.51 0.52 0.00 -1.23 0.00 0.00 174.94 174.74 3a11 s ALA 233 N 1.26 3.54 -0.19 9.38 0.00 0.03 0.12 121.76 135.91 3a11 s ALA 233 Ca 0.04 -0.77 -0.16 0.00 0.00 0.00 0.00 51.96 51.07 3a11 s ALA 233 Cb -0.14 -2.95 0.05 0.00 0.00 0.00 0.00 23.12 20.09 3a11 s ALA 233 CO -0.09 -0.95 0.49 0.00 0.00 0.00 0.00 175.76 175.22 3a11 s ALA 234 N 2.37 -1.23 0.51 0.00 0.00 -0.12 -3.73 121.76 119.55 3a11 s ALA 234 Ca 0.20 1.48 -0.20 0.00 0.00 0.00 0.00 51.96 53.44 3a11 s ALA 234 Cb -0.15 -0.86 -0.07 0.00 0.00 0.00 0.00 23.12 22.03 3a11 s ALA 234 CO 0.11 -0.25 1.08 -1.21 0.00 0.00 0.00 175.76 175.50 3a11 s GLU 235 N 0.52 3.61 0.34 0.00 8.01 -1.26 -3.87 118.70 126.05 3a11 s GLU 235 Ca -0.02 1.49 0.08 0.00 0.01 0.00 0.00 54.97 56.53 3a11 s GLU 235 Cb -0.04 -2.08 0.79 0.00 -4.31 0.00 0.00 34.13 28.50 3a11 s GLU 235 CO -0.03 -0.62 1.85 1.79 0.01 0.00 0.00 175.26 178.27 3a11 h THR 236 N 1.42 0.81 0.00 3.63 1.35 -1.96 -1.28 112.91 116.89 3a11 h THR 236 Ca -0.50 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 3a11 h THR 236 Cb 1.24 0.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.69 3a11 h THR 236 CO 0.58 0.13 0.00 0.00 -0.25 0.00 0.00 175.52 175.98 3a11 n TYR 237 N -4.59 0.00 0.80 4.73 4.11 -1.26 -1.28 117.16 119.67 3a11 n TYR 237 Ca 0.19 0.00 0.09 0.00 -0.00 0.00 0.00 57.90 58.18 3a11 n TYR 237 Cb 0.49 -0.00 0.01 0.00 -0.00 0.00 0.00 39.34 39.84 3a11 n TYR 237 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 3a11 n LYS 238 N -0.47 1.56 -2.65 -3.48 5.02 -0.48 -3.57 118.16 114.09 3a11 n LYS 238 Ca 0.00 -1.00 -0.41 0.00 -2.02 0.00 0.00 58.31 54.87 3a11 n LYS 238 Cb 0.01 -1.34 -0.04 0.00 -0.02 0.00 0.00 35.03 33.63 3a11 n LYS 238 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3a11 s PHE 239 N -2.00 3.72 0.08 2.13 0.08 -0.40 -0.89 117.98 120.70 3a11 s PHE 239 Ca 0.16 1.71 0.09 0.00 0.12 0.00 0.00 56.93 59.01 3a11 s PHE 239 Cb 0.15 -3.14 -0.03 0.00 -0.57 0.00 0.00 43.02 39.43 3a11 s PHE 239 CO 0.42 -0.11 -0.23 -1.58 -0.10 0.00 0.00 175.22 173.62 3a11 s HIS 240 N 0.05 1.99 -1.26 0.36 2.46 0.21 -4.89 115.29 114.21 3a11 s HIS 240 Ca 0.49 -0.39 0.26 0.00 0.47 0.00 0.00 55.06 55.88 3a11 s HIS 240 Cb -0.25 -1.14 1.24 0.00 -0.13 0.00 0.00 32.58 32.29 3a11 s HIS 240 CO 0.31 0.17 1.86 -0.35 -2.47 0.00 0.00 174.74 174.27 3a11 n PRO 241 N 1.45 0.23 -2.67 2.88 -0.04 -1.26 -2.00 135.00 133.59 3a11 n PRO 241 Ca -0.18 0.05 -0.23 0.00 -0.04 0.00 0.00 63.50 63.10 3a11 n PRO 241 Cb 0.53 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.59 3a11 n PRO 241 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3a11 s GLU 242 N -2.74 1.82 0.29 0.54 8.01 -1.26 -4.57 118.70 120.78 3a11 s GLU 242 Ca 0.20 -1.20 0.08 0.00 0.01 0.00 0.00 54.97 54.06 3a11 s GLU 242 Cb 0.17 -2.39 -0.04 0.00 -4.31 0.00 0.00 34.13 27.56 3a11 s GLU 242 CO 0.43 -1.32 0.10 0.95 0.01 0.00 0.00 175.26 175.43 3a11 s THR 243 N -3.04 3.61 0.00 3.63 -4.23 -1.26 -1.93 115.64 112.41 3a11 s THR 243 Ca 0.65 -1.69 0.00 0.00 -1.18 0.00 0.00 61.69 59.47 3a11 s THR 243 Cb -0.05 -3.04 0.00 0.00 1.34 0.00 0.00 72.50 70.74 3a11 s THR 243 CO 0.43 -0.31 0.00 0.23 -0.54 0.00 0.00 174.62 174.43 3a11 n MET 244 N -1.06 0.00 0.03 3.99 2.81 -1.26 -2.24 117.12 119.39 3a11 n MET 244 Ca -0.06 0.00 -0.07 0.00 -1.81 0.00 0.00 57.70 55.76 3a11 n MET 244 Cb 0.59 0.00 0.10 0.00 -0.71 0.00 0.00 33.22 33.20 3a11 n MET 244 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 3a11 h LEU 245 N 0.00 0.48 0.94 4.03 -0.00 -1.99 -3.46 115.31 115.30 3a11 h LEU 245 Ca 0.00 -0.25 -0.19 0.00 -0.00 0.00 0.00 57.88 57.44 3a11 h LEU 245 Cb 0.00 -0.14 -0.04 0.00 -0.00 0.00 0.00 40.66 40.48 3a11 h LEU 245 CO 0.00 0.91 -0.21 0.61 -0.00 0.00 0.00 178.44 179.75 3a11 n GLY 246 N 0.15 0.50 0.00 0.83 0.00 -0.95 -5.11 105.19 100.62 3a11 n GLY 246 Ca -0.02 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.46 3a11 n GLY 246 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a11 n GLN 247 N -2.29 0.00 -3.65 1.61 10.64 -1.26 -5.07 117.38 117.36 3a11 n GLN 247 Ca -0.10 0.00 -0.03 0.00 -1.83 0.00 0.00 57.00 55.03 3a11 n GLN 247 Cb 0.46 0.00 -0.05 0.00 -0.86 0.00 0.00 30.24 29.79 3a11 n GLN 247 CO 0.00 0.00 0.00 -2.00 -1.83 0.00 0.00 177.06 173.23 3a11 s GLU 252 N 0.84 0.55 -0.25 2.61 2.56 -1.26 -5.26 118.70 118.50 3a11 s GLU 252 Ca 0.00 1.35 -0.15 0.00 0.00 0.00 0.00 54.97 56.17 3a11 s GLU 252 Cb 0.00 0.68 -0.04 0.00 2.00 0.00 0.00 34.13 36.77 3a11 s GLU 252 CO 0.00 -0.20 0.38 -1.64 -0.56 0.00 0.00 175.26 173.24 3a11 s MET 253 N 2.65 4.07 0.68 4.30 -1.94 -1.26 -1.81 119.30 125.98 3a11 s MET 253 Ca -0.06 0.09 -0.03 0.00 -1.71 0.00 0.00 55.69 53.99 3a11 s MET 253 Cb -0.11 -3.62 0.08 0.00 2.01 0.00 0.00 34.83 33.20 3a11 s MET 253 CO -0.18 -0.20 0.95 1.03 -0.01 0.00 0.00 175.02 176.61 3a11 s ARG 254 N 1.82 2.04 0.03 2.03 0.52 -0.38 -4.96 118.95 120.05 3a11 s ARG 254 Ca 0.16 -0.71 -0.30 0.00 -0.52 0.00 0.00 55.73 54.36 3a11 s ARG 254 Cb -0.15 -2.30 -0.08 0.00 0.52 0.00 0.00 34.95 32.93 3a11 s ARG 254 CO 0.09 -1.22 1.82 0.34 0.02 0.00 0.00 175.30 176.36 3a11 s ASP 255 N -4.58 6.52 0.45 0.23 3.68 -1.26 -4.45 116.67 117.25 3a11 s ASP 255 Ca 0.62 2.54 0.27 0.00 2.13 0.00 0.00 52.55 58.12 3a11 s ASP 255 Cb -0.08 -2.54 1.33 0.00 -1.45 0.00 0.00 42.92 40.17 3a11 s ASP 255 CO 0.43 -0.99 1.72 -0.65 0.13 0.00 0.00 175.17 175.81 3a11 h PRO 256 N 9.73 0.19 0.00 4.34 0.11 -1.93 0.10 132.00 144.55 3a11 h PRO 256 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3a11 h PRO 256 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3a11 h PRO 256 CO 0.94 0.13 0.00 0.25 -0.21 0.00 0.00 178.00 179.11 3a11 n THR 257 N -4.52 0.69 0.07 -1.15 -2.24 -1.26 -1.67 114.28 104.19 3a11 n THR 257 Ca 0.30 0.17 -0.08 0.00 -2.27 0.00 0.00 64.05 62.18 3a11 n THR 257 Cb 1.18 -0.94 0.06 0.00 -2.10 0.00 0.00 70.33 68.53 3a11 n THR 257 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 3a11 h GLU 258 N 0.00 0.31 0.00 -0.78 4.81 -1.17 -3.27 114.58 114.48 3a11 h GLU 258 Ca 0.00 -0.25 -0.14 0.00 -0.13 0.00 0.00 59.36 58.84 3a11 h GLU 258 Cb 0.15 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3a11 h GLU 258 CO 0.00 0.89 -0.79 0.28 -0.73 0.00 0.00 179.01 178.66 3a11 h VAL 259 N 0.22 1.03 -3.82 0.32 2.07 -1.50 -3.43 116.25 111.14 3a11 h VAL 259 Ca -0.02 -2.06 -0.67 0.00 0.82 0.00 0.00 66.70 64.77 3a11 h VAL 259 Cb 1.25 2.24 -0.37 0.00 -1.52 0.00 0.00 31.29 32.88 3a11 h VAL 259 CO 0.11 0.35 -0.77 -0.63 0.02 0.00 0.00 177.57 176.65 3a11 s ILE 260 N -2.28 2.27 0.38 4.57 -1.09 -0.85 -5.09 121.20 119.12 3a11 s ILE 260 Ca -0.24 -1.76 -0.25 0.00 -2.23 0.00 0.00 60.65 56.17 3a11 s ILE 260 Cb 0.03 -2.41 -0.12 0.00 -1.58 0.00 0.00 42.46 38.38 3a11 s ILE 260 CO 0.56 -0.16 0.84 -2.65 -1.23 0.00 0.00 174.94 172.30 3a11 n PRO 261 N 4.41 1.02 -0.22 2.79 -0.02 -1.23 -3.99 135.00 137.76 3a11 n PRO 261 Ca -0.10 0.37 -0.03 0.00 -2.02 0.00 0.00 63.50 61.71 3a11 n PRO 261 Cb 0.42 -1.77 0.03 0.00 -0.02 0.00 0.00 33.50 32.16 3a11 n PRO 261 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3a11 h GLU 262 N 1.36 -0.11 -0.29 -0.52 4.81 -1.95 0.17 114.58 118.06 3a11 h GLU 262 Ca -0.41 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 58.91 3a11 h GLU 262 Cb 1.36 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.76 3a11 h GLU 262 CO 0.56 -0.07 0.28 -0.44 -0.73 0.00 0.00 179.01 178.61 3a11 h ASP 263 N -0.11 0.00 0.14 1.04 3.45 -1.99 -0.51 116.42 118.44 3a11 h ASP 263 Ca 0.27 0.00 -0.36 0.00 0.43 0.00 0.00 57.03 57.37 3a11 h ASP 263 Cb 0.54 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.29 3a11 h ASP 263 CO -0.70 0.00 -2.00 1.21 -1.57 0.00 0.00 179.24 176.18 3a11 n GLU 264 N -3.92 0.75 0.22 3.56 2.13 -0.22 -4.28 120.64 118.88 3a11 n GLU 264 Ca 0.04 0.26 0.07 0.00 0.66 0.00 0.00 57.16 58.19 3a11 n GLU 264 Cb 0.44 -1.71 0.51 0.00 0.27 0.00 0.00 31.44 30.94 3a11 n GLU 264 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 3a11 h LEU 265 N 0.07 0.00 -0.31 4.31 5.85 -0.11 -1.64 115.31 123.48 3a11 h LEU 265 Ca -0.42 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.30 3a11 h LEU 265 Cb 2.03 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.06 3a11 h LEU 265 CO 0.08 0.25 0.00 2.29 -0.34 0.00 0.00 178.44 180.72 3a11 n LYS 266 N -3.92 0.07 0.04 1.25 2.85 -0.29 -1.55 118.16 116.62 3a11 n LYS 266 Ca -0.02 0.35 0.12 0.00 -1.05 0.00 0.00 58.31 57.71 3a11 n LYS 266 Cb 0.33 -1.65 0.12 0.00 -0.65 0.00 0.00 35.03 33.18 3a11 n LYS 266 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 3a11 n THR 267 N -1.79 0.22 -3.30 0.58 -1.04 -0.62 -4.95 114.28 103.38 3a11 n THR 267 Ca 0.02 -0.22 -0.37 0.00 -2.04 0.00 0.00 64.05 61.45 3a11 n THR 267 Cb 0.17 0.08 -0.06 0.00 -1.82 0.00 0.00 70.33 68.70 3a11 n THR 267 CO 0.00 0.00 0.00 0.26 -0.64 0.00 0.00 175.07 174.69 3a11 s TRP 268 N -3.15 3.68 0.47 -1.42 0.52 -0.59 -5.04 118.94 113.42 3a11 s TRP 268 Ca 0.06 1.17 -0.24 0.00 0.02 0.00 0.00 56.10 57.10 3a11 s TRP 268 Cb 0.14 -2.44 -0.08 0.00 -1.15 0.00 0.00 33.47 29.95 3a11 s TRP 268 CO 0.75 0.48 1.40 -0.35 0.02 0.00 0.00 176.95 179.26 3a11 n PRO 269 N 1.14 2.10 0.20 4.98 -0.04 -1.26 -4.77 135.00 137.34 3a11 n PRO 269 Ca -0.07 0.75 0.13 0.00 -0.04 0.00 0.00 63.50 64.28 3a11 n PRO 269 Cb 0.51 -2.60 0.71 0.00 -0.04 0.00 0.00 33.50 32.08 3a11 n PRO 269 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3a11 h LYS 270 N 2.07 0.00 -0.01 0.54 6.56 -1.96 -1.11 116.57 122.66 3a11 h LYS 270 Ca -0.51 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.09 3a11 h LYS 270 Cb 1.28 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.94 3a11 h LYS 270 CO 0.60 0.00 0.04 -0.97 -2.06 0.00 0.00 179.45 177.06 3a11 h ASN 271 N 0.00 0.00 -3.70 0.86 -0.00 -2.03 -3.40 115.58 107.31 3a11 h ASN 271 Ca 0.00 0.00 -0.64 0.00 -0.00 0.00 0.00 56.30 55.66 3a11 h ASN 271 Cb 0.02 0.00 -0.18 0.00 -0.00 0.00 0.00 38.32 38.15 3a11 h ASN 271 CO 0.00 0.00 -0.56 -0.63 -0.00 0.00 0.00 177.43 176.24 3a11 s ILE 272 N -4.33 4.92 -0.23 2.57 1.01 -0.42 -5.08 121.20 119.62 3a11 s ILE 272 Ca -0.05 0.03 -0.08 0.00 0.00 0.00 0.00 60.65 60.55 3a11 s ILE 272 Cb 0.14 -3.31 -0.04 0.00 0.01 0.00 0.00 42.46 39.26 3a11 s ILE 272 CO 0.45 0.32 0.09 -1.61 0.00 0.00 0.00 174.94 174.19 3a11 s GLU 273 N 1.46 3.81 -0.35 2.79 2.02 -1.26 -4.95 118.70 122.22 3a11 s GLU 273 Ca 0.06 -0.41 -0.22 0.00 0.02 0.00 0.00 54.97 54.43 3a11 s GLU 273 Cb -0.15 -3.36 0.00 0.00 0.10 0.00 0.00 34.13 30.73 3a11 s GLU 273 CO 0.06 -0.05 0.73 0.08 0.02 0.00 0.00 175.26 176.11 3a11 s VAL 274 N 1.26 4.80 -0.23 2.63 1.01 -1.26 -5.03 120.40 123.58 3a11 s VAL 274 Ca 0.05 0.85 -0.08 0.00 0.00 0.00 0.00 61.98 62.80 3a11 s VAL 274 Cb -0.14 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 3a11 s VAL 274 CO 0.04 -0.35 0.09 0.26 0.00 0.00 0.00 175.10 175.14 3a11 s TRP 275 N 2.93 3.17 -0.63 5.22 0.52 -1.26 -4.71 118.94 124.17 3a11 s TRP 275 Ca 0.29 -0.14 0.06 0.00 0.02 0.00 0.00 56.10 56.33 3a11 s TRP 275 Cb -0.14 -2.20 0.23 0.00 -1.15 0.00 0.00 33.47 30.21 3a11 s TRP 275 CO 0.15 -0.13 0.67 -1.71 0.02 0.00 0.00 176.95 175.95 3a11 n ASN 276 N 4.42 3.23 -4.77 2.95 5.15 -1.26 -5.08 115.26 119.90 3a11 n ASN 276 Ca -0.16 -3.32 -0.39 0.00 -0.60 0.00 0.00 54.58 50.11 3a11 n ASN 276 Cb 0.52 -0.68 -0.01 0.00 -0.53 0.00 0.00 39.78 39.08 3a11 n ASN 276 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3a11 s PRO 277 N -2.12 4.01 -0.03 1.20 0.04 -1.26 -1.25 135.00 135.59 3a11 s PRO 277 Ca 0.36 2.06 -0.22 0.00 0.04 0.00 0.00 61.00 63.25 3a11 s PRO 277 Cb 0.11 -2.75 -0.25 0.00 0.04 0.00 0.00 34.50 31.65 3a11 s PRO 277 CO -0.05 -0.42 1.03 0.00 0.04 0.00 0.00 177.00 177.59 3a11 h ALA 278 N 2.71 0.03 -1.98 8.56 0.00 -1.73 -3.42 119.26 123.42 3a11 h ALA 278 Ca -0.49 -0.56 -0.53 0.00 0.00 0.00 0.00 54.91 53.32 3a11 h ALA 278 Cb 1.24 0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.93 3a11 h ALA 278 CO 0.63 0.27 -0.65 -0.06 0.00 0.00 0.00 179.25 179.43 3a11 s PHE 279 N -3.00 2.12 0.16 0.00 0.08 -1.26 -1.02 117.98 115.05 3a11 s PHE 279 Ca -0.14 -0.70 0.02 0.00 0.12 0.00 0.00 56.93 56.22 3a11 s PHE 279 Cb 0.02 -1.29 -0.05 0.00 -0.57 0.00 0.00 43.02 41.13 3a11 s PHE 279 CO 0.80 0.31 -0.01 0.16 -0.10 0.00 0.00 175.22 176.38 3a11 s ASP 280 N -3.52 1.18 -0.22 1.36 3.84 -0.74 -4.59 116.67 113.98 3a11 s ASP 280 Ca 0.32 -1.15 -0.06 0.00 -0.00 0.00 0.00 52.55 51.67 3a11 s ASP 280 Cb 0.05 0.12 -0.02 0.00 -1.38 0.00 0.00 42.92 41.69 3a11 s ASP 280 CO 0.14 -0.55 0.02 -0.69 -0.00 0.00 0.00 175.17 174.09 3a11 s VAL 281 N -3.66 3.98 -0.24 2.11 1.01 -1.26 -3.22 120.40 119.12 3a11 s VAL 281 Ca 0.22 -0.29 -0.16 0.00 0.00 0.00 0.00 61.98 61.75 3a11 s VAL 281 Cb 0.06 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 3a11 s VAL 281 CO 0.03 0.39 0.42 -0.89 0.00 0.00 0.00 175.10 175.05 3a11 s THR 282 N 1.35 5.16 0.49 3.92 2.01 -0.04 -4.82 115.64 123.71 3a11 s THR 282 Ca 0.04 0.70 -0.23 0.00 0.31 0.00 0.00 61.69 62.52 3a11 s THR 282 Cb -0.15 -3.74 -0.07 0.00 0.01 0.00 0.00 72.50 68.55 3a11 s THR 282 CO 0.01 0.17 1.33 -2.84 -0.69 0.00 0.00 174.62 172.61 3a11 s PRO 283 N 1.85 3.49 0.57 4.92 0.02 -1.26 -0.51 135.00 144.08 3a11 s PRO 283 Ca 0.18 2.18 0.26 0.00 0.02 0.00 0.00 61.00 63.64 3a11 s PRO 283 Cb -0.15 -2.44 1.64 0.00 0.02 0.00 0.00 34.50 33.56 3a11 s PRO 283 CO 0.09 -0.90 2.21 -1.00 -0.33 0.00 0.00 177.00 177.07 3a11 h PRO 284 N 1.93 0.00 0.00 5.54 0.13 -1.85 -2.17 132.00 135.58 3a11 h PRO 284 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3a11 h PRO 284 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 3a11 h PRO 284 CO 0.59 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.51 3a11 n GLU 285 N -4.05 0.12 -0.22 0.86 0.00 -1.26 -1.71 120.64 114.37 3a11 n GLU 285 Ca -0.02 0.19 0.09 0.00 0.00 0.00 0.00 57.16 57.42 3a11 n GLU 285 Cb 0.12 -1.50 0.21 0.00 0.00 0.00 0.00 31.44 30.26 3a11 n GLU 285 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 3a11 n TYR 286 N -1.38 0.57 -4.31 -1.84 4.01 -0.82 -4.88 117.16 108.51 3a11 n TYR 286 Ca 0.05 -0.38 -0.32 0.00 -0.16 0.00 0.00 57.90 57.10 3a11 n TYR 286 Cb 0.14 -0.01 -0.16 0.00 -0.31 0.00 0.00 39.34 39.00 3a11 n TYR 286 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3a11 s VAL 287 N -1.12 1.91 -0.06 -0.72 1.01 -0.70 -4.76 120.40 115.97 3a11 s VAL 287 Ca 0.34 -0.86 -0.24 0.00 0.00 0.00 0.00 61.98 61.21 3a11 s VAL 287 Cb 0.18 -1.72 -0.19 0.00 0.00 0.00 0.00 36.38 34.65 3a11 s VAL 287 CO 0.25 0.52 1.01 0.44 0.00 0.00 0.00 175.10 177.31 3a11 h ASP 288 N 7.71 -0.08 -5.09 3.32 3.32 -1.60 -3.42 116.42 120.58 3a11 h ASP 288 Ca -0.39 -0.52 -0.10 0.00 0.02 0.00 0.00 57.03 56.04 3a11 h ASP 288 Cb 1.16 0.02 -0.16 0.00 0.22 0.00 0.00 39.33 40.57 3a11 h ASP 288 CO 0.58 0.53 -0.36 0.68 -1.72 0.00 0.00 179.24 178.94 3a11 s VAL 289 N -3.53 0.11 -0.15 -1.35 -7.23 -1.12 -4.39 120.40 102.74 3a11 s VAL 289 Ca -0.15 -0.94 -0.03 0.00 -1.81 0.00 0.00 61.98 59.06 3a11 s VAL 289 Cb 0.00 -1.03 -0.02 0.00 0.56 0.00 0.00 36.38 35.89 3a11 s VAL 289 CO 0.59 -0.52 -0.07 -0.63 -0.31 0.00 0.00 175.10 174.17 3a11 s ILE 290 N -2.91 3.57 -0.47 -0.62 1.01 -0.32 -1.63 121.20 119.83 3a11 s ILE 290 Ca -0.02 -0.47 -0.19 0.00 0.00 0.00 0.00 60.65 59.97 3a11 s ILE 290 Cb 0.01 -2.55 0.04 0.00 0.01 0.00 0.00 42.46 39.96 3a11 s ILE 290 CO -0.06 0.49 0.60 -0.63 0.00 0.00 0.00 174.94 175.34 3a11 s ILE 291 N 0.49 4.90 0.39 2.92 -1.09 0.32 -2.41 121.20 126.72 3a11 s ILE 291 Ca -0.05 -0.29 0.08 0.00 -2.23 0.00 0.00 60.65 58.15 3a11 s ILE 291 Cb -0.15 -4.22 -0.00 0.00 -1.58 0.00 0.00 42.46 36.50 3a11 s ILE 291 CO 0.03 -0.68 0.48 -0.89 -1.23 0.00 0.00 174.94 172.65 3a11 s THR 292 N 2.59 3.19 0.07 2.92 2.01 -0.07 -0.94 115.64 125.42 3a11 s THR 292 Ca 0.17 -1.12 0.29 0.00 0.31 0.00 0.00 61.69 61.34 3a11 s THR 292 Cb -0.17 -3.10 0.32 0.00 0.01 0.00 0.00 72.50 69.56 3a11 s THR 292 CO 0.14 -0.05 1.89 -0.33 -0.69 0.00 0.00 174.62 175.58 3a11 h GLU 293 N 0.84 0.00 -0.72 4.92 3.07 -1.84 -2.02 114.58 118.84 3a11 h GLU 293 Ca -0.42 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.44 3a11 h GLU 293 Cb 1.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.18 3a11 h GLU 293 CO 0.51 0.09 0.00 2.89 -1.40 0.00 0.00 179.01 181.10 3a11 n ARG 294 N -3.21 2.93 0.00 2.33 1.85 -1.26 -4.81 116.66 114.48 3a11 n ARG 294 Ca 0.01 -2.68 0.00 0.00 -1.00 0.00 0.00 57.85 54.18 3a11 n ARG 294 Cb 0.37 -1.64 0.00 0.00 -1.05 0.00 0.00 32.46 30.14 3a11 n ARG 294 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3a11 n GLY 295 N 1.55 0.77 3.72 2.89 0.00 -0.76 -5.04 105.19 108.32 3a11 n GLY 295 Ca 0.25 -2.30 -0.39 0.00 0.00 0.00 0.00 46.02 43.58 3a11 n GLY 295 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a11 s ILE 296 N -0.83 5.11 0.04 -0.61 1.01 -1.26 -0.89 121.20 123.77 3a11 s ILE 296 Ca 0.00 1.18 -0.00 0.00 0.00 0.00 0.00 60.65 61.83 3a11 s ILE 296 Cb 0.00 -3.92 -0.03 0.00 0.01 0.00 0.00 42.46 38.52 3a11 s ILE 296 CO 0.00 0.30 -0.04 0.27 0.00 0.00 0.00 174.94 175.48 3a11 s ILE 297 N 0.63 0.23 0.59 2.92 -4.36 -1.01 -4.98 121.20 115.21 3a11 s ILE 297 Ca 0.31 -1.42 -0.15 0.00 -0.26 0.00 0.00 60.65 59.14 3a11 s ILE 297 Cb -0.16 -0.97 -0.04 0.00 1.25 0.00 0.00 42.46 42.53 3a11 s ILE 297 CO 0.14 -0.75 1.03 -2.16 0.24 0.00 0.00 174.94 173.44 3a11 s PRO 298 N -2.79 3.47 0.28 0.37 0.04 -1.26 -1.17 135.00 133.93 3a11 s PRO 298 Ca -0.03 1.06 0.01 0.00 0.04 0.00 0.00 61.00 62.08 3a11 s PRO 298 Cb -0.00 -2.06 0.63 0.00 0.04 0.00 0.00 34.50 33.11 3a11 s PRO 298 CO -0.05 -0.68 1.70 -1.35 0.04 0.00 0.00 177.00 176.66 3a11 h PRO 299 N 0.36 0.38 0.00 0.56 0.11 -1.82 -1.61 132.00 129.99 3a11 h PRO 299 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3a11 h PRO 299 Cb 1.21 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3a11 h PRO 299 CO 0.59 0.25 0.00 2.48 -0.21 0.00 0.00 178.00 181.11 3a11 n TYR 300 N -5.05 0.00 0.26 0.65 0.18 -1.26 -2.10 117.16 109.84 3a11 n TYR 300 Ca 0.19 0.00 0.10 0.00 1.88 0.00 0.00 57.90 60.07 3a11 n TYR 300 Cb 0.57 0.00 0.17 0.00 -0.38 0.00 0.00 39.34 39.70 3a11 n TYR 300 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3a11 n ALA 301 N -0.65 2.39 -0.21 -3.48 0.00 -0.60 -4.40 120.51 113.56 3a11 n ALA 301 Ca 0.04 -0.94 0.11 0.00 0.00 0.00 0.00 53.44 52.65 3a11 n ALA 301 Cb 0.02 -0.70 0.41 0.00 0.00 0.00 0.00 19.45 19.18 3a11 n ALA 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a11 h ALA 302 N 3.63 1.87 0.00 0.00 0.00 -1.59 0.11 119.26 123.27 3a11 h ALA 302 Ca 0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3a11 h ALA 302 Cb 0.85 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3a11 h ALA 302 CO 0.00 -0.05 -0.35 0.97 0.00 0.00 0.00 179.25 179.82 3a11 h ILE 303 N 0.63 1.05 -0.21 0.00 2.10 -1.77 -2.14 117.51 117.17 3a11 h ILE 303 Ca 0.38 -1.28 -0.16 0.00 1.08 0.00 0.00 64.86 64.88 3a11 h ILE 303 Cb 0.59 1.73 -0.01 0.00 -1.09 0.00 0.00 36.82 38.04 3a11 h ILE 303 CO -0.14 0.34 -0.53 0.44 -1.08 0.00 0.00 178.15 177.18 3a11 h ASP 304 N 0.00 0.68 -0.56 2.19 3.32 -1.09 -2.55 116.42 118.41 3a11 h ASP 304 Ca -0.00 -0.36 -0.06 0.00 0.02 0.00 0.00 57.03 56.63 3a11 h ASP 304 Cb 0.70 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 3a11 h ASP 304 CO 0.05 1.08 0.12 0.40 -1.72 0.00 0.00 179.24 179.16 3a11 h ILE 305 N 0.48 1.25 -0.61 0.35 1.08 -1.04 -0.57 117.51 118.45 3a11 h ILE 305 Ca 0.01 -0.92 0.00 0.00 -0.39 0.00 0.00 64.86 63.57 3a11 h ILE 305 Cb 1.08 0.77 -0.03 0.00 -3.07 0.00 0.00 36.82 35.57 3a11 h ILE 305 CO 0.10 0.34 0.39 -0.07 -0.69 0.00 0.00 178.15 178.22 3a11 h LEU 306 N 0.81 0.71 0.52 1.44 3.38 -1.33 -0.39 115.31 120.44 3a11 h LEU 306 Ca 0.17 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 3a11 h LEU 306 Cb 0.37 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 40.95 3a11 h LEU 306 CO 0.01 0.53 -0.25 -0.09 0.09 0.00 0.00 178.44 178.72 3a11 h ARG 307 N 0.82 -0.67 -0.63 1.13 2.43 -1.25 -1.16 114.38 115.06 3a11 h ARG 307 Ca 0.22 0.05 -0.06 0.00 -0.81 0.00 0.00 59.98 59.38 3a11 h ARG 307 Cb -0.07 0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 3a11 h ARG 307 CO -0.05 -0.38 0.15 0.93 -1.51 0.00 0.00 179.97 179.12 3a11 h GLU 308 N -1.08 0.99 0.14 0.20 3.07 -1.12 -0.95 114.58 115.83 3a11 h GLU 308 Ca -0.07 -0.22 -0.29 0.00 -0.50 0.00 0.00 59.36 58.28 3a11 h GLU 308 Cb 0.60 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.37 3a11 h GLU 308 CO 0.12 0.88 -1.46 0.93 -1.40 0.00 0.00 179.01 178.08 3a11 h GLU 309 N 0.94 0.29 -0.13 2.33 4.39 -1.18 -3.40 114.58 117.82 3a11 h GLU 309 Ca 0.20 -0.50 -0.07 0.00 0.34 0.00 0.00 59.36 59.34 3a11 h GLU 309 Cb 0.34 0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 29.13 3a11 h GLU 309 CO 0.00 1.24 -0.34 1.19 -1.16 0.00 0.00 179.01 179.94 3a11 n PHE 310 N -3.85 0.40 -2.17 4.33 3.72 -0.46 -4.52 117.46 114.90 3a11 n PHE 310 Ca -0.24 -1.54 -0.00 0.00 -0.05 0.00 0.00 57.45 55.62 3a11 n PHE 310 Cb 0.94 -0.34 -0.00 0.00 -0.94 0.00 0.00 39.48 39.14 3a11 n PHE 310 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3a11 n GLY 311 N -1.12 -0.38 3.76 1.37 0.00 -0.36 -4.75 105.19 103.71 3a11 n GLY 311 Ca 0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.87 3a11 n GLY 311 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3a11 s TRP 312 N -1.81 3.39 0.27 1.61 -0.00 -1.06 -4.96 118.94 116.38 3a11 s TRP 312 Ca 0.00 1.63 -0.21 0.00 -0.00 0.00 0.00 56.10 57.52 3a11 s TRP 312 Cb 0.00 -3.35 0.04 0.00 -0.00 0.00 0.00 33.47 30.15 3a11 s TRP 312 CO 0.00 -0.89 0.79 0.00 -0.00 0.00 0.00 176.95 176.85 3a11 s ALA 313 N -1.24 -1.24 -1.17 5.86 0.00 -1.26 -4.13 121.76 118.59 3a11 s ALA 313 Ca 0.48 -0.30 -0.21 0.00 0.00 0.00 0.00 51.96 51.93 3a11 s ALA 313 Cb -0.32 0.78 0.03 0.00 0.00 0.00 0.00 23.12 23.60 3a11 s ALA 313 CO 0.42 -1.03 1.72 -0.51 0.00 0.00 0.00 175.76 176.35 3a11 s LEU 314 N -2.97 3.54 0.44 0.00 1.43 -1.26 -4.89 118.68 114.98 3a11 s LEU 314 Ca 0.12 -1.87 0.06 0.00 -1.03 0.00 0.00 54.13 51.41 3a11 s LEU 314 Cb -0.05 -2.58 -0.05 0.00 0.03 0.00 0.00 46.19 43.55 3a11 s LEU 314 CO 0.07 -1.75 0.11 -0.54 0.23 0.00 0.00 176.35 174.47 3a11 s LYS 315 N 5.10 2.14 -0.07 1.70 -0.14 -1.26 -5.06 119.74 122.14 3a11 s LYS 315 Ca 0.56 -2.06 0.19 0.00 -1.36 0.00 0.00 55.97 53.30 3a11 s LYS 315 Cb 0.01 -1.79 -0.25 0.00 -1.68 0.00 0.00 37.83 34.12 3a11 s LYS 315 CO 0.03 -0.19 0.41 0.66 -0.76 0.00 0.00 175.35 175.50 3a11 n TYR 316 N -1.21 0.25 -4.40 3.18 4.01 -1.26 -4.98 117.16 112.75 3a11 n TYR 316 Ca -0.06 0.08 -0.25 0.00 -0.16 0.00 0.00 57.90 57.51 3a11 n TYR 316 Cb 0.66 -0.85 -0.10 0.00 -0.31 0.00 0.00 39.34 38.74 3a11 n TYR 316 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3a11 s THR 317 N -2.97 2.70 0.44 -0.72 -4.23 -1.26 -5.13 115.64 104.47 3a11 s THR 317 Ca -0.07 -2.11 -0.07 0.00 -1.18 0.00 0.00 61.69 58.25 3a11 s THR 317 Cb 0.09 -2.38 -0.05 0.00 1.34 0.00 0.00 72.50 71.51 3a11 s THR 317 CO 0.85 -0.27 0.77 -0.70 -0.54 0.00 0.00 174.62 174.73 3a11 s GLU 318 N -3.19 3.64 0.37 3.99 2.56 -1.26 -4.95 118.70 119.86 3a11 s GLU 318 Ca 0.27 0.30 0.19 0.00 0.00 0.00 0.00 54.97 55.72 3a11 s GLU 318 Cb -0.07 -2.39 1.02 0.00 2.00 0.00 0.00 34.13 34.69 3a11 s GLU 318 CO 0.14 -0.12 1.52 -1.00 -0.56 0.00 0.00 175.26 175.24 3a11 h PRO 319 N 0.70 0.00 -0.53 4.30 0.13 -1.95 0.72 132.00 135.37 3a11 h PRO 319 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3a11 h PRO 319 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3a11 h PRO 319 CO 0.63 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.73 3a11 n TRP 320 N -2.24 0.79 -4.16 1.56 2.14 -1.26 -4.85 117.44 109.42 3a11 n TRP 320 Ca -0.01 -0.53 -0.35 0.00 2.07 0.00 0.00 57.50 58.68 3a11 n TRP 320 Cb 0.23 -0.05 -0.08 0.00 -0.81 0.00 0.00 31.31 30.60 3a11 n TRP 320 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 3a11 s GLU 321 N -1.16 3.16 0.00 -2.67 2.02 0.24 -4.81 118.70 115.50 3a11 s GLU 321 Ca 0.37 -0.31 0.29 0.00 0.02 0.00 0.00 54.97 55.33 3a11 s GLU 321 Cb 0.20 -2.95 1.70 0.00 0.10 0.00 0.00 34.13 33.19 3a11 s GLU 321 CO 0.23 0.72 2.04 -0.25 0.02 0.00 0.00 175.26 178.03